From 4b81802ae848f85530a8538e3dc5c03d2d71c59b Mon Sep 17 00:00:00 2001 From: Oliver Henrich Date: Mon, 5 Jul 2021 16:07:40 +0100 Subject: [PATCH 01/14] Created new feature branch for PR as per request --- doc/src/PDF/CG-DNA.pdf | Bin 4230823 -> 4240268 bytes doc/src/atom_style.rst | 28 +- doc/src/bond_oxdna.rst | 19 +- doc/src/pair_oxdna.rst | 18 +- doc/src/pair_oxdna2.rst | 18 +- doc/src/pair_oxrna2.rst | 18 +- doc/utils/sphinx-config/false_positives.txt | 13 +- examples/PACKAGES/cgdna/README | 2 +- .../cgdna/examples/oxDNA/duplex1/data.duplex1 | 103 +- .../cgdna/examples/oxDNA/duplex1/in.duplex1 | 33 +- .../oxDNA/duplex1/log.27May21.duplex1.g++.1 | 1171 +++++++++++++++ .../oxDNA/duplex1/log.27May21.duplex1.g++.4 | 1171 +++++++++++++++ .../oxDNA/duplex1/log.30Jun20.duplex1.g++.1 | 1175 --------------- .../oxDNA/duplex1/log.30Jun20.duplex1.g++.4 | 1175 --------------- .../cgdna/examples/oxDNA/duplex2/data.duplex2 | 149 +- .../cgdna/examples/oxDNA/duplex2/in.duplex2 | 33 +- .../oxDNA/duplex2/log.27May21.duplex2.g++.1 | 1173 +++++++++++++++ .../oxDNA/duplex2/log.27May21.duplex2.g++.4 | 1173 +++++++++++++++ .../oxDNA/duplex2/log.30Jun20.duplex2.g++.1 | 1176 --------------- .../oxDNA/duplex2/log.30Jun20.duplex2.g++.4 | 1176 --------------- .../examples/oxDNA2/duplex1/data.duplex1 | 103 +- .../cgdna/examples/oxDNA2/duplex1/in.duplex1 | 36 +- .../oxDNA2/duplex1/log.27May21.duplex1.g++.1 | 1181 +++++++++++++++ .../oxDNA2/duplex1/log.27May21.duplex1.g++.4 | 1181 +++++++++++++++ .../oxDNA2/duplex1/log.30Jun20.duplex1.g++.1 | 1182 --------------- .../oxDNA2/duplex1/log.30Jun20.duplex1.g++.4 | 1182 --------------- .../examples/oxDNA2/duplex2/data.duplex2 | 149 +- .../cgdna/examples/oxDNA2/duplex2/in.duplex2 | 36 +- .../oxDNA2/duplex2/log.27May21.duplex2.g++.1 | 1183 +++++++++++++++ .../oxDNA2/duplex2/log.27May21.duplex2.g++.4 | 1183 +++++++++++++++ .../oxDNA2/duplex2/log.30Jun20.duplex2.g++.1 | 1184 --------------- .../oxDNA2/duplex2/log.30Jun20.duplex2.g++.4 | 1184 --------------- .../examples/oxDNA2/duplex3/data.duplex3 | 111 +- .../cgdna/examples/oxDNA2/duplex3/in.duplex3 | 36 +- .../oxDNA2/duplex3/log.27May21.duplex3.g++.1 | 1181 +++++++++++++++ .../oxDNA2/duplex3/log.27May21.duplex3.g++.4 | 1181 +++++++++++++++ .../oxDNA2/duplex3/log.30Jun20.duplex3.g++.1 | 1182 --------------- .../oxDNA2/duplex3/log.30Jun20.duplex3.g++.4 | 1182 --------------- .../oxDNA2/unique_bp/data.duplex4.4type | 238 +-- .../oxDNA2/unique_bp/data.duplex4.8type | 242 ++-- .../oxDNA2/unique_bp/in.duplex4.4type | 45 +- .../oxDNA2/unique_bp/in.duplex4.8type | 45 +- .../unique_bp/log.27May21.duplex4.4type.g++1 | 1230 ++++++++++++++++ .../unique_bp/log.27May21.duplex4.4type.g++4 | 1230 ++++++++++++++++ .../unique_bp/log.27May21.duplex4.8type.g++1 | 1272 +++++++++++++++++ .../unique_bp/log.27May21.duplex4.8type.g++4 | 1272 +++++++++++++++++ .../unique_bp/log.30Jun20.duplex4.4type.g++1 | 244 ---- .../unique_bp/log.30Jun20.duplex4.4type.g++4 | 244 ---- .../unique_bp/log.30Jun20.duplex4.8type.g++1 | 286 ---- .../unique_bp/log.30Jun20.duplex4.8type.g++4 | 286 ---- .../examples/oxRNA2/duplex2/data.duplex2 | 91 ++ .../in.duplex4 => duplex2/in.duplex2} | 40 +- .../oxRNA2/duplex2/log.27May21.duplex2.g++.1 | 1182 +++++++++++++++ .../oxRNA2/duplex2/log.27May21.duplex2.g++.4 | 1182 +++++++++++++++ .../examples/oxRNA2/duplex4/data.duplex4 | 96 -- .../oxRNA2/duplex4/log.30Jun20.duplex4.g++.1 | 1183 --------------- .../oxRNA2/duplex4/log.30Jun20.duplex4.g++.4 | 1183 --------------- src/.gitignore | 12 +- src/CG-DNA/Install.sh | 2 + src/CG-DNA/atom_vec_oxdna.cpp | 103 ++ src/CG-DNA/atom_vec_oxdna.h | 48 + src/CG-DNA/pair_oxdna_stk.cpp | 233 +-- src/CG-DNA/pair_oxdna_stk.h | 1 + src/CG-DNA/pair_oxrna2_stk.cpp | 285 ++-- src/CG-DNA/pair_oxrna2_stk.h | 1 + src/atom.cpp | 47 +- src/atom.h | 20 +- src/atom_vec.h | 2 + src/read_data.cpp | 9 + src/read_data.h | 3 +- 70 files changed, 20432 insertions(+), 16406 deletions(-) create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.4 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.4 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.4 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.4 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.4 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 create mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++4 create mode 100644 examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/data.duplex2 rename examples/PACKAGES/cgdna/examples/oxRNA2/{duplex4/in.duplex4 => duplex2/in.duplex2} (67%) create mode 100644 examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 create mode 100644 examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/data.duplex4 delete mode 100644 examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.1 delete mode 100644 examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.4 create mode 100644 src/CG-DNA/atom_vec_oxdna.cpp create mode 100644 src/CG-DNA/atom_vec_oxdna.h diff --git a/doc/src/PDF/CG-DNA.pdf b/doc/src/PDF/CG-DNA.pdf index 2577875f687a372fd334748c1eabc0e44fba7f6a..632df1fdff1e6f5674b5dc2c4c523c430eea6242 100644 GIT binary patch delta 122968 zcmV(@K-Ryfoq__4=Yj%|B>^*+kta7OQH5GdliNm;zUx=;G=Yu~u>cCsJ#D*XYcw;K zJ??fmc4ZyVKsAXq2+(+_#rgG&S^4-fi@|2M2{!NF1X_Og@a8{$ zFlLdTAAk1!P&S>dZ?+~&y!+;GV?u9k%cZzsT~OHX>6+TEw$p%yT1v&Uw^*Ia_{!7eE+p;zSv=GrqlJf`)RmI zjDJ^7`>H+FR>!|@%W>B~qf6$!kELty@x4xVUtvr?wZuam@$2997&+Ztk!8#=lNNql z` z7SRn1bZENz(EFG4{{f@>v8?+w4u?_f6MtnJ27c^h`o7xtd@>S|ILw7fVdj`C4VD{J 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zYVsF2GY#~v_6Hs4wnUb}e-wWdE_<#Ei85Z`)h2iy(uo=U1==`FHLAjVBF5Lz-Rw_W zE8goO8lLBbG#&LP!v#2h?EX_(5?ygzmuu^zA+2fv)Q=BS;Z)jGHT+bzwDHsDQ94q7 zF{#p1UJ8(vI<3l?kg-ue65W5X7VD1cyh@Z4q-)z#U5d3BDOm!oR#V@D$7fe4V+%bs zTNd+<>YXU9{kb@dO%9FE{?@Z3aPqX(SdZN}5G^KlDjiQ2i|b^mbpd)!a8H6K-mY0& zBRVjAe^6~17@etNu|a)RCQptb{C*uzb%lL>-ey#0_c9yVk;!EVvnNpkGe! wyaM=RKqmZWOLTT|GBvdQpUu(P#n8#c!^zYPnuUpplZ}Z1`uA^9c`@k!2OuO>MgRZ+ diff --git a/doc/src/atom_style.rst b/doc/src/atom_style.rst index a54971cf3b..437324e2d9 100644 --- a/doc/src/atom_style.rst +++ b/doc/src/atom_style.rst @@ -10,7 +10,7 @@ Syntax atom_style style args -* style = *angle* or *atomic* or *body* or *bond* or *charge* or *dipole* or *dpd* or *edpd* or *electron* or *ellipsoid* or *full* or *line* or *mdpd* or *molecular* or *peri* or *smd* or *sph* or *sphere* or *spin* or *tdpd* or *tri* or *template* or *hybrid* +* style = *angle* or *atomic* or *body* or *bond* or *charge* or *dipole* or *dpd* or *edpd* or *electron* or *ellipsoid* or *full* or *line* or *mdpd* or *molecular* or *oxdna* or *peri* or *smd* or *sph* or *sphere* or *spin* or *tdpd* or *tri* or *template* or *hybrid* .. parsed-literal:: @@ -110,6 +110,8 @@ quantities. +--------------+-----------------------------------------------------+--------------------------------------+ | *molecular* | bonds, angles, dihedrals, impropers | uncharged molecules | +--------------+-----------------------------------------------------+--------------------------------------+ +| *oxdna* | nucleotide polarity | coarse-grained DNA and RNA models | ++--------------+-----------------------------------------------------+--------------------------------------+ | *peri* | mass, volume | mesoscopic Peridynamic models | +--------------+-----------------------------------------------------+--------------------------------------+ | *smd* | volume, kernel diameter, contact radius, mass | solid and fluid SPH particles | @@ -193,8 +195,14 @@ position, which is represented by the eradius = electron size. For the *peri* style, the particles are spherical and each stores a per-particle mass and volume. +The *oxdna* style is for coarse-grained nucleotides and stores the +3'-to-5' polarity of the nucleotide strand, which is set through +the bond topology in the data file. The first (second) atom in a +bond definition is understood to point towards the 3'-end (5'-end) +of the strand. Note that this style is part of the USER-CGDNA package. + The *dpd* style is for dissipative particle dynamics (DPD) particles. -Note that it is part of the DPD-REACT package, and is not for use with +Note that it is part of the USER-DPD package, and is not for use with the :doc:`pair_style dpd or dpd/stat ` commands, which can simply use atom_style atomic. Atom_style dpd extends DPD particle properties with internal temperature (dpdTheta), internal conductive @@ -319,7 +327,7 @@ styles take the same arguments and should produce the same results, except for round-off and precision issues. Note that other acceleration packages in LAMMPS, specifically the GPU, -INTEL, OPENMP, and OPT packages do not use accelerated atom +USER-INTEL, USER-OMP, and OPT packages do not use accelerated atom styles. The accelerated styles are part of the KOKKOS package. They are only @@ -352,24 +360,26 @@ The *dipole* style is part of the DIPOLE package. The *peri* style is part of the PERI package for Peridynamics. -The *electron* style is part of the EFF package for :doc:`electronic force fields `. +The *oxdna* style is part of the USER-CGDNA package for coarse-grained simulation of DNA and RNA. -The *dpd* style is part of the DPD-REACT package for dissipative +The *electron* style is part of the USER-EFF package for :doc:`electronic force fields `. + +The *dpd* style is part of the USER-DPD package for dissipative particle dynamics (DPD). -The *edpd*\ , *mdpd*\ , and *tdpd* styles are part of the DPD-MESO package +The *edpd*\ , *mdpd*\ , and *tdpd* styles are part of the USER-MESODPD package for energy-conserving dissipative particle dynamics (eDPD), many-body dissipative particle dynamics (mDPD), and transport dissipative particle dynamics (tDPD), respectively. -The *sph* style is part of the SPH package for smoothed particle +The *sph* style is part of the USER-SPH package for smoothed particle hydrodynamics (SPH). See `this PDF guide `_ to using SPH in LAMMPS. -The *mesont* style is part of the MESONT package. +The *mesont* style is part of the USER-MESONT package. The *spin* style is part of the SPIN package. -The *wavepacket* style is part of the AWPMD package for the +The *wavepacket* style is part of the USER-AWPMD package for the :doc:`antisymmetrized wave packet MD method `. Related commands diff --git a/doc/src/bond_oxdna.rst b/doc/src/bond_oxdna.rst index b2cc68fa22..4f87393aec 100644 --- a/doc/src/bond_oxdna.rst +++ b/doc/src/bond_oxdna.rst @@ -76,17 +76,26 @@ commands: The coefficients in the above example have to be kept fixed and cannot be changed without reparameterizing the entire model. +.. note:: + + This bond style has to be used with the *atom_style hybrid bond ellipsoid oxdna* + (see documentation of :doc:`atom_style `). The *atom_style oxdna* + stores the 3'-to-5' polarity of the nucleotide strand, which is set through + the bond topology in the data file. The first (second) atom in a bond definition + is understood to point towards the 3'-end (5'-end) of the strand. + + Example input and data files for DNA and RNA duplexes can be found in -examples/PACKAGES/cgdna/examples/oxDNA/ , /oxDNA2/ and /oxRNA2/. A simple python +examples/USER/cgdna/examples/oxDNA/ , /oxDNA2/ and /oxRNA2/. A simple python setup tool which creates single straight or helical DNA strands, DNA/RNA duplexes or arrays of DNA/RNA duplexes can be found in -examples/PACKAGES/cgdna/util/. +examples/USER/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxDNA/oxRNA publications. These are :ref:`(Ouldridge) ` and :ref:`(Ouldridge-DPhil) ` for oxDNA, @@ -101,14 +110,14 @@ Restrictions """""""""""" This bond style can only be used if LAMMPS was built with the -CG-DNA package and the MOLECULE and ASPHERE package. See the +USER-CGDNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands """""""""""""""" :doc:`pair_style oxdna/excv `, :doc:`pair_style oxdna2/excv `, :doc:`pair_style oxrna2/excv `, -:doc:`bond_coeff `, :doc:`fix nve/dotc/langevin ` +:doc:`bond_coeff `, :doc:`atom_style oxdna `, :doc:`fix nve/dotc/langevin ` Default """"""" diff --git a/doc/src/pair_oxdna.rst b/doc/src/pair_oxdna.rst index b6b55a503b..26479bccc6 100644 --- a/doc/src/pair_oxdna.rst +++ b/doc/src/pair_oxdna.rst @@ -91,15 +91,23 @@ for a detailed description of the oxDNA force field. or :doc:`fix nve/dotc/langevin ` the temperature coefficients have to be matched to the one used in the fix. -Example input and data files for DNA duplexes can be found in examples/PACKAGES/cgdna/examples/oxDNA/ and /oxDNA2/. +.. note:: + + These pair styles have to be used with the *atom_style hybrid bond ellipsoid oxdna* + (see documentation of :doc:`atom_style `). The *atom_style oxdna* + stores the 3'-to-5' polarity of the nucleotide strand, which is set through + the bond topology in the data file. The first (second) atom in a bond definition + is understood to point towards the 3'-end (5'-end) of the strand. + +Example input and data files for DNA duplexes can be found in examples/USER/cgdna/examples/oxDNA/ and /oxDNA2/. A simple python setup tool which creates single straight or helical DNA strands, -DNA duplexes or arrays of DNA duplexes can be found in examples/PACKAGES/cgdna/util/. +DNA duplexes or arrays of DNA duplexes can be found in examples/USER/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxDNA publications :ref:`(Ouldridge) `, :ref:`(Ouldridge-DPhil) ` @@ -111,7 +119,7 @@ Restrictions """""""""""" These pair styles can only be used if LAMMPS was built with the -CG-DNA package and the MOLECULE and ASPHERE package. See the +USER-CGDNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands @@ -120,7 +128,7 @@ Related commands :doc:`bond_style oxdna/fene `, :doc:`pair_coeff `, :doc:`bond_style oxdna2/fene `, :doc:`pair_style oxdna2/excv `, :doc:`bond_style oxrna2/fene `, :doc:`pair_style oxrna2/excv `, -:doc:`fix nve/dotc/langevin ` +:doc:`atom_style oxdna `, :doc:`fix nve/dotc/langevin ` Default """"""" diff --git a/doc/src/pair_oxdna2.rst b/doc/src/pair_oxdna2.rst index 37739c3813..7f5a2642eb 100644 --- a/doc/src/pair_oxdna2.rst +++ b/doc/src/pair_oxdna2.rst @@ -100,15 +100,23 @@ and :ref:`(Ouldridge) ` for a detailed description of the oxDNA2 fo e.g. through :doc:`fix langevin ` or :doc:`fix nve/dotc/langevin ` the temperature coefficients have to be matched to the one used in the fix. -Example input and data files for DNA duplexes can be found in examples/PACKAGES/cgdna/examples/oxDNA/ and /oxDNA2/. +.. note:: + + These pair styles have to be used with the *atom_style hybrid bond ellipsoid oxdna* + (see documentation of :doc:`atom_style `). The *atom_style oxdna* + stores the 3'-to-5' polarity of the nucleotide strand, which is set through + the bond topology in the data file. The first (second) atom in a bond definition + is understood to point towards the 3'-end (5'-end) of the strand. + +Example input and data files for DNA duplexes can be found in examples/USER/cgdna/examples/oxDNA/ and /oxDNA2/. A simple python setup tool which creates single straight or helical DNA strands, -DNA duplexes or arrays of DNA duplexes can be found in examples/PACKAGES/cgdna/util/. +DNA duplexes or arrays of DNA duplexes can be found in examples/USER/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxDNA2 publications :ref:`(Snodin) ` and :ref:`(Sulc) `. @@ -118,7 +126,7 @@ Restrictions """""""""""" These pair styles can only be used if LAMMPS was built with the -CG-DNA package and the MOLECULE and ASPHERE package. See the +USER-CGDNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands @@ -127,7 +135,7 @@ Related commands :doc:`bond_style oxdna2/fene `, :doc:`pair_coeff `, :doc:`bond_style oxdna/fene `, :doc:`pair_style oxdna/excv `, :doc:`bond_style oxrna2/fene `, :doc:`pair_style oxrna2/excv `, -:doc:`fix nve/dotc/langevin ` +:doc:`atom_style oxdna `, :doc:`fix nve/dotc/langevin ` Default """"""" diff --git a/doc/src/pair_oxrna2.rst b/doc/src/pair_oxrna2.rst index bd89f1fec0..81c5562489 100644 --- a/doc/src/pair_oxrna2.rst +++ b/doc/src/pair_oxrna2.rst @@ -101,15 +101,23 @@ and :ref:`(Ouldridge) ` for a detailed description of the oxRNA2 fo e.g. through :doc:`fix langevin ` or :doc:`fix nve/dotc/langevin ` the temperature coefficients have to be matched to the one used in the fix. -Example input and data files for DNA duplexes can be found in examples/PACKAGES/cgdna/examples/oxDNA/ and /oxDNA2/. +.. note:: + + These pair styles have to be used with the *atom_style hybrid bond ellipsoid oxdna* + (see documentation of :doc:`atom_style `). The *atom_style oxdna* + stores the 3'-to-5' polarity of the nucleotide strand, which is set through + the bond topology in the data file. The first (second) atom in a bond definition + is understood to point towards the 3'-end (5'-end) of the strand. + +Example input and data files for DNA duplexes can be found in examples/USER/cgdna/examples/oxDNA/ and /oxDNA2/. A simple python setup tool which creates single straight or helical DNA strands, -DNA duplexes or arrays of DNA duplexes can be found in examples/PACKAGES/cgdna/util/. +DNA duplexes or arrays of DNA duplexes can be found in examples/USER/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxRNA2 publications :ref:`(Sulc1) ` and :ref:`(Sulc2) `. @@ -119,7 +127,7 @@ Restrictions """""""""""" These pair styles can only be used if LAMMPS was built with the -CG-DNA package and the MOLECULE and ASPHERE package. See the +USER-CGDNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands @@ -128,7 +136,7 @@ Related commands :doc:`bond_style oxrna2/fene `, :doc:`pair_coeff `, :doc:`bond_style oxdna/fene `, :doc:`pair_style oxdna/excv `, :doc:`bond_style oxdna2/fene `, :doc:`pair_style oxdna2/excv `, -:doc:`fix nve/dotc/langevin ` +:doc:`atom_style oxdna `, :doc:`fix nve/dotc/langevin ` Default """"""" diff --git a/doc/utils/sphinx-config/false_positives.txt b/doc/utils/sphinx-config/false_positives.txt index e57f81dbc8..b7c9853a61 100644 --- a/doc/utils/sphinx-config/false_positives.txt +++ b/doc/utils/sphinx-config/false_positives.txt @@ -1325,7 +1325,6 @@ hyperradius hyperspherical hysteretic hz -IAP Ibanez iatom ibar @@ -1648,8 +1647,6 @@ larentzos Larentzos Laroche lars -LATBOLTZ -latboltz latencies Latour latourr @@ -1800,8 +1797,6 @@ Lysogorskiy Lyulin lz Maaravi -MACHDYN -machdyn Mackay Mackrodt Macromolecules @@ -1896,7 +1891,8 @@ mdi mdpd mDPD meam -MEAM +meamc +MEAMC meamf meanDist mech @@ -2323,6 +2319,7 @@ Ntriples Ntype ntypes Ntypes +nucleotide nucleotides nullptr num @@ -2680,7 +2677,6 @@ qoverride qqr qqrd qtb -Quadfel quadratically quadrupolar Quant @@ -2740,7 +2736,7 @@ README realtime reamin reax -REAXFF +REAXC ReaxFF rebo recursing @@ -2862,7 +2858,6 @@ Rossky rosybrown rotationally Rotenberg -Rothenburg Rovigatti royalblue rozero diff --git a/examples/PACKAGES/cgdna/README b/examples/PACKAGES/cgdna/README index a403ce0321..9ad170b639 100644 --- a/examples/PACKAGES/cgdna/README +++ b/examples/PACKAGES/cgdna/README @@ -72,7 +72,7 @@ between two individual nucleotides can be established. /******************************************************************************/ -/examples/oxRNA2/duplex4 +/examples/oxRNA2/duplex2 This example uses the duplex2 with the oxRNA2 force field instead of oxDNA or oxDNA2 force field. Sequence-dependent stacking and hydrogen-bonding diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/data.duplex1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/data.duplex1 index 0ef671c603..54eb2beaf5 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/data.duplex1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/data.duplex1 @@ -1,15 +1,14 @@ -# LAMMPS data file +LAMMPS data file via write_data, version 27 May 2021 + 10 atoms -10 ellipsoids -8 bonds - 4 atom types +8 bonds 1 bond types +10 ellipsoids -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi Masses @@ -18,56 +17,52 @@ Masses 3 3.1575 4 3.1575 -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms +Atoms # hybrid -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.860249842674776e-01 -3.518234140414736e-01 3.897628551303122e-01 1 1 1 -3 3 -1.874009511073395e-01 -5.699832309147915e-01 7.795257102606244e-01 1 1 1 -4 4 1.824198365552941e-01 -5.715968887521518e-01 1.169288565390937e+00 1 1 1 -5 1 4.829362784135484e-01 -3.560513319622209e-01 1.559051420521249e+00 1 1 1 -6 4 -4.829362784135484e-01 3.560513319622209e-01 1.559051420521249e+00 2 1 1 -7 1 -1.824198365552941e-01 5.715968887521516e-01 1.169288565390937e+00 2 1 1 -8 2 1.874009511073395e-01 5.699832309147913e-01 7.795257102606243e-01 2 1 1 -9 3 4.860249842674775e-01 3.518234140414733e-01 3.897628551303121e-01 2 1 1 -10 4 5.999999999999996e-01 -1.332267629550188e-16 -1.110223024625157e-16 2 1 1 +1 1 -0.33741452300167507 -0.43708835412476305 0.6450685042019271 1 1 3.7269849963023267 0 0 0 +2 2 -0.32142606102826937 -0.7137743037592722 1.1817366147004618 1 1 3.7269849963023267 0 0 0 +3 3 -0.130363628207774 -0.9147144801536078 1.62581312195109 1 1 3.7269849963023267 0 0 0 +4 4 0.16795127962282844 -0.9808507459807022 2.0894908590909003 1 1 3.7269849963023267 0 0 0 +5 1 0.46370423490634166 -0.7803347954883079 2.4251986815515827 1 1 3.7269849963023267 0 0 0 +6 4 -0.4462950185476711 0.09062163051035639 2.4668941268777607 2 1 3.7269849963023267 0 0 0 +7 1 -0.03377054097560965 0.20979847489755046 2.078208732038921 2 1 3.7269849963023267 0 0 0 +8 2 0.3297325391466579 0.17657587120899895 1.7206328374934152 2 1 3.7269849963023267 0 0 0 +9 3 0.6063699309305985 0.04682595158675571 1.2335049647817748 2 1 3.7269849963023267 0 0 0 +10 4 0.8003979559814726 -0.364393011459011 0.9884025318908612 2 1 3.7269849963023267 0 0 0 -# Atom-ID, translational velocity, angular momentum Velocities -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 +1 0.320321385294804 -0.13632815939410442 -0.029398292452023418 0.3064009492028237 -0.15808560233691588 0.35878007201886397 +2 0.16868594667473025 -0.04950805613064363 0.15811007290373785 -0.07666583909321756 -0.0008074676325318194 -0.21475821019816385 +3 -0.22924557018300165 0.08381876748892438 -0.0919832851533896 0.4039387481683193 0.6123610642545824 -0.11063432848545783 +4 -0.22186204313310393 0.04952817499985707 -0.0693642101605732 -0.1358248430264938 0.4118493572385653 -0.056529305922687775 +5 0.08156431270087049 -0.2564594759800144 0.1724544416027875 0.05439894663158808 0.09338481510384318 0.3205408219238883 +6 0.03598698404367743 -0.04868642973674152 0.02860105256592922 0.04007709957283992 -0.317943400069374 0.36438025397586354 +7 -0.00822868972307372 0.047514932936351305 -0.027726409420297023 0.18356392696891796 -0.49877294396308003 0.06993313839189567 +8 -0.07177147672242379 0.1718272727853115 0.39056151182616994 -0.16728362538690794 -0.47839708820957955 -0.17897249005947627 +9 -0.1748638855727651 -0.0781638161351808 0.0560181565271157 -0.28062568580131014 0.2405396522734162 -0.4311598357169048 +10 0.18870318272756448 -0.1066780134639517 0.12610657946741227 -0.05740397100183697 0.36748833227892685 0.1498775724372025 -# Atom-ID, shape, quaternion -Ellipsoids - -1 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.513258223252946e-01 0.000000000000000e+00 0.000000000000000e+00 3.081869234362515e-01 -3 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 8.100416404457962e-01 0.000000000000000e+00 0.000000000000000e+00 5.863723567357894e-01 -4 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.899012371043606e-01 0.000000000000000e+00 0.000000000000000e+00 8.074754054847398e-01 -5 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 3.123349185122326e-01 0.000000000000000e+00 0.000000000000000e+00 9.499720515246527e-01 -6 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.499720515246527e-01 -3.123349185122326e-01 -0.000000000000000e+00 -7 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.074754054847401e-01 -5.899012371043604e-01 0.000000000000000e+00 -8 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 5.863723567357896e-01 -8.100416404457959e-01 0.000000000000000e+00 -9 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -3.081869234362514e-01 9.513258223252947e-01 0.000000000000000e+00 -10 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 1.110223024625157e-16 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology Bonds -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 6 7 -6 1 7 8 -7 1 8 9 -8 1 9 10 +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 6 7 +6 1 7 8 +7 1 8 9 +8 1 9 10 + +Ellipsoids + +1 1.173984503142341 1.173984503142341 1.173984503142341 0.9890278201757743 0.01779228232037064 -0.14337734159225404 0.030827642240801516 +2 1.173984503142341 1.173984503142341 1.173984503142341 0.939687458852748 0.04174166924055095 -0.023337773785056866 0.338674565089608 +3 1.173984503142341 1.173984503142341 1.173984503142341 0.8210113150655425 0.03012140921736572 0.017666019956944813 0.5698429897612057 +4 1.173984503142341 1.173984503142341 1.173984503142341 0.6623662858285051 -0.028186343967346823 0.022942552517501488 0.7482981175276918 +5 1.173984503142341 1.173984503142341 1.173984503142341 0.3601488726765216 0.0513614985821682 0.0724224158335286 0.9286602067807472 +6 1.173984503142341 1.173984503142341 1.173984503142341 0.11941234710084649 0.9244660117493703 -0.35317942248051865 -0.07979711784524246 +7 1.173984503142341 1.173984503142341 1.173984503142341 -0.17949125421205164 0.7412884899431119 -0.6379094464220707 0.1065166771202199 +8 1.173984503142341 1.173984503142341 1.173984503142341 -0.10483691088405202 0.5508895999584645 -0.8250090480220789 0.06992811634525403 +9 1.173984503142341 1.173984503142341 1.173984503142341 0.07777239911646 -0.3724087549185288 0.9103052384821374 -0.1631181963720798 +10 1.173984503142341 1.173984503142341 1.173984503142341 0.16279109707978262 0.027148630125149613 0.9849325709665359 -0.0516705065113425 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/in.duplex1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/in.duplex1 index 04ff545704..fcddbf51ba 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/in.duplex1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/in.duplex1 @@ -11,11 +11,11 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 1 delay 0 check yes read_data data.duplex1 @@ -40,27 +40,16 @@ pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 # NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" +compute quat all property/atom quatw quati quatj quatk compute erot all erotate/asphere compute ekin all ke @@ -71,10 +60,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" run 1000000 -#write_restart config.${number}.* +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 new file mode 100644 index 0000000000..6433d417de --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 @@ -0,0 +1,1171 @@ +LAMMPS (27 May 2021) +variable number equal 1 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex1 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 10 atoms + reading velocities ... + 10 velocities + scanning bonds ... + 2 = max bonds/atom + 10 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 8 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.002 seconds + +set atom * mass 3.1575 +Setting atom values ... + 10 settings made for mass + +group all type 1 4 +10 atoms in group all + +# oxDNA bond interactions - FENE backbone +bond_style oxdna/fene +bond_coeff * 2.0 0.25 0.7525 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk +pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.1.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 2.9560004 + ghost atom cutoff = 3.8 + binsize = 1.4780002, bins = 28 28 28 + 4 neighbor lists, perpetual/occasional/extra = 4 0 0 + (1) pair oxdna/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +0 ekin = 1.10853632272819 | erot = 2.81573649976629 | epot = -13.0576219534369 | etot = -9.13334913094246 +Per MPI rank memory allocation (min/avg/max) = 9.199 | 9.199 | 9.199 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.082113802 -1.3488546 0.043092397 -1.1949086 -4.6816211e-05 64000 +1000 ekin = 1.08024346604046 | erot = 2.90873406534668 | epot = -13.1223266626202 | etot = -9.13334913123307 +2000 ekin = 1.05028450914437 | erot = 2.98006324808558 | epot = -13.1636968886591 | etot = -9.13334913142915 +3000 ekin = 1.01964458529397 | erot = 3.02592193798632 | epot = -13.1789156547658 | etot = -9.13334913148547 +4000 ekin = 0.989515033089539 | erot = 3.04428486059471 | epot = -13.1671490250724 | etot = -9.13334913138813 +5000 ekin = 0.961283929687833 | erot = 3.03510855539557 | epot = -13.1297416162282 | etot = -9.13334913114481 +6000 ekin = 0.936412193404256 | erot = 3.00022299571975 | epot = -13.0699843199583 | etot = -9.13334913083425 +7000 ekin = 0.916233699107968 | erot = 2.9427713444016 | epot = -12.9923541739966 | etot = -9.13334913048708 +8000 ekin = 0.901760662506268 | erot = 2.86671228744165 | epot = -12.9018220800865 | etot = -9.13334913013859 +9000 ekin = 0.893571390067879 | erot = 2.77649686780605 | epot = -12.8034173876806 | etot = -9.13334912980667 +10000 ekin = 0.891805685056846 | erot = 2.67686855006734 | epot = -12.7020233645916 | etot = -9.13334912946739 +11000 ekin = 0.896243557993589 | erot = 2.57266042063119 | epot = -12.6022531078194 | etot = -9.13334912919466 +12000 ekin = 0.906416039154817 | erot = 2.46827537271556 | epot = -12.5080405408347 | etot = -9.13334912896435 +13000 ekin = 0.921704091778491 | erot = 2.36760645470833 | epot = -12.4226596752787 | etot = -9.13334912879189 +14000 ekin = 0.941405275130078 | erot = 2.27374941641176 | epot = -12.3485038202328 | etot = -9.13334912869101 +15000 ekin = 0.964770892951775 | erot = 2.18876720165113 | epot = -12.2868872232635 | etot = -9.13334912866062 +16000 ekin = 0.991029016801086 | erot = 2.11380018376645 | epot = -12.2381783292304 | etot = -9.13334912866289 +17000 ekin = 1.01940907375712 | erot = 2.04893605182118 | epot = -12.2016942543555 | etot = -9.13334912877717 +18000 ekin = 1.04917923728265 | erot = 1.99335017578101 | epot = -12.1758785419805 | etot = -9.1333491289168 +19000 ekin = 1.07969247848165 | erot = 1.9456993336297 | epot = -12.158740941176 | etot = -9.1333491290647 +20000 ekin = 1.11043268152286 | erot = 1.90411175657083 | epot = -12.1478935672812 | etot = -9.13334912918749 +21000 ekin = 1.14104909735583 | erot = 1.8669588297925 | epot = -12.1413570564146 | etot = -9.13334912926631 +22000 ekin = 1.17136821848099 | erot = 1.83313674901904 | epot = -12.137854096792 | etot = -9.13334912929197 +23000 ekin = 1.20137634097693 | erot = 1.80222523558985 | epot = -12.1369507058331 | etot = -9.13334912926636 +24000 ekin = 1.23117249622899 | erot = 1.77451266102195 | epot = -12.1390342864515 | etot = -9.13334912920057 +25000 ekin = 1.26089526640644 | erot = 1.75088411697598 | epot = -12.1451285124969 | etot = -9.13334912911446 +26000 ekin = 1.29063712254632 | erot = 1.73259428379509 | epot = -12.1565805353676 | etot = -9.13334912902614 +27000 ekin = 1.32035987087029 | erot = 1.72114061671178 | epot = -12.174849616541 | etot = -9.13334912895896 +28000 ekin = 1.34980460658797 | erot = 1.71795709927858 | epot = -12.2011108348018 | etot = -9.13334912893528 +29000 ekin = 1.37841624051162 | erot = 1.72414013785742 | epot = -12.2359055073442 | etot = -9.13334912897515 +30000 ekin = 1.40529015727354 | erot = 1.7401965663967 | epot = -12.2788358527639 | etot = -9.13334912909364 +31000 ekin = 1.42915801743398 | erot = 1.76583252336952 | epot = -12.3283396701001 | etot = -9.13334912929657 +32000 ekin = 1.44843712560542 | erot = 1.79982181745343 | epot = -12.381608072634 | etot = -9.13334912957512 +33000 ekin = 1.4613690466868 | erot = 1.84000474140075 | epot = -12.4347229179884 | etot = -9.13334912990085 +34000 ekin = 1.46625940785515 | erot = 1.8834645985662 | epot = -12.4830731366474 | etot = -9.13334913022609 +35000 ekin = 1.46179739484306 | erot = 1.92688889524941 | epot = -12.5220354205852 | etot = -9.1333491304927 +36000 ekin = 1.44738855724075 | erot = 1.96705754746497 | epot = -12.5477952353504 | etot = -9.13334913064463 +37000 ekin = 1.42340054468548 | erot = 2.00129614949928 | epot = -12.5580458249024 | etot = -9.13334913071763 +38000 ekin = 1.39122781542979 | erot = 2.02761655303766 | epot = -12.5521934990546 | etot = -9.13334913058718 +39000 ekin = 1.35313842096815 | erot = 2.04547852103605 | epot = -12.5319660723435 | etot = -9.13334913033932 +40000 ekin = 1.3119358769936 | erot = 2.05554364627561 | epot = -12.5008286533154 | etot = -9.13334913004622 +41000 ekin = 1.27054093924541 | erot = 2.05894429581373 | epot = -12.4628343648331 | etot = -9.13334912977395 +42000 ekin = 1.23161000992325 | erot = 2.0569489325571 | epot = -12.4219080720068 | etot = -9.13334912952641 +43000 ekin = 1.19723969759492 | erot = 2.0508575807566 | epot = -12.3814464076994 | etot = -9.13334912934792 +44000 ekin = 1.16880185863997 | erot = 2.0417223836063 | epot = -12.3438733714903 | etot = -9.13334912924402 +45000 ekin = 1.14690787175718 | erot = 2.03029950061776 | epot = -12.3105565015798 | etot = -9.13334912920486 +46000 ekin = 1.13147919636051 | erot = 2.01712256175378 | epot = -12.2819508873242 | etot = -9.13334912920993 +47000 ekin = 1.12189300492721 | erot = 2.00264798837262 | epot = -12.2578901225351 | etot = -9.13334912923523 +48000 ekin = 1.11716788112728 | erot = 1.98739120721199 | epot = -12.2379082176346 | etot = -9.13334912929533 +49000 ekin = 1.1161579479525 | erot = 1.9718736810838 | epot = -12.2213807583349 | etot = -9.13334912929863 +50000 ekin = 1.11772326336401 | erot = 1.95708534394633 | epot = -12.2081577365826 | etot = -9.13334912927228 +51000 ekin = 1.12084924497878 | erot = 1.94437394210225 | epot = -12.1985723162997 | etot = -9.1333491292187 +52000 ekin = 1.12470549785255 | erot = 1.93529800314878 | epot = -12.193352630151 | etot = -9.13334912914964 +53000 ekin = 1.12864556674978 | erot = 1.93145365271669 | epot = -12.1934483485498 | etot = -9.13334912908328 +54000 ekin = 1.13216113523089 | erot = 1.93430274875511 | epot = -12.1998130130121 | etot = -9.13334912902615 +55000 ekin = 1.13481106600234 | erot = 1.94490436967246 | epot = -12.2130645647022 | etot = -9.13334912902743 +56000 ekin = 1.13614343535815 | erot = 1.96361884590791 | epot = -12.2331114103531 | etot = -9.13334912908709 +57000 ekin = 1.1356317831128 | erot = 1.99002978527249 | epot = -12.2590106975985 | etot = -9.13334912921326 +58000 ekin = 1.13263976908242 | erot = 2.02286978616499 | epot = -12.2888586846526 | etot = -9.1333491294052 +59000 ekin = 1.1264242611343 | erot = 2.0600441344171 | epot = -12.3198175252029 | etot = -9.13334912965145 +60000 ekin = 1.11618536041532 | erot = 2.09876774945548 | epot = -12.3483022398005 | etot = -9.13334912992969 +61000 ekin = 1.10116810417865 | erot = 2.13581434618271 | epot = -12.3703315805684 | etot = -9.13334913020702 +62000 ekin = 1.08081637521803 | erot = 2.16786879318304 | epot = -12.3820342988433 | etot = -9.13334913044225 +63000 ekin = 1.0549701442815 | erot = 2.19194503254439 | epot = -12.3802643074576 | etot = -9.13334913063172 +64000 ekin = 1.02408601603158 | erot = 2.20562384873134 | epot = -12.363058995418 | etot = -9.13334913065512 +65000 ekin = 0.989434415807708 | erot = 2.20769180278661 | epot = -12.3304753491252 | etot = -9.13334913053086 +66000 ekin = 0.953195593563862 | erot = 2.19842250482632 | epot = -12.2849672286539 | etot = -9.13334913026373 +67000 ekin = 0.918366365968225 | erot = 2.17942400884185 | epot = -12.2311395047049 | etot = -9.1333491298948 +68000 ekin = 0.888467814666231 | erot = 2.15321364358203 | epot = -12.1750305877201 | etot = -9.13334912947183 +69000 ekin = 0.867150037001581 | erot = 2.12288633704373 | epot = -12.1233855031208 | etot = -9.13334912907546 +70000 ekin = 0.857579951604692 | erot = 2.09151913845149 | epot = -12.082448218843 | etot = -9.13334912878685 +71000 ekin = 0.861815425267398 | erot = 2.06157004239557 | epot = -12.0567345963619 | etot = -9.1333491286989 +72000 ekin = 0.880191815685381 | erot = 2.03435275439358 | epot = -12.0478936988731 | etot = -9.13334912879414 +73000 ekin = 0.911201453876584 | erot = 2.00982694750394 | epot = -12.0543775304379 | etot = -9.13334912905734 +74000 ekin = 0.951849895585041 | erot = 1.9868541827262 | epot = -12.0720532077345 | etot = -9.13334912942327 +75000 ekin = 0.99815100864117 | erot = 1.96362530027599 | epot = -12.0951254387264 | etot = -9.13334912980919 +76000 ekin = 1.04581734271588 | erot = 1.93821700241353 | epot = -12.117383475267 | etot = -9.13334913013757 +77000 ekin = 1.09091996835703 | erot = 1.90910715282285 | epot = -12.1333762515352 | etot = -9.13334913035536 +78000 ekin = 1.1303763192792 | erot = 1.87551578135385 | epot = -12.1392412310751 | etot = -9.13334913044201 +79000 ekin = 1.16219588597788 | erot = 1.83750580183261 | epot = -12.1330508182184 | etot = -9.13334913040788 +80000 ekin = 1.18548972632236 | erot = 1.7958594266999 | epot = -12.1146982833063 | etot = -9.13334913028402 +81000 ekin = 1.2003060571896 | erot = 1.7518136593975 | epot = -12.0854688466957 | etot = -9.13334913010857 +82000 ekin = 1.20737786492201 | erot = 1.70676694760222 | epot = -12.047493942439 | etot = -9.13334912991478 +83000 ekin = 1.20786051402077 | erot = 1.66205278152633 | epot = -12.0032624252717 | etot = -9.13334912972465 +84000 ekin = 1.2031099157248 | erot = 1.61882913247322 | epot = -11.9552881777461 | etot = -9.13334912954807 +85000 ekin = 1.19452073297168 | erot = 1.57808043002419 | epot = -11.905950292382 | etot = -9.13334912938609 +86000 ekin = 1.1834210068256 | erot = 1.54069268896236 | epot = -11.8574628250235 | etot = -9.13334912923555 +87000 ekin = 1.17100858957346 | erot = 1.50755090689516 | epot = -11.8119086255617 | etot = -9.13334912909308 +88000 ekin = 1.15831377551682 | erot = 1.47961680456717 | epot = -11.7712797090416 | etot = -9.13334912895765 +89000 ekin = 1.14617682817399 | erot = 1.45796378128887 | epot = -11.7374897382937 | etot = -9.13334912883082 +90000 ekin = 1.1352344796942 | erot = 1.44376438030019 | epot = -11.7123479887108 | etot = -9.13334912871639 +91000 ekin = 1.12591345720549 | erot = 1.4382377250094 | epot = -11.6975003108345 | etot = -9.13334912861963 +92000 ekin = 1.11843099489285 | erot = 1.44256930748509 | epot = -11.6943494309244 | etot = -9.13334912854647 +93000 ekin = 1.11280329634815 | erot = 1.45781524814476 | epot = -11.7039676729951 | etot = -9.13334912850217 +94000 ekin = 1.1088620912734 | erot = 1.48480045701867 | epot = -11.7270116767841 | etot = -9.13334912849204 +95000 ekin = 1.10627886010341 | erot = 1.52396220647534 | epot = -11.7635901951105 | etot = -9.1333491285317 +96000 ekin = 1.10459509814424 | erot = 1.57519859223417 | epot = -11.8131428189843 | etot = -9.13334912860592 +97000 ekin = 1.10325943769906 | erot = 1.63800664193794 | epot = -11.8746152083616 | etot = -9.13334912872458 +98000 ekin = 1.10166959581646 | erot = 1.71130689804965 | epot = -11.9463256227537 | etot = -9.13334912888763 +99000 ekin = 1.09921849385163 | erot = 1.79339905630357 | epot = -12.025966679247 | etot = -9.13334912909177 +100000 ekin = 1.09534596880106 | erot = 1.88196872528567 | epot = -12.110663823416 | etot = -9.13334912932925 +101000 ekin = 1.08959720755117 | erot = 1.9741561693145 | epot = -12.1971025064518 | etot = -9.13334912958617 +102000 ekin = 1.08168751154815 | erot = 2.06670282185174 | epot = -12.2817394632424 | etot = -9.13334912984251 +103000 ekin = 1.07156932342314 | erot = 2.1561819250806 | epot = -12.3611003785771 | etot = -9.13334913007335 +104000 ekin = 1.05949237996071 | erot = 2.23930158373566 | epot = -12.4321430939484 | etot = -9.13334913025202 +105000 ekin = 1.04604342224876 | erot = 2.31323902285848 | epot = -12.4926315754929 | etot = -9.13334913038569 +106000 ekin = 1.03224316318559 | erot = 2.37579242095986 | epot = -12.5413847145642 | etot = -9.13334913041873 +107000 ekin = 1.01951120148931 | erot = 2.4258560374057 | epot = -12.5787163692801 | etot = -9.13334913038512 +108000 ekin = 1.00875017477207 | erot = 2.46348952984498 | epot = -12.6055888348734 | etot = -9.13334913025635 +109000 ekin = 1.00109573552394 | erot = 2.48980806114977 | epot = -12.6242529267277 | etot = -9.13334913005403 +110000 ekin = 0.997931591358088 | erot = 2.5067391861081 | epot = -12.6380199072774 | etot = -9.13334912981123 +111000 ekin = 1.00076792351317 | erot = 2.51665915373057 | epot = -12.6507762068075 | etot = -9.13334912956375 +112000 ekin = 1.01109610479921 | erot = 2.52200701599672 | epot = -12.666452250139 | etot = -9.13334912934309 +113000 ekin = 1.03019016817876 | erot = 2.52496101252908 | epot = -12.6885003099862 | etot = -9.13334912927831 +114000 ekin = 1.05821017520619 | erot = 2.52722573627543 | epot = -12.7187850407016 | etot = -9.13334912922002 +115000 ekin = 1.09472530400134 | erot = 2.53003930448858 | epot = -12.7581137377194 | etot = -9.13334912922944 +116000 ekin = 1.13884650903324 | erot = 2.5341483243048 | epot = -12.806343962644 | etot = -9.13334912930592 +117000 ekin = 1.18909444999475 | erot = 2.53980839277165 | epot = -12.862251972215 | etot = -9.13334912944864 +118000 ekin = 1.24341490970464 | erot = 2.54678348242668 | epot = -12.923547521787 | etot = -9.13334912965564 +119000 ekin = 1.29923662064181 | erot = 2.55432909401041 | epot = -12.9869148445731 | etot = -9.13334912992093 +120000 ekin = 1.35358959215635 | erot = 2.56118615921826 | epot = -13.0481248816038 | etot = -9.13334913022922 +121000 ekin = 1.40329803815439 | erot = 2.56563135861683 | epot = -13.1022785273255 | etot = -9.1333491305543 +122000 ekin = 1.445246921966 | erot = 2.56562448409245 | epot = -13.1442205369173 | etot = -9.1333491308589 +123000 ekin = 1.47669540804816 | erot = 2.55906317998218 | epot = -13.169107719131 | etot = -9.13334913110063 +124000 ekin = 1.49558302658146 | erot = 2.5441110594373 | epot = -13.1730432172611 | etot = -9.13334913124231 +125000 ekin = 1.50076122489725 | erot = 2.51952798471315 | epot = -13.1536383408711 | etot = -9.13334913126073 +126000 ekin = 1.492147286847 | erot = 2.48515933103523 | epot = -13.1106557490372 | etot = -9.13334913115495 +127000 ekin = 1.47053410713945 | erot = 2.4417448007513 | epot = -13.0456280388473 | etot = -9.13334913095659 +128000 ekin = 1.43743445323496 | erot = 2.39059049317552 | epot = -12.9613740770757 | etot = -9.13334913066523 +129000 ekin = 1.39501109707047 | erot = 2.33380120125823 | epot = -12.8621614286434 | etot = -9.13334913031469 +130000 ekin = 1.34584042016749 | erot = 2.27401545397179 | epot = -12.7532050040791 | etot = -9.13334912993986 +131000 ekin = 1.2926893078659 | erot = 2.21410134111226 | epot = -12.6401397785506 | etot = -9.13334912957246 +132000 ekin = 1.23832315616827 | erot = 2.15686384200888 | epot = -12.5285361274153 | etot = -9.13334912923812 +133000 ekin = 1.18535267681206 | erot = 2.10479906741761 | epot = -12.4235008731851 | etot = -9.13334912895546 +134000 ekin = 1.13612155562826 | erot = 2.05991346428631 | epot = -12.3293841486505 | etot = -9.13334912873589 +135000 ekin = 1.0926326232607 | erot = 2.02360952444368 | epot = -12.2495912762905 | etot = -9.13334912858609 +136000 ekin = 1.05650575788368 | erot = 1.99662030668685 | epot = -12.1864751930781 | etot = -9.13334912850755 +137000 ekin = 1.02895878679479 | erot = 1.97899212834889 | epot = -12.1413000436434 | etot = -9.13334912849973 +138000 ekin = 1.01080388995871 | erot = 1.97013512172236 | epot = -12.1142881402333 | etot = -9.13334912855227 +139000 ekin = 1.0024545939537 | erot = 1.96888144460879 | epot = -12.1046851672404 | etot = -9.13334912867795 +140000 ekin = 1.00393780740642 | erot = 1.97333010973457 | epot = -12.1106170460029 | etot = -9.13334912886192 +141000 ekin = 1.01490973367055 | erot = 1.981045309448 | epot = -12.1293041722138 | etot = -9.1333491290952 +142000 ekin = 1.03468044934438 | erot = 1.98917872502441 | epot = -12.1572083037337 | etot = -9.13334912936491 +143000 ekin = 1.06225104646194 | erot = 1.99463134790794 | epot = -12.1902315240233 | etot = -9.13334912965338 +144000 ekin = 1.09636709127268 | erot = 1.99441220318412 | epot = -12.2241284243805 | etot = -9.13334912992373 +145000 ekin = 1.13559045362138 | erot = 1.98572590466025 | epot = -12.2546654884644 | etot = -9.13334913018274 +146000 ekin = 1.17838854122105 | erot = 1.96612892354279 | epot = -12.2778665951536 | etot = -9.1333491303898 +147000 ekin = 1.22300699749193 | erot = 1.93405129395002 | epot = -12.290407421963 | etot = -9.1333491305211 +148000 ekin = 1.2678567786303 | erot = 1.8889162135087 | epot = -12.2901221226999 | etot = -9.13334913056086 +149000 ekin = 1.3117055148731 | erot = 1.83123494690898 | epot = -12.2762895922886 | etot = -9.13334913050653 +150000 ekin = 1.35361858091208 | erot = 1.76263607509641 | epot = -12.2496037863729 | etot = -9.1333491303644 +151000 ekin = 1.39299848911435 | erot = 1.68572491420636 | epot = -12.2120725334744 | etot = -9.13334913015369 +152000 ekin = 1.42958376961917 | erot = 1.60381549112361 | epot = -12.1667483906421 | etot = -9.13334912989933 +153000 ekin = 1.46340801747597 | erot = 1.52060159601932 | epot = -12.1173587431246 | etot = -9.13334912962934 +154000 ekin = 1.49472650224563 | erot = 1.43981503875286 | epot = -12.0678906703689 | etot = -9.13334912937042 +155000 ekin = 1.52392161825078 | erot = 1.36491657683223 | epot = -12.0221873242284 | etot = -9.13334912914537 +156000 ekin = 1.55140022159552 | erot = 1.29884972381827 | epot = -11.9835990743854 | etot = -9.13334912897165 +157000 ekin = 1.57749707056581 | erot = 1.24387068637226 | epot = -11.9547168857972 | etot = -9.13334912885911 +158000 ekin = 1.60239506185774 | erot = 1.20145363967813 | epot = -11.9371978303523 | etot = -9.13334912881643 +159000 ekin = 1.62604462003774 | erot = 1.17226436760495 | epot = -11.9316581164847 | etot = -9.13334912884197 +160000 ekin = 1.64813303486531 | erot = 1.15619534708311 | epot = -11.9376775108796 | etot = -9.1333491289312 +161000 ekin = 1.66807327612962 | erot = 1.15245312716187 | epot = -11.9538755323658 | etot = -9.1333491290743 +162000 ekin = 1.68501875283037 | erot = 1.159694715128 | epot = -11.9780625972156 | etot = -9.13334912925725 +163000 ekin = 1.69790620824652 | erot = 1.17620989126099 | epot = -12.0074652289689 | etot = -9.13334912946138 +164000 ekin = 1.70552711798371 | erot = 1.20014309389824 | epot = -12.0390193415463 | etot = -9.13334912966436 +165000 ekin = 1.70662691809321 | erot = 1.22974121417715 | epot = -12.0697172621122 | etot = -9.13334912984189 +166000 ekin = 1.70002908026819 | erot = 1.26360423252405 | epot = -12.0969824427627 | etot = -9.13334912997049 +167000 ekin = 1.68477683955853 | erot = 1.30090518403758 | epot = -12.1190311536263 | etot = -9.13334913003015 +168000 ekin = 1.66027923283156 | erot = 1.34154370359067 | epot = -12.1351720664304 | etot = -9.13334913000821 +169000 ekin = 1.62644124957699 | erot = 1.38619810991388 | epot = -12.1459884893937 | etot = -9.13334912990282 +170000 ekin = 1.58375251890748 | erot = 1.43625221626181 | epot = -12.1533538648945 | etot = -9.13334912972517 +171000 ekin = 1.53331003043903 | erot = 1.49359459893396 | epot = -12.1602537588719 | etot = -9.13334912949887 +172000 ekin = 1.47676106161383 | erot = 1.56031583407029 | epot = -12.1704260249397 | etot = -9.13334912925555 +173000 ekin = 1.41695754705511 | erot = 1.63848249765397 | epot = -12.1887891730442 | etot = -9.13334912833508 +174000 ekin = 1.35937684304471 | erot = 1.72968793645222 | epot = -12.2224139078249 | etot = -9.13334912832797 +175000 ekin = 1.30537540818802 | erot = 1.83369980102243 | epot = -12.2724243375749 | etot = -9.13334912836449 +176000 ekin = 1.25571357800298 | erot = 1.94952726339927 | epot = -12.3385899698485 | etot = -9.13334912844629 +177000 ekin = 1.21104692225309 | erot = 2.07558802224364 | epot = -12.4199840730636 | etot = -9.1333491285669 +178000 ekin = 1.17189512057036 | erot = 2.2097607957462 | epot = -12.5150050450636 | etot = -9.13334912874707 +179000 ekin = 1.13864315857374 | erot = 2.34949890132865 | epot = -12.6214911888111 | etot = -9.13334912890866 +180000 ekin = 1.11156621835598 | erot = 2.4923400853998 | epot = -12.7372554328242 | etot = -9.13334912906842 +181000 ekin = 1.0908716761359 | erot = 2.63567357536115 | epot = -12.8598943807494 | etot = -9.13334912925236 +182000 ekin = 1.07675226579844 | erot = 2.77693577183306 | epot = -12.9870371670188 | etot = -9.13334912938731 +183000 ekin = 1.06942294234155 | erot = 2.91405263083415 | epot = -13.1168247026758 | etot = -9.13334912950007 +184000 ekin = 1.0691348870584 | erot = 3.04520163111632 | epot = -13.2476856477696 | etot = -9.13334912959489 +185000 ekin = 1.0761434592279 | erot = 3.16875772929896 | epot = -13.378250318212 | etot = -9.13334912968513 +186000 ekin = 1.09060563376748 | erot = 3.28317984154828 | epot = -13.5071346051097 | etot = -9.13334912979392 +187000 ekin = 1.11239929858147 | erot = 3.38683780589062 | epot = -13.6325862344239 | etot = -9.13334912995184 +188000 ekin = 1.1408883756264 | erot = 3.47780595660488 | epot = -13.7520434624192 | etot = -9.13334913018788 +189000 ekin = 1.17469755695846 | erot = 3.55369218298226 | epot = -13.8617388704564 | etot = -9.13334913051572 +190000 ekin = 1.21158961983337 | erot = 3.61161008256056 | epot = -13.9565488333127 | etot = -9.13334913091872 +191000 ekin = 1.24837558083726 | erot = 3.64780345127543 | epot = -14.0295281634881 | etot = -9.13334913137539 +192000 ekin = 1.28102311682962 | erot = 3.65810395428988 | epot = -14.0724762027871 | etot = -9.13334913166757 +193000 ekin = 1.30598320816986 | erot = 3.64139295006496 | epot = -14.0807252900249 | etot = -9.13334913179008 +194000 ekin = 1.32049648836633 | erot = 3.59844552363043 | epot = -14.0522911436922 | etot = -9.13334913169544 +195000 ekin = 1.32298604774291 | erot = 3.53212928134959 | epot = -13.9884644604293 | etot = -9.1333491313368 +196000 ekin = 1.31323645162591 | erot = 3.44751612705322 | epot = -13.8941017095235 | etot = -9.13334913084437 +197000 ekin = 1.2922893469817 | erot = 3.35072340322515 | epot = -13.7763618804991 | etot = -9.13334913029223 +198000 ekin = 1.2621263378666 | erot = 3.24789114382012 | epot = -13.6433666114233 | etot = -9.13334912973653 +199000 ekin = 1.22527047461745 | erot = 3.14483705467225 | epot = -13.5034566585633 | etot = -9.13334912927362 +200000 ekin = 1.18441799207266 | erot = 3.0459424596301 | epot = -13.3637095806219 | etot = -9.13334912891918 +201000 ekin = 1.14216630511974 | erot = 2.95390025492367 | epot = -13.2294156887273 | etot = -9.13334912868395 +202000 ekin = 1.10084220211772 | erot = 2.86987712396355 | epot = -13.1040684546435 | etot = -9.13334912856227 +203000 ekin = 1.06240856569037 | erot = 2.79366067226837 | epot = -12.9894183664998 | etot = -9.13334912854109 +204000 ekin = 1.02841768821243 | erot = 2.72389144275518 | epot = -12.885658259572 | etot = -9.1333491286044 +205000 ekin = 0.999988405220968 | erot = 2.65832732458324 | epot = -12.791664858539 | etot = -9.13334912873479 +206000 ekin = 0.97779962122531 | erot = 2.59412391514203 | epot = -12.7052726652799 | etot = -9.13334912891257 +207000 ekin = 0.962105653965551 | erot = 2.52813792126136 | epot = -12.6235927043399 | etot = -9.13334912911301 +208000 ekin = 0.952783648018979 | erot = 2.45726642892335 | epot = -12.5433992062488 | etot = -9.13334912930652 +209000 ekin = 0.949416945748643 | erot = 2.37882137049751 | epot = -12.4615874457068 | etot = -9.13334912946065 +210000 ekin = 0.951402263215311 | erot = 2.29090939419261 | epot = -12.3756607869545 | etot = -9.1333491295466 +211000 ekin = 0.95805195207769 | erot = 2.19275562021934 | epot = -12.284156701844 | etot = -9.13334912954697 +212000 ekin = 0.96865966770056 | erot = 2.08489619855888 | epot = -12.1869049957201 | etot = -9.13334912946064 +213000 ekin = 0.982515908120043 | erot = 1.96918422281076 | epot = -12.0850492602329 | etot = -9.13334912930206 +214000 ekin = 0.998888701919842 | erot = 1.84860041862008 | epot = -11.980838249636 | etot = -9.1333491290961 +215000 ekin = 1.01700134912577 | erot = 1.7269089749226 | epot = -11.8772594529197 | etot = -9.13334912887134 +216000 ekin = 1.03603050122463 | erot = 1.60822693577909 | epot = -11.777606565659 | etot = -9.13334912865524 +217000 ekin = 1.05512477228481 | erot = 1.49657917533873 | epot = -11.6850530760954 | etot = -9.13334912847187 +218000 ekin = 1.07342860744196 | erot = 1.39550092670247 | epot = -11.602278662484 | etot = -9.13334912833954 +219000 ekin = 1.09009860355589 | erot = 1.3077352195161 | epot = -11.5311829513411 | etot = -9.13334912826914 +220000 ekin = 1.10431207607363 | erot = 1.23505496062928 | epot = -11.4727161649659 | etot = -9.133349128263 +221000 ekin = 1.11527717993061 | erot = 1.17821867809278 | epot = -11.4268449863379 | etot = -9.13334912831453 +222000 ekin = 1.12225437592987 | erot = 1.13704823944161 | epot = -11.3926517437815 | etot = -9.13334912841006 +223000 ekin = 1.12459297621425 | erot = 1.11060060825111 | epot = -11.3685427129972 | etot = -9.13334912853179 +224000 ekin = 1.12177911879631 | erot = 1.0973962554392 | epot = -11.352524502896 | etot = -9.13334912866047 +225000 ekin = 1.11348637905768 | erot = 1.09566402531922 | epot = -11.3424995331557 | etot = -9.13334912877881 +226000 ekin = 1.09961800000719 | erot = 1.10360909760931 | epot = -11.336576226485 | etot = -9.13334912886849 +227000 ekin = 1.08033165066233 | erot = 1.11952730043393 | epot = -11.3332080800317 | etot = -9.13334912893547 +228000 ekin = 1.05604602872796 | erot = 1.14187865421847 | epot = -11.3312738119169 | etot = -9.13334912897043 +229000 ekin = 1.02742418663523 | erot = 1.16938489301661 | epot = -11.3301582086283 | etot = -9.13334912897648 +230000 ekin = 0.995339184991744 | erot = 1.20102048198601 | epot = -11.3297087959367 | etot = -9.1333491289589 +231000 ekin = 0.960829492708849 | erot = 1.23597735762291 | epot = -11.3301559792542 | etot = -9.13334912892242 +232000 ekin = 0.925050432735381 | erot = 1.27360958612375 | epot = -11.3320091477352 | etot = -9.13334912887609 +233000 ekin = 0.889225435959855 | erot = 1.31337910210623 | epot = -11.3359536668891 | etot = -9.13334912882302 +234000 ekin = 0.854600006628786 | erot = 1.35483402381913 | epot = -11.3427831592146 | etot = -9.13334912876667 +235000 ekin = 0.822390924845215 | erot = 1.3975743001583 | epot = -11.3533143537191 | etot = -9.13334912871561 +236000 ekin = 0.793732848711805 | erot = 1.44121433399063 | epot = -11.3682963113761 | etot = -9.13334912867363 +237000 ekin = 0.769632191219349 | erot = 1.48535644446062 | epot = -11.3883377643262 | etot = -9.13334912864621 +238000 ekin = 0.750918993365892 | erot = 1.52956143549207 | epot = -11.4138295574954 | etot = -9.13334912863744 +239000 ekin = 0.738206267496996 | erot = 1.57333361162144 | epot = -11.4448890077674 | etot = -9.13334912864894 +240000 ekin = 0.731862193743759 | erot = 1.61613149974219 | epot = -11.4813428221651 | etot = -9.13334912867916 +241000 ekin = 0.731999328001761 | erot = 1.65741090456851 | epot = -11.522759361293 | etot = -9.13334912872275 +242000 ekin = 0.738482620157007 | erot = 1.69669130986299 | epot = -11.5685230587937 | etot = -9.13334912877373 +243000 ekin = 0.750955042325049 | erot = 1.73364929482313 | epot = -11.6179534659678 | etot = -9.13334912881964 +244000 ekin = 0.768877080466256 | erot = 1.7682236027561 | epot = -11.6704498120765 | etot = -9.13334912885413 +245000 ekin = 0.791573929294277 | erot = 1.8006804512131 | epot = -11.7256035093788 | etot = -9.13334912887145 +246000 ekin = 0.818282914271192 | erot = 1.83164107445171 | epot = -11.7832731175935 | etot = -9.13334912887059 +247000 ekin = 0.848193621601337 | erot = 1.86205096555236 | epot = -11.8435937160095 | etot = -9.13334912885584 +248000 ekin = 0.880474358635153 | erot = 1.89308546777788 | epot = -11.9069089552495 | etot = -9.13334912883646 +249000 ekin = 0.914280881218948 | erot = 1.92599713223883 | epot = -11.9736271422837 | etot = -9.13334912882589 +250000 ekin = 0.948746730716193 | erot = 1.96192054843726 | epot = -12.0440164079936 | etot = -9.13334912884018 +251000 ekin = 0.982959063854097 | erot = 2.00165977259901 | epot = -12.117967965348 | etot = -9.13334912889492 +252000 ekin = 1.01592948249834 | erot = 2.04549252396365 | epot = -12.1947711354631 | etot = -9.13334912900107 +253000 ekin = 1.04657777483967 | erot = 2.09303441305961 | epot = -12.2729613170592 | etot = -9.13334912915988 +254000 ekin = 1.07373541755064 | erot = 2.14319803018447 | epot = -12.3502825770981 | etot = -9.13334912936302 +255000 ekin = 1.09620163163021 | erot = 2.19430966720544 | epot = -12.4238604284173 | etot = -9.13334912958161 +256000 ekin = 1.11287206428147 | erot = 2.24438579427432 | epot = -12.4906069883386 | etot = -9.13334912978282 +257000 ekin = 1.12287782510627 | erot = 2.29146665865402 | epot = -12.5476936136917 | etot = -9.13334912993145 +258000 ekin = 1.1257229350027 | erot = 2.33396623628263 | epot = -12.5930383012894 | etot = -9.13334913000407 +259000 ekin = 1.12139026023651 | erot = 2.37095948468542 | epot = -12.6256988749108 | etot = -9.13334912998886 +260000 ekin = 1.11036122819336 | erot = 2.40229658115378 | epot = -12.6460069392473 | etot = -9.13334912990019 +261000 ekin = 1.09354805445089 | erot = 2.42847877902912 | epot = -12.6553759632423 | etot = -9.13334912976232 +262000 ekin = 1.07216031825802 | erot = 2.45046938603017 | epot = -12.6559788338922 | etot = -9.13334912960406 +263000 ekin = 1.0475436871831 | erot = 2.46943297797184 | epot = -12.6503257946118 | etot = -9.13334912945687 +264000 ekin = 1.02102495133846 | erot = 2.48647844637136 | epot = -12.6408525270502 | etot = -9.13334912934037 +265000 ekin = 0.993788783443776 | erot = 2.50247063136386 | epot = -12.6296085440766 | etot = -9.133349129269 +266000 ekin = 0.966800247930049 | erot = 2.51790683905006 | epot = -12.6180562162301 | etot = -9.13334912924995 +267000 ekin = 0.940784249459332 | erot = 2.53283827184806 | epot = -12.6069716505893 | etot = -9.13334912928195 +268000 ekin = 0.916272152394485 | erot = 2.54684612152499 | epot = -12.5964674032728 | etot = -9.13334912935337 +269000 ekin = 0.893722172477293 | erot = 2.55907244306945 | epot = -12.5861437450343 | etot = -9.13334912948759 +270000 ekin = 0.873709285128899 | erot = 2.56799722891213 | epot = -12.5750556436016 | etot = -9.13334912956054 +271000 ekin = 0.857156433251465 | erot = 2.57226369508347 | epot = -12.5627692579077 | etot = -9.13334912957277 +272000 ekin = 0.845541083723895 | erot = 2.57096110909448 | epot = -12.5498513223266 | etot = -9.13334912950826 +273000 ekin = 0.840983736969595 | erot = 2.56364270819374 | epot = -12.5379755745175 | etot = -9.13334912935415 +274000 ekin = 0.846103061110329 | erot = 2.5505449718359 | epot = -12.5299971620895 | etot = -9.13334912914328 +275000 ekin = 0.8635707412448 | erot = 2.53260377851052 | epot = -12.5295236486813 | etot = -9.13334912892599 +276000 ekin = 0.895419299415128 | erot = 2.51114645014782 | epot = -12.5399148783706 | etot = -9.13334912880768 +277000 ekin = 0.942302359418684 | erot = 2.48734970425694 | epot = -12.5630011925123 | etot = -9.13334912883671 +278000 ekin = 1.00299069941579 | erot = 2.46199112036428 | epot = -12.59833094881 | etot = -9.13334912902996 +279000 ekin = 1.07434561589251 | erot = 2.43529774590787 | epot = -12.6429924911401 | etot = -9.13334912933968 +280000 ekin = 1.15182340984025 | erot = 2.40711596365544 | epot = -12.6922885031805 | etot = -9.1333491296848 +281000 ekin = 1.23030856581814 | erot = 2.3772696475126 | epot = -12.7409273433241 | etot = -9.13334912999334 +282000 ekin = 1.3048397487977 | erot = 2.34551973870795 | epot = -12.783708617699 | etot = -9.13334913019334 +283000 ekin = 1.37151257999445 | erot = 2.31231452819901 | epot = -12.8171762384384 | etot = -9.13334913024492 +284000 ekin = 1.42789685319388 | erot = 2.27901843146217 | epot = -12.8402644148118 | etot = -9.13334913015571 +285000 ekin = 1.47299679574469 | erot = 2.24762833985829 | epot = -12.8539742655641 | etot = -9.13334912996108 +286000 ekin = 1.50701906587704 | erot = 2.22050056283338 | epot = -12.8608687584217 | etot = -9.13334912971131 +287000 ekin = 1.53099472144769 | erot = 2.19999584806509 | epot = -12.8643396989723 | etot = -9.13334912945952 +288000 ekin = 1.5463644976888 | erot = 2.18811490987502 | epot = -12.867828536815 | etot = -9.13334912925118 +289000 ekin = 1.55461163491209 | erot = 2.18618804174359 | epot = -12.8741488057736 | etot = -9.1333491291179 +290000 ekin = 1.55699428674678 | erot = 2.19466879450596 | epot = -12.8850122103268 | etot = -9.13334912907411 +291000 ekin = 1.55439775255655 | erot = 2.21306131817982 | epot = -12.9008081998535 | etot = -9.13334912911716 +292000 ekin = 1.54729960240269 | erot = 2.23998314421976 | epot = -12.920631875854 | etot = -9.13334912923156 +293000 ekin = 1.53582108608416 | erot = 2.27333490842362 | epot = -12.9425051239026 | etot = -9.13334912939478 +294000 ekin = 1.51982864506192 | erot = 2.31049721096853 | epot = -12.9636749856261 | etot = -9.13334912959569 +295000 ekin = 1.4990515421335 | erot = 2.34851873983924 | epot = -12.9809194117666 | etot = -9.13334912979385 +296000 ekin = 1.47319364802825 | erot = 2.38443281021054 | epot = -12.990975588222 | etot = -9.13334912998318 +297000 ekin = 1.44203124546003 | erot = 2.41536854589925 | epot = -12.9907489215098 | etot = -9.13334913015052 +298000 ekin = 1.40549976702121 | erot = 2.43867409046074 | epot = -12.9775229877651 | etot = -9.13334913028317 +299000 ekin = 1.36377241662837 | erot = 2.45204871800424 | epot = -12.9491702650002 | etot = -9.13334913036758 +300000 ekin = 1.31732711912191 | erot = 2.45368408092553 | epot = -12.9043603304389 | etot = -9.13334913039146 +301000 ekin = 1.26699022414752 | erot = 2.44240353914579 | epot = -12.84274289364 | etot = -9.13334913034668 +302000 ekin = 1.21394210637188 | erot = 2.4177727859295 | epot = -12.7650640225334 | etot = -9.13334913023199 +303000 ekin = 1.15967414429359 | erot = 2.38015189683651 | epot = -12.6731751711848 | etot = -9.13334913005473 +304000 ekin = 1.10589726251319 | erot = 2.3306693961817 | epot = -12.5699157885247 | etot = -9.1333491298298 +305000 ekin = 1.05441504199283 | erot = 2.27111808933723 | epot = -12.4588822609067 | etot = -9.13334912957668 +306000 ekin = 1.00698421397173 | erot = 2.2037921851408 | epot = -12.3441255284281 | etot = -9.13334912931559 +307000 ekin = 0.965188337627791 | erot = 2.13129764385447 | epot = -12.229835110546 | etot = -9.13334912906376 +308000 ekin = 0.930345631944718 | erot = 2.05636814615618 | epot = -12.1200629069343 | etot = -9.13334912883336 +309000 ekin = 0.903461768093194 | erot = 1.98167791132931 | epot = -12.0184888080555 | etot = -9.13334912863296 +310000 ekin = 0.885228515008207 | erot = 1.9096787021164 | epot = -11.9282563455899 | etot = -9.13334912846534 +311000 ekin = 0.876047647700639 | erot = 1.84263812610115 | epot = -11.8520349021347 | etot = -9.1333491283329 +312000 ekin = 0.876068182199122 | erot = 1.78248869456952 | epot = -11.7919060050077 | etot = -9.13334912823909 +313000 ekin = 0.885223985969969 | erot = 1.7307289288228 | epot = -11.7493020429826 | etot = -9.13334912818982 +314000 ekin = 0.903258342515117 | erot = 1.68832066988407 | epot = -11.7249281405914 | etot = -9.13334912819223 +315000 ekin = 0.92973139171837 | erot = 1.65558558099762 | epot = -11.7186661009697 | etot = -9.13334912825367 +316000 ekin = 0.964013828970545 | erot = 1.63211973509071 | epot = -11.7294826924401 | etot = -9.13334912837886 +317000 ekin = 1.00527629211658 | erot = 1.61675326466501 | epot = -11.7553786853486 | etot = -9.133349128567 +318000 ekin = 1.05248736450112 | erot = 1.60758570940595 | epot = -11.7934222027158 | etot = -9.13334912880877 +319000 ekin = 1.10443332868111 | erot = 1.60212494474541 | epot = -11.8399074025113 | etot = -9.13334912908479 +320000 ekin = 1.15976924920803 | erot = 1.59754526105434 | epot = -11.8906636396275 | etot = -9.13334912936512 +321000 ekin = 1.21710352305647 | erot = 1.59105554518199 | epot = -11.9415081978524 | etot = -9.1333491296139 +322000 ekin = 1.27510751189443 | erot = 1.58033324923121 | epot = -11.9887898909205 | etot = -9.13334912979485 +323000 ekin = 1.33263084645681 | erot = 1.56394390937376 | epot = -12.0299238857109 | etot = -9.13334912988034 +324000 ekin = 1.38879590712182 | erot = 1.54164678485274 | epot = -12.0637918218341 | etot = -9.13334912985956 +325000 ekin = 1.44304623679676 | erot = 1.51450056885298 | epot = -12.0908959353913 | etot = -9.13334912974154 +326000 ekin = 1.49513435445649 | erot = 1.48473073066082 | epot = -12.1132142146708 | etot = -9.13334912955353 +327000 ekin = 1.54505065938314 | erot = 1.45538400860374 | epot = -12.1337837973217 | etot = -9.13334912933481 +328000 ekin = 1.59290981434222 | erot = 1.42984788209372 | epot = -12.1561068255641 | etot = -9.13334912912813 +329000 ekin = 1.63881860975595 | erot = 1.41133335467821 | epot = -12.1835010934066 | etot = -9.13334912897247 +330000 ekin = 1.68274896183067 | erot = 1.40240729591368 | epot = -12.2185053866423 | etot = -9.13334912889792 +331000 ekin = 1.72443467169541 | erot = 1.40463116342043 | epot = -12.2624149640398 | etot = -9.13334912892392 +332000 ekin = 1.76330533674306 | erot = 1.41833479327466 | epot = -12.3149892590748 | etot = -9.13334912905709 +333000 ekin = 1.79846823309272 | erot = 1.44253834966228 | epot = -12.3743557120448 | etot = -9.13334912928976 +334000 ekin = 1.82874900591091 | erot = 1.47503277033851 | epot = -12.4371309058479 | etot = -9.13334912959843 +335000 ekin = 1.85279616115815 | erot = 1.51263570197495 | epot = -12.4987809930766 | etot = -9.13334912994346 +336000 ekin = 1.86927630558769 | erot = 1.55160162438146 | epot = -12.5542270602388 | etot = -9.13334913026965 +337000 ekin = 1.87711735413928 | erot = 1.58820049773309 | epot = -12.5986669823879 | etot = -9.13334913051552 +338000 ekin = 1.8757484092316 | erot = 1.6193886872291 | epot = -12.6284862270853 | etot = -9.13334913062456 +339000 ekin = 1.86534866362714 | erot = 1.64338736517832 | epot = -12.6420851593669 | etot = -9.13334913056142 +340000 ekin = 1.84695798886988 | erot = 1.66009075059751 | epot = -12.6403978697905 | etot = -9.13334913032312 +341000 ekin = 1.82243969076644 | erot = 1.67114820362586 | epot = -12.6269370243339 | etot = -9.13334912994157 +342000 ekin = 1.79428655955874 | erot = 1.67969211618902 | epot = -12.6073278052238 | etot = -9.133349129476 +343000 ekin = 1.76531632972536 | erot = 1.68978090506872 | epot = -12.5884463637908 | etot = -9.1333491289967 +344000 ekin = 1.73833039739277 | erot = 1.70570000747006 | epot = -12.5773795334332 | etot = -9.13334912857035 +345000 ekin = 1.71580589060262 | erot = 1.73127559556322 | epot = -12.580430614415 | etot = -9.13334912824918 +346000 ekin = 1.69966353097581 | erot = 1.7693123493474 | epot = -12.6023250083908 | etot = -9.13334912806759 +347000 ekin = 1.69112042623267 | erot = 1.82120184302259 | epot = -12.6456713972998 | etot = -9.13334912804452 +348000 ekin = 1.69061396982738 | erot = 1.88669704033596 | epot = -12.7106601383503 | etot = -9.13334912818693 +349000 ekin = 1.69777681788179 | erot = 1.96382926866177 | epot = -12.7949552150348 | etot = -9.13334912849127 +350000 ekin = 1.71145115010227 | erot = 2.04895591402528 | epot = -12.8937561930704 | etot = -9.13334912894289 +351000 ekin = 1.72974629646146 | erot = 2.1369563691048 | epot = -13.0000517950767 | etot = -9.13334912951043 +352000 ekin = 1.75015893903906 | erot = 2.22162008456579 | epot = -13.1051281537452 | etot = -9.13334913014033 +353000 ekin = 1.76978034905526 | erot = 2.29627029645936 | epot = -13.1993997762715 | etot = -9.13334913075683 +354000 ekin = 1.78560210911934 | erot = 2.35462017023363 | epot = -13.2735714106202 | etot = -9.13334913126719 +355000 ekin = 1.79489785472827 | erot = 2.39176336004102 | epot = -13.3200103463511 | etot = -9.13334913158185 +356000 ekin = 1.79561393246587 | erot = 2.40509186859446 | epot = -13.3340549326997 | etot = -9.13334913163939 +357000 ekin = 1.78667091072642 | erot = 2.39487614134841 | epot = -13.3148961835033 | etot = -9.13334913142845 +358000 ekin = 1.76810167230534 | erot = 2.36429897994076 | epot = -13.2657497831712 | etot = -9.13334913092509 +359000 ekin = 1.74170569044722 | erot = 2.31907684809554 | epot = -13.1941316689282 | etot = -9.13334913038545 +360000 ekin = 1.70943632676221 | erot = 2.26611368397208 | epot = -13.1088991405415 | etot = -9.13334912980724 +361000 ekin = 1.6731500596548 | erot = 2.21234166615765 | epot = -13.0188408550993 | etot = -9.13334912928682 +362000 ekin = 1.634809940016 | erot = 2.16376887379865 | epot = -12.9319279427069 | etot = -9.13334912889222 +363000 ekin = 1.59622606057565 | erot = 2.12469986683786 | epot = -12.8542750560711 | etot = -9.13334912865763 +364000 ekin = 1.55890205833807 | erot = 2.09734631559797 | epot = -12.7895975025222 | etot = -9.13334912858612 +365000 ekin = 1.52397421076796 | erot = 2.08181308416692 | epot = -12.739136423592 | etot = -9.13334912865715 +366000 ekin = 1.49221260734036 | erot = 2.07639009796169 | epot = -12.7019518341359 | etot = -9.13334912883381 +367000 ekin = 1.46405952364985 | erot = 2.07805510122118 | epot = -12.6754637539441 | etot = -9.13334912907312 +368000 ekin = 1.43967726932424 | erot = 2.08307216057543 | epot = -12.656098559234 | etot = -9.13334912933437 +369000 ekin = 1.41899010811527 | erot = 2.08756917147217 | epot = -12.6399084091733 | etot = -9.13334912958585 +370000 ekin = 1.40171557356816 | erot = 2.08800173652823 | epot = -12.6230664399027 | etot = -9.1333491298063 +371000 ekin = 1.38739280854927 | erot = 2.08146226240579 | epot = -12.6022042009378 | etot = -9.1333491299827 +372000 ekin = 1.37542340308652 | erot = 2.0658519370229 | epot = -12.5746244702144 | etot = -9.133349130105 +373000 ekin = 1.36513752357975 | erot = 2.03996886737111 | epot = -12.5384555211137 | etot = -9.13334913016288 +374000 ekin = 1.35583949105233 | erot = 2.00351975772433 | epot = -12.492708378947 | etot = -9.13334913017032 +375000 ekin = 1.34694157711505 | erot = 1.9571603826854 | epot = -12.4374510898693 | etot = -9.13334913006881 +376000 ekin = 1.33814968105308 | erot = 1.90258032253329 | epot = -12.3740791334843 | etot = -9.13334912989794 +377000 ekin = 1.32936261120845 | erot = 1.84227265725227 | epot = -12.3049843981382 | etot = -9.13334912967749 +378000 ekin = 1.32063159991379 | erot = 1.77926043319037 | epot = -12.2332411625439 | etot = -9.1333491294397 +379000 ekin = 1.3120834036888 | erot = 1.71672941783635 | epot = -12.1621619507418 | etot = -9.13334912921662 +380000 ekin = 1.30384179784224 | erot = 1.65764204155785 | epot = -12.0948329684342 | etot = -9.13334912903407 +381000 ekin = 1.29657917475835 | erot = 1.60487100826682 | epot = -12.0347993118456 | etot = -9.13334912882041 +382000 ekin = 1.29092190134688 | erot = 1.56061067707075 | epot = -11.9848817072435 | etot = -9.13334912882587 +383000 ekin = 1.28620909068414 | erot = 1.52536833769996 | epot = -11.9449265572234 | etot = -9.13334912883934 +384000 ekin = 1.28205683099616 | erot = 1.49922806168814 | epot = -11.9146340215165 | etot = -9.13334912883216 +385000 ekin = 1.27850478017852 | erot = 1.48216189144812 | epot = -11.8940158004146 | etot = -9.13334912878801 +386000 ekin = 1.27603762173976 | erot = 1.47423730493005 | epot = -11.8836240553806 | etot = -9.13334912871082 +387000 ekin = 1.27548287271889 | erot = 1.47565716104732 | epot = -11.8844891623906 | etot = -9.1333491286244 +388000 ekin = 1.27780044585764 | erot = 1.4866096409742 | epot = -11.8977592153989 | etot = -9.13334912856707 +389000 ekin = 1.28381262703554 | erot = 1.50697425852406 | epot = -11.9241360141389 | etot = -9.13334912857925 +390000 ekin = 1.29393930260835 | erot = 1.53598035068249 | epot = -11.9632687819863 | etot = -9.1333491286955 +391000 ekin = 1.30800074456092 | erot = 1.57190984924451 | epot = -12.0132597227351 | etot = -9.13334912892964 +392000 ekin = 1.32513099179442 | erot = 1.6119758486771 | epot = -12.0704559697441 | etot = -9.13334912927258 +393000 ekin = 1.34382543000144 | erot = 1.65241448883384 | epot = -12.1295890485257 | etot = -9.13334912969045 +394000 ekin = 1.36212102398638 | erot = 1.6888101262474 | epot = -12.1842802803632 | etot = -9.13334913012946 +395000 ekin = 1.37788072140313 | erot = 1.71661593054037 | epot = -12.2278457824682 | etot = -9.13334913052473 +396000 ekin = 1.38913154512396 | erot = 1.73181112618336 | epot = -12.2542918021054 | etot = -9.13334913079804 +397000 ekin = 1.39439357479726 | erot = 1.73153617599066 | epot = -12.259278881721 | etot = -9.13334913093312 +398000 ekin = 1.39293904659167 | erot = 1.71441550438762 | epot = -12.2407036818559 | etot = -9.13334913087659 +399000 ekin = 1.38493174777411 | erot = 1.68094766350892 | epot = -12.1992285419456 | etot = -9.13334913066253 +400000 ekin = 1.37142116074065 | erot = 1.63330764197891 | epot = -12.1380779330258 | etot = -9.13334913030619 +401000 ekin = 1.3541299125241 | erot = 1.57501044311702 | epot = -12.0624894855341 | etot = -9.13334912989297 +402000 ekin = 1.33517991856866 | erot = 1.5104836498003 | epot = -11.9790126977741 | etot = -9.13334912940515 +403000 ekin = 1.31709653187235 | erot = 1.44458891478892 | epot = -11.8950345756004 | etot = -9.13334912893911 +404000 ekin = 1.30234590493843 | erot = 1.38198365576714 | epot = -11.8176786892413 | etot = -9.13334912853574 +405000 ekin = 1.29301391716244 | erot = 1.32673455588816 | epot = -11.7530976012891 | etot = -9.1333491282385 +406000 ekin = 1.29065467462766 | erot = 1.28204116436335 | epot = -11.7060449670173 | etot = -9.13334912802629 +407000 ekin = 1.29643237294776 | erot = 1.25006436588379 | epot = -11.6798458667512 | etot = -9.13334912791969 +408000 ekin = 1.31094700615233 | erot = 1.23190986721494 | epot = -11.6762060012839 | etot = -9.13334912791662 +409000 ekin = 1.3342243830335 | erot = 1.22763489752233 | epot = -11.6952084085713 | etot = -9.13334912801545 +410000 ekin = 1.36572014154938 | erot = 1.23628017302484 | epot = -11.7353494427869 | etot = -9.13334912821272 +411000 ekin = 1.4043266876074 | erot = 1.25592548503562 | epot = -11.7936013011448 | etot = -9.13334912850182 +412000 ekin = 1.44839088645834 | erot = 1.28379672627847 | epot = -11.8655367416051 | etot = -9.13334912886833 +413000 ekin = 1.49576795241815 | erot = 1.31646032748924 | epot = -11.9455774091914 | etot = -9.13334912928402 +414000 ekin = 1.5439492088942 | erot = 1.35014055217855 | epot = -12.027438890777 | etot = -9.13334912970421 +415000 ekin = 1.59029421705112 | erot = 1.38116660571169 | epot = -12.1048099528338 | etot = -9.13334913007095 +416000 ekin = 1.63235973909058 | erot = 1.40649922749285 | epot = -12.1722080969091 | etot = -9.13334913032568 +417000 ekin = 1.66825800489166 | erot = 1.42422016761161 | epot = -12.2258273029358 | etot = -9.13334913043252 +418000 ekin = 1.69693219837184 | erot = 1.43381449957472 | epot = -12.2640958283215 | etot = -9.13334913037492 +419000 ekin = 1.71824951894736 | erot = 1.43620625779617 | epot = -12.2878049069281 | etot = -9.13334913018453 +420000 ekin = 1.73288337430514 | erot = 1.43350825350777 | epot = -12.2997407577244 | etot = -9.1333491299115 +421000 ekin = 1.74204129532326 | erot = 1.4285602867495 | epot = -12.3039507116833 | etot = -9.13334912961054 +422000 ekin = 1.74713701807662 | erot = 1.42445618730831 | epot = -12.3049423347128 | etot = -9.13334912932785 +423000 ekin = 1.74949063384663 | erot = 1.42413436044403 | epot = -12.3069741233953 | etot = -9.13334912910463 +424000 ekin = 1.7500975464296 | erot = 1.43005641925169 | epot = -12.3135030946284 | etot = -9.13334912894713 +425000 ekin = 1.74947257256678 | erot = 1.44412400802352 | epot = -12.3269457094746 | etot = -9.1333491288843 +426000 ekin = 1.69664946387399 | erot = 1.40011304962673 | epot = -12.2301116346004 | etot = -9.13334912109972 +427000 ekin = 1.76448154345933 | erot = 1.46695774970221 | epot = -12.364788469981 | etot = -9.13334917681948 +428000 ekin = 1.77864040382709 | erot = 1.51204937412293 | epot = -12.4240389057583 | etot = -9.13334912780824 +429000 ekin = 1.77744254090633 | erot = 1.55645173379942 | epot = -12.4672434028106 | etot = -9.13334912810484 +430000 ekin = 1.76864481713901 | erot = 1.60567169371236 | epot = -12.5076656392895 | etot = -9.13334912843816 +431000 ekin = 1.75041443993041 | erot = 1.65655638514198 | epot = -12.5403199538344 | etot = -9.13334912876204 +432000 ekin = 1.72143753020921 | erot = 1.70559294341375 | epot = -12.5603796026449 | etot = -9.13334912902196 +433000 ekin = 1.68129756274196 | erot = 1.74934007551163 | epot = -12.5639867674191 | etot = -9.13334912916547 +434000 ekin = 1.6307765097995 | erot = 1.78490039303317 | epot = -12.5490260319879 | etot = -9.13334912915522 +435000 ekin = 1.57198882084473 | erot = 1.81033246556209 | epot = -12.5156704153878 | etot = -9.13334912898102 +436000 ekin = 1.50828072851458 | erot = 1.82489908961108 | epot = -12.4665289467911 | etot = -9.13334912866549 +437000 ekin = 1.44388315301215 | erot = 1.82908776308002 | epot = -12.4063200443511 | etot = -9.13334912825894 +438000 ekin = 1.38337900429706 | erot = 1.82441107452533 | epot = -12.3411392066478 | etot = -9.13334912782545 +439000 ekin = 1.33110407576216 | erot = 1.81306694504084 | epot = -12.2775201482282 | etot = -9.13334912742516 +440000 ekin = 1.29061754888996 | erot = 1.79757475508363 | epot = -12.2215414310742 | etot = -9.13334912710057 +441000 ekin = 1.26434687832154 | erot = 1.78048600607395 | epot = -12.1781820112662 | etot = -9.13334912687068 +442000 ekin = 1.25344985037923 | erot = 1.76421040799427 | epot = -12.1510093851079 | etot = -9.13334912673437 +443000 ekin = 1.25787308938408 | erot = 1.7509340047669 | epot = -12.1421562208304 | etot = -9.13334912667946 +444000 ekin = 1.27654491138799 | erot = 1.74256727852004 | epot = -12.1524613166018 | etot = -9.13334912669374 +445000 ekin = 1.30762960642476 | erot = 1.74066161517015 | epot = -12.1816403483645 | etot = -9.13334912676961 +446000 ekin = 1.3487848533523 | erot = 1.74626611357075 | epot = -12.2284000938277 | etot = -9.13334912690466 +447000 ekin = 1.39739993763746 | erot = 1.75974793458065 | epot = -12.2904969993185 | etot = -9.13334912710037 +448000 ekin = 1.45076649190917 | erot = 1.7806071793413 | epot = -12.364722798603 | etot = -9.13334912735256 +449000 ekin = 1.50623999605376 | erot = 1.80738848344697 | epot = -12.4469776071506 | etot = -9.13334912764992 +450000 ekin = 1.56138908054617 | erot = 1.83773497344343 | epot = -12.5324731819609 | etot = -9.1333491279713 +451000 ekin = 1.61412412964542 | erot = 1.86859865234422 | epot = -12.6160719102768 | etot = -9.13334912828714 +452000 ekin = 1.6628093163013 | erot = 1.89658548036375 | epot = -12.6927439252283 | etot = -9.1333491285633 +453000 ekin = 1.70634971637105 | erot = 1.91837476586798 | epot = -12.7580736110109 | etot = -9.1333491287719 +454000 ekin = 1.74423056750383 | erot = 1.93111374790632 | epot = -12.8086934443058 | etot = -9.13334912889565 +455000 ekin = 1.77648988409902 | erot = 1.93270291378172 | epot = -12.8425419268138 | etot = -9.13334912893303 +456000 ekin = 1.80361911556758 | erot = 1.92192628287797 | epot = -12.8588945273422 | etot = -9.13334912889667 +457000 ekin = 1.82640016706239 | erot = 1.89842961389939 | epot = -12.8581789097705 | etot = -9.13334912880868 +458000 ekin = 1.84570455025963 | erot = 1.86259298695739 | epot = -12.8416466659125 | etot = -9.13334912869546 +459000 ekin = 1.86229070170975 | erot = 1.8153534231514 | epot = -12.8109932534393 | etot = -9.13334912857818 +460000 ekin = 1.87663848085893 | erot = 1.75803306182783 | epot = -12.7680206711608 | etot = -9.13334912847404 +461000 ekin = 1.88883864523215 | erot = 1.69219746384297 | epot = -12.7143852374647 | etot = -9.13334912838955 +462000 ekin = 1.89856203652326 | erot = 1.6195667802744 | epot = -12.6514779451227 | etot = -9.133349128325 +463000 ekin = 1.90510221764502 | erot = 1.54196437877849 | epot = -12.5804157247001 | etot = -9.1333491282766 +464000 ekin = 1.90747686786683 | erot = 1.46127993198489 | epot = -12.502105928087 | etot = -9.13334912823527 +465000 ekin = 1.90457977356189 | erot = 1.37946070091747 | epot = -12.4173896026655 | etot = -9.13334912818618 +466000 ekin = 1.89536572152358 | erot = 1.29851485172168 | epot = -12.3272297013671 | etot = -9.13334912812186 +467000 ekin = 1.87901831710009 | erot = 1.22048659414398 | epot = -12.2328540392803 | etot = -9.13334912803627 +468000 ekin = 1.85509917792091 | erot = 1.1473912628406 | epot = -12.13583956869 | etot = -9.13334912792853 +469000 ekin = 1.82366605107355 | erot = 1.08110787535096 | epot = -12.0381230542272 | etot = -9.13334912780273 +470000 ekin = 1.78535216075648 | erot = 1.02324127043684 | epot = -11.9419425588579 | etot = -9.13334912766458 +471000 ekin = 1.74141051513421 | erot = 0.974982090043725 | epot = -11.8497417326974 | etot = -9.13334912751951 +472000 ekin = 1.69372019705975 | erot = 0.937000644455065 | epot = -11.7640699688868 | etot = -9.13334912737203 +473000 ekin = 1.64473632771015 | erot = 0.909402534931994 | epot = -11.6874879898697 | etot = -9.13334912722754 +474000 ekin = 1.59734995177404 | erot = 0.891755018431719 | epot = -11.6224540973016 | etot = -9.13334912709589 +475000 ekin = 1.55462885495293 | erot = 0.883174765260449 | epot = -11.5711527472053 | etot = -9.13334912699189 +476000 ekin = 1.51944866261199 | erot = 0.882459888569853 | epot = -11.5352576781139 | etot = -9.13334912693209 +477000 ekin = 1.49408243529063 | erot = 0.888250161717153 | epot = -11.515681723936 | etot = -9.13334912692819 +478000 ekin = 1.4798562258565 | erot = 0.899197335533059 | epot = -11.5124026883719 | etot = -9.13334912698235 +479000 ekin = 1.47695373952859 | erot = 0.914115348457697 | epot = -11.5244182150805 | etot = -9.13334912709421 +480000 ekin = 1.48439477575451 | erot = 0.932072516621074 | epot = -11.5498164196183 | etot = -9.13334912724273 +481000 ekin = 1.50022741217501 | erot = 0.952423999184349 | epot = -11.5860005387821 | etot = -9.13334912742275 +482000 ekin = 1.52172985963404 | erot = 0.974754211846627 | epot = -11.6298331991075 | etot = -9.13334912762685 +483000 ekin = 1.54567018241475 | erot = 0.998770450814902 | epot = -11.6777897610758 | etot = -9.13334912784619 +484000 ekin = 1.56858614723056 | erot = 1.02419763510876 | epot = -11.7261329104084 | etot = -9.1333491280691 +485000 ekin = 1.5870734695504 | erot = 1.05070585623167 | epot = -11.771128454062 | etot = -9.1333491282799 +486000 ekin = 1.59807103603055 | erot = 1.07788995424718 | epot = -11.809310118738 | etot = -9.13334912846031 +487000 ekin = 1.59911980804395 | erot = 1.10529931942213 | epot = -11.8377682560594 | etot = -9.13334912859333 +488000 ekin = 1.58856342116616 | erot = 1.13249736396264 | epot = -11.8544099137962 | etot = -9.13334912866743 +489000 ekin = 1.56566142904661 | erot = 1.15911683125844 | epot = -11.8581273889842 | etot = -9.13334912867911 +490000 ekin = 1.5306026855461 | erot = 1.18488502427377 | epot = -11.8488368384537 | etot = -9.13334912863386 +491000 ekin = 1.4844342706942 | erot = 1.20959914016026 | epot = -11.8273825393274 | etot = -9.13334912847297 +492000 ekin = 1.42930345354388 | erot = 1.23291829593372 | epot = -11.7955708778621 | etot = -9.13334912838453 +493000 ekin = 1.3674956414507 | erot = 1.2543854460511 | epot = -11.7552302157779 | etot = -9.13334912827613 +494000 ekin = 1.30137262987975 | erot = 1.27348228002552 | epot = -11.708204038061 | etot = -9.13334912815568 +495000 ekin = 1.23360970816894 | erot = 1.28954660636143 | epot = -11.6565054425584 | etot = -9.13334912802799 +496000 ekin = 1.16375548640691 | erot = 1.3002319560856 | epot = -11.5973366205377 | etot = -9.13334917804515 +497000 ekin = 1.02574644939778 | erot = 1.24927230426217 | epot = -11.4083678755021 | etot = -9.13334912184212 +498000 ekin = 1.13339044616663 | erot = 1.24939677704446 | epot = -11.5161363891186 | etot = -9.13334916590748 +499000 ekin = 1.1643476239328 | erot = 1.2586467315497 | epot = -11.5563434800384 | etot = -9.13334912455595 +500000 ekin = 1.16768486506805 | erot = 1.25769344443913 | epot = -11.5587274345818 | etot = -9.13334912507467 +501000 ekin = 1.17559895497574 | erot = 1.25038915442602 | epot = -11.5593372343045 | etot = -9.13334912490274 +502000 ekin = 1.18926606273964 | erot = 1.23784323633042 | epot = -11.5604584237508 | etot = -9.13334912468077 +503000 ekin = 1.20982408114982 | erot = 1.22204157664332 | epot = -11.5652147822326 | etot = -9.1333491244395 +504000 ekin = 1.23811782737094 | erot = 1.20572865378445 | epot = -11.5771956053593 | etot = -9.13334912420395 +505000 ekin = 1.27460966228848 | erot = 1.19199209322162 | epot = -11.599950879511 | etot = -9.13334912400085 +506000 ekin = 1.31928047819669 | erot = 1.18393687677918 | epot = -11.6365664788306 | etot = -9.13334912385476 +507000 ekin = 1.37157700900589 | erot = 1.18435118386637 | epot = -11.6892773166552 | etot = -9.13334912378295 +508000 ekin = 1.43042502721634 | erot = 1.19541187481652 | epot = -11.759186025826 | etot = -9.13334912379309 +509000 ekin = 1.49431413372954 | erot = 1.21846596295747 | epot = -11.84612922057 | etot = -9.13334912388303 +510000 ekin = 1.56143815900091 | erot = 1.25390781315509 | epot = -11.9486950961993 | etot = -9.13334912404329 +511000 ekin = 1.62985405359645 | erot = 1.30115550674131 | epot = -12.0643586845984 | etot = -9.13334912426069 +512000 ekin = 1.69760948238553 | erot = 1.35871536004462 | epot = -12.1896739669537 | etot = -9.13334912452353 +513000 ekin = 1.76279412854899 | erot = 1.42431355746946 | epot = -12.3204568108429 | etot = -9.13334912482448 +514000 ekin = 1.82349978434328 | erot = 1.49507387317972 | epot = -12.4519227826811 | etot = -9.13334912515808 +515000 ekin = 1.87772649131842 | erot = 1.56773414236326 | epot = -12.5788097591951 | etot = -9.13334912551346 +516000 ekin = 1.92332299298634 | erot = 1.63891274676095 | epot = -12.6955848656127 | etot = -9.13334912586538 +517000 ekin = 1.95805681102191 | erot = 1.70543998934226 | epot = -12.7968459265369 | etot = -9.13334912617277 +518000 ekin = 1.97984991947131 | erot = 1.76473849815428 | epot = -12.8779375440131 | etot = -9.13334912638746 +519000 ekin = 1.98711819296806 | erot = 1.81518192785056 | epot = -12.9356492472892 | etot = -9.13334912647053 +520000 ekin = 1.97908911077307 | erot = 1.85632478175216 | epot = -12.9687630189372 | etot = -9.13334912641193 +521000 ekin = 1.95594858056491 | erot = 1.88892760796818 | epot = -12.9782253147591 | etot = -9.13334912622604 +522000 ekin = 1.91881161738275 | erot = 1.91475582237592 | epot = -12.9669165657094 | etot = -9.13334912595078 +523000 ekin = 1.86954045343384 | erot = 1.93620351350401 | epot = -12.9390930925734 | etot = -9.13334912563555 +524000 ekin = 1.81047332181796 | erot = 1.95582271022227 | epot = -12.8996451573717 | etot = -9.1333491253315 +525000 ekin = 1.74413482435803 | erot = 1.97582576721665 | epot = -12.853309716661 | etot = -9.13334912508635 +526000 ekin = 1.67297434025033 | erot = 1.99761678040497 | epot = -12.8039402455932 | etot = -9.1333491249379 +527000 ekin = 1.5991686561631 | erot = 2.02141684187647 | epot = -12.753934622946 | etot = -9.13334912490644 +528000 ekin = 1.52452149634769 | erot = 2.046058779126 | epot = -12.7039294004621 | etot = -9.1333491249884 +529000 ekin = 1.4504814163815 | erot = 2.06903286947805 | epot = -12.6528634110116 | etot = -9.13334912515203 +530000 ekin = 1.37827485203473 | erot = 2.0868382112308 | epot = -12.5984621886064 | etot = -9.13334912534092 +531000 ekin = 1.3091154482528 | erot = 2.09562136598182 | epot = -12.5380859397209 | etot = -9.1333491254863 +532000 ekin = 1.24441932207011 | erot = 2.09198653946293 | epot = -12.4697549870592 | etot = -9.13334912552613 +533000 ekin = 1.18594679653286 | erot = 2.07377924595502 | epot = -12.3930751679117 | etot = -9.13334912542376 +534000 ekin = 1.1358131246152 | erot = 2.04062941960225 | epot = -12.3097916693957 | etot = -9.13334912517824 +535000 ekin = 1.09635528031573 | erot = 1.99411201499638 | epot = -12.2238164201347 | etot = -9.13334912482263 +536000 ekin = 1.06988655695763 | erot = 1.93750945181547 | epot = -12.1407451331865 | etot = -9.13334912441337 +537000 ekin = 1.05839509271428 | erot = 1.87547351818765 | epot = -12.067217734895 | etot = -9.13334912399308 +538000 ekin = 1.0632389138569 | erot = 1.81331424698671 | epot = -12.0099022845221 | etot = -9.13334912367847 +539000 ekin = 1.08487929970153 | erot = 1.75562392314899 | epot = -11.9738523463437 | etot = -9.1333491234932 +540000 ekin = 1.12268189023152 | erot = 1.70611667318676 | epot = -11.9621476868923 | etot = -9.13334912347407 +541000 ekin = 1.17481105396039 | erot = 1.66717481231005 | epot = -11.9753349899086 | etot = -9.13334912363814 +542000 ekin = 1.23824417791102 | erot = 1.63956314455323 | epot = -12.0111564464434 | etot = -9.13334912397912 +543000 ekin = 1.30892832432196 | erot = 1.62236761446703 | epot = -12.0646450632514 | etot = -9.13334912446245 +544000 ekin = 1.38208514507633 | erot = 1.61318872881496 | epot = -12.1286229989214 | etot = -9.13334912503009 +545000 ekin = 1.45263801176139 | erot = 1.60857948401433 | epot = -12.194566621382 | etot = -9.13334912560626 +546000 ekin = 1.51570974605577 | erot = 1.60467377472423 | epot = -12.2537326468904 | etot = -9.13334912611039 +547000 ekin = 1.56711452712077 | erot = 1.5978880038112 | epot = -12.2983516574063 | etot = -9.13334912647434 +548000 ekin = 1.60376221827811 | erot = 1.58554162816014 | epot = -12.3226529730938 | etot = -9.13334912665559 +549000 ekin = 1.6239104162595 | erot = 1.56625626420505 | epot = -12.3235158071101 | etot = -9.13334912664558 +550000 ekin = 1.62723358008672 | erot = 1.54012357327806 | epot = -12.30070627981 | etot = -9.13334912644519 +551000 ekin = 1.61471889891336 | erot = 1.50851459569879 | epot = -12.2565826207564 | etot = -9.13334912614428 +552000 ekin = 1.58843016682055 | erot = 1.4734893638341 | epot = -12.1952686564244 | etot = -9.13334912576979 +553000 ekin = 1.55120098109625 | erot = 1.43753302718273 | epot = -12.1220831336482 | etot = -9.1333491253692 +554000 ekin = 1.50631636212865 | erot = 1.40318755322487 | epot = -12.0428530403314 | etot = -9.1333491249779 +555000 ekin = 1.45722878986198 | erot = 1.3727969819938 | epot = -11.9633748964754 | etot = -9.13334912461958 +556000 ekin = 1.40732293284862 | erot = 1.34837590638604 | epot = -11.8890479635409 | etot = -9.13334912430622 +557000 ekin = 1.35973750772558 | erot = 1.33157707038633 | epot = -11.8246637021546 | etot = -9.1333491240427 +558000 ekin = 1.3172359073265 | erot = 1.3237162803257 | epot = -11.7743013114838 | etot = -9.13334912383159 +559000 ekin = 1.2821102830885 | erot = 1.32580526483737 | epot = -11.7412646716021 | etot = -9.13334912367621 +560000 ekin = 1.25610590404606 | erot = 1.33855626266036 | epot = -11.7280112902894 | etot = -9.133349123583 +561000 ekin = 1.24035844263076 | erot = 1.36234138770616 | epot = -11.7360489538972 | etot = -9.13334912356032 +562000 ekin = 1.23534624012456 | erot = 1.39711468447884 | epot = -11.7658100482193 | etot = -9.1333491236159 +563000 ekin = 1.24087113988293 | erot = 1.4423315029889 | epot = -11.8165517666224 | etot = -9.13334912375058 +564000 ekin = 1.25609129142967 | erot = 1.49691875868316 | epot = -11.8863591740662 | etot = -9.13334912395332 +565000 ekin = 1.27963015842585 | erot = 1.55937933471928 | epot = -11.9723586173333 | etot = -9.13334912418822 +566000 ekin = 1.30976945418509 | erot = 1.62795664726991 | epot = -12.071075225903 | etot = -9.13334912444796 +567000 ekin = 1.34469873511446 | erot = 1.70073738337955 | epot = -12.1787852431846 | etot = -9.13334912469059 +568000 ekin = 1.3827577993095 | erot = 1.77591787231153 | epot = -12.2920247965257 | etot = -9.13334912490467 +569000 ekin = 1.42260294142512 | erot = 1.85183127902824 | epot = -12.4077833455478 | etot = -9.13334912509444 +570000 ekin = 1.46311433096258 | erot = 1.92670412005392 | epot = -12.5231675763841 | etot = -9.13334912536755 +571000 ekin = 1.50327753329096 | erot = 1.99853100880983 | epot = -12.6351576677818 | etot = -9.13334912568103 +572000 ekin = 1.54192966726804 | erot = 2.0649761373004 | epot = -12.7402549304433 | etot = -9.13334912587482 +573000 ekin = 1.57823855407033 | erot = 2.12427016696493 | epot = -12.8358578469925 | etot = -9.13334912595728 +574000 ekin = 1.61207502224245 | erot = 2.17570201380688 | epot = -12.9211261619195 | etot = -9.13334912587019 +575000 ekin = 1.64402582173614 | erot = 2.22028441014118 | epot = -12.9976593575029 | etot = -9.13334912562555 +576000 ekin = 1.67538587678149 | erot = 2.26042238856294 | epot = -13.0691573906352 | etot = -9.13334912529081 +577000 ekin = 1.7078920937872 | erot = 2.29915883242306 | epot = -13.1404000511779 | etot = -9.13334912496764 +578000 ekin = 1.74326819508177 | erot = 2.33909725076169 | epot = -13.2157145705919 | etot = -9.13334912474848 +579000 ekin = 1.78272231838101 | erot = 2.38182643842008 | epot = -13.2978978814957 | etot = -9.13334912469457 +580000 ekin = 1.82652189372822 | erot = 2.42751679139619 | epot = -13.3873878099572 | etot = -9.13334912483282 +581000 ekin = 1.87370675175303 | erot = 2.47480205693856 | epot = -13.4818579338654 | etot = -9.13334912517378 +582000 ekin = 1.92197052578468 | erot = 2.5209271515326 | epot = -13.576246802977 | etot = -9.13334912565971 +583000 ekin = 1.96774925896929 | erot = 2.5622766080168 | epot = -13.6633749932262 | etot = -9.13334912624012 +584000 ekin = 2.00657374540297 | erot = 2.59498886542894 | epot = -13.7349117376518 | etot = -9.1333491268199 +585000 ekin = 2.03371871575794 | erot = 2.6156627420042 | epot = -13.7827305850441 | etot = -9.13334912728194 +586000 ekin = 2.04507827703381 | erot = 2.62214006251515 | epot = -13.8005674670651 | etot = -9.13334912751611 +587000 ekin = 2.03806243485746 | erot = 2.61411994889086 | epot = -13.7855315112076 | etot = -9.13334912745932 +588000 ekin = 2.01223115184444 | erot = 2.59335030112075 | epot = -13.7389305800901 | etot = -9.13334912712496 +589000 ekin = 1.96942837554651 | erot = 2.56324673362772 | epot = -13.6660242357781 | etot = -9.13334912660385 +590000 ekin = 1.91334419959089 | erot = 2.52801524733256 | epot = -13.574708572955 | etot = -9.13334912603151 +591000 ekin = 1.84865383330884 | erot = 2.4915831336859 | epot = -13.4735860925299 | etot = -9.13334912553512 +592000 ekin = 1.78006004419929 | erot = 2.45674050607992 | epot = -13.3701496754639 | etot = -9.13334912518467 +593000 ekin = 1.71159279762526 | erot = 2.42478693108587 | epot = -13.2697288536894 | etot = -9.13334912497825 +594000 ekin = 1.64634946405755 | erot = 2.39569805900575 | epot = -13.1753966479338 | etot = -9.13334912487046 +595000 ekin = 1.5865947994934 | erot = 2.36854432556366 | epot = -13.0884882498757 | etot = -9.13334912481863 +596000 ekin = 1.53398103551819 | erot = 2.34182175784585 | epot = -13.0091519181739 | etot = -9.13334912480987 +597000 ekin = 1.48969441622987 | erot = 2.31355286209804 | epot = -12.9365964031787 | etot = -9.13334912485079 +598000 ekin = 1.45449014890813 | erot = 2.28129539495166 | epot = -12.8691346688017 | etot = -9.13334912494188 +599000 ekin = 1.4286828360633 | erot = 2.24230571379077 | epot = -12.8043376749144 | etot = -9.13334912506028 +600000 ekin = 1.41215819513153 | erot = 2.19421771508645 | epot = -12.7397250351149 | etot = -9.13334912489694 +601000 ekin = 1.40437980063996 | erot = 2.13675092847909 | epot = -12.6744798541792 | etot = -9.13334912506017 +602000 ekin = 1.40442466853487 | erot = 2.0686359576415 | epot = -12.6064097512942 | etot = -9.13334912511782 +603000 ekin = 1.41112302449782 | erot = 1.98998056957469 | epot = -12.5344527191434 | etot = -9.13334912507092 +604000 ekin = 1.42310135152322 | erot = 1.9027452432284 | epot = -12.4591957196956 | etot = -9.13334912494394 +605000 ekin = 1.43883447822635 | erot = 1.81030632011162 | epot = -12.382489923109 | etot = -9.13334912477107 +606000 ekin = 1.45673760095324 | erot = 1.71684240504965 | epot = -12.3069291305862 | etot = -9.13334912458332 +607000 ekin = 1.47529863713266 | erot = 1.62672298753197 | epot = -12.2353707490669 | etot = -9.13334912440231 +608000 ekin = 1.49323166610448 | erot = 1.54399943869277 | epot = -12.1705802290369 | etot = -9.13334912423965 +609000 ekin = 1.50961256615827 | erot = 1.47208306434152 | epot = -12.1150447546089 | etot = -9.13334912410907 +610000 ekin = 1.52396039431393 | erot = 1.41350705715352 | epot = -12.0708165754616 | etot = -9.13334912399415 +611000 ekin = 1.53622860047132 | erot = 1.36992443741477 | epot = -12.0395021618094 | etot = -9.13334912392332 +612000 ekin = 1.54668536626219 | erot = 1.34205362873306 | epot = -12.0220881189051 | etot = -9.13334912390986 +613000 ekin = 1.55571309695651 | erot = 1.32960894336309 | epot = -12.0186711642903 | etot = -9.13334912397073 +614000 ekin = 1.56356369221671 | erot = 1.33131277562909 | epot = -12.028225591966 | etot = -9.13334912412021 +615000 ekin = 1.57013881826616 | erot = 1.34494539762102 | epot = -12.0484333402241 | etot = -9.13334912433694 +616000 ekin = 1.5748568190386 | erot = 1.36757312206584 | epot = -12.0757790657621 | etot = -9.13334912465767 +617000 ekin = 1.57672646781163 | erot = 1.39546251367079 | epot = -12.1055381065046 | etot = -9.13334912502222 +618000 ekin = 1.57456346737768 | erot = 1.42448013453851 | epot = -12.1323927272936 | etot = -9.13334912537746 +619000 ekin = 1.56732946470101 | erot = 1.45059208153023 | epot = -12.1512706718931 | etot = -9.13334912566186 +620000 ekin = 1.55451321753897 | erot = 1.47039334455765 | epot = -12.1582556879159 | etot = -9.13334912581928 +621000 ekin = 1.53644782338436 | erot = 1.48161304591079 | epot = -12.1514099951079 | etot = -9.13334912581271 +622000 ekin = 1.51447783518453 | erot = 1.48347710481977 | epot = -12.1313040656388 | etot = -9.13334912563447 +623000 ekin = 1.49092960733185 | erot = 1.47683215248873 | epot = -12.101110885129 | etot = -9.13334912530837 +624000 ekin = 1.46886130170239 | erot = 1.46422198591474 | epot = -12.0664324125275 | etot = -9.13334912491036 +625000 ekin = 1.45155188812906 | erot = 1.44918251594133 | epot = -12.034083528554 | etot = -9.13334912448364 +626000 ekin = 1.44224748158227 | erot = 1.43533399591538 | epot = -12.0109306015702 | etot = -9.13334912407255 +627000 ekin = 1.44381530880348 | erot = 1.42638005354494 | epot = -12.0035444860842 | etot = -9.13334912373574 +628000 ekin = 1.4583308162053 | erot = 1.4256082487489 | epot = -12.0172881884918 | etot = -9.13334912353762 +629000 ekin = 1.48676985537521 | erot = 1.43535417576745 | epot = -12.0554731546307 | etot = -9.13334912348804 +630000 ekin = 1.52866417049647 | erot = 1.45689184513091 | epot = -12.1189051392532 | etot = -9.13334912362577 +631000 ekin = 1.58193413339469 | erot = 1.49015054897199 | epot = -12.2054338063848 | etot = -9.13334912401817 +632000 ekin = 1.6423485105623 | erot = 1.53357750658553 | epot = -12.3092751416905 | etot = -9.13334912454265 +633000 ekin = 1.70466841197628 | erot = 1.58426390209731 | epot = -12.4222814392234 | etot = -9.13334912514981 +634000 ekin = 1.76318354699949 | erot = 1.63860587790227 | epot = -12.5351385506363 | etot = -9.13334912573451 +635000 ekin = 1.81242625035339 | erot = 1.69306627320296 | epot = -12.6388416497417 | etot = -9.13334912618538 +636000 ekin = 1.84805557838623 | erot = 1.74492785469711 | epot = -12.7263325594983 | etot = -9.13334912641493 +637000 ekin = 1.86755595285165 | erot = 1.79286465558875 | epot = -12.7937697348511 | etot = -9.13334912641071 +638000 ekin = 1.8704735746913 | erot = 1.83697965057034 | epot = -12.840802351469 | etot = -9.13334912620734 +639000 ekin = 1.85817220593526 | erot = 1.87849437006229 | epot = -12.8700157018793 | etot = -9.13334912588174 +640000 ekin = 1.83325502875059 | erot = 1.91930247136211 | epot = -12.8859066256261 | etot = -9.13334912551343 +641000 ekin = 1.79889805051579 | erot = 1.96149522931869 | epot = -12.8937424049928 | etot = -9.1333491251583 +642000 ekin = 1.75833330344831 | erot = 2.00701454516796 | epot = -12.8986969734715 | etot = -9.13334912485521 +643000 ekin = 1.71452400738503 | erot = 2.05742054584748 | epot = -12.9052936778285 | etot = -9.13334912459598 +644000 ekin = 1.67006045206469 | erot = 2.11379950766342 | epot = -12.9172090841588 | etot = -9.13334912443064 +645000 ekin = 1.62710169193507 | erot = 2.17652829047503 | epot = -12.9369791067681 | etot = -9.13334912435798 +646000 ekin = 1.58731920570871 | erot = 2.24499987972099 | epot = -12.9656682098005 | etot = -9.13334912437076 +647000 ekin = 1.5519287984978 | erot = 2.31774723145552 | epot = -13.0030251544465 | etot = -9.13334912449313 +648000 ekin = 1.52155547404241 | erot = 2.3921684940498 | epot = -13.0470730928209 | etot = -9.1333491247287 +649000 ekin = 1.49615701172334 | erot = 2.46459269466401 | epot = -13.0940988314631 | etot = -9.13334912507576 +650000 ekin = 1.4749582040793 | erot = 2.53042613107505 | epot = -13.1387334606739 | etot = -9.13334912551956 +651000 ekin = 1.45644758275727 | erot = 2.58442104122277 | epot = -13.1742177500083 | etot = -9.13334912602828 +652000 ekin = 1.43848054669938 | erot = 2.62109720355956 | epot = -13.1929268768061 | etot = -9.13334912654716 +653000 ekin = 1.418535386466 | erot = 2.63533318879061 | epot = -13.1872177022545 | etot = -9.13334912699785 +654000 ekin = 1.39414099594557 | erot = 2.62311445987521 | epot = -13.1506045831126 | etot = -9.13334912729179 +655000 ekin = 1.36342278664424 | erot = 2.58232798191531 | epot = -13.0790998958907 | etot = -9.13334912733113 +656000 ekin = 1.32754554559858 | erot = 2.51343997306615 | epot = -12.9743346448082 | etot = -9.1333491261435 +657000 ekin = 1.07738759792772 | erot = 2.44669612963399 | epot = -12.6574327807952 | etot = -9.13334905323347 +658000 ekin = 1.00652014230032 | erot = 2.49084781647026 | epot = -12.6307170433285 | etot = -9.13334908455789 +659000 ekin = 1.07240085017734 | erot = 2.42929901831529 | epot = -12.635048983779 | etot = -9.13334911528638 +660000 ekin = 1.09381648980785 | erot = 2.30102308261602 | epot = -12.5281886879193 | etot = -9.13334911549543 +661000 ekin = 1.11701334337999 | erot = 2.16959631554143 | epot = -12.4199587738156 | etot = -9.13334911489422 +662000 ekin = 1.14263894057994 | erot = 2.04231481245697 | epot = -12.3183028674859 | etot = -9.13334911444903 +663000 ekin = 1.17093665277096 | erot = 1.92510458369648 | epot = -12.2293903506437 | etot = -9.13334911417622 +664000 ekin = 1.20146324496831 | erot = 1.82207009510825 | epot = -12.1568824541654 | etot = -9.13334911408881 +665000 ekin = 1.23289032447975 | erot = 1.735648364276 | epot = -12.1018878027968 | etot = -9.13334911404106 +666000 ekin = 1.26340464455218 | erot = 1.667025926681 | epot = -12.0637796854968 | etot = -9.13334911426366 +667000 ekin = 1.29102574814593 | erot = 1.61488086820421 | epot = -12.0392557309133 | etot = -9.13334911456314 +668000 ekin = 1.31376054134927 | erot = 1.5764971277367 | epot = -12.0236067839923 | etot = -9.13334911490633 +669000 ekin = 1.32989404565464 | erot = 1.54828621181587 | epot = -12.0115293726992 | etot = -9.13334911522865 +670000 ekin = 1.33826340890754 | erot = 1.52640844797489 | epot = -11.9980209723676 | etot = -9.13334911548521 +671000 ekin = 1.33847461323346 | erot = 1.50724764864856 | epot = -11.9790713775232 | etot = -9.13334911564113 +672000 ekin = 1.33101969554678 | erot = 1.48781306139283 | epot = -11.9521818726182 | etot = -9.13334911567861 +673000 ekin = 1.31737035051176 | erot = 1.4661022805312 | epot = -11.9168217466047 | etot = -9.13334911556173 +674000 ekin = 1.29992521798198 | erot = 1.4413124176082 | epot = -11.8745867509663 | etot = -9.13334911537614 +675000 ekin = 1.28129254582524 | erot = 1.41347048294566 | epot = -11.8281121439067 | etot = -9.13334911513581 +676000 ekin = 1.26413925333757 | erot = 1.38336835396576 | epot = -11.780856722189 | etot = -9.13334911488567 +677000 ekin = 1.25080949630036 | erot = 1.35227525692409 | epot = -11.7364338679154 | etot = -9.13334911469091 +678000 ekin = 1.24240325883958 | erot = 1.3212224636356 | epot = -11.6969748370327 | etot = -9.13334911455754 +679000 ekin = 1.2393516412486 | erot = 1.29124446460956 | epot = -11.6639452203567 | etot = -9.13334911449854 +680000 ekin = 1.24151057851822 | erot = 1.26358348831142 | epot = -11.6384431811751 | etot = -9.13334911434545 +681000 ekin = 1.2481079198548 | erot = 1.23998966300245 | epot = -11.6214466973225 | etot = -9.13334911446523 +682000 ekin = 1.25738088472655 | erot = 1.22073219170507 | epot = -11.6114621910609 | etot = -9.13334911462931 +683000 ekin = 1.26715254864191 | erot = 1.2055490969485 | epot = -11.6060507604 | etot = -9.13334911480957 +684000 ekin = 1.27521936884399 | erot = 1.1939299525654 | epot = -11.6024984363875 | etot = -9.13334911497808 +685000 ekin = 1.27965818658062 | erot = 1.18525667281043 | epot = -11.5982639744944 | etot = -9.13334911510335 +686000 ekin = 1.27906445706628 | erot = 1.17887846190797 | epot = -11.5912920341647 | etot = -9.13334911519041 +687000 ekin = 1.27268261754012 | erot = 1.17407129022145 | epot = -11.5801030230213 | etot = -9.13334911525974 +688000 ekin = 1.26041914406642 | erot = 1.1700760478346 | epot = -11.5638443071288 | etot = -9.13334911522773 +689000 ekin = 1.2428793849551 | erot = 1.16656725574329 | epot = -11.5427957558554 | etot = -9.13334911515697 +690000 ekin = 1.22118240404883 | erot = 1.16336387131168 | epot = -11.5178953904198 | etot = -9.13334911505928 +691000 ekin = 1.19679867225268 | erot = 1.16037339233088 | epot = -11.4905211795297 | etot = -9.13334911494617 +692000 ekin = 1.17139142555539 | erot = 1.15758648593064 | epot = -11.4623270263136 | etot = -9.1333491148276 +693000 ekin = 1.14685376597371 | erot = 1.15519232867376 | epot = -11.4353952091881 | etot = -9.1333491145406 +694000 ekin = 1.12537035278852 | erot = 1.15368599836277 | epot = -11.412405465604 | etot = -9.13334911445274 +695000 ekin = 1.10824764597662 | erot = 1.15324052660538 | epot = -11.3948372869643 | etot = -9.1333491143823 +696000 ekin = 1.09641524899341 | erot = 1.15407441364682 | epot = -11.383838776975 | etot = -9.13334911433473 +697000 ekin = 1.09040706960007 | erot = 1.15645735234472 | epot = -11.3802135362623 | etot = -9.13334911431747 +698000 ekin = 1.09030542376481 | erot = 1.16063392710713 | epot = -11.3842884652006 | etot = -9.13334911432863 +699000 ekin = 1.0955253614223 | erot = 1.16669639941862 | epot = -11.3955708752032 | etot = -9.13334911436229 +700000 ekin = 1.10527379803485 | erot = 1.17478862115944 | epot = -11.4134115336302 | etot = -9.13334911443592 +701000 ekin = 1.11851271408444 | erot = 1.18492470948241 | epot = -11.4367865380912 | etot = -9.13334911452438 +702000 ekin = 1.1339554937307 | erot = 1.19694667251745 | epot = -11.4642512808782 | etot = -9.13334911463 +703000 ekin = 1.15018285433623 | erot = 1.2105705597141 | epot = -11.4941025287948 | etot = -9.13334911474445 +704000 ekin = 1.1657667345821 | erot = 1.22535908060157 | epot = -11.5244749300411 | etot = -9.13334911485743 +705000 ekin = 1.17938915503837 | erot = 1.24076765314074 | epot = -11.553505923137 | etot = -9.1333491149579 +706000 ekin = 1.18994261306683 | erot = 1.25622348494622 | epot = -11.5795152130485 | etot = -9.13334911503546 +707000 ekin = 1.19660107195869 | erot = 1.27122780267335 | epot = -11.6011779897132 | etot = -9.13334911508118 +708000 ekin = 1.19885615187048 | erot = 1.28546332267694 | epot = -11.6176685896373 | etot = -9.13334911508987 +709000 ekin = 1.19651981509827 | erot = 1.29888532038517 | epot = -11.6287542505434 | etot = -9.13334911506 +710000 ekin = 1.18969957497472 | erot = 1.31177606554499 | epot = -11.6348247555143 | etot = -9.13334911499455 +711000 ekin = 1.1787538760317 | erot = 1.3247479148329 | epot = -11.6368509057657 | etot = -9.13334911490108 +712000 ekin = 1.16423391784202 | erot = 1.33868945229471 | epot = -11.6362724849272 | etot = -9.13334911479043 +713000 ekin = 1.14681758773388 | erot = 1.35466305351125 | epot = -11.634829755923 | etot = -9.13334911467782 +714000 ekin = 1.12724173590936 | erot = 1.37373509014309 | epot = -11.6343259406299 | etot = -9.13334911457743 +715000 ekin = 1.10624050750221 | erot = 1.39681075798059 | epot = -11.636400379986 | etot = -9.13334911450316 +716000 ekin = 1.08449847089202 | erot = 1.42446438144908 | epot = -11.6423119668073 | etot = -9.13334911446624 +717000 ekin = 1.06262586730476 | erot = 1.45678801963507 | epot = -11.6527630014134 | etot = -9.13334911447358 +718000 ekin = 1.04116056517941 | erot = 1.49328580499488 | epot = -11.6677954846997 | etot = -9.13334911452541 +719000 ekin = 1.02059756446808 | erot = 1.53283565407152 | epot = -11.6867823331548 | etot = -9.1333491146152 +720000 ekin = 1.0014427609145 | erot = 1.57373478108394 | epot = -11.7085266567279 | etot = -9.13334911472945 +721000 ekin = 0.984282698240367 | erot = 1.61383653731675 | epot = -11.7314683504059 | etot = -9.13334911484873 +722000 ekin = 0.969856334574407 | erot = 1.65076935459341 | epot = -11.7539748041227 | etot = -9.13334911495492 +723000 ekin = 0.959109074095759 | erot = 1.68219090541347 | epot = -11.7746490945311 | etot = -9.13334911502187 +724000 ekin = 0.953206498551804 | erot = 1.70610525280783 | epot = -11.7926608663973 | etot = -9.13334911503771 +725000 ekin = 0.953487871458015 | erot = 1.72112406445722 | epot = -11.8079610509135 | etot = -9.13334911499828 +726000 ekin = 0.961348420448175 | erot = 1.7266421875677 | epot = -11.8213397229277 | etot = -9.13334911491184 +727000 ekin = 0.978055186999046 | erot = 1.72290320033124 | epot = -11.8343075021266 | etot = -9.13334911479628 +728000 ekin = 1.00452582497673 | erot = 1.71095374107487 | epot = -11.8488286807248 | etot = -9.13334911467315 +729000 ekin = 1.04110137579934 | erot = 1.69252215341149 | epot = -11.8669726437798 | etot = -9.13334911456893 +730000 ekin = 1.08735958690386 | erot = 1.66981008958264 | epot = -11.890518790993 | etot = -9.13334911450653 +731000 ekin = 1.1420041837516 | erot = 1.64524141706267 | epot = -11.920594715318 | etot = -9.1333491145037 +732000 ekin = 1.20285318014365 | erot = 1.62119095713356 | epot = -11.9573932518487 | etot = -9.13334911457145 +733000 ekin = 1.26692596391617 | erot = 1.5997652891012 | epot = -12.0000403677204 | etot = -9.13334911470305 +734000 ekin = 1.33064406418141 | erot = 1.58254289880734 | epot = -12.0465360778975 | etot = -9.13334911490875 +735000 ekin = 1.39013484388619 | erot = 1.57032898633438 | epot = -12.0938129453804 | etot = -9.13334911515982 +736000 ekin = 1.44157509139699 | erot = 1.56317476788781 | epot = -12.1380989747131 | etot = -9.13334911542835 +737000 ekin = 1.48157845589818 | erot = 1.56044545881657 | epot = -12.1753730303924 | etot = -9.13334911567769 +738000 ekin = 1.50757504378139 | erot = 1.56100911667208 | epot = -12.2019332763223 | etot = -9.13334911586887 +739000 ekin = 1.51813561812423 | erot = 1.56352092529645 | epot = -12.2150056593871 | etot = -9.13334911596644 +740000 ekin = 1.5131891484932 | erot = 1.56675183785207 | epot = -12.2132901022912 | etot = -9.13334911594598 +741000 ekin = 1.49408865830106 | erot = 1.56989906104169 | epot = -12.1973368351425 | etot = -9.13334911579973 +742000 ekin = 1.46350061535612 | erot = 1.57280025700805 | epot = -12.1696499879058 | etot = -9.13334911554164 +743000 ekin = 1.42512524133835 | erot = 1.5759331060082 | epot = -12.1344074625141 | etot = -9.13334911516755 +744000 ekin = 1.38338487585248 | erot = 1.58054361278335 | epot = -12.0972776034333 | etot = -9.13334911479746 +745000 ekin = 1.34281951273925 | erot = 1.58823582840579 | epot = -12.0644044556005 | etot = -9.13334911445543 +746000 ekin = 1.3074733476531 | erot = 1.60047096980707 | epot = -12.041293431658 | etot = -9.13334911419779 +747000 ekin = 1.28046646005374 | erot = 1.61821768665581 | epot = -12.0320332608023 | etot = -9.13334911409271 +748000 ekin = 1.26367955923549 | erot = 1.64132893143149 | epot = -12.0383576048368 | etot = -9.13334911416977 +749000 ekin = 1.25742934419916 | erot = 1.66831440024107 | epot = -12.0590928588777 | etot = -9.1333491144375 +750000 ekin = 1.26047795507714 | erot = 1.69628448614349 | epot = -12.0901115560711 | etot = -9.13334911485048 +751000 ekin = 1.27026186447005 | erot = 1.72133386885556 | epot = -12.1249448486651 | etot = -9.13334911533951 +752000 ekin = 1.28339547086213 | erot = 1.7391907550537 | epot = -12.1559353417243 | etot = -9.13334911580849 +753000 ekin = 1.29635957466465 | erot = 1.74596876191514 | epot = -12.1756774527986 | etot = -9.1333491162188 +754000 ekin = 1.30599158740738 | erot = 1.73885024062937 | epot = -12.1781909444246 | etot = -9.13334911638781 +755000 ekin = 1.31024888115925 | erot = 1.71683511467824 | epot = -12.1604331121785 | etot = -9.13334911634098 +756000 ekin = 1.30846938321297 | erot = 1.68097972249326 | epot = -12.1227982217976 | etot = -9.13334911609136 +757000 ekin = 1.30124985041155 | erot = 1.63419006476318 | epot = -12.0687890308635 | etot = -9.13334911568874 +758000 ekin = 1.29019641090291 | erot = 1.58073563388876 | epot = -12.0042811599956 | etot = -9.13334911520392 +759000 ekin = 1.27761222227388 | erot = 1.52554636406421 | epot = -11.9365077010364 | etot = -9.13334911469834 +760000 ekin = 1.26609069506515 | erot = 1.47348693038562 | epot = -11.8729267397093 | etot = -9.13334911425857 +761000 ekin = 1.25808964011373 | erot = 1.42869550462559 | epot = -11.8201342586628 | etot = -9.13334911392351 +762000 ekin = 1.2557222220027 | erot = 1.39407442311413 | epot = -11.7831457588655 | etot = -9.13334911374866 +763000 ekin = 1.26054534569423 | erot = 1.37090045944292 | epot = -11.7647949188326 | etot = -9.13334911369551 +764000 ekin = 1.27353435439597 | erot = 1.35887199086497 | epot = -11.7657554590525 | etot = -9.13334911379152 +765000 ekin = 1.29496682599499 | erot = 1.35616457698383 | epot = -11.7844805169715 | etot = -9.13334911399271 +766000 ekin = 1.32454629041756 | erot = 1.35977679503123 | epot = -11.8176721997117 | etot = -9.13334911426287 +767000 ekin = 1.36163954271379 | erot = 1.36618632224179 | epot = -11.8611749795103 | etot = -9.13334911455469 +768000 ekin = 1.40531019892094 | erot = 1.37181010083784 | epot = -11.9104694145876 | etot = -9.13334911482879 +769000 ekin = 1.45446512868536 | erot = 1.37353498051673 | epot = -11.9613492242422 | etot = -9.13334911504015 +770000 ekin = 1.50793050151783 | erot = 1.36921125650349 | epot = -12.0104908732572 | etot = -9.13334911523587 +771000 ekin = 1.56389616692798 | erot = 1.35775090661774 | epot = -12.0549961888034 | etot = -9.13334911525767 +772000 ekin = 1.62113703503969 | erot = 1.33970323505823 | epot = -12.0941893852864 | etot = -9.13334911518849 +773000 ekin = 1.67872851568979 | erot = 1.3170298298989 | epot = -12.1291074606507 | etot = -9.13334911506197 +774000 ekin = 1.73569257108243 | erot = 1.29264163251396 | epot = -12.1616833185185 | etot = -9.13334911492206 +775000 ekin = 1.79085656132941 | erot = 1.26988000053024 | epot = -12.1940856766708 | etot = -9.13334911481117 +776000 ekin = 1.84276100467541 | erot = 1.25197534039084 | epot = -12.2280854598246 | etot = -9.13334911475839 +777000 ekin = 1.88967118603039 | erot = 1.24159765892512 | epot = -12.2646179597273 | etot = -9.1333491147718 +778000 ekin = 1.9297162225995 | erot = 1.24057583215499 | epot = -12.303641169595 | etot = -9.13334911484054 +779000 ekin = 1.9611316425415 | erot = 1.24980912494295 | epot = -12.3442898824248 | etot = -9.13334911494038 +780000 ekin = 1.98254203385539 | erot = 1.26932045667715 | epot = -12.3852116055761 | etot = -9.13334911504356 +781000 ekin = 1.9932140640502 | erot = 1.29840823519191 | epot = -12.4249714143716 | etot = -9.13334911512951 +782000 ekin = 1.99321095940136 | erot = 1.33580885492537 | epot = -12.4623689295147 | etot = -9.13334911518796 +783000 ekin = 1.98342491292877 | erot = 1.37983642298654 | epot = -12.4966104511329 | etot = -9.13334911521759 +784000 ekin = 1.96551238429458 | erot = 1.42849371621366 | epot = -12.5273552156782 | etot = -9.13334911516994 +785000 ekin = 1.94195910111536 | erot = 1.4796134882178 | epot = -12.5549217044944 | etot = -9.13334911516124 +786000 ekin = 1.91549982325668 | erot = 1.53087711626571 | epot = -12.5797260546585 | etot = -9.13334911513609 +787000 ekin = 1.88902915932762 | erot = 1.57997565975501 | epot = -12.6023539341757 | etot = -9.13334911509307 +788000 ekin = 1.8655374655374 | erot = 1.62478646024939 | epot = -12.6236730408243 | etot = -9.13334911503753 +789000 ekin = 1.84793067283938 | erot = 1.66350572426187 | epot = -12.6447855120654 | etot = -9.13334911496417 +790000 ekin = 1.83884831411928 | erot = 1.69477325871393 | epot = -12.6669706877276 | etot = -9.13334911489441 +791000 ekin = 1.84038435201287 | erot = 1.717681278482 | epot = -12.6914147453501 | etot = -9.1333491148552 +792000 ekin = 1.85374621231071 | erot = 1.73169683790039 | epot = -12.7187921650887 | etot = -9.13334911487764 +793000 ekin = 1.87892178729581 | erot = 1.7365357692381 | epot = -12.7488066715196 | etot = -9.13334911498573 +794000 ekin = 1.9144051004538 | erot = 1.73204169927541 | epot = -12.7797959149079 | etot = -9.13334911517866 +795000 ekin = 1.95726697872445 | erot = 1.7181897621696 | epot = -12.8088058563145 | etot = -9.13334911542047 +796000 ekin = 2.00360851779741 | erot = 1.69525335458669 | epot = -12.8322109880317 | etot = -9.13334911564764 +797000 ekin = 2.04914358120541 | erot = 1.66405946741293 | epot = -12.8465521644082 | etot = -9.13334911578984 +798000 ekin = 2.08995546227646 | erot = 1.62623745951928 | epot = -12.8495420375983 | etot = -9.13334911580259 +799000 ekin = 2.12309292251455 | erot = 1.58427028115591 | epot = -12.8407123193571 | etot = -9.13334911568662 +800000 ekin = 2.14682990847798 | erot = 1.54126138558611 | epot = -12.8214404095459 | etot = -9.13334911548182 +801000 ekin = 2.16058282773072 | erot = 1.50048202046291 | epot = -12.7944139634394 | etot = -9.13334911524581 +802000 ekin = 2.16461511109769 | erot = 1.46486615502033 | epot = -12.7628303811484 | etot = -9.13334911503038 +803000 ekin = 2.15969104316893 | erot = 1.43661335441228 | epot = -12.7296535124497 | etot = -9.13334911486855 +804000 ekin = 2.14679128688362 | erot = 1.41698988507324 | epot = -12.697130286716 | etot = -9.13334911475917 +805000 ekin = 2.12692065944467 | erot = 1.40638520513925 | epot = -12.6666549793083 | etot = -9.13334911472434 +806000 ekin = 2.10099028264049 | erot = 1.40422932574232 | epot = -12.6385687231435 | etot = -9.13334911476072 +807000 ekin = 2.0698276384243 | erot = 1.40909451157967 | epot = -12.6122712648421 | etot = -9.1333491148381 +808000 ekin = 2.03419092298425 | erot = 1.41919422166235 | epot = -12.5867342595753 | etot = -9.13334911492871 +809000 ekin = 1.99478586656647 | erot = 1.4323885834066 | epot = -12.5605235650258 | etot = -9.13334911505277 +810000 ekin = 1.95230744547314 | erot = 1.44625258192792 | epot = -12.5319091425763 | etot = -9.13334911517529 +811000 ekin = 1.90747094189393 | erot = 1.45847148723586 | epot = -12.4992915444127 | etot = -9.13334911528296 +812000 ekin = 1.86102893103176 | erot = 1.4670396354885 | epot = -12.4614176818835 | etot = -9.13334911536329 +813000 ekin = 1.81416432243969 | erot = 1.47049868907969 | epot = -12.4180121266556 | etot = -9.13334911513622 +814000 ekin = 1.7690292616789 | erot = 1.46826739311699 | epot = -12.3706457700814 | etot = -9.13334911528547 +815000 ekin = 1.71533069952221 | erot = 1.45797598424745 | epot = -12.3066557947942 | etot = -9.13334911102453 +816000 ekin = 1.68468183703207 | erot = 1.43935942019696 | epot = -12.257390367637 | etot = -9.13334911040796 +817000 ekin = 1.67569540451596 | erot = 1.42022759193342 | epot = -12.2292721045984 | etot = -9.13334910814902 +818000 ekin = 1.65431804078292 | erot = 1.40071144600214 | epot = -12.1883785945463 | etot = -9.13334910776125 +819000 ekin = 1.63740188371185 | erot = 1.3825693171682 | epot = -12.1533203082661 | etot = -9.13334910738609 +820000 ekin = 1.62512170450201 | erot = 1.36928168852872 | epot = -12.127752500055 | etot = -9.13334910702429 +821000 ekin = 1.61915909097238 | erot = 1.36404110715767 | epot = -12.116549304838 | etot = -9.13334910670795 +822000 ekin = 1.62172343975997 | erot = 1.36925913747531 | epot = -12.1243316837534 | etot = -9.13334910651813 +823000 ekin = 1.63427494812674 | erot = 1.38616632190425 | epot = -12.1537903765404 | etot = -9.13334910650937 +824000 ekin = 1.65698382618117 | erot = 1.41459711184826 | epot = -12.2049300447226 | etot = -9.13334910669317 +825000 ekin = 1.68854753273754 | erot = 1.4530163184112 | epot = -12.2749129581874 | etot = -9.13334910703868 +826000 ekin = 1.72638863496182 | erot = 1.49875661578855 | epot = -12.3584943582387 | etot = -9.13334910748834 +827000 ekin = 1.76710423380894 | erot = 1.5483943923347 | epot = -12.4488477341201 | etot = -9.13334910797649 +828000 ekin = 1.80698482334212 | erot = 1.59818184900584 | epot = -12.5385157807928 | etot = -9.13334910844479 +829000 ekin = 1.84246939970371 | erot = 1.64447465717353 | epot = -12.6202931657229 | etot = -9.13334910884565 +830000 ekin = 1.87048980343784 | erot = 1.68412933438467 | epot = -12.6879682469633 | etot = -9.13334910914077 +831000 ekin = 1.88871335828315 | erot = 1.71486645417632 | epot = -12.7369289217598 | etot = -9.13334910930037 +832000 ekin = 1.89569916792215 | erot = 1.73558694751606 | epot = -12.7646352247433 | etot = -9.13334910930512 +833000 ekin = 1.89096344935919 | erot = 1.74659447551767 | epot = -12.7709070340313 | etot = -9.13334910915446 +834000 ekin = 1.87493429545044 | erot = 1.74964392180392 | epot = -12.7579273261441 | etot = -9.13334910888973 +835000 ekin = 1.84878280514188 | erot = 1.74762027308111 | epot = -12.7297521867477 | etot = -9.13334910852467 +836000 ekin = 1.81414476909458 | erot = 1.74421722088821 | epot = -12.6917110981233 | etot = -9.13334910814055 +837000 ekin = 1.77277875467178 | erot = 1.74335285139621 | epot = -12.6494807138721 | etot = -9.13334910780415 +838000 ekin = 1.72624445531291 | erot = 1.74841404792742 | epot = -12.6080076108072 | etot = -9.13334910756691 +839000 ekin = 1.67568816110695 | erot = 1.76165550554617 | epot = -12.5706927741087 | etot = -9.13334910745559 +840000 ekin = 1.62179135099361 | erot = 1.78387657046074 | epot = -12.5390170289109 | etot = -9.13334910745657 +841000 ekin = 1.56488441151228 | erot = 1.81456573943011 | epot = -12.5127992584808 | etot = -9.13334910753844 +842000 ekin = 1.50517399563012 | erot = 1.85205645865189 | epot = -12.4905795619798 | etot = -9.13334910769775 +843000 ekin = 1.44300548284013 | erot = 1.89358112522623 | epot = -12.4699357158733 | etot = -9.1333491078069 +844000 ekin = 1.37906620630961 | erot = 1.9363968518669 | epot = -12.4488121660479 | etot = -9.13334910787136 +845000 ekin = 1.31446352833253 | erot = 1.97812996436854 | epot = -12.4259426005726 | etot = -9.13334910787156 +846000 ekin = 1.2506869232932 | erot = 2.01700234954142 | epot = -12.4010383806382 | etot = -9.13334910780356 +847000 ekin = 1.18947724707827 | erot = 2.05204320492274 | epot = -12.3748695596767 | etot = -9.13334910767568 +848000 ekin = 1.13265732504563 | erot = 2.08314733278718 | epot = -12.3491537653375 | etot = -9.13334910750474 +849000 ekin = 1.08197657769804 | erot = 2.11099249695246 | epot = -12.3263181819604 | etot = -9.1333491073099 +850000 ekin = 1.03899924537826 | erot = 2.13684654285134 | epot = -12.3091948953427 | etot = -9.13334910711305 +851000 ekin = 1.00503792489466 | erot = 2.16230618699749 | epot = -12.3006932188269 | etot = -9.13334910693474 +852000 ekin = 0.981116857869625 | erot = 2.18901371773925 | epot = -12.3034796824018 | etot = -9.13334910679296 +853000 ekin = 0.967947652220943 | erot = 2.21839549972771 | epot = -12.3196922586521 | etot = -9.13334910670346 +854000 ekin = 0.965908910686514 | erot = 2.25145766401094 | epot = -12.3507156813713 | etot = -9.13334910667388 +855000 ekin = 0.975031148290714 | erot = 2.28866143868334 | epot = -12.3970416936804 | etot = -9.13334910670631 +856000 ekin = 0.994993726116716 | erot = 2.32988587266416 | epot = -12.4582287055777 | etot = -9.13334910679682 +857000 ekin = 1.02514000045904 | erot = 2.37447147764261 | epot = -12.5329605850375 | etot = -9.13334910693581 +858000 ekin = 1.06451194043056 | erot = 2.42132581263801 | epot = -12.619186860179 | etot = -9.13334910711044 +859000 ekin = 1.11189872921113 | erot = 2.46906217646869 | epot = -12.7143100129879 | etot = -9.13334910730811 +860000 ekin = 1.1658880043274 | erot = 2.51613734357253 | epot = -12.8153744554191 | etot = -9.13334910751921 +861000 ekin = 1.22490604809786 | erot = 2.56095681693251 | epot = -12.9192119727698 | etot = -9.13334910773946 +862000 ekin = 1.2872363258061 | erot = 2.60192847235973 | epot = -13.0225139061362 | etot = -9.1333491079704 +863000 ekin = 1.35101431938244 | erot = 2.63746581474711 | epot = -13.1218292423458 | etot = -9.13334910821624 +864000 ekin = 1.41420820518659 | erot = 2.66596355874005 | epot = -13.2135208724068 | etot = -9.13334910848016 +865000 ekin = 1.47460562928785 | erot = 2.6857819546387 | epot = -13.2937366926867 | etot = -9.13334910876018 +866000 ekin = 1.52983303720772 | erot = 2.69527584727129 | epot = -13.3584579935244 | etot = -9.13334910904542 +867000 ekin = 1.57743376516812 | erot = 2.6928893309621 | epot = -13.4036722054452 | etot = -9.13334910931502 +868000 ekin = 1.61502389037303 | erot = 2.67731200500682 | epot = -13.4256850049196 | etot = -9.13334910953978 +869000 ekin = 1.64053051308163 | erot = 2.6476662552779 | epot = -13.4215458780457 | etot = -9.13334910968619 +870000 ekin = 1.65249590024982 | erot = 2.60367561916209 | epot = -13.3895206291353 | etot = -9.13334910972337 +871000 ekin = 1.65040511753768 | erot = 2.54576053414292 | epot = -13.3295147613111 | etot = -9.1333491096305 +872000 ekin = 1.63497077370826 | erot = 2.47502461263164 | epot = -13.2433444957426 | etot = -9.13334910940269 +873000 ekin = 1.60829551086271 | erot = 2.39312864670762 | epot = -13.1347732666248 | etot = -9.1333491090545 +874000 ekin = 1.57383856497694 | erot = 2.30208675135929 | epot = -13.0092744249551 | etot = -9.13334910861885 +875000 ekin = 1.53613967512438 | erot = 2.20404109164597 | epot = -12.8735298749149 | etot = -9.1333491081445 +876000 ekin = 1.50030007471464 | erot = 2.10106901468353 | epot = -12.7347181970869 | etot = -9.13334910768869 +877000 ekin = 1.47128183650108 | erot = 1.99505592486885 | epot = -12.5996868686778 | etot = -9.13334910730782 +878000 ekin = 1.45315269235 | erot = 1.88764504253699 | epot = -12.4741468419323 | etot = -9.13334910704534 +879000 ekin = 1.4484500959266 | erot = 1.78026193724842 | epot = -12.3620611400946 | etot = -9.13334910691957 +880000 ekin = 1.45783397194386 | erot = 1.67420503622016 | epot = -12.2653881150821 | etot = -9.13334910691806 +881000 ekin = 1.48012455416753 | erot = 1.57078382964449 | epot = -12.1842574908138 | etot = -9.13334910700176 +882000 ekin = 1.51270015737059 | erot = 1.47147015192501 | epot = -12.1175194164142 | etot = -9.13334910711862 +883000 ekin = 1.55211568291773 | erot = 1.37801244883105 | epot = -12.0634772389701 | etot = -9.13334910722133 +884000 ekin = 1.59475301549695 | erot = 1.29246300163005 | epot = -12.0205651244067 | etot = -9.13334910727973 +885000 ekin = 1.63734681492245 | erot = 1.21709221485168 | epot = -11.9877881370588 | etot = -9.13334910728466 +886000 ekin = 1.6773121130015 | erot = 1.15420415260407 | epot = -11.9648653728497 | etot = -9.13334910724412 +887000 ekin = 1.71288068345535 | erot = 1.10590165063719 | epot = -11.9521314412674 | etot = -9.13334910717484 +888000 ekin = 1.74309500656915 | erot = 1.07385834530941 | epot = -11.950302458975 | etot = -9.13334910709643 +889000 ekin = 1.76770969091231 | erot = 1.05913784424334 | epot = -11.9601966421835 | etot = -9.13334910702782 +890000 ekin = 1.78703240996185 | erot = 1.06207375035186 | epot = -11.9824552673014 | etot = -9.13334910698768 +891000 ekin = 1.80172329224763 | erot = 1.08220747466305 | epot = -12.0172798739035 | etot = -9.13334910699285 +892000 ekin = 1.81257293682635 | erot = 1.11828058018264 | epot = -12.0642026240649 | etot = -9.13334910705593 +893000 ekin = 1.82028982711442 | erot = 1.16828769625092 | epot = -12.1219266305462 | etot = -9.13334910718089 +894000 ekin = 1.82533649728179 | erot = 1.22960280171653 | epot = -12.1882884063592 | etot = -9.13334910736086 +895000 ekin = 1.82785071659427 | erot = 1.2991877547128 | epot = -12.2603875788832 | etot = -9.13334910757614 +896000 ekin = 1.82766966747743 | erot = 1.37387583336524 | epot = -12.3348946086395 | etot = -9.13334910779684 +897000 ekin = 1.82444603807961 | erot = 1.45069893544394 | epot = -12.4084940815133 | etot = -9.13334910798977 +898000 ekin = 1.81781661005541 | erot = 1.52720356356609 | epot = -12.4783692817485 | etot = -9.13334910812701 +899000 ekin = 1.80756915109155 | erot = 1.60168843028858 | epot = -12.5426066895729 | etot = -9.13334910819277 +900000 ekin = 1.79375843955379 | erot = 1.67330364931526 | epot = -12.6004111970576 | etot = -9.13334910818851 +901000 ekin = 1.77674318475336 | erot = 1.74197941465947 | epot = -12.6520717075445 | etot = -9.13334910813171 +902000 ekin = 1.75714245727909 | erot = 1.80819394408805 | epot = -12.6986855094183 | etot = -9.13334910805119 +903000 ekin = 1.7357334444054 | erot = 1.87263325992122 | epot = -12.7417158123058 | etot = -9.13334910797918 +904000 ekin = 1.71332625907535 | erot = 1.93582474193924 | epot = -12.782500108957 | etot = -9.13334910794242 +905000 ekin = 1.69065428569354 | erot = 1.99783248441353 | epot = -12.8218358780628 | etot = -9.1333491079557 +906000 ekin = 1.66831072855137 | erot = 2.05808381419499 | epot = -12.8597436507661 | etot = -9.13334910801975 +907000 ekin = 1.64674588303028 | erot = 2.11535919823548 | epot = -12.8954541893857 | etot = -9.13334910811994 +908000 ekin = 1.62631907113306 | erot = 2.16793324012268 | epot = -12.9276014194903 | etot = -9.13334910823454 +909000 ekin = 1.60738004099874 | erot = 2.21381581983028 | epot = -12.9545449691698 | etot = -9.13334910834077 +910000 ekin = 1.59034402491101 | erot = 2.25102295600898 | epot = -12.9747160893416 | etot = -9.13334910842156 +911000 ekin = 1.57572782710831 | erot = 2.27781488082938 | epot = -12.9868918164058 | etot = -9.13334910846814 +912000 ekin = 1.5641305468329 | erot = 2.29287003004535 | epot = -12.9903496853576 | etot = -9.13334910847936 +913000 ekin = 1.5561639873769 | erot = 2.29539983334633 | epot = -12.9849129291808 | etot = -9.13334910845755 +914000 ekin = 1.55235379274342 | erot = 2.2852276038725 | epot = -12.970930505022 | etot = -9.13334910840612 +915000 ekin = 1.55303636075847 | erot = 2.26284508697262 | epot = -12.94923055606 | etot = -9.13334910832891 +916000 ekin = 1.5582700337321 | erot = 2.22943339360812 | epot = -12.9210525355727 | etot = -9.13334910823245 +917000 ekin = 1.567769240557 | erot = 2.18681551598724 | epot = -12.8879338646715 | etot = -9.13334910812723 +918000 ekin = 1.58086450735443 | erot = 2.13731406706596 | epot = -12.8515276824492 | etot = -9.1333491080288 +919000 ekin = 1.5964919092129 | erot = 2.08351907893934 | epot = -12.8133600961054 | etot = -9.13334910795319 +920000 ekin = 1.613218928833 | erot = 2.02800735916595 | epot = -12.7745753959116 | etot = -9.13334910791269 +921000 ekin = 1.62931395437424 | erot = 1.97307497750711 | epot = -12.7357380397945 | etot = -9.13334910791311 +922000 ekin = 1.64286104746403 | erot = 1.9205387034094 | epot = -12.6967488588242 | etot = -9.13334910795072 +923000 ekin = 1.65191234390798 | erot = 1.87163759208079 | epot = -12.6568990440028 | etot = -9.13334910801399 +924000 ekin = 1.65466206201181 | erot = 1.82703710613301 | epot = -12.6150482762312 | etot = -9.1333491080864 +925000 ekin = 1.64962158356019 | erot = 1.7869168012849 | epot = -12.5698874929949 | etot = -9.13334910814982 +926000 ekin = 1.63577435705856 | erot = 1.75111283230762 | epot = -12.5202362975531 | etot = -9.13334910818689 +927000 ekin = 1.61269412580932 | erot = 1.71928618607917 | epot = -12.4653294200718 | etot = -9.13334910818336 +928000 ekin = 1.58061327338363 | erot = 1.69109387512973 | epot = -12.4050562566428 | etot = -9.13334910812944 +929000 ekin = 1.54043465718537 | erot = 1.66634444993708 | epot = -12.3401282151431 | etot = -9.1333491080206 +930000 ekin = 1.49368612296874 | erot = 1.64511875929371 | epot = -12.272153990122 | etot = -9.13334910785959 +931000 ekin = 1.44242020035585 | erot = 1.62783092394188 | epot = -12.2036002319551 | etot = -9.13334910765736 +932000 ekin = 1.38906420477755 | erot = 1.6152004876811 | epot = -12.1376137998939 | etot = -9.13334910743527 +933000 ekin = 1.33622958395961 | erot = 1.60811568410308 | epot = -12.0776943752853 | etot = -9.13334910722259 +934000 ekin = 1.2864948698278 | erot = 1.60739378972964 | epot = -12.0272377666119 | etot = -9.13334910705443 +935000 ekin = 1.24218246525189 | erot = 1.61347919083567 | epot = -11.9890107630518 | etot = -9.13334910696425 +936000 ekin = 1.20515312897568 | erot = 1.62614770366198 | epot = -11.9646499396149 | etot = -9.13334910697722 +937000 ekin = 1.17664231216342 | erot = 1.64429583354988 | epot = -11.954287252818 | etot = -9.13334910710468 +938000 ekin = 1.15716006420355 | erot = 1.66588444175493 | epot = -11.956393613298 | etot = -9.13334910733952 +939000 ekin = 1.1464717171079 | erot = 1.68810326831979 | epot = -11.9679240930744 | etot = -9.13334910764671 +940000 ekin = 1.14367004080966 | erot = 1.70771457433986 | epot = -11.9847337231458 | etot = -9.13334910799624 +941000 ekin = 1.14733884563068 | erot = 1.72149292700232 | epot = -12.0021808809547 | etot = -9.13334910832172 +942000 ekin = 1.15580134680235 | erot = 1.72687300440463 | epot = -12.0160234597692 | etot = -9.13334910856219 +943000 ekin = 1.1674372951318 | erot = 1.72249936625656 | epot = -12.0232857700532 | etot = -9.13334910866488 +944000 ekin = 1.18103106474372 | erot = 1.70858712464011 | epot = -12.022967297985 | etot = -9.13334910860112 +945000 ekin = 1.19606804453646 | erot = 1.68696892706896 | epot = -12.0163860799882 | etot = -9.13334910838277 +946000 ekin = 1.21284058109418 | erot = 1.66075870249184 | epot = -12.006948391658 | etot = -9.13334910807199 +947000 ekin = 1.23222210572278 | erot = 1.6336701113943 | epot = -11.9992413248879 | etot = -9.13334910777082 +948000 ekin = 1.25509690715209 | erot = 1.60916358071798 | epot = -11.9976095954562 | etot = -9.13334910758614 +949000 ekin = 1.28167104220565 | erot = 1.58969080393768 | epot = -12.0047109537229 | etot = -9.13334910757956 +950000 ekin = 1.31105510038024 | erot = 1.57628415674479 | epot = -12.0206883648626 | etot = -9.13334910773754 +951000 ekin = 1.34140314928621 | erot = 1.56859135849714 | epot = -12.0433436157658 | etot = -9.13334910798244 +952000 ekin = 1.37054117668943 | erot = 1.56526000759068 | epot = -12.0691502925011 | etot = -9.13334910822102 +953000 ekin = 1.39670348101787 | erot = 1.56444621742151 | epot = -12.0944988068312 | etot = -9.13334910839178 +954000 ekin = 1.418975292381 | erot = 1.56423287014588 | epot = -12.1165572710088 | etot = -9.13334910848189 +955000 ekin = 1.43729048070642 | erot = 1.56287479952712 | epot = -12.1335143887448 | etot = -9.13334910851126 +956000 ekin = 1.4521106633277 | erot = 1.5589293854746 | epot = -12.1443891573079 | etot = -9.13334910850558 +957000 ekin = 1.46402190623311 | erot = 1.55132217595963 | epot = -12.1486931906758 | etot = -9.1333491084831 +958000 ekin = 1.47342593725724 | erot = 1.53954965711569 | epot = -12.1463247028086 | etot = -9.13334910843571 +959000 ekin = 1.48038578494991 | erot = 1.52394133601144 | epot = -12.1376762293203 | etot = -9.1333491083589 +960000 ekin = 1.48460604034119 | erot = 1.50575363436951 | epot = -12.123708782956 | etot = -9.13334910824526 +961000 ekin = 1.48549975936096 | erot = 1.48721075412105 | epot = -12.1060596215745 | etot = -9.1333491080925 +962000 ekin = 1.48229853496308 | erot = 1.47141202583098 | epot = -12.0870596687005 | etot = -9.13334910790645 +963000 ekin = 1.4741760327198 | erot = 1.46210240867199 | epot = -12.0696275490933 | etot = -9.13334910770152 +964000 ekin = 1.46036644524797 | erot = 1.46332191688881 | epot = -12.0570374696332 | etot = -9.13334910749639 +965000 ekin = 1.44026662181698 | erot = 1.47896324786388 | epot = -12.0525789769985 | etot = -9.13334910731761 +966000 ekin = 1.41351583400278 | erot = 1.51227943251815 | epot = -12.0591443737115 | etot = -9.13334910719058 +967000 ekin = 1.38005134111899 | erot = 1.56539665062779 | epot = -12.0787970988869 | etot = -9.13334910714008 +968000 ekin = 1.34025482724314 | erot = 1.6388568627753 | epot = -12.1124607971947 | etot = -9.13334910717624 +969000 ekin = 1.29476921981363 | erot = 1.73132793710989 | epot = -12.1594462642464 | etot = -9.13334910732287 +970000 ekin = 1.24442005392726 | erot = 1.83972520712881 | epot = -12.217494368596 | etot = -9.1333491075399 +971000 ekin = 1.19046696427247 | erot = 1.95943091409806 | epot = -12.2832469861666 | etot = -9.13334910779604 +972000 ekin = 1.13463097113647 | erot = 2.08475088502996 | epot = -12.3527309642158 | etot = -9.13334910804932 +973000 ekin = 1.07911059567858 | erot = 2.20953944502461 | epot = -12.4219991489609 | etot = -9.13334910825774 +974000 ekin = 1.02657367041557 | erot = 2.32774347840719 | epot = -12.4876662572468 | etot = -9.13334910842406 +975000 ekin = 0.979977932768277 | erot = 2.43392801404807 | epot = -12.5472550553029 | etot = -9.13334910848655 +976000 ekin = 0.942304887100931 | erot = 2.52399013956154 | epot = -12.5996441351357 | etot = -9.13334910847322 +977000 ekin = 0.916335295707905 | erot = 2.59517570124579 | epot = -12.6448601053641 | etot = -9.13334910841037 +978000 ekin = 0.90431642289399 | erot = 2.64601698758131 | epot = -12.6836825188069 | etot = -9.13334910833155 +979000 ekin = 0.907654941511536 | erot = 2.67612704045953 | epot = -12.7171310902397 | etot = -9.13334910826865 +980000 ekin = 0.926700183439006 | erot = 2.68592744664022 | epot = -12.7459767383234 | etot = -9.1333491082442 +981000 ekin = 0.960659745242456 | erot = 2.67638285527366 | epot = -12.7703917087825 | etot = -9.13334910826642 +982000 ekin = 1.00766017971475 | erot = 2.64879736700748 | epot = -12.7898066550524 | etot = -9.13334910833016 +983000 ekin = 1.06493892794398 | erot = 2.60470505315865 | epot = -12.8029930895196 | etot = -9.13334910841693 +984000 ekin = 1.12913508942297 | erot = 2.54586103455185 | epot = -12.8083452324744 | etot = -9.13334910849963 +985000 ekin = 1.19663599745843 | erot = 2.47431116851685 | epot = -12.804296274524 | etot = -9.13334910854871 +986000 ekin = 1.26393164267929 | erot = 2.3924915963827 | epot = -12.7897723476014 | etot = -9.13334910853942 +987000 ekin = 1.32792910236552 | erot = 2.30329384117171 | epot = -12.764572051996 | etot = -9.13334910845872 +988000 ekin = 1.38618594051916 | erot = 2.21003704541292 | epot = -12.7295720942411 | etot = -9.133349108309 +989000 ekin = 1.43703663165432 | erot = 2.1163177663603 | epot = -12.6867035061219 | etot = -9.13334910810728 +990000 ekin = 1.47960743026485 | erot = 2.02574976476465 | epot = -12.6387063029103 | etot = -9.13334910788076 +991000 ekin = 1.51373724652975 | erot = 1.94164272477107 | epot = -12.5887290789609 | etot = -9.13334910766011 +992000 ekin = 1.53983818593236 | erot = 1.86668512516266 | epot = -12.539872418568 | etot = -9.13334910747295 +993000 ekin = 1.55873490674598 | erot = 1.8026898200528 | epot = -12.4947738341376 | etot = -9.13334910733883 +994000 ekin = 1.57151651515921 | erot = 1.75043914206067 | epot = -12.4553047644873 | etot = -9.13334910726744 +995000 ekin = 1.57942173437226 | erot = 1.70964079469052 | epot = -12.4224116363224 | etot = -9.13334910725962 +996000 ekin = 1.58376261673973 | erot = 1.67898574512825 | epot = -12.3960974691761 | etot = -9.1333491073081 +997000 ekin = 1.58587878576943 | erot = 1.65629050260393 | epot = -12.3755183957746 | etot = -9.1333491074012 +998000 ekin = 1.58710748473035 | erot = 1.63870906510968 | epot = -12.3591656573628 | etot = -9.13334910752281 +999000 ekin = 1.58875603201178 | erot = 1.62299637538288 | epot = -12.3451015150516 | etot = -9.13334910765698 +1000000 ekin = 1.59207001216863 | erot = 1.60581739807408 | epot = -12.3312365180243 | etot = -9.13334910778154 + 1000000 0.11793111 -1.2674127 0.034288999 -1.0739167 -1.3883882e-05 64000 +Loop time of 14.6434 on 1 procs for 1000000 steps with 10 atoms + +Performance: 59002.538 tau/day, 68289.974 timesteps/s +99.7% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 12.032 | 12.032 | 12.032 | 0.0 | 82.17 +Bond | 0.59079 | 0.59079 | 0.59079 | 0.0 | 4.03 +Neigh | 0.018165 | 0.018165 | 0.018165 | 0.0 | 0.12 +Comm | 0.18074 | 0.18074 | 0.18074 | 0.0 | 1.23 +Output | 0.097602 | 0.097602 | 0.097602 | 0.0 | 0.67 +Modify | 1.47 | 1.47 | 1.47 | 0.0 | 10.04 +Other | | 0.2538 | | | 1.73 + +Nlocal: 10.0000 ave 10 max 10 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 37.0000 ave 37 max 37 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 37 +Ave neighs/atom = 3.7000000 +Ave special neighs/atom = 3.6000000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.1.* nocoeff +System init for write_data ... +Total wall time: 0:00:14 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 new file mode 100644 index 0000000000..cf52039af3 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 @@ -0,0 +1,1171 @@ +LAMMPS (27 May 2021) +variable number equal 1 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex1 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 10 atoms + reading velocities ... + 10 velocities + scanning bonds ... + 2 = max bonds/atom + 10 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 8 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +set atom * mass 3.1575 +Setting atom values ... + 10 settings made for mass + +group all type 1 4 +10 atoms in group all + +# oxDNA bond interactions - FENE backbone +bond_style oxdna/fene +bond_coeff * 2.0 0.25 0.7525 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk +pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.1.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 2.9560004 + ghost atom cutoff = 3.8 + binsize = 1.4780002, bins = 28 28 28 + 4 neighbor lists, perpetual/occasional/extra = 4 0 0 + (1) pair oxdna/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +0 ekin = 1.10853632272819 | erot = 2.81573649976629 | epot = -13.057621953437 | etot = -9.13334913094248 +Per MPI rank memory allocation (min/avg/max) = 9.105 | 9.111 | 9.117 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.082113802 -1.3488546 0.043092397 -1.1949086 -4.6816211e-05 64000 +1000 ekin = 1.08024346604046 | erot = 2.90873406534668 | epot = -13.1223266626202 | etot = -9.1333491312331 +2000 ekin = 1.05028450914436 | erot = 2.98006324808558 | epot = -13.1636968886591 | etot = -9.13334913142917 +3000 ekin = 1.01964458529397 | erot = 3.02592193798632 | epot = -13.1789156547658 | etot = -9.13334913148548 +4000 ekin = 0.989515033089525 | erot = 3.04428486059471 | epot = -13.1671490250723 | etot = -9.1333491313881 +5000 ekin = 0.961283929687808 | erot = 3.03510855539557 | epot = -13.1297416162282 | etot = -9.13334913114479 +6000 ekin = 0.936412193404227 | erot = 3.00022299571976 | epot = -13.0699843199583 | etot = -9.13334913083429 +7000 ekin = 0.916233699107936 | erot = 2.94277134440162 | epot = -12.9923541739966 | etot = -9.13334913048706 +8000 ekin = 0.901760662506231 | erot = 2.86671228744167 | epot = -12.9018220800865 | etot = -9.13334913013858 +9000 ekin = 0.893571390067841 | erot = 2.77649686780609 | epot = -12.8034173876806 | etot = -9.13334912980669 +10000 ekin = 0.891805685056811 | erot = 2.67686855006738 | epot = -12.7020233645916 | etot = -9.13334912946736 +11000 ekin = 0.89624355799356 | erot = 2.57266042063124 | epot = -12.6022531078195 | etot = -9.13334912919468 +12000 ekin = 0.906416039154793 | erot = 2.46827537271561 | epot = -12.5080405408348 | etot = -9.13334912896439 +13000 ekin = 0.921704091778473 | erot = 2.36760645470838 | epot = -12.4226596752788 | etot = -9.13334912879192 +14000 ekin = 0.941405275130068 | erot = 2.2737494164118 | epot = -12.3485038202329 | etot = -9.13334912869106 +15000 ekin = 0.964770892951775 | erot = 2.18876720165115 | epot = -12.2868872232636 | etot = -9.13334912866066 +16000 ekin = 0.991029016801094 | erot = 2.11380018376644 | epot = -12.2381783292305 | etot = -9.13334912866301 +17000 ekin = 1.01940907375713 | erot = 2.04893605182115 | epot = -12.2016942543556 | etot = -9.13334912877728 +18000 ekin = 1.04917923728266 | erot = 1.99335017578094 | epot = -12.1758785419806 | etot = -9.13334912891698 +19000 ekin = 1.07969247848165 | erot = 1.9456993336296 | epot = -12.1587409411761 | etot = -9.1333491290649 +20000 ekin = 1.11043268152285 | erot = 1.90411175657071 | epot = -12.1478935672812 | etot = -9.13334912918769 +21000 ekin = 1.14104909735582 | erot = 1.86695882979236 | epot = -12.1413570564147 | etot = -9.13334912926648 +22000 ekin = 1.17136821848096 | erot = 1.83313674901888 | epot = -12.137854096792 | etot = -9.13334912929214 +23000 ekin = 1.2013763409769 | erot = 1.80222523558969 | epot = -12.1369507058331 | etot = -9.13334912926655 +24000 ekin = 1.23117249622896 | erot = 1.77451266102179 | epot = -12.1390342864515 | etot = -9.13334912920078 +25000 ekin = 1.26089526640641 | erot = 1.75088411697583 | epot = -12.1451285124969 | etot = -9.13334912911465 +26000 ekin = 1.29063712254627 | erot = 1.73259428379496 | epot = -12.1565805353675 | etot = -9.1333491290263 +27000 ekin = 1.32035987087024 | erot = 1.72114061671166 | epot = -12.174849616541 | etot = -9.1333491289591 +28000 ekin = 1.34980460658793 | erot = 1.71795709927849 | epot = -12.2011108348018 | etot = -9.13334912893538 +29000 ekin = 1.37841624051158 | erot = 1.72414013785736 | epot = -12.2359055073442 | etot = -9.13334912897524 +30000 ekin = 1.4052901572735 | erot = 1.74019656639666 | epot = -12.2788358527639 | etot = -9.13334912909376 +31000 ekin = 1.42915801743395 | erot = 1.76583252336951 | epot = -12.3283396701002 | etot = -9.13334912929672 +32000 ekin = 1.44843712560541 | erot = 1.79982181745344 | epot = -12.3816080726341 | etot = -9.13334912957528 +33000 ekin = 1.46136904668681 | erot = 1.84000474140078 | epot = -12.4347229179886 | etot = -9.13334912990105 +34000 ekin = 1.46625940785516 | erot = 1.88346459856623 | epot = -12.4830731366477 | etot = -9.13334913022626 +35000 ekin = 1.46179739484309 | erot = 1.92688889524945 | epot = -12.5220354205854 | etot = -9.13334913049288 +36000 ekin = 1.44738855724078 | erot = 1.96705754746501 | epot = -12.5477952353506 | etot = -9.13334913064481 +37000 ekin = 1.4234005446855 | erot = 2.00129614949931 | epot = -12.5580458249026 | etot = -9.13334913071783 +38000 ekin = 1.3912278154298 | erot = 2.02761655303769 | epot = -12.5521934990549 | etot = -9.13334913058744 +39000 ekin = 1.35313842096816 | erot = 2.04547852103606 | epot = -12.5319660723438 | etot = -9.1333491303396 +40000 ekin = 1.3119358769936 | erot = 2.05554364627562 | epot = -12.5008286533157 | etot = -9.13334913004646 +41000 ekin = 1.27054093924539 | erot = 2.05894429581373 | epot = -12.4628343648333 | etot = -9.13334912977422 +42000 ekin = 1.23161000992321 | erot = 2.05694893255708 | epot = -12.4219080720069 | etot = -9.13334912952666 +43000 ekin = 1.19723969759484 | erot = 2.05085758075657 | epot = -12.3814464076996 | etot = -9.13334912934817 +44000 ekin = 1.16880185863986 | erot = 2.04172238360625 | epot = -12.3438733714904 | etot = -9.13334912924427 +45000 ekin = 1.14690787175704 | erot = 2.03029950061769 | epot = -12.3105565015799 | etot = -9.13334912920516 +46000 ekin = 1.13147919636032 | erot = 2.0171225617537 | epot = -12.2819508873243 | etot = -9.13334912921024 +47000 ekin = 1.12189300492699 | erot = 2.00264798837252 | epot = -12.257890122535 | etot = -9.13334912923549 +48000 ekin = 1.11716788112702 | erot = 1.98739120721189 | epot = -12.2379082176346 | etot = -9.13334912929565 +49000 ekin = 1.11615794795221 | erot = 1.9718736810837 | epot = -12.2213807583348 | etot = -9.13334912929892 +50000 ekin = 1.1177232633637 | erot = 1.95708534394624 | epot = -12.2081577365825 | etot = -9.13334912927258 +51000 ekin = 1.12084924497845 | erot = 1.94437394210216 | epot = -12.1985723162997 | etot = -9.13334912921905 +52000 ekin = 1.12470549785223 | erot = 1.93529800314872 | epot = -12.1933526301509 | etot = -9.13334912914997 +53000 ekin = 1.12864556674947 | erot = 1.93145365271665 | epot = -12.1934483485497 | etot = -9.13334912908361 +54000 ekin = 1.1321611352306 | erot = 1.93430274875508 | epot = -12.1998130130121 | etot = -9.13334912902645 +55000 ekin = 1.13481106600208 | erot = 1.94490436967246 | epot = -12.2130645647023 | etot = -9.13334912902776 +56000 ekin = 1.13614343535792 | erot = 1.96361884590792 | epot = -12.2331114103532 | etot = -9.13334912908741 +57000 ekin = 1.1356317831126 | erot = 1.99002978527251 | epot = -12.2590106975987 | etot = -9.13334912921363 +58000 ekin = 1.13263976908227 | erot = 2.02286978616502 | epot = -12.2888586846528 | etot = -9.13334912940555 +59000 ekin = 1.1264242611342 | erot = 2.06004413441711 | epot = -12.3198175252031 | etot = -9.13334912965183 +60000 ekin = 1.11618536041525 | erot = 2.09876774945547 | epot = -12.3483022398008 | etot = -9.13334912993007 +61000 ekin = 1.10116810417863 | erot = 2.13581434618268 | epot = -12.3703315805686 | etot = -9.13334913020732 +62000 ekin = 1.08081637521804 | erot = 2.16786879318297 | epot = -12.3820342988436 | etot = -9.13334913044258 +63000 ekin = 1.05497014428154 | erot = 2.19194503254427 | epot = -12.3802643074579 | etot = -9.13334913063206 +64000 ekin = 1.02408601603167 | erot = 2.20562384873119 | epot = -12.3630589954182 | etot = -9.13334913065535 +65000 ekin = 0.989434415807826 | erot = 2.20769180278645 | epot = -12.3304753491253 | etot = -9.13334913053107 +66000 ekin = 0.953195593564014 | erot = 2.19842250482616 | epot = -12.2849672286541 | etot = -9.13334913026396 +67000 ekin = 0.918366365968406 | erot = 2.1794240088417 | epot = -12.2311395047052 | etot = -9.13334912989506 +68000 ekin = 0.888467814666429 | erot = 2.1532136435819 | epot = -12.1750305877205 | etot = -9.13334912947212 +69000 ekin = 0.867150037001785 | erot = 2.12288633704363 | epot = -12.1233855031212 | etot = -9.13334912907574 +70000 ekin = 0.85757995160489 | erot = 2.09151913845141 | epot = -12.0824482188435 | etot = -9.13334912878716 +71000 ekin = 0.861815425267566 | erot = 2.06157004239551 | epot = -12.0567345963622 | etot = -9.13334912869916 +72000 ekin = 0.880191815685505 | erot = 2.03435275439352 | epot = -12.0478936988734 | etot = -9.13334912879438 +73000 ekin = 0.91120145387665 | erot = 2.00982694750387 | epot = -12.0543775304381 | etot = -9.13334912905755 +74000 ekin = 0.951849895585045 | erot = 1.9868541827261 | epot = -12.0720532077347 | etot = -9.13334912942354 +75000 ekin = 0.998151008641101 | erot = 1.96362530027586 | epot = -12.0951254387265 | etot = -9.13334912980952 +76000 ekin = 1.04581734271574 | erot = 1.93821700241337 | epot = -12.1173834752671 | etot = -9.13334913013795 +77000 ekin = 1.09091996835682 | erot = 1.90910715282265 | epot = -12.1333762515352 | etot = -9.13334913035578 +78000 ekin = 1.13037631927892 | erot = 1.87551578135363 | epot = -12.139241231075 | etot = -9.1333491304424 +79000 ekin = 1.16219588597756 | erot = 1.83750580183238 | epot = -12.1330508182181 | etot = -9.1333491304082 +80000 ekin = 1.18548972632201 | erot = 1.79585942669966 | epot = -12.114698283306 | etot = -9.13334913028433 +81000 ekin = 1.20030605718923 | erot = 1.75181365939726 | epot = -12.0854688466954 | etot = -9.13334913010891 +82000 ekin = 1.20737786492164 | erot = 1.70676694760199 | epot = -12.0474939424388 | etot = -9.13334912991512 +83000 ekin = 1.20786051402042 | erot = 1.66205278152611 | epot = -12.0032624252715 | etot = -9.13334912972499 +84000 ekin = 1.20310991572446 | erot = 1.618829132473 | epot = -11.9552881777459 | etot = -9.13334912954841 +85000 ekin = 1.19452073297137 | erot = 1.57808043002399 | epot = -11.9059502923818 | etot = -9.13334912938643 +86000 ekin = 1.18342100682531 | erot = 1.54069268896217 | epot = -11.8574628250234 | etot = -9.13334912923592 +87000 ekin = 1.17100858957319 | erot = 1.50755090689499 | epot = -11.8119086255617 | etot = -9.13334912909349 +88000 ekin = 1.15831377551658 | erot = 1.47961680456701 | epot = -11.7712797090417 | etot = -9.13334912895806 +89000 ekin = 1.14617682817377 | erot = 1.45796378128875 | epot = -11.7374897382938 | etot = -9.13334912883123 +90000 ekin = 1.13523447969399 | erot = 1.4437643803001 | epot = -11.712347988711 | etot = -9.13334912871686 +91000 ekin = 1.12591345720529 | erot = 1.43823772500936 | epot = -11.6975003108348 | etot = -9.13334912862016 +92000 ekin = 1.11843099489266 | erot = 1.44256930748509 | epot = -11.6943494309247 | etot = -9.13334912854699 +93000 ekin = 1.11280329634796 | erot = 1.4578152481448 | epot = -11.7039676729955 | etot = -9.1333491285027 +94000 ekin = 1.10886209127321 | erot = 1.48480045701876 | epot = -11.7270116767845 | etot = -9.13334912849256 +95000 ekin = 1.10627886010321 | erot = 1.52396220647548 | epot = -11.7635901951109 | etot = -9.13334912853226 +96000 ekin = 1.10459509814404 | erot = 1.57519859223434 | epot = -11.8131428189848 | etot = -9.13334912860644 +97000 ekin = 1.10325943769886 | erot = 1.63800664193814 | epot = -11.8746152083621 | etot = -9.13334912872509 +98000 ekin = 1.10166959581627 | erot = 1.71130689804987 | epot = -11.9463256227543 | etot = -9.13334912888813 +99000 ekin = 1.09921849385146 | erot = 1.7933990563038 | epot = -12.0259666792475 | etot = -9.13334912909226 +100000 ekin = 1.09534596880091 | erot = 1.88196872528591 | epot = -12.1106638234166 | etot = -9.13334912932976 +101000 ekin = 1.08959720755104 | erot = 1.97415616931472 | epot = -12.1971025064524 | etot = -9.13334912958667 +102000 ekin = 1.08168751154804 | erot = 2.06670282185194 | epot = -12.281739463243 | etot = -9.133349129843 +103000 ekin = 1.07156932342305 | erot = 2.15618192508077 | epot = -12.3611003785777 | etot = -9.13334913007386 +104000 ekin = 1.05949237996066 | erot = 2.2393015837358 | epot = -12.4321430939489 | etot = -9.13334913025249 +105000 ekin = 1.04604342224874 | erot = 2.31323902285858 | epot = -12.4926315754935 | etot = -9.1333491303862 +106000 ekin = 1.03224316318559 | erot = 2.37579242095991 | epot = -12.5413847145648 | etot = -9.13334913041925 +107000 ekin = 1.01951120148935 | erot = 2.42585603740572 | epot = -12.5787163692807 | etot = -9.1333491303856 +108000 ekin = 1.00875017477213 | erot = 2.46348952984495 | epot = -12.6055888348739 | etot = -9.13334913025687 +109000 ekin = 1.00109573552403 | erot = 2.48980806114969 | epot = -12.6242529267284 | etot = -9.13334913005465 +110000 ekin = 0.997931591358209 | erot = 2.50673918610797 | epot = -12.6380199072781 | etot = -9.1333491298119 +111000 ekin = 1.00076792351332 | erot = 2.51665915373038 | epot = -12.6507762068081 | etot = -9.13334912956442 +112000 ekin = 1.01109610479939 | erot = 2.52200701599649 | epot = -12.6664522501395 | etot = -9.13334912934366 +113000 ekin = 1.03019016817897 | erot = 2.52496101252879 | epot = -12.6885003099866 | etot = -9.13334912927888 +114000 ekin = 1.05821017520641 | erot = 2.52722573627505 | epot = -12.718785040702 | etot = -9.13334912922054 +115000 ekin = 1.09472530400156 | erot = 2.53003930448813 | epot = -12.7581137377196 | etot = -9.13334912922996 +116000 ekin = 1.13884650903347 | erot = 2.53414832430427 | epot = -12.8063439626442 | etot = -9.13334912930642 +117000 ekin = 1.18909444999498 | erot = 2.53980839277107 | epot = -12.8622519722151 | etot = -9.13334912944908 +118000 ekin = 1.24341490970488 | erot = 2.54678348242605 | epot = -12.923547521787 | etot = -9.13334912965603 +119000 ekin = 1.29923662064205 | erot = 2.55432909400977 | epot = -12.9869148445731 | etot = -9.1333491299213 +120000 ekin = 1.3535895921566 | erot = 2.56118615921763 | epot = -13.0481248816038 | etot = -9.13334913022958 +121000 ekin = 1.40329803815465 | erot = 2.56563135861624 | epot = -13.1022785273256 | etot = -9.13334913055468 +122000 ekin = 1.44524692196627 | erot = 2.56562448409192 | epot = -13.1442205369174 | etot = -9.13334913085923 +123000 ekin = 1.47669540804843 | erot = 2.55906317998174 | epot = -13.1691077191311 | etot = -9.13334913110098 +124000 ekin = 1.49558302658173 | erot = 2.54411105943694 | epot = -13.1730432172614 | etot = -9.1333491312427 +125000 ekin = 1.50076122489751 | erot = 2.51952798471286 | epot = -13.1536383408715 | etot = -9.13334913126112 +126000 ekin = 1.49214728684725 | erot = 2.48515933103502 | epot = -13.1106557490377 | etot = -9.13334913115539 +127000 ekin = 1.47053410713968 | erot = 2.44174480075115 | epot = -13.0456280388479 | etot = -9.13334913095708 +128000 ekin = 1.43743445323518 | erot = 2.39059049317542 | epot = -12.9613740770764 | etot = -9.13334913066578 +129000 ekin = 1.39501109707066 | erot = 2.33380120125817 | epot = -12.8621614286441 | etot = -9.1333491303153 +130000 ekin = 1.34584042016766 | erot = 2.27401545397176 | epot = -12.7532050040799 | etot = -9.13334912994046 +131000 ekin = 1.29268930786602 | erot = 2.21410134111226 | epot = -12.6401397785514 | etot = -9.13334912957311 +132000 ekin = 1.23832315616835 | erot = 2.15686384200887 | epot = -12.528536127416 | etot = -9.13334912923874 +133000 ekin = 1.18535267681209 | erot = 2.10479906741759 | epot = -12.4235008731857 | etot = -9.13334912895606 +134000 ekin = 1.13612155562824 | erot = 2.05991346428628 | epot = -12.329384148651 | etot = -9.13334912873644 +135000 ekin = 1.09263262326063 | erot = 2.02360952444363 | epot = -12.2495912762909 | etot = -9.13334912858664 +136000 ekin = 1.05650575788357 | erot = 1.99662030668678 | epot = -12.1864751930785 | etot = -9.13334912850817 +137000 ekin = 1.02895878679464 | erot = 1.9789921283488 | epot = -12.1413000436437 | etot = -9.13334912850029 +138000 ekin = 1.01080388995852 | erot = 1.97013512172225 | epot = -12.1142881402336 | etot = -9.13334912855282 +139000 ekin = 1.00245459395347 | erot = 1.96888144460865 | epot = -12.1046851672407 | etot = -9.13334912867858 +140000 ekin = 1.00393780740617 | erot = 1.9733301097344 | epot = -12.1106170460032 | etot = -9.13334912886262 +141000 ekin = 1.01490973367029 | erot = 1.9810453094478 | epot = -12.129304172214 | etot = -9.13334912909595 +142000 ekin = 1.03468044934412 | erot = 1.98917872502417 | epot = -12.157208303734 | etot = -9.13334912936574 +143000 ekin = 1.06225104646169 | erot = 1.99463134790766 | epot = -12.1902315240236 | etot = -9.13334912965421 +144000 ekin = 1.09636709127244 | erot = 1.99441220318379 | epot = -12.2241284243807 | etot = -9.1333491299245 +145000 ekin = 1.13559045362115 | erot = 1.98572590465988 | epot = -12.2546654884646 | etot = -9.13334913018355 +146000 ekin = 1.17838854122085 | erot = 1.96612892354236 | epot = -12.2778665951537 | etot = -9.13334913039054 +147000 ekin = 1.22300699749175 | erot = 1.93405129394955 | epot = -12.2904074219631 | etot = -9.13334913052184 +148000 ekin = 1.26785677863015 | erot = 1.88891621350819 | epot = -12.2901221226999 | etot = -9.13334913056158 +149000 ekin = 1.31170551487297 | erot = 1.83123494690843 | epot = -12.2762895922886 | etot = -9.13334913050724 +150000 ekin = 1.35361858091197 | erot = 1.76263607509584 | epot = -12.2496037863729 | etot = -9.13334913036511 +151000 ekin = 1.39299848911427 | erot = 1.68572491420578 | epot = -12.2120725334745 | etot = -9.13334913015443 +152000 ekin = 1.42958376961909 | erot = 1.60381549112304 | epot = -12.1667483906422 | etot = -9.13334912990011 +153000 ekin = 1.46340801747592 | erot = 1.52060159601877 | epot = -12.1173587431249 | etot = -9.13334912963019 +154000 ekin = 1.49472650224559 | erot = 1.43981503875235 | epot = -12.0678906703692 | etot = -9.13334912937122 +155000 ekin = 1.52392161825077 | erot = 1.36491657683176 | epot = -12.0221873242286 | etot = -9.13334912914611 +156000 ekin = 1.55140022159552 | erot = 1.29884972381787 | epot = -11.9835990743858 | etot = -9.13334912897239 +157000 ekin = 1.57749707056582 | erot = 1.24387068637192 | epot = -11.9547168857975 | etot = -9.13334912885979 +158000 ekin = 1.60239506185775 | erot = 1.20145363967788 | epot = -11.9371978303528 | etot = -9.13334912881713 +159000 ekin = 1.62604462003778 | erot = 1.17226436760477 | epot = -11.9316581164852 | etot = -9.13334912884267 +160000 ekin = 1.64813303486537 | erot = 1.15619534708302 | epot = -11.9376775108803 | etot = -9.13334912893192 +161000 ekin = 1.6680732761297 | erot = 1.15245312716186 | epot = -11.9538755323666 | etot = -9.13334912907501 +162000 ekin = 1.68501875283048 | erot = 1.15969471512808 | epot = -11.9780625972165 | etot = -9.13334912925795 +163000 ekin = 1.69790620824667 | erot = 1.17620989126115 | epot = -12.0074652289698 | etot = -9.13334912946203 +164000 ekin = 1.70552711798388 | erot = 1.20014309389848 | epot = -12.0390193415473 | etot = -9.13334912966499 +165000 ekin = 1.70662691809342 | erot = 1.22974121417746 | epot = -12.0697172621134 | etot = -9.13334912984253 +166000 ekin = 1.70002908026843 | erot = 1.26360423252443 | epot = -12.096982442764 | etot = -9.13334912997113 +167000 ekin = 1.68477683955878 | erot = 1.30090518403802 | epot = -12.1190311536275 | etot = -9.13334913003072 +168000 ekin = 1.66027923283182 | erot = 1.34154370359116 | epot = -12.1351720664317 | etot = -9.13334913000876 +169000 ekin = 1.62644124957724 | erot = 1.38619810991441 | epot = -12.1459884893951 | etot = -9.13334912990346 +170000 ekin = 1.58375251890772 | erot = 1.43625221626238 | epot = -12.1533538648959 | etot = -9.13334912972576 +171000 ekin = 1.53331003043923 | erot = 1.49359459893455 | epot = -12.1602537588732 | etot = -9.13334912949943 +172000 ekin = 1.47676106161397 | erot = 1.56031583407089 | epot = -12.170426024941 | etot = -9.13334912925612 +173000 ekin = 1.41695754705518 | erot = 1.63848249765459 | epot = -12.1887891730454 | etot = -9.13334912833566 +174000 ekin = 1.35937684304471 | erot = 1.72968793645282 | epot = -12.2224139078261 | etot = -9.13334912832854 +175000 ekin = 1.30537540818795 | erot = 1.83369980102301 | epot = -12.2724243375761 | etot = -9.1333491283651 +176000 ekin = 1.25571357800282 | erot = 1.94952726339983 | epot = -12.3385899698495 | etot = -9.13334912844688 +177000 ekin = 1.21104692225286 | erot = 2.07558802224418 | epot = -12.4199840730645 | etot = -9.1333491285675 +178000 ekin = 1.17189512057006 | erot = 2.2097607957467 | epot = -12.5150050450644 | etot = -9.13334912874763 +179000 ekin = 1.13864315857337 | erot = 2.34949890132912 | epot = -12.6214911888117 | etot = -9.13334912890923 +180000 ekin = 1.11156621835557 | erot = 2.49234008540025 | epot = -12.7372554328249 | etot = -9.13334912906903 +181000 ekin = 1.09087167613546 | erot = 2.6356735753616 | epot = -12.8598943807501 | etot = -9.13334912925305 +182000 ekin = 1.076752265798 | erot = 2.77693577183354 | epot = -12.9870371670196 | etot = -9.13334912938803 +183000 ekin = 1.0694229423411 | erot = 2.91405263083468 | epot = -13.1168247026766 | etot = -9.13334912950083 +184000 ekin = 1.06913488705798 | erot = 3.04520163111691 | epot = -13.2476856477706 | etot = -9.13334912959569 +185000 ekin = 1.07614345922752 | erot = 3.16875772929962 | epot = -13.378250318213 | etot = -9.13334912968585 +186000 ekin = 1.09060563376715 | erot = 3.283179841549 | epot = -13.5071346051107 | etot = -9.1333491297946 +187000 ekin = 1.11239929858119 | erot = 3.38683780589135 | epot = -13.6325862344251 | etot = -9.13334912995254 +188000 ekin = 1.14088837562617 | erot = 3.47780595660562 | epot = -13.7520434624204 | etot = -9.13334913018863 +189000 ekin = 1.17469755695826 | erot = 3.55369218298297 | epot = -13.8617388704576 | etot = -9.13334913051635 +190000 ekin = 1.21158961983318 | erot = 3.61161008256116 | epot = -13.9565488333137 | etot = -9.13334913091936 +191000 ekin = 1.24837558083706 | erot = 3.64780345127586 | epot = -14.029528163489 | etot = -9.13334913137609 +192000 ekin = 1.28102311682938 | erot = 3.65810395429009 | epot = -14.0724762027878 | etot = -9.13334913166834 +193000 ekin = 1.30598320816956 | erot = 3.6413929500649 | epot = -14.0807252900253 | etot = -9.13334913179085 +194000 ekin = 1.32049648836596 | erot = 3.5984455236301 | epot = -14.0522911436923 | etot = -9.13334913169622 +195000 ekin = 1.32298604774247 | erot = 3.53212928134902 | epot = -13.9884644604291 | etot = -9.13334913133759 +196000 ekin = 1.31323645162542 | erot = 3.44751612705246 | epot = -13.894101709523 | etot = -9.13334913084515 +197000 ekin = 1.29228934698117 | erot = 3.35072340322429 | epot = -13.7763618804985 | etot = -9.13334913029301 +198000 ekin = 1.26212633786607 | erot = 3.24789114381922 | epot = -13.6433666114226 | etot = -9.13334912973732 +199000 ekin = 1.22527047461696 | erot = 3.14483705467137 | epot = -13.5034566585627 | etot = -9.13334912927433 +200000 ekin = 1.18441799207221 | erot = 3.04594245962928 | epot = -13.3637095806213 | etot = -9.13334912891985 +201000 ekin = 1.14216630511935 | erot = 2.95390025492293 | epot = -13.2294156887269 | etot = -9.13334912868461 +202000 ekin = 1.10084220211739 | erot = 2.86987712396292 | epot = -13.1040684546433 | etot = -9.13334912856296 +203000 ekin = 1.06240856569008 | erot = 2.79366067226783 | epot = -12.9894183664997 | etot = -9.13334912854175 +204000 ekin = 1.02841768821218 | erot = 2.7238914427547 | epot = -12.885658259572 | etot = -9.13334912860517 +205000 ekin = 0.999988405220756 | erot = 2.65832732458277 | epot = -12.7916648585391 | etot = -9.13334912873555 +206000 ekin = 0.977799621225127 | erot = 2.59412391514154 | epot = -12.70527266528 | etot = -9.13334912891328 +207000 ekin = 0.962105653965382 | erot = 2.52813792126081 | epot = -12.6235927043399 | etot = -9.13334912911372 +208000 ekin = 0.952783648018805 | erot = 2.4572664289227 | epot = -12.5433992062487 | etot = -9.13334912930716 +209000 ekin = 0.949416945748458 | erot = 2.37882137049673 | epot = -12.4615874457065 | etot = -9.13334912946133 +210000 ekin = 0.951402263215111 | erot = 2.29090939419168 | epot = -12.375660786954 | etot = -9.13334912954725 +211000 ekin = 0.958051952077477 | erot = 2.19275562021825 | epot = -12.2841567018434 | etot = -9.13334912954766 +212000 ekin = 0.968659667700339 | erot = 2.08489619855764 | epot = -12.1869049957193 | etot = -9.13334912946129 +213000 ekin = 0.982515908119824 | erot = 1.96918422280939 | epot = -12.0850492602319 | etot = -9.13334912930273 +214000 ekin = 0.998888701919625 | erot = 1.84860041861863 | epot = -11.980838249635 | etot = -9.13334912909677 +215000 ekin = 1.01700134912557 | erot = 1.72690897492111 | epot = -11.8772594529187 | etot = -9.13334912887207 +216000 ekin = 1.03603050122443 | erot = 1.60822693577763 | epot = -11.777606565658 | etot = -9.13334912865598 +217000 ekin = 1.05512477228462 | erot = 1.49657917533736 | epot = -11.6850530760946 | etot = -9.13334912847261 +218000 ekin = 1.07342860744178 | erot = 1.39550092670122 | epot = -11.6022786624833 | etot = -9.13334912834026 +219000 ekin = 1.09009860355571 | erot = 1.30773521951501 | epot = -11.5311829513406 | etot = -9.13334912826989 +220000 ekin = 1.10431207607347 | erot = 1.23505496062837 | epot = -11.4727161649656 | etot = -9.13334912826375 +221000 ekin = 1.11527717993044 | erot = 1.17821867809205 | epot = -11.4268449863377 | etot = -9.13334912831525 +222000 ekin = 1.12225437592971 | erot = 1.13704823944105 | epot = -11.3926517437815 | etot = -9.13334912841074 +223000 ekin = 1.1245929762141 | erot = 1.11060060825072 | epot = -11.3685427129973 | etot = -9.13334912853248 +224000 ekin = 1.12177911879615 | erot = 1.09739625543894 | epot = -11.3525245028962 | etot = -9.13334912866115 +225000 ekin = 1.11348637905752 | erot = 1.09566402531907 | epot = -11.3424995331561 | etot = -9.13334912877947 +226000 ekin = 1.09961800000704 | erot = 1.10360909760923 | epot = -11.3365762264854 | etot = -9.13334912886916 +227000 ekin = 1.08033165066218 | erot = 1.11952730043391 | epot = -11.3332080800322 | etot = -9.13334912893613 +228000 ekin = 1.05604602872783 | erot = 1.14187865421846 | epot = -11.3312738119174 | etot = -9.13334912897114 +229000 ekin = 1.02742418663512 | erot = 1.16938489301659 | epot = -11.3301582086289 | etot = -9.13334912897717 +230000 ekin = 0.995339184991671 | erot = 1.20102048198595 | epot = -11.3297087959372 | etot = -9.13334912895961 +231000 ekin = 0.960829492708811 | erot = 1.2359773576228 | epot = -11.3301559792548 | etot = -9.13334912892318 +232000 ekin = 0.92505043273539 | erot = 1.27360958612358 | epot = -11.3320091477358 | etot = -9.13334912887685 +233000 ekin = 0.889225435959919 | erot = 1.31337910210598 | epot = -11.3359536668897 | etot = -9.13334912882377 +234000 ekin = 0.854600006628912 | erot = 1.35483402381882 | epot = -11.3427831592152 | etot = -9.13334912876742 +235000 ekin = 0.822390924845405 | erot = 1.39757430015793 | epot = -11.3533143537197 | etot = -9.13334912871641 +236000 ekin = 0.793732848712064 | erot = 1.44121433399019 | epot = -11.3682963113767 | etot = -9.13334912867447 +237000 ekin = 0.769632191219681 | erot = 1.48535644446014 | epot = -11.3883377643268 | etot = -9.13334912864699 +238000 ekin = 0.750918993366291 | erot = 1.52956143549159 | epot = -11.4138295574961 | etot = -9.1333491286382 +239000 ekin = 0.738206267497456 | erot = 1.57333361162098 | epot = -11.4448890077681 | etot = -9.13334912864969 +240000 ekin = 0.731862193744267 | erot = 1.61613149974176 | epot = -11.4813428221659 | etot = -9.13334912867991 +241000 ekin = 0.731999328002306 | erot = 1.65741090456815 | epot = -11.5227593612939 | etot = -9.13334912872343 +242000 ekin = 0.738482620157578 | erot = 1.69669130986271 | epot = -11.5685230587946 | etot = -9.13334912877436 +243000 ekin = 0.75095504232563 | erot = 1.73364929482296 | epot = -11.6179534659688 | etot = -9.13334912882023 +244000 ekin = 0.76887708046684 | erot = 1.76822360275604 | epot = -11.6704498120776 | etot = -9.13334912885467 +245000 ekin = 0.791573929294853 | erot = 1.80068045121316 | epot = -11.72560350938 | etot = -9.13334912887203 +246000 ekin = 0.818282914271752 | erot = 1.8316410744519 | epot = -11.7832731175948 | etot = -9.13334912887118 +247000 ekin = 0.848193621601871 | erot = 1.86205096555267 | epot = -11.8435937160109 | etot = -9.13334912885635 +248000 ekin = 0.880474358635652 | erot = 1.89308546777831 | epot = -11.9069089552509 | etot = -9.1333491288369 +249000 ekin = 0.914280881219407 | erot = 1.92599713223939 | epot = -11.9736271422852 | etot = -9.13334912882638 +250000 ekin = 0.948746730716592 | erot = 1.96192054843792 | epot = -12.0440164079952 | etot = -9.13334912884067 +251000 ekin = 0.982959063854421 | erot = 2.00165977259976 | epot = -12.1179679653496 | etot = -9.13334912889544 +252000 ekin = 1.01592948249857 | erot = 2.04549252396446 | epot = -12.1947711354647 | etot = -9.13334912900165 +253000 ekin = 1.04657777483978 | erot = 2.09303441306042 | epot = -12.2729613170607 | etot = -9.13334912916053 +254000 ekin = 1.07373541755064 | erot = 2.14319803018524 | epot = -12.3502825770996 | etot = -9.13334912936369 +255000 ekin = 1.09620163163007 | erot = 2.1943096672061 | epot = -12.4238604284185 | etot = -9.13334912958234 +256000 ekin = 1.1128720642812 | erot = 2.24438579427484 | epot = -12.4906069883395 | etot = -9.13334912978351 +257000 ekin = 1.12287782510587 | erot = 2.29146665865438 | epot = -12.5476936136924 | etot = -9.13334912993218 +258000 ekin = 1.12572293500218 | erot = 2.33396623628282 | epot = -12.5930383012898 | etot = -9.1333491300048 +259000 ekin = 1.12139026023591 | erot = 2.37095948468545 | epot = -12.625698874911 | etot = -9.13334912998962 +260000 ekin = 1.11036122819271 | erot = 2.4022965811537 | epot = -12.6460069392473 | etot = -9.13334912990093 +261000 ekin = 1.09354805445024 | erot = 2.42847877902899 | epot = -12.6553759632423 | etot = -9.13334912976304 +262000 ekin = 1.07216031825739 | erot = 2.45046938603003 | epot = -12.6559788338922 | etot = -9.13334912960477 +263000 ekin = 1.04754368718255 | erot = 2.4694329779717 | epot = -12.6503257946119 | etot = -9.13334912945761 +264000 ekin = 1.02102495133799 | erot = 2.48647844637127 | epot = -12.6408525270504 | etot = -9.13334912934109 +265000 ekin = 0.993788783443426 | erot = 2.50247063136383 | epot = -12.629608544077 | etot = -9.13334912926975 +266000 ekin = 0.966800247929825 | erot = 2.51790683905008 | epot = -12.6180562162306 | etot = -9.1333491292507 +267000 ekin = 0.940784249459232 | erot = 2.53283827184812 | epot = -12.6069716505901 | etot = -9.13334912928275 +268000 ekin = 0.916272152394501 | erot = 2.54684612152506 | epot = -12.5964674032737 | etot = -9.13334912935417 +269000 ekin = 0.893722172477421 | erot = 2.55907244306951 | epot = -12.5861437450353 | etot = -9.13334912948841 +270000 ekin = 0.873709285129123 | erot = 2.56799722891213 | epot = -12.5750556436025 | etot = -9.1333491295613 +271000 ekin = 0.857156433251772 | erot = 2.57226369508336 | epot = -12.5627692579086 | etot = -9.13334912957348 +272000 ekin = 0.845541083724271 | erot = 2.57096110909421 | epot = -12.5498513223275 | etot = -9.13334912950897 +273000 ekin = 0.840983736970027 | erot = 2.56364270819324 | epot = -12.5379755745181 | etot = -9.13334912935485 +274000 ekin = 0.846103061110809 | erot = 2.55054497183512 | epot = -12.5299971620899 | etot = -9.13334912914396 +275000 ekin = 0.863570741245335 | erot = 2.53260377850945 | epot = -12.5295236486815 | etot = -9.13334912892668 +276000 ekin = 0.895419299415727 | erot = 2.51114645014648 | epot = -12.5399148783706 | etot = -9.13334912880838 +277000 ekin = 0.942302359419358 | erot = 2.48734970425542 | epot = -12.5630011925123 | etot = -9.13334912883751 +278000 ekin = 1.00299069941656 | erot = 2.46199112036264 | epot = -12.5983309488099 | etot = -9.13334912903073 +279000 ekin = 1.07434561589337 | erot = 2.43529774590622 | epot = -12.6429924911401 | etot = -9.13334912934047 +280000 ekin = 1.1518234098412 | erot = 2.40711596365387 | epot = -12.6922885031807 | etot = -9.13334912968566 +281000 ekin = 1.23030856581916 | erot = 2.37726964751121 | epot = -12.7409273433246 | etot = -9.13334912999419 +282000 ekin = 1.30483974879876 | erot = 2.34551973870678 | epot = -12.7837086176998 | etot = -9.13334913019425 +283000 ekin = 1.37151257999554 | erot = 2.31231452819811 | epot = -12.8171762384395 | etot = -9.13334913024583 +284000 ekin = 1.42789685319497 | erot = 2.27901843146156 | epot = -12.8402644148132 | etot = -9.13334913015666 +285000 ekin = 1.47299679574576 | erot = 2.24762833985798 | epot = -12.8539742655657 | etot = -9.13334912996199 +286000 ekin = 1.50701906587807 | erot = 2.22050056283333 | epot = -12.8608687584236 | etot = -9.1333491297122 +287000 ekin = 1.53099472144866 | erot = 2.19999584806528 | epot = -12.8643396989743 | etot = -9.13334912946032 +288000 ekin = 1.54636449768968 | erot = 2.18811490987538 | epot = -12.8678285368172 | etot = -9.13334912925209 +289000 ekin = 1.55461163491285 | erot = 2.18618804174405 | epot = -12.8741488057757 | etot = -9.1333491291188 +290000 ekin = 1.55699428674741 | erot = 2.19466879450645 | epot = -12.8850122103288 | etot = -9.13334912907495 +291000 ekin = 1.55439775255703 | erot = 2.21306131818027 | epot = -12.9008081998553 | etot = -9.13334912911797 +292000 ekin = 1.54729960240303 | erot = 2.23998314422011 | epot = -12.9206318758555 | etot = -9.13334912923236 +293000 ekin = 1.53582108608436 | erot = 2.27333490842382 | epot = -12.9425051239038 | etot = -9.1333491293956 +294000 ekin = 1.51982864506198 | erot = 2.31049721096855 | epot = -12.9636749856271 | etot = -9.13334912959652 +295000 ekin = 1.49905154213345 | erot = 2.34851873983909 | epot = -12.9809194117672 | etot = -9.13334912979465 +296000 ekin = 1.4731936480281 | erot = 2.38443281021024 | epot = -12.9909755882223 | etot = -9.13334912998395 +297000 ekin = 1.44203124545982 | erot = 2.41536854589882 | epot = -12.99074892151 | etot = -9.13334913015133 +298000 ekin = 1.40549976702096 | erot = 2.4386740904602 | epot = -12.9775229877651 | etot = -9.13334913028399 +299000 ekin = 1.36377241662811 | erot = 2.45204871800361 | epot = -12.9491702650001 | etot = -9.13334913036838 +300000 ekin = 1.31732711912166 | erot = 2.45368408092481 | epot = -12.9043603304387 | etot = -9.13334913039221 +301000 ekin = 1.26699022414728 | erot = 2.44240353914498 | epot = -12.8427428936397 | etot = -9.13334913034745 +302000 ekin = 1.21394210637167 | erot = 2.41777278592862 | epot = -12.765064022533 | etot = -9.13334913023274 +303000 ekin = 1.1596741442934 | erot = 2.38015189683557 | epot = -12.6731751711844 | etot = -9.13334913005544 +304000 ekin = 1.10589726251302 | erot = 2.33066939618069 | epot = -12.5699157885241 | etot = -9.13334912983043 +305000 ekin = 1.05441504199268 | erot = 2.27111808933615 | epot = -12.4588822609062 | etot = -9.13334912957738 +306000 ekin = 1.00698421397159 | erot = 2.20379218513968 | epot = -12.3441255284276 | etot = -9.13334912931634 +307000 ekin = 0.965188337627658 | erot = 2.13129764385332 | epot = -12.2298351105454 | etot = -9.13334912906444 +308000 ekin = 0.930345631944601 | erot = 2.056368146155 | epot = -12.1200629069337 | etot = -9.13334912883408 +309000 ekin = 0.903461768093092 | erot = 1.98167791132811 | epot = -12.0184888080548 | etot = -9.13334912863359 +310000 ekin = 0.885228515008126 | erot = 1.90967870211519 | epot = -11.9282563455893 | etot = -9.13334912846596 +311000 ekin = 0.876047647700586 | erot = 1.84263812609996 | epot = -11.852034902134 | etot = -9.13334912833348 +312000 ekin = 0.876068182199105 | erot = 1.78248869456835 | epot = -11.7919060050072 | etot = -9.13334912823976 +313000 ekin = 0.885223985970005 | erot = 1.73072892882167 | epot = -11.7493020429822 | etot = -9.13334912819049 +314000 ekin = 0.903258342515217 | erot = 1.68832066988298 | epot = -11.7249281405911 | etot = -9.13334912819286 +315000 ekin = 0.929731391718549 | erot = 1.65558558099657 | epot = -11.7186661009695 | etot = -9.13334912825433 +316000 ekin = 0.964013828970821 | erot = 1.6321197350897 | epot = -11.72948269244 | etot = -9.13334912837943 +317000 ekin = 1.00527629211697 | erot = 1.61675326466403 | epot = -11.7553786853486 | etot = -9.13334912856759 +318000 ekin = 1.05248736450164 | erot = 1.60758570940499 | epot = -11.7934222027159 | etot = -9.13334912880928 +319000 ekin = 1.10443332868175 | erot = 1.60212494474445 | epot = -11.8399074025115 | etot = -9.13334912908528 +320000 ekin = 1.15976924920879 | erot = 1.59754526105337 | epot = -11.8906636396278 | etot = -9.13334912936562 +321000 ekin = 1.21710352305735 | erot = 1.591055545181 | epot = -11.9415081978527 | etot = -9.13334912961438 +322000 ekin = 1.27510751189543 | erot = 1.58033324923022 | epot = -11.9887898909209 | etot = -9.1333491297953 +323000 ekin = 1.33263084645792 | erot = 1.56394390937281 | epot = -12.0299238857116 | etot = -9.13334912988083 +324000 ekin = 1.38879590712306 | erot = 1.5416467848519 | epot = -12.0637918218349 | etot = -9.13334912985997 +325000 ekin = 1.44304623679811 | erot = 1.51450056885231 | epot = -12.0908959353924 | etot = -9.13334912974197 +326000 ekin = 1.49513435445796 | erot = 1.48473073066039 | epot = -12.1132142146722 | etot = -9.1333491295539 +327000 ekin = 1.54505065938471 | erot = 1.45538400860359 | epot = -12.1337837973235 | etot = -9.13334912933516 +328000 ekin = 1.59290981434387 | erot = 1.42984788209389 | epot = -12.1561068255661 | etot = -9.13334912912838 +329000 ekin = 1.63881860975765 | erot = 1.41133335467872 | epot = -12.1835010934091 | etot = -9.13334912897275 +330000 ekin = 1.68274896183239 | erot = 1.4024072959145 | epot = -12.2185053866451 | etot = -9.13334912889826 +331000 ekin = 1.72443467169707 | erot = 1.4046311634215 | epot = -12.2624149640428 | etot = -9.13334912892422 +332000 ekin = 1.76330533674463 | erot = 1.41833479327589 | epot = -12.3149892590779 | etot = -9.13334912905735 +333000 ekin = 1.79846823309411 | erot = 1.44253834966357 | epot = -12.3743557120476 | etot = -9.13334912928995 +334000 ekin = 1.82874900591204 | erot = 1.47503277033971 | epot = -12.4371309058505 | etot = -9.1333491295987 +335000 ekin = 1.85279616115898 | erot = 1.5126357019759 | epot = -12.4987809930786 | etot = -9.13334912994371 +336000 ekin = 1.86927630558816 | erot = 1.55160162438203 | epot = -12.5542270602401 | etot = -9.13334913026992 +337000 ekin = 1.87711735413937 | erot = 1.5882004977332 | epot = -12.5986669823884 | etot = -9.13334913051582 +338000 ekin = 1.8757484092313 | erot = 1.61938868722871 | epot = -12.6284862270849 | etot = -9.13334913062489 +339000 ekin = 1.86534866362648 | erot = 1.64338736517746 | epot = -12.6420851593657 | etot = -9.13334913056172 +340000 ekin = 1.84695798886891 | erot = 1.66009075059628 | epot = -12.6403978697887 | etot = -9.13334913032349 +341000 ekin = 1.82243969076525 | erot = 1.67114820362438 | epot = -12.6269370243315 | etot = -9.13334912994192 +342000 ekin = 1.79428655955741 | erot = 1.67969211618746 | epot = -12.6073278052212 | etot = -9.13334912947637 +343000 ekin = 1.76531632972398 | erot = 1.68978090506725 | epot = -12.5884463637883 | etot = -9.13334912899707 +344000 ekin = 1.73833039739143 | erot = 1.70570000746884 | epot = -12.5773795334311 | etot = -9.13334912857087 +345000 ekin = 1.71580589060137 | erot = 1.73127559556237 | epot = -12.5804306144134 | etot = -9.13334912824962 +346000 ekin = 1.6996635309747 | erot = 1.76931234934698 | epot = -12.6023250083897 | etot = -9.13334912806806 +347000 ekin = 1.69112042623171 | erot = 1.82120184302266 | epot = -12.6456713972995 | etot = -9.13334912804509 +348000 ekin = 1.69061396982658 | erot = 1.88669704033649 | epot = -12.7106601383506 | etot = -9.13334912818748 +349000 ekin = 1.69777681788112 | erot = 1.96382926866272 | epot = -12.7949552150357 | etot = -9.13334912849182 +350000 ekin = 1.7114511501017 | erot = 2.04895591402652 | epot = -12.8937561930717 | etot = -9.13334912894347 +351000 ekin = 1.72974629646096 | erot = 2.13695636910622 | epot = -13.0000517950781 | etot = -9.13334912951097 +352000 ekin = 1.75015893903857 | erot = 2.22162008456721 | epot = -13.1051281537467 | etot = -9.13334913014092 +353000 ekin = 1.76978034905472 | erot = 2.29627029646064 | epot = -13.1993997762728 | etot = -9.13334913075749 +354000 ekin = 1.7856021091187 | erot = 2.35462017023462 | epot = -13.2735714106211 | etot = -9.13334913126782 +355000 ekin = 1.7948978547275 | erot = 2.39176336004161 | epot = -13.3200103463516 | etot = -9.13334913158252 +356000 ekin = 1.79561393246494 | erot = 2.4050918685946 | epot = -13.3340549326996 | etot = -9.13334913164005 +357000 ekin = 1.78667091072534 | erot = 2.39487614134816 | epot = -13.3148961835026 | etot = -9.13334913142907 +358000 ekin = 1.76810167230416 | erot = 2.3642989799402 | epot = -13.26574978317 | etot = -9.13334913092568 +359000 ekin = 1.74170569044599 | erot = 2.31907684809484 | epot = -13.1941316689269 | etot = -9.13334913038603 +360000 ekin = 1.70943632676095 | erot = 2.26611368397139 | epot = -13.1088991405402 | etot = -9.13334912980783 +361000 ekin = 1.67315005965356 | erot = 2.2123416661571 | epot = -13.0188408550981 | etot = -9.1333491292874 +362000 ekin = 1.63480994001483 | erot = 2.16376887379833 | epot = -12.931927942706 | etot = -9.13334912889285 +363000 ekin = 1.59622606057457 | erot = 2.12469986683786 | epot = -12.8542750560708 | etot = -9.13334912865833 +364000 ekin = 1.55890205833708 | erot = 2.0973463155983 | epot = -12.7895975025221 | etot = -9.13334912858677 +365000 ekin = 1.52397421076707 | erot = 2.08181308416756 | epot = -12.7391364235924 | etot = -9.13334912865774 +366000 ekin = 1.49221260733957 | erot = 2.0763900979626 | epot = -12.7019518341366 | etot = -9.13334912883443 +367000 ekin = 1.46405952364913 | erot = 2.0780551012223 | epot = -12.6754637539451 | etot = -9.13334912907368 +368000 ekin = 1.43967726932358 | erot = 2.08307216057664 | epot = -12.6560985592352 | etot = -9.13334912933493 +369000 ekin = 1.41899010811464 | erot = 2.08756917147338 | epot = -12.6399084091744 | etot = -9.13334912958638 +370000 ekin = 1.40171557356751 | erot = 2.08800173652931 | epot = -12.6230664399037 | etot = -9.13334912980689 +371000 ekin = 1.38739280854856 | erot = 2.08146226240663 | epot = -12.6022042009385 | etot = -9.13334912998331 +372000 ekin = 1.37542340308569 | erot = 2.06585193702337 | epot = -12.5746244702146 | etot = -9.13334913010555 +373000 ekin = 1.3651375235788 | erot = 2.03996886737112 | epot = -12.5384555211133 | etot = -9.13334913016337 +374000 ekin = 1.35583949105123 | erot = 2.00351975772384 | epot = -12.4927083789459 | etot = -9.13334913017084 +375000 ekin = 1.34694157711379 | erot = 1.9571603826844 | epot = -12.4374510898675 | etot = -9.13334913006932 +376000 ekin = 1.33814968105167 | erot = 1.90258032253183 | epot = -12.374079133482 | etot = -9.13334912989844 +377000 ekin = 1.32936261120695 | erot = 1.84227265725044 | epot = -12.3049843981354 | etot = -9.133349129678 +378000 ekin = 1.32063159991224 | erot = 1.77926043318832 | epot = -12.2332411625408 | etot = -9.13334912944026 +379000 ekin = 1.31208340368726 | erot = 1.71672941783422 | epot = -12.1621619507387 | etot = -9.13334912921721 +380000 ekin = 1.30384179784077 | erot = 1.65764204155578 | epot = -12.0948329684312 | etot = -9.13334912903461 +381000 ekin = 1.29657917475703 | erot = 1.60487100826496 | epot = -12.0347993118431 | etot = -9.13334912882109 +382000 ekin = 1.29092190134574 | erot = 1.5606106770692 | epot = -11.9848817072416 | etot = -9.13334912882662 +383000 ekin = 1.2862090906832 | erot = 1.52536833769879 | epot = -11.9449265572222 | etot = -9.13334912884017 +384000 ekin = 1.28205683099545 | erot = 1.49922806168738 | epot = -11.9146340215159 | etot = -9.13334912883307 +385000 ekin = 1.27850478017806 | erot = 1.48216189144778 | epot = -11.8940158004147 | etot = -9.13334912878889 +386000 ekin = 1.27603762173955 | erot = 1.47423730493012 | epot = -11.8836240553814 | etot = -9.1333491287117 +387000 ekin = 1.27548287271892 | erot = 1.47565716104777 | epot = -11.8844891623921 | etot = -9.13334912862536 +388000 ekin = 1.27780044585788 | erot = 1.48660964097499 | epot = -11.8977592154009 | etot = -9.13334912856799 +389000 ekin = 1.28381262703596 | erot = 1.50697425852508 | epot = -11.9241360141413 | etot = -9.13334912858021 +390000 ekin = 1.29393930260888 | erot = 1.53598035068365 | epot = -11.9632687819891 | etot = -9.13334912869656 +391000 ekin = 1.30800074456151 | erot = 1.57190984924569 | epot = -12.0132597227379 | etot = -9.13334912893074 +392000 ekin = 1.325130991795 | erot = 1.61197584867816 | epot = -12.0704559697468 | etot = -9.13334912927367 +393000 ekin = 1.34382543000193 | erot = 1.65241448883467 | epot = -12.1295890485281 | etot = -9.13334912969153 +394000 ekin = 1.3621210239867 | erot = 1.68881012624785 | epot = -12.1842802803652 | etot = -9.13334913013061 +395000 ekin = 1.37788072140323 | erot = 1.71661593054036 | epot = -12.2278457824695 | etot = -9.13334913052588 +396000 ekin = 1.3891315451238 | erot = 1.73181112618284 | epot = -12.2542918021058 | etot = -9.13334913079917 +397000 ekin = 1.39439357479683 | erot = 1.73153617598965 | epot = -12.2592788817207 | etot = -9.13334913093423 +398000 ekin = 1.392939046591 | erot = 1.71441550438621 | epot = -12.2407036818549 | etot = -9.13334913087766 +399000 ekin = 1.38493174777325 | erot = 1.68094766350724 | epot = -12.1992285419441 | etot = -9.13334913066366 +400000 ekin = 1.37142116073966 | erot = 1.63330764197713 | epot = -12.1380779330241 | etot = -9.13334913030734 +401000 ekin = 1.35412991252306 | erot = 1.57501044311532 | epot = -12.0624894855325 | etot = -9.13334912989417 +402000 ekin = 1.33517991856765 | erot = 1.51048364979885 | epot = -11.9790126977729 | etot = -9.13334912940637 +403000 ekin = 1.31709653187147 | erot = 1.44458891478784 | epot = -11.8950345755996 | etot = -9.13334912894028 +404000 ekin = 1.30234590493773 | erot = 1.38198365576653 | epot = -11.8176786892413 | etot = -9.13334912853706 +405000 ekin = 1.29301391716195 | erot = 1.32673455588805 | epot = -11.7530976012898 | etot = -9.13334912823978 +406000 ekin = 1.2906546746274 | erot = 1.28204116436375 | epot = -11.7060449670187 | etot = -9.13334912802758 +407000 ekin = 1.29643237294776 | erot = 1.25006436588465 | epot = -11.6798458667535 | etot = -9.13334912792104 +408000 ekin = 1.31094700615259 | erot = 1.23190986721618 | epot = -11.6762060012866 | etot = -9.13334912791786 +409000 ekin = 1.33422438303399 | erot = 1.22763489752384 | epot = -11.6952084085746 | etot = -9.13334912801675 +410000 ekin = 1.36572014155011 | erot = 1.23628017302646 | epot = -11.7353494427907 | etot = -9.1333491282141 +411000 ekin = 1.4043266876083 | erot = 1.25592548503719 | epot = -11.7936013011487 | etot = -9.13334912850318 +412000 ekin = 1.44839088645936 | erot = 1.28379672627982 | epot = -11.8655367416088 | etot = -9.13334912886961 +413000 ekin = 1.49576795241922 | erot = 1.31646032749018 | epot = -11.9455774091946 | etot = -9.13334912928523 +414000 ekin = 1.54394920889522 | erot = 1.35014055217893 | epot = -12.0274388907797 | etot = -9.13334912970551 +415000 ekin = 1.59029421705203 | erot = 1.38116660571141 | epot = -12.1048099528357 | etot = -9.13334913007226 +416000 ekin = 1.63235973909131 | erot = 1.40649922749186 | epot = -12.1722080969101 | etot = -9.13334913032698 +417000 ekin = 1.66825800489219 | erot = 1.42422016760995 | epot = -12.225827302936 | etot = -9.13334913043386 +418000 ekin = 1.69693219837218 | erot = 1.43381449957251 | epot = -12.264095828321 | etot = -9.13334913037631 +419000 ekin = 1.71824951894753 | erot = 1.43620625779358 | epot = -12.287804906927 | etot = -9.13334913018588 +420000 ekin = 1.73288337430522 | erot = 1.433508253505 | epot = -12.299740757723 | etot = -9.13334912991281 +421000 ekin = 1.7420412953233 | erot = 1.42856028674674 | epot = -12.3039507116819 | etot = -9.13334912961185 +422000 ekin = 1.7471370180767 | erot = 1.42445618730574 | epot = -12.3049423347116 | etot = -9.13334912932917 +423000 ekin = 1.74949063384677 | erot = 1.42413436044179 | epot = -12.3069741233945 | etot = -9.13334912910593 +424000 ekin = 1.75009754642981 | erot = 1.4300564192499 | epot = -12.3135030946281 | etot = -9.13334912894843 +425000 ekin = 1.74947257256704 | erot = 1.44412400802223 | epot = -12.3269457094749 | etot = -9.13334912888562 +426000 ekin = 1.69664946387257 | erot = 1.40011304962302 | epot = -12.2301116345967 | etot = -9.1333491211011 +427000 ekin = 1.76448154346295 | erot = 1.46695774970494 | epot = -12.3647884699887 | etot = -9.13334917682078 +428000 ekin = 1.77864040382729 | erot = 1.51204937412326 | epot = -12.4240389057601 | etot = -9.13334912780956 +429000 ekin = 1.77744254090634 | erot = 1.55645173379999 | epot = -12.4672434028126 | etot = -9.13334912810625 +430000 ekin = 1.76864481713877 | erot = 1.60567169371301 | epot = -12.5076656392914 | etot = -9.1333491284396 +431000 ekin = 1.75041443992984 | erot = 1.65655638514254 | epot = -12.5403199538359 | etot = -9.1333491287635 +432000 ekin = 1.72143753020827 | erot = 1.70559294341406 | epot = -12.5603796026458 | etot = -9.13334912902348 +433000 ekin = 1.68129756274064 | erot = 1.74934007551155 | epot = -12.5639867674192 | etot = -9.13334912916702 +434000 ekin = 1.63077650979783 | erot = 1.78490039303262 | epot = -12.5490260319872 | etot = -9.13334912915677 +435000 ekin = 1.57198882084277 | erot = 1.81033246556102 | epot = -12.5156704153863 | etot = -9.1333491289825 +436000 ekin = 1.50828072851243 | erot = 1.8248990896095 | epot = -12.4665289467889 | etot = -9.13334912866695 +437000 ekin = 1.44388315300992 | erot = 1.82908776307803 | epot = -12.4063200443484 | etot = -9.13334912826041 +438000 ekin = 1.38337900429486 | erot = 1.82441107452303 | epot = -12.3411392066449 | etot = -9.13334912782701 +439000 ekin = 1.33110407576011 | erot = 1.81306694503837 | epot = -12.2775201482251 | etot = -9.13334912742665 +440000 ekin = 1.29061754888814 | erot = 1.79757475508114 | epot = -12.2215414310713 | etot = -9.13334912710203 +441000 ekin = 1.26434687831999 | erot = 1.78048600607157 | epot = -12.1781820112636 | etot = -9.13334912687206 +442000 ekin = 1.25344985037798 | erot = 1.76421040799211 | epot = -12.1510093851058 | etot = -9.13334912673572 +443000 ekin = 1.25787308938312 | erot = 1.75093400476504 | epot = -12.142156220829 | etot = -9.13334912668082 +444000 ekin = 1.27654491138731 | erot = 1.74256727851856 | epot = -12.1524613166009 | etot = -9.13334912669505 +445000 ekin = 1.30762960642434 | erot = 1.74066161516909 | epot = -12.1816403483644 | etot = -9.13334912677094 +446000 ekin = 1.34878485335211 | erot = 1.74626611357013 | epot = -12.2284000938283 | etot = -9.13334912690606 +447000 ekin = 1.39739993763745 | erot = 1.75974793458045 | epot = -12.2904969993196 | etot = -9.13334912710174 +448000 ekin = 1.45076649190932 | erot = 1.78060717934147 | epot = -12.3647227986048 | etot = -9.13334912735396 +449000 ekin = 1.50623999605402 | erot = 1.80738848344743 | epot = -12.4469776071528 | etot = -9.1333491276513 +450000 ekin = 1.5613890805465 | erot = 1.83773497344407 | epot = -12.5324731819632 | etot = -9.13334912797267 +451000 ekin = 1.61412412964578 | erot = 1.86859865234491 | epot = -12.6160719102792 | etot = -9.13334912828851 +452000 ekin = 1.66280931630166 | erot = 1.89658548036437 | epot = -12.6927439252307 | etot = -9.13334912856467 +453000 ekin = 1.7063497163714 | erot = 1.9183747658684 | epot = -12.758073611013 | etot = -9.13334912877319 +454000 ekin = 1.74423056750415 | erot = 1.93111374790646 | epot = -12.8086934443075 | etot = -9.13334912889692 +455000 ekin = 1.77648988409932 | erot = 1.93270291378152 | epot = -12.8425419268151 | etot = -9.13334912893425 +456000 ekin = 1.80361911556787 | erot = 1.9219262828774 | epot = -12.8588945273431 | etot = -9.13334912889786 +457000 ekin = 1.82640016706269 | erot = 1.89842961389848 | epot = -12.858178909771 | etot = -9.1333491288098 +458000 ekin = 1.84570455025997 | erot = 1.8625929869562 | epot = -12.8416466659128 | etot = -9.13334912869665 +459000 ekin = 1.86229070171015 | erot = 1.81535342315 | epot = -12.8109932534395 | etot = -9.13334912857936 +460000 ekin = 1.87663848085941 | erot = 1.75803306182628 | epot = -12.7680206711609 | etot = -9.1333491284752 +461000 ekin = 1.88883864523272 | erot = 1.69219746384138 | epot = -12.7143852374648 | etot = -9.13334912839074 +462000 ekin = 1.89856203652394 | erot = 1.61956678027284 | epot = -12.6514779451229 | etot = -9.13334912832615 +463000 ekin = 1.90510221764579 | erot = 1.54196437877704 | epot = -12.5804157247006 | etot = -9.13334912827778 +464000 ekin = 1.90747686786769 | erot = 1.46127993198361 | epot = -12.5021059280878 | etot = -9.13334912823649 +465000 ekin = 1.90457977356283 | erot = 1.37946070091642 | epot = -12.4173896026667 | etot = -9.13334912818744 +466000 ekin = 1.89536572152456 | erot = 1.29851485172089 | epot = -12.3272297013685 | etot = -9.13334912812307 +467000 ekin = 1.87901831710111 | erot = 1.22048659414348 | epot = -12.232854039282 | etot = -9.13334912803741 +468000 ekin = 1.85509917792192 | erot = 1.1473912628404 | epot = -12.135839568692 | etot = -9.13334912792963 +469000 ekin = 1.82366605107452 | erot = 1.08110787535108 | epot = -12.0381230542294 | etot = -9.13334912780381 +470000 ekin = 1.78535216075739 | erot = 1.02324127043727 | epot = -11.9419425588602 | etot = -9.13334912766558 +471000 ekin = 1.74141051513502 | erot = 0.974982090044474 | epot = -11.8497417327 | etot = -9.13334912752053 +472000 ekin = 1.69372019706046 | erot = 0.937000644456116 | epot = -11.7640699688896 | etot = -9.13334912737304 +473000 ekin = 1.64473632771078 | erot = 0.909402534933341 | epot = -11.6874879898728 | etot = -9.13334912722864 +474000 ekin = 1.59734995177461 | erot = 0.891755018433343 | epot = -11.622454097305 | etot = -9.13334912709702 +475000 ekin = 1.55462885495348 | erot = 0.883174765262338 | epot = -11.571152747209 | etot = -9.13334912699314 +476000 ekin = 1.51944866261258 | erot = 0.882459888572011 | epot = -11.5352576781179 | etot = -9.13334912693328 +477000 ekin = 1.49408243529128 | erot = 0.888250161719579 | epot = -11.5156817239402 | etot = -9.1333491269293 +478000 ekin = 1.47985622585725 | erot = 0.899197335535745 | epot = -11.5124026883765 | etot = -9.13334912698345 +479000 ekin = 1.47695373952945 | erot = 0.914115348460641 | epot = -11.5244182150854 | etot = -9.13334912709531 +480000 ekin = 1.48439477575547 | erot = 0.932072516624243 | epot = -11.5498164196235 | etot = -9.13334912724377 +481000 ekin = 1.50022741217604 | erot = 0.952423999187706 | epot = -11.5860005387875 | etot = -9.1333491274238 +482000 ekin = 1.52172985963508 | erot = 0.974754211850123 | epot = -11.6298331991131 | etot = -9.13334912762789 +483000 ekin = 1.54567018241573 | erot = 0.998770450818459 | epot = -11.6777897610815 | etot = -9.13334912784727 +484000 ekin = 1.5685861472314 | erot = 1.02419763511229 | epot = -11.7261329104139 | etot = -9.13334912807017 +485000 ekin = 1.58707346955103 | erot = 1.05070585623507 | epot = -11.7711284540671 | etot = -9.13334912828097 +486000 ekin = 1.5980710360309 | erot = 1.07788995425036 | epot = -11.8093101187427 | etot = -9.13334912846141 +487000 ekin = 1.59911980804398 | erot = 1.10529931942497 | epot = -11.8377682560634 | etot = -9.13334912859443 +488000 ekin = 1.58856342116581 | erot = 1.13249736396505 | epot = -11.8544099137994 | etot = -9.1333491286685 +489000 ekin = 1.56566142904586 | erot = 1.15911683126035 | epot = -11.8581273889864 | etot = -9.13334912868024 +490000 ekin = 1.53060268554494 | erot = 1.1848850242751 | epot = -11.848836838455 | etot = -9.13334912863495 +491000 ekin = 1.48443427069261 | erot = 1.20959914016099 | epot = -11.8273825393277 | etot = -9.13334912847408 +492000 ekin = 1.42930345354192 | erot = 1.23291829593384 | epot = -11.7955708778614 | etot = -9.13334912838564 +493000 ekin = 1.36749564144839 | erot = 1.25438544605061 | epot = -11.7552302157762 | etot = -9.13334912827722 +494000 ekin = 1.30137262987712 | erot = 1.27348228002446 | epot = -11.7082040380584 | etot = -9.13334912815681 +495000 ekin = 1.23360970816606 | erot = 1.28954660635986 | epot = -11.656505442555 | etot = -9.13334912802907 +496000 ekin = 1.16375548639931 | erot = 1.30023195608135 | epot = -11.597336620527 | etot = -9.13334917804638 +497000 ekin = 1.02574644939749 | erot = 1.24927230425605 | epot = -11.4083678754971 | etot = -9.1333491218436 +498000 ekin = 1.13339044618068 | erot = 1.24939677704364 | epot = -11.5161363891335 | etot = -9.13334916590914 +499000 ekin = 1.16434762393443 | erot = 1.25864673154736 | epot = -11.5563434800394 | etot = -9.13334912455761 +500000 ekin = 1.16768486506973 | erot = 1.25769344443679 | epot = -11.5587274345829 | etot = -9.13334912507638 +501000 ekin = 1.17559895497739 | erot = 1.25038915442381 | epot = -11.5593372343056 | etot = -9.13334912490443 +502000 ekin = 1.18926606274124 | erot = 1.23784323632847 | epot = -11.5604584237521 | etot = -9.13334912468242 +503000 ekin = 1.20982408115136 | erot = 1.22204157664177 | epot = -11.5652147822342 | etot = -9.13334912444111 +504000 ekin = 1.2381178273724 | erot = 1.20572865378346 | epot = -11.5771956053614 | etot = -9.13334912420554 +505000 ekin = 1.27460966228983 | erot = 1.19199209322132 | epot = -11.5999508795136 | etot = -9.13334912400249 +506000 ekin = 1.31928047819791 | erot = 1.1839368767797 | epot = -11.6365664788341 | etot = -9.13334912385644 +507000 ekin = 1.37157700900694 | erot = 1.18435118386784 | epot = -11.6892773166593 | etot = -9.13334912378454 +508000 ekin = 1.43042502721723 | erot = 1.19541187481904 | epot = -11.7591860258309 | etot = -9.13334912379462 +509000 ekin = 1.49431413373027 | erot = 1.21846596296109 | epot = -11.8461292205759 | etot = -9.13334912388451 +510000 ekin = 1.56143815900149 | erot = 1.25390781315983 | epot = -11.9486950962062 | etot = -9.13334912404484 +511000 ekin = 1.6298540535969 | erot = 1.30115550674715 | epot = -12.0643586846064 | etot = -9.13334912426233 +512000 ekin = 1.69760948238587 | erot = 1.35871536005148 | epot = -12.1896739669624 | etot = -9.13334912452507 +513000 ekin = 1.76279412854926 | erot = 1.42431355747723 | epot = -12.3204568108526 | etot = -9.1333491248261 +514000 ekin = 1.82349978434352 | erot = 1.49507387318822 | epot = -12.4519227826915 | etot = -9.13334912515979 +515000 ekin = 1.87772649131863 | erot = 1.56773414237229 | epot = -12.578809759206 | etot = -9.1333491255151 +516000 ekin = 1.92332299298654 | erot = 1.63891274677026 | epot = -12.6955848656238 | etot = -9.13334912586698 +517000 ekin = 1.95805681102207 | erot = 1.70543998935156 | epot = -12.796845926548 | etot = -9.13334912617437 +518000 ekin = 1.97984991947139 | erot = 1.76473849816332 | epot = -12.8779375440238 | etot = -9.13334912638909 +519000 ekin = 1.98711819296805 | erot = 1.81518192785907 | epot = -12.9356492472993 | etot = -9.13334912647214 +520000 ekin = 1.97908911077294 | erot = 1.85632478175992 | epot = -12.9687630189464 | etot = -9.13334912641354 +521000 ekin = 1.95594858056464 | erot = 1.88892760797505 | epot = -12.9782253147673 | etot = -9.13334912622764 +522000 ekin = 1.91881161738233 | erot = 1.91475582238184 | epot = -12.9669165657166 | etot = -9.13334912595242 +523000 ekin = 1.8695404534333 | erot = 1.93620351350896 | epot = -12.9390930925794 | etot = -9.13334912563714 +524000 ekin = 1.81047332181735 | erot = 1.95582271022629 | epot = -12.8996451573767 | etot = -9.13334912533309 +525000 ekin = 1.74413482435742 | erot = 1.97582576721985 | epot = -12.8533097166652 | etot = -9.13334912508796 +526000 ekin = 1.67297434024978 | erot = 1.99761678040749 | epot = -12.8039402455968 | etot = -9.13334912493949 +527000 ekin = 1.59916865616268 | erot = 2.02141684187848 | epot = -12.7539346229491 | etot = -9.13334912490795 +528000 ekin = 1.52452149634747 | erot = 2.04605877912766 | epot = -12.703929400465 | etot = -9.13334912498985 +529000 ekin = 1.45048141638157 | erot = 2.06903286947953 | epot = -12.6528634110146 | etot = -9.13334912515348 +530000 ekin = 1.37827485203517 | erot = 2.08683821123225 | epot = -12.5984621886097 | etot = -9.13334912534224 +531000 ekin = 1.30911544825371 | erot = 2.09562136598341 | epot = -12.5380859397248 | etot = -9.13334912548764 +532000 ekin = 1.24441932207159 | erot = 2.0919865394648 | epot = -12.4697549870638 | etot = -9.13334912552745 +533000 ekin = 1.18594679653503 | erot = 2.07377924595734 | epot = -12.3930751679176 | etot = -9.1333491254252 +534000 ekin = 1.13581312461818 | erot = 2.04062941960519 | epot = -12.3097916694029 | etot = -9.13334912517958 +535000 ekin = 1.09635528031962 | erot = 1.99411201500012 | epot = -12.2238164201439 | etot = -9.13334912482411 +536000 ekin = 1.06988655696252 | erot = 1.93750945182015 | epot = -12.1407451331975 | etot = -9.13334912441483 +537000 ekin = 1.05839509272021 | erot = 1.87547351819332 | epot = -12.067217734908 | etot = -9.13334912399445 +538000 ekin = 1.06323891386383 | erot = 1.8133142469933 | epot = -12.0099022845371 | etot = -9.13334912367997 +539000 ekin = 1.08487929970935 | erot = 1.75562392315627 | epot = -11.9738523463603 | etot = -9.1333491234947 +540000 ekin = 1.12268189024 | erot = 1.70611667319426 | epot = -11.9621476869098 | etot = -9.13334912347552 +541000 ekin = 1.17481105396921 | erot = 1.66717481231705 | epot = -11.9753349899259 | etot = -9.13334912363967 +542000 ekin = 1.23824417791975 | erot = 1.63956314455877 | epot = -12.0111564464592 | etot = -9.13334912398068 +543000 ekin = 1.30892832433008 | erot = 1.62236761446997 | epot = -12.064645063264 | etot = -9.13334912446397 +544000 ekin = 1.38208514508333 | erot = 1.61318872881414 | epot = -12.1286229989291 | etot = -9.13334912503163 +545000 ekin = 1.45263801176678 | erot = 1.60857948400874 | epot = -12.1945666213833 | etot = -9.13334912560776 +546000 ekin = 1.51570974605917 | erot = 1.6046737747132 | epot = -12.2537326468843 | etot = -9.13334912611194 +547000 ekin = 1.56711452712199 | erot = 1.5978880037946 | epot = -12.2983516573924 | etot = -9.13334912647585 +548000 ekin = 1.60376221827712 | erot = 1.58554162813844 | epot = -12.3226529730727 | etot = -9.1333491266571 +549000 ekin = 1.62391041625646 | erot = 1.56625626417929 | epot = -12.3235158070828 | etot = -9.13334912664708 +550000 ekin = 1.62723358008189 | erot = 1.54012357324966 | epot = -12.3007062797783 | etot = -9.1333491264467 +551000 ekin = 1.61471889890709 | erot = 1.50851459566941 | epot = -12.2565826207224 | etot = -9.13334912614586 +552000 ekin = 1.58843016681321 | erot = 1.4734893638054 | epot = -12.1952686563899 | etot = -9.13334912577134 +553000 ekin = 1.55120098108813 | erot = 1.43753302715615 | epot = -12.1220831336151 | etot = -9.13334912537079 +554000 ekin = 1.50631636212005 | erot = 1.40318755320161 | epot = -12.0428530403011 | etot = -9.13334912497946 +555000 ekin = 1.45722878985314 | erot = 1.37279698197473 | epot = -11.963374896449 | etot = -9.13334912462112 +556000 ekin = 1.40732293283973 | erot = 1.34837590637177 | epot = -11.8890479635191 | etot = -9.13334912430758 +557000 ekin = 1.3597375077168 | erot = 1.33157707037723 | epot = -11.8246637021381 | etot = -9.13334912404409 +558000 ekin = 1.31723590731803 | erot = 1.32371628032195 | epot = -11.774301311473 | etot = -9.13334912383299 +559000 ekin = 1.28211028308052 | erot = 1.32580526483901 | epot = -11.7412646715973 | etot = -9.13334912367774 +560000 ekin = 1.25610590403879 | erot = 1.3385562626673 | epot = -11.7280112902908 | etot = -9.13334912358467 +561000 ekin = 1.2403584426244 | erot = 1.36234138771829 | epot = -11.7360489539048 | etot = -9.13334912356214 +562000 ekin = 1.23534624011934 | erot = 1.39711468449598 | epot = -11.7658100482331 | etot = -9.13334912361783 +563000 ekin = 1.24087113987902 | erot = 1.44233150301079 | epot = -11.8165517666423 | etot = -9.13334912375254 +564000 ekin = 1.25609129142723 | erot = 1.49691875870951 | epot = -11.8863591740921 | etot = -9.13334912395532 +565000 ekin = 1.27963015842495 | erot = 1.55937933474963 | epot = -11.9723586173646 | etot = -9.13334912419005 +566000 ekin = 1.30976945418571 | erot = 1.62795664730359 | epot = -12.0710752259391 | etot = -9.13334912444983 +567000 ekin = 1.34469873511645 | erot = 1.70073738341556 | epot = -12.1787852432246 | etot = -9.13334912469256 +568000 ekin = 1.3827577993125 | erot = 1.77591787234845 | epot = -12.2920247965675 | etot = -9.13334912490654 +569000 ekin = 1.42260294142859 | erot = 1.85183127906418 | epot = -12.4077833455891 | etot = -9.13334912509629 +570000 ekin = 1.46311433096579 | erot = 1.92670412008669 | epot = -12.5231675764218 | etot = -9.13334912536935 +571000 ekin = 1.50327753329307 | erot = 1.99853100883714 | epot = -12.6351576678129 | etot = -9.13334912568273 +572000 ekin = 1.54192966726832 | erot = 2.0649761373204 | epot = -12.7402549304653 | etot = -9.13334912587657 +573000 ekin = 1.57823855406821 | erot = 2.12427016697656 | epot = -12.8358578470038 | etot = -9.13334912595906 +574000 ekin = 1.61207502223778 | erot = 2.1757020138103 | epot = -12.9211261619202 | etot = -9.13334912587208 +575000 ekin = 1.64402582172922 | erot = 2.2202844101377 | epot = -12.9976593574945 | etot = -9.13334912562756 +576000 ekin = 1.67538587677304 | erot = 2.26042238855478 | epot = -13.0691573906207 | etot = -9.13334912529285 +577000 ekin = 1.70789209377811 | erot = 2.29915883241272 | epot = -13.1404000511603 | etot = -9.13334912496951 +578000 ekin = 1.74326819507297 | erot = 2.33909725075146 | epot = -13.2157145705747 | etot = -9.13334912475026 +579000 ekin = 1.78272231837321 | erot = 2.38182643841169 | epot = -13.2978978814812 | etot = -9.13334912469626 +580000 ekin = 1.82652189372187 | erot = 2.42751679139068 | epot = -13.3873878099471 | etot = -9.13334912483456 +581000 ekin = 1.87370675174828 | erot = 2.47480205693634 | epot = -13.4818579338601 | etot = -9.1333491251755 +582000 ekin = 1.92197052578147 | erot = 2.52092715153357 | epot = -13.5762468029765 | etot = -9.13334912566144 +583000 ekin = 1.96774925896735 | erot = 2.5622766080205 | epot = -13.6633749932296 | etot = -9.13334912624179 +584000 ekin = 2.00657374540193 | erot = 2.59498886543468 | epot = -13.7349117376582 | etot = -9.13334912682161 +585000 ekin = 2.03371871575739 | erot = 2.61566274201115 | epot = -13.7827305850522 | etot = -9.13334912728366 +586000 ekin = 2.04507827703348 | erot = 2.62214006252247 | epot = -13.8005674670738 | etot = -9.13334912751786 +587000 ekin = 2.03806243485725 | erot = 2.6141199488978 | epot = -13.7855315112163 | etot = -9.13334912746122 +588000 ekin = 2.01223115184455 | erot = 2.59335030112668 | epot = -13.7389305800982 | etot = -9.13334912712697 +589000 ekin = 1.96942837554738 | erot = 2.5632467336321 | epot = -13.6660242357853 | etot = -9.13334912660584 +590000 ekin = 1.91334419959305 | erot = 2.52801524733486 | epot = -13.5747085729613 | etot = -9.13334912603339 +591000 ekin = 1.84865383331265 | erot = 2.49158313368545 | epot = -13.4735860925352 | etot = -9.13334912553709 +592000 ekin = 1.7800600442048 | erot = 2.45674050607598 | epot = -13.3701496754675 | etot = -9.13334912518674 +593000 ekin = 1.71159279763216 | erot = 2.42478693107787 | epot = -13.2697288536903 | etot = -9.13334912498026 +594000 ekin = 1.64634946406535 | erot = 2.39569805899352 | epot = -13.1753966479312 | etot = -9.13334912487234 +595000 ekin = 1.58659479950168 | erot = 2.36854432554773 | epot = -13.08848824987 | etot = -9.13334912482058 +596000 ekin = 1.53398103552672 | erot = 2.3418217578273 | epot = -13.0091519181659 | etot = -9.13334912481192 +597000 ekin = 1.48969441623861 | erot = 2.31355286207825 | epot = -12.9365964031697 | etot = -9.13334912485281 +598000 ekin = 1.45449014891718 | erot = 2.28129539493194 | epot = -12.8691346687931 | etot = -9.133349124944 +599000 ekin = 1.42868283607278 | erot = 2.24230571377212 | epot = -12.8043376749072 | etot = -9.13334912506228 +600000 ekin = 1.41215819514151 | erot = 2.19421771507013 | epot = -12.7397250351106 | etot = -9.133349124899 +601000 ekin = 1.40437980065043 | erot = 2.13675092846565 | epot = -12.6744798541783 | etot = -9.13334912506218 +602000 ekin = 1.40442466854576 | erot = 2.0686359576303 | epot = -12.6064097512959 | etot = -9.13334912511984 +603000 ekin = 1.41112302450901 | erot = 1.98998056956515 | epot = -12.5344527191469 | etot = -9.13334912507278 +604000 ekin = 1.4231013515346 | erot = 1.90274524322012 | epot = -12.4591957197004 | etot = -9.13334912494573 +605000 ekin = 1.43883447823777 | erot = 1.81030632010434 | epot = -12.3824899231149 | etot = -9.13334912477274 +606000 ekin = 1.45673760096453 | erot = 1.7168424050433 | epot = -12.3069291305928 | etot = -9.133349124585 +607000 ekin = 1.4752986371436 | erot = 1.62672298752655 | epot = -12.2353707490741 | etot = -9.13334912440396 +608000 ekin = 1.49323166611483 | erot = 1.54399943868836 | epot = -12.1705802290446 | etot = -9.13334912424139 +609000 ekin = 1.50961256616777 | erot = 1.47208306433822 | epot = -12.1150447546167 | etot = -9.13334912411072 +610000 ekin = 1.52396039432232 | erot = 1.41350705715133 | epot = -12.0708165754694 | etot = -9.13334912399578 +611000 ekin = 1.53622860047837 | erot = 1.36992443741373 | epot = -12.039502161817 | etot = -9.13334912392491 +612000 ekin = 1.54668536626771 | erot = 1.3420536287331 | epot = -12.0220881189121 | etot = -9.13334912391134 +613000 ekin = 1.55571309696042 | erot = 1.32960894336408 | epot = -12.0186711642966 | etot = -9.13334912397207 +614000 ekin = 1.563563692219 | erot = 1.33131277563083 | epot = -12.0282255919713 | etot = -9.13334912412147 +615000 ekin = 1.57013881826698 | erot = 1.34494539762326 | epot = -12.0484333402285 | etot = -9.13334912433831 +616000 ekin = 1.57485681903816 | erot = 1.36757312206826 | epot = -12.0757790657655 | etot = -9.13334912465904 +617000 ekin = 1.57672646781027 | erot = 1.39546251367309 | epot = -12.105538106507 | etot = -9.13334912502361 +618000 ekin = 1.57456346737574 | erot = 1.4244801345404 | epot = -12.132392727295 | etot = -9.13334912537887 +619000 ekin = 1.5673294646989 | erot = 1.45059208153146 | epot = -12.1512706718936 | etot = -9.13334912566327 +620000 ekin = 1.55451321753706 | erot = 1.47039334455802 | epot = -12.1582556879157 | etot = -9.13334912582065 +621000 ekin = 1.53644782338304 | erot = 1.48161304591016 | epot = -12.1514099951074 | etot = -9.13334912581417 +622000 ekin = 1.51447783518414 | erot = 1.48347710481805 | epot = -12.1313040656382 | etot = -9.13334912563599 +623000 ekin = 1.49092960733273 | erot = 1.47683215248592 | epot = -12.1011108851286 | etot = -9.13334912530997 +624000 ekin = 1.4688613017048 | erot = 1.46422198591098 | epot = -12.0664324125277 | etot = -9.13334912491195 +625000 ekin = 1.45155188813316 | erot = 1.44918251593658 | epot = -12.034083528555 | etot = -9.13334912448521 +626000 ekin = 1.44224748158819 | erot = 1.43533399590959 | epot = -12.0109306015719 | etot = -9.13334912407414 +627000 ekin = 1.44381530881133 | erot = 1.42638005353812 | epot = -12.0035444860869 | etot = -9.13334912373746 +628000 ekin = 1.45833081621508 | erot = 1.42560824874111 | epot = -12.0172881884954 | etot = -9.13334912353925 +629000 ekin = 1.48676985538685 | erot = 1.43535417575888 | epot = -12.0554731546353 | etot = -9.13334912348959 +630000 ekin = 1.52866417050986 | erot = 1.45689184512165 | epot = -12.1189051392586 | etot = -9.13334912362712 +631000 ekin = 1.58193413340953 | erot = 1.49015054896213 | epot = -12.2054338063912 | etot = -9.13334912401955 +632000 ekin = 1.64234851057805 | erot = 1.53357750657515 | epot = -12.3092751416974 | etot = -9.13334912454419 +633000 ekin = 1.70466841199232 | erot = 1.58426390208643 | epot = -12.4222814392301 | etot = -9.13334912515131 +634000 ekin = 1.76318354701509 | erot = 1.6386058778909 | epot = -12.535138550642 | etot = -9.13334912573606 +635000 ekin = 1.8124262503678 | erot = 1.69306627319109 | epot = -12.6388416497458 | etot = -9.13334912618693 +636000 ekin = 1.84805557839874 | erot = 1.74492785468478 | epot = -12.7263325594999 | etot = -9.13334912641637 +637000 ekin = 1.86755595286166 | erot = 1.7928646555761 | epot = -12.7937697348498 | etot = -9.13334912641204 +638000 ekin = 1.87047357469836 | erot = 1.83697965055749 | epot = -12.8408023514645 | etot = -9.13334912620865 +639000 ekin = 1.85817220593915 | erot = 1.87849437004942 | epot = -12.8700157018716 | etot = -9.13334912588304 +640000 ekin = 1.83325502875125 | erot = 1.91930247134942 | epot = -12.8859066256153 | etot = -9.13334912551468 +641000 ekin = 1.79889805051336 | erot = 1.96149522930644 | epot = -12.8937424049792 | etot = -9.13334912515942 +642000 ekin = 1.75833330344306 | erot = 2.0070145451564 | epot = -12.8986969734556 | etot = -9.13334912485619 +643000 ekin = 1.71452400737735 | erot = 2.05742054583686 | epot = -12.9052936778113 | etot = -9.13334912459706 +644000 ekin = 1.67006045205506 | erot = 2.11379950765405 | epot = -12.9172090841409 | etot = -9.13334912443175 +645000 ekin = 1.62710169192397 | erot = 2.17652829046706 | epot = -12.9369791067501 | etot = -9.1333491243591 +646000 ekin = 1.58731920569661 | erot = 2.24499987971455 | epot = -12.9656682097832 | etot = -9.13334912437201 +647000 ekin = 1.55192879848518 | erot = 2.31774723145065 | epot = -13.0030251544301 | etot = -9.13334912449424 +648000 ekin = 1.52155547402964 | erot = 2.39216849404641 | epot = -13.0470730928058 | etot = -9.13334912472975 +649000 ekin = 1.49615701171073 | erot = 2.46459269466187 | epot = -13.0940988314493 | etot = -9.13334912507674 +650000 ekin = 1.47495820406704 | erot = 2.53042613107379 | epot = -13.1387334606614 | etot = -9.13334912552054 +651000 ekin = 1.45644758274541 | erot = 2.58442104122196 | epot = -13.1742177499967 | etot = -9.13334912602929 +652000 ekin = 1.4384805466879 | erot = 2.62109720355865 | epot = -13.1929268767948 | etot = -9.13334912654824 +653000 ekin = 1.4185353864548 | erot = 2.63533318878906 | epot = -13.1872177022428 | etot = -9.13334912699892 +654000 ekin = 1.39414099593459 | erot = 2.6231144598725 | epot = -13.1506045830999 | etot = -9.13334912729284 +655000 ekin = 1.36342278663345 | erot = 2.58232798191103 | epot = -13.0790998958767 | etot = -9.13334912733224 +656000 ekin = 1.32754554558812 | erot = 2.51343997306009 | epot = -12.9743346447928 | etot = -9.13334912614456 +657000 ekin = 1.07738759791824 | erot = 2.44669612962647 | epot = -12.6574327807795 | etot = -9.1333490532348 +658000 ekin = 1.00652014229351 | erot = 2.49084781646048 | epot = -12.6307170433127 | etot = -9.13334908455866 +659000 ekin = 1.07240085017135 | erot = 2.4292990183042 | epot = -12.6350489837628 | etot = -9.13334911528726 +660000 ekin = 1.09381648980313 | erot = 2.3010230826046 | epot = -12.528188687904 | etot = -9.13334911549627 +661000 ekin = 1.11701334337659 | erot = 2.16959631553002 | epot = -12.4199587738017 | etot = -9.13334911489508 +662000 ekin = 1.14263894057787 | erot = 2.04231481244588 | epot = -12.3183028674738 | etot = -9.13334911445 +663000 ekin = 1.17093665277018 | erot = 1.92510458368601 | epot = -12.2293903506333 | etot = -9.13334911417715 +664000 ekin = 1.20146324496878 | erot = 1.82207009509857 | epot = -12.156882454157 | etot = -9.13334911408967 +665000 ekin = 1.2328903244818 | erot = 1.73564836426701 | epot = -12.1018878027908 | etot = -9.13334911404196 +666000 ekin = 1.26340464455561 | erot = 1.66702592667295 | epot = -12.0637796854931 | etot = -9.13334911426453 +667000 ekin = 1.29102574815048 | erot = 1.61488086819728 | epot = -12.0392557309118 | etot = -9.13334911456403 +668000 ekin = 1.31376054135466 | erot = 1.57649712773101 | epot = -12.0236067839929 | etot = -9.1333491149072 +669000 ekin = 1.32989404566059 | erot = 1.54828621181143 | epot = -12.0115293727016 | etot = -9.13334911522957 +670000 ekin = 1.33826340891376 | erot = 1.52640844797163 | epot = -11.9980209723715 | etot = -9.13334911548607 +671000 ekin = 1.33847461323971 | erot = 1.50724764864628 | epot = -11.979071377528 | etot = -9.13334911564201 +672000 ekin = 1.3310196955529 | erot = 1.48781306139119 | epot = -11.9521818726236 | etot = -9.13334911567955 +673000 ekin = 1.31737035051771 | erot = 1.46610228052978 | epot = -11.9168217466101 | etot = -9.13334911556266 +674000 ekin = 1.2999252179878 | erot = 1.44131241760654 | epot = -11.8745867509713 | etot = -9.13334911537699 +675000 ekin = 1.28129254583113 | erot = 1.41347048294326 | epot = -11.8281121439111 | etot = -9.13334911513667 +676000 ekin = 1.26413925334382 | erot = 1.38336835396219 | epot = -11.7808567221925 | etot = -9.13334911488653 +677000 ekin = 1.25080949630729 | erot = 1.35227525691902 | epot = -11.7364338679181 | etot = -9.13334911469175 +678000 ekin = 1.24240325884752 | erot = 1.32122246362882 | epot = -11.6969748370346 | etot = -9.13334911455831 +679000 ekin = 1.23935164125775 | erot = 1.29124446460097 | epot = -11.663945220358 | etot = -9.13334911449931 +680000 ekin = 1.24151057852865 | erot = 1.2635834883011 | epot = -11.638443181176 | etot = -9.13334911434626 +681000 ekin = 1.2481079198664 | erot = 1.23998966299057 | epot = -11.6214466973231 | etot = -9.13334911446618 +682000 ekin = 1.257380884739 | erot = 1.22073219169185 | epot = -11.6114621910611 | etot = -9.13334911463027 +683000 ekin = 1.26715254865479 | erot = 1.20554909693427 | epot = -11.6060507603996 | etot = -9.13334911481052 +684000 ekin = 1.27521936885684 | erot = 1.19392995255055 | epot = -11.6024984363864 | etot = -9.13334911497898 +685000 ekin = 1.27965818659302 | erot = 1.18525667279546 | epot = -11.5982639744928 | etot = -9.13334911510429 +686000 ekin = 1.27906445707785 | erot = 1.17887846189336 | epot = -11.5912920341624 | etot = -9.1333491151912 +687000 ekin = 1.27268261755062 | erot = 1.17407129020767 | epot = -11.5801030230189 | etot = -9.13334911526056 +688000 ekin = 1.2604191440757 | erot = 1.17007604782204 | epot = -11.5638443071263 | etot = -9.1333491152286 +689000 ekin = 1.24287938496311 | erot = 1.16656725573226 | epot = -11.5427957558532 | etot = -9.13334911515785 +690000 ekin = 1.2211824040556 | erot = 1.16336387130235 | epot = -11.5178953904181 | etot = -9.13334911506011 +691000 ekin = 1.19679867225831 | erot = 1.16037339232328 | epot = -11.4905211795286 | etot = -9.13334911494703 +692000 ekin = 1.17139142556005 | erot = 1.15758648592469 | epot = -11.4623270263132 | etot = -9.13334911482849 +693000 ekin = 1.14685376597763 | erot = 1.15519232866932 | epot = -11.4353952091884 | etot = -9.13334911454142 +694000 ekin = 1.12537035279197 | erot = 1.15368599835963 | epot = -11.4124054656052 | etot = -9.13334911445361 +695000 ekin = 1.10824764597993 | erot = 1.15324052660334 | epot = -11.3948372869664 | etot = -9.13334911438314 +696000 ekin = 1.0964152489969 | erot = 1.15407441364564 | epot = -11.3838387769781 | etot = -9.13334911433559 +697000 ekin = 1.09040706960405 | erot = 1.15645735234421 | epot = -11.3802135362665 | etot = -9.13334911431825 +698000 ekin = 1.09030542376955 | erot = 1.16063392710707 | epot = -11.384288465206 | etot = -9.13334911432937 +699000 ekin = 1.09552536142799 | erot = 1.16669639941878 | epot = -11.3955708752099 | etot = -9.13334911436315 +700000 ekin = 1.10527379804157 | erot = 1.17478862115957 | epot = -11.4134115336379 | etot = -9.13334911443675 +701000 ekin = 1.11851271409214 | erot = 1.18492470948231 | epot = -11.4367865380995 | etot = -9.13334911452505 +702000 ekin = 1.13395549373925 | erot = 1.19694667251692 | epot = -11.4642512808869 | etot = -9.13334911463076 +703000 ekin = 1.15018285434544 | erot = 1.21057055971299 | epot = -11.4941025288036 | etot = -9.1333491147452 +704000 ekin = 1.16576673459169 | erot = 1.22535908059982 | epot = -11.5244749300498 | etot = -9.1333491148583 +705000 ekin = 1.17938915504808 | erot = 1.24076765313842 | epot = -11.5535059231453 | etot = -9.13334911495876 +706000 ekin = 1.18994261307642 | erot = 1.25622348494356 | epot = -11.5795152130563 | etot = -9.1333491150363 +707000 ekin = 1.19660107196796 | erot = 1.27122780267074 | epot = -11.6011779897208 | etot = -9.13334911508208 +708000 ekin = 1.19885615187931 | erot = 1.2854633226749 | epot = -11.6176685896449 | etot = -9.13334911509071 +709000 ekin = 1.19651981510658 | erot = 1.29888532038428 | epot = -11.6287542505517 | etot = -9.13334911506088 +710000 ekin = 1.1896995749825 | erot = 1.31177606554588 | epot = -11.6348247555237 | etot = -9.13334911499534 +711000 ekin = 1.17875387603898 | erot = 1.32474791483616 | epot = -11.636850905777 | etot = -9.13334911490182 +712000 ekin = 1.16423391784884 | erot = 1.33868945230085 | epot = -11.6362724849409 | etot = -9.13334911479125 +713000 ekin = 1.14681758774029 | erot = 1.3546630535206 | epot = -11.6348297559395 | etot = -9.13334911467859 +714000 ekin = 1.12724173591538 | erot = 1.37373509015582 | epot = -11.6343259406492 | etot = -9.13334911457805 +715000 ekin = 1.10624050750783 | erot = 1.39681075799666 | epot = -11.6364003800083 | etot = -9.13334911450384 +716000 ekin = 1.08449847089723 | erot = 1.42446438146828 | epot = -11.6423119668325 | etot = -9.13334911446702 +717000 ekin = 1.0626258673095 | erot = 1.45678801965701 | epot = -11.6527630014408 | etot = -9.13334911447428 +718000 ekin = 1.0411605651836 | erot = 1.493285805019 | epot = -11.6677954847286 | etot = -9.13334911452601 +719000 ekin = 1.02059756447165 | erot = 1.5328356540972 | epot = -11.6867823331847 | etot = -9.13334911461582 +720000 ekin = 1.00144276091742 | erot = 1.5737347811105 | epot = -11.708526656758 | etot = -9.13334911473003 +721000 ekin = 0.984282698242622 | erot = 1.61383653734357 | epot = -11.7314683504355 | etot = -9.13334911484931 +722000 ekin = 0.969856334576067 | erot = 1.65076935461989 | epot = -11.7539748041515 | etot = -9.1333491149555 +723000 ekin = 0.959109074096986 | erot = 1.68219090543913 | epot = -11.7746490945585 | etot = -9.13334911502237 +724000 ekin = 0.953206498552839 | erot = 1.70610525283234 | epot = -11.7926608664234 | etot = -9.13334911503819 +725000 ekin = 0.953487871459188 | erot = 1.72112406448039 | epot = -11.8079610509383 | etot = -9.13334911499874 +726000 ekin = 0.96134842044988 | erot = 1.72664218758949 | epot = -11.8213397229517 | etot = -9.13334911491229 +727000 ekin = 0.978055187001709 | erot = 1.72290320035172 | epot = -11.8343075021501 | etot = -9.13334911479668 +728000 ekin = 1.00452582498075 | erot = 1.71095374109418 | epot = -11.8488286807485 | etot = -9.13334911467359 +729000 ekin = 1.041101375805 | erot = 1.6925221534298 | epot = -11.8669726438041 | etot = -9.13334911456933 +730000 ekin = 1.08735958691132 | erot = 1.66981008960002 | epot = -11.8905187910182 | etot = -9.13334911450692 +731000 ekin = 1.14200418376082 | erot = 1.64524141707914 | epot = -11.9205947153442 | etot = -9.13334911450421 +732000 ekin = 1.2028531801544 | erot = 1.6211909571491 | epot = -11.9573932518755 | etot = -9.13334911457201 +733000 ekin = 1.26692596392809 | erot = 1.59976528911575 | epot = -12.0000403677474 | etot = -9.13334911470354 +734000 ekin = 1.33064406419401 | erot = 1.58254289882086 | epot = -12.0465360779241 | etot = -9.13334911490923 +735000 ekin = 1.39013484389891 | erot = 1.57032898634687 | epot = -12.093812945406 | etot = -9.13334911516024 +736000 ekin = 1.44157509140931 | erot = 1.56317476789936 | epot = -12.1380989747374 | etot = -9.13334911542874 +737000 ekin = 1.48157845590956 | erot = 1.56044545882736 | epot = -12.175373030415 | etot = -9.13334911567811 +738000 ekin = 1.50757504379143 | erot = 1.56100911668234 | epot = -12.201933276343 | etot = -9.13334911586924 +739000 ekin = 1.51813561813258 | erot = 1.5635209253064 | epot = -12.2150056594058 | etot = -9.13334911596682 +740000 ekin = 1.51318914849964 | erot = 1.56675183786185 | epot = -12.213290102308 | etot = -9.1333491159465 +741000 ekin = 1.49408865830542 | erot = 1.56989906105133 | epot = -12.197336835157 | etot = -9.1333491158003 +742000 ekin = 1.46350061535832 | erot = 1.57280025701738 | epot = -12.1696499879178 | etot = -9.13334911554208 +743000 ekin = 1.42512524133836 | erot = 1.57593310601688 | epot = -12.1344074625233 | etot = -9.13334911516808 +744000 ekin = 1.38338487585034 | erot = 1.58054361279092 | epot = -12.0972776034393 | etot = -9.13334911479806 +745000 ekin = 1.34281951273504 | erot = 1.58823582841167 | epot = -12.0644044556028 | etot = -9.13334911445607 +746000 ekin = 1.30747334764684 | erot = 1.60047096981066 | epot = -12.0412934316558 | etot = -9.13334911419833 +747000 ekin = 1.28046646004539 | erot = 1.6182176866567 | epot = -12.0320332607954 | etot = -9.13334911409333 +748000 ekin = 1.26367955922522 | erot = 1.6413289314295 | epot = -12.0383576048251 | etot = -9.1333491141704 +749000 ekin = 1.25742934418728 | erot = 1.6683144002363 | epot = -12.0590928588618 | etot = -9.13334911443821 +750000 ekin = 1.26047795506412 | erot = 1.69628448613638 | epot = -12.0901115560516 | etot = -9.13334911485111 +751000 ekin = 1.27026186445649 | erot = 1.7213338688469 | epot = -12.1249448486435 | etot = -9.13334911534013 +752000 ekin = 1.28339547084868 | erot = 1.73919075504447 | epot = -12.1559353417022 | etot = -9.13334911580908 +753000 ekin = 1.29635957465195 | erot = 1.74596876190635 | epot = -12.1756774527778 | etot = -9.13334911621948 +754000 ekin = 1.30599158739589 | erot = 1.73885024062191 | epot = -12.1781909444063 | etot = -9.13334911638853 +755000 ekin = 1.31024888114924 | erot = 1.71683511467272 | epot = -12.1604331121636 | etot = -9.13334911634163 +756000 ekin = 1.30846938320446 | erot = 1.68097972248998 | epot = -12.1227982217864 | etot = -9.13334911609197 +757000 ekin = 1.30124985040436 | erot = 1.63419006476215 | epot = -12.0687890308559 | etot = -9.13334911568938 +758000 ekin = 1.2901964108967 | erot = 1.58073563388977 | epot = -12.0042811599911 | etot = -9.13334911520461 +759000 ekin = 1.27761222226823 | erot = 1.52554636406693 | epot = -11.9365077010342 | etot = -9.13334911469902 +760000 ekin = 1.26609069505968 | erot = 1.47348693038979 | epot = -11.8729267397086 | etot = -9.13334911425916 +761000 ekin = 1.25808964010813 | erot = 1.42869550463111 | epot = -11.8201342586633 | etot = -9.13334911392401 +762000 ekin = 1.25572222199678 | erot = 1.39407442312114 | epot = -11.7831457588671 | etot = -9.13334911374923 +763000 ekin = 1.26054534568777 | erot = 1.37090045945164 | epot = -11.7647949188355 | etot = -9.13334911369611 +764000 ekin = 1.27353435438893 | erot = 1.35887199087599 | epot = -11.765755459057 | etot = -9.13334911379209 +765000 ekin = 1.29496682598708 | erot = 1.35616457699752 | epot = -11.784480516978 | etot = -9.13334911399342 +766000 ekin = 1.32454629040877 | erot = 1.35977679504827 | epot = -11.8176721997206 | etot = -9.13334911426354 +767000 ekin = 1.36163954270418 | erot = 1.36618632226284 | epot = -11.8611749795223 | etot = -9.13334911455532 +768000 ekin = 1.40531019891056 | erot = 1.37181010086345 | epot = -11.9104694146033 | etot = -9.1333491148293 +769000 ekin = 1.45446512867426 | erot = 1.3735349805472 | epot = -11.9613492242621 | etot = -9.13334911504064 +770000 ekin = 1.50793050150594 | erot = 1.36921125653879 | epot = -12.0104908732812 | etot = -9.13334911523644 +771000 ekin = 1.56389616691507 | erot = 1.35775090665738 | epot = -12.0549961888307 | etot = -9.13334911525823 +772000 ekin = 1.62113703502565 | erot = 1.3397032351014 | epot = -12.0941893853161 | etot = -9.13334911518905 +773000 ekin = 1.67872851567452 | erot = 1.31702982994443 | epot = -12.1291074606815 | etot = -9.13334911506253 +774000 ekin = 1.73569257106584 | erot = 1.29264163256045 | epot = -12.161683318549 | etot = -9.13334911492273 +775000 ekin = 1.79085656131151 | erot = 1.26988000057613 | epot = -12.1940856766996 | etot = -9.13334911481191 +776000 ekin = 1.84276100465629 | erot = 1.25197534043462 | epot = -12.22808545985 | etot = -9.1333491147591 +777000 ekin = 1.88967118601021 | erot = 1.24159765896537 | epot = -12.2646179597479 | etot = -9.13334911477235 +778000 ekin = 1.92971622257856 | erot = 1.24057583219052 | epot = -12.3036411696102 | etot = -9.13334911484109 +779000 ekin = 1.9611316425201 | erot = 1.24980912497287 | epot = -12.3442898824337 | etot = -9.13334911494076 +780000 ekin = 1.98254203383388 | erot = 1.26932045670087 | epot = -12.3852116055787 | etot = -9.13334911504397 +781000 ekin = 1.99321406402893 | erot = 1.29840823520918 | epot = -12.424971414368 | etot = -9.13334911512989 +782000 ekin = 1.99321095938066 | erot = 1.33580885493627 | epot = -12.4623689295052 | etot = -9.13334911518827 +783000 ekin = 1.98342491290893 | erot = 1.37983642299143 | epot = -12.4966104511182 | etot = -9.13334911521788 +784000 ekin = 1.9655123842759 | erot = 1.42849371621316 | epot = -12.5273552156592 | etot = -9.13334911517014 +785000 ekin = 1.94195910109809 | erot = 1.4796134882127 | epot = -12.5549217044722 | etot = -9.13334911516144 +786000 ekin = 1.91549982324098 | erot = 1.53087711625688 | epot = -12.5797260546341 | etot = -9.13334911513619 +787000 ekin = 1.88902915931362 | erot = 1.57997565974334 | epot = -12.6023539341502 | etot = -9.13334911509327 +788000 ekin = 1.86553746552517 | erot = 1.62478646023569 | epot = -12.6236730407985 | etot = -9.13334911503765 +789000 ekin = 1.84793067282888 | erot = 1.66350572424678 | epot = -12.64478551204 | etot = -9.13334911496435 +790000 ekin = 1.83884831411046 | erot = 1.69477325869788 | epot = -12.666970687703 | etot = -9.13334911489468 +791000 ekin = 1.84038435200563 | erot = 1.7176812784652 | epot = -12.6914147453263 | etot = -9.13334911485547 +792000 ekin = 1.85374621230498 | erot = 1.73169683788286 | epot = -12.7187921650658 | etot = -9.13334911487796 +793000 ekin = 1.8789217872916 | erot = 1.73653576921967 | epot = -12.7488066714975 | etot = -9.13334911498622 +794000 ekin = 1.91440510045115 | erot = 1.73204169925583 | epot = -12.7797959148858 | etot = -9.13334911517881 +795000 ekin = 1.95726697872348 | erot = 1.71818976214858 | epot = -12.8088058562927 | etot = -9.13334911542061 +796000 ekin = 2.00360851779832 | erot = 1.69525335456394 | epot = -12.83221098801 | etot = -9.13334911564777 +797000 ekin = 2.04914358120832 | erot = 1.6640594673882 | epot = -12.8465521643865 | etot = -9.13334911578995 +798000 ekin = 2.08995546228143 | erot = 1.62623745949242 | epot = -12.8495420375764 | etot = -9.13334911580254 +799000 ekin = 2.12309292252157 | erot = 1.58427028112694 | epot = -12.8407123193349 | etot = -9.13334911568641 +800000 ekin = 2.14682990848697 | erot = 1.54126138555531 | epot = -12.8214404095241 | etot = -9.1333491154818 +801000 ekin = 2.16058282774156 | erot = 1.50048202043082 | epot = -12.7944139634182 | etot = -9.13334911524585 +802000 ekin = 2.16461511111025 | erot = 1.46486615498777 | epot = -12.7628303811285 | etot = -9.13334911503043 +803000 ekin = 2.15969104318309 | erot = 1.43661335438027 | epot = -12.7296535124319 | etot = -9.13334911486852 +804000 ekin = 2.14679128689927 | erot = 1.41698988504299 | epot = -12.6971302867013 | etot = -9.133349114759 +805000 ekin = 2.12692065946171 | erot = 1.40638520511209 | epot = -12.6666549792979 | etot = -9.13334911472415 +806000 ekin = 2.10099028265881 | erot = 1.40422932571964 | epot = -12.638568723139 | etot = -9.13334911476051 +807000 ekin = 2.06982763844373 | erot = 1.40909451156273 | epot = -12.6122712648444 | etot = -9.13334911483793 +808000 ekin = 2.03419092300448 | erot = 1.4191942216523 | epot = -12.5867342595854 | etot = -9.13334911492858 +809000 ekin = 1.99478586658702 | erot = 1.43238858340406 | epot = -12.5605235650437 | etot = -9.13334911505266 +810000 ekin = 1.95230744549328 | erot = 1.44625258193298 | epot = -12.5319091426013 | etot = -9.13334911517508 +811000 ekin = 1.90747094191263 | erot = 1.45847148724801 | epot = -12.4992915444435 | etot = -9.13334911528283 +812000 ekin = 1.86102893104771 | erot = 1.4670396355065 | epot = -12.4614176819174 | etot = -9.1333491153632 +813000 ekin = 1.81416432245149 | erot = 1.47049868910168 | epot = -12.4180121266893 | etot = -9.13334911513612 +814000 ekin = 1.76902926168515 | erot = 1.46826739314062 | epot = -12.3706457701111 | etot = -9.13334911528532 +815000 ekin = 1.71533069951599 | erot = 1.45797598426857 | epot = -12.3066557948091 | etot = -9.13334911102451 +816000 ekin = 1.68468183703012 | erot = 1.43935942021377 | epot = -12.2573903676517 | etot = -9.13334911040781 +817000 ekin = 1.67569540451046 | erot = 1.42022759194491 | epot = -12.2292721046041 | etot = -9.13334910814875 +818000 ekin = 1.6543180407743 | erot = 1.40071144600671 | epot = -12.1883785945421 | etot = -9.1333491077611 +819000 ekin = 1.63740188370202 | erot = 1.3825693171654 | epot = -12.1533203082532 | etot = -9.13334910738577 +820000 ekin = 1.62512170449269 | erot = 1.36928168851892 | epot = -12.1277525000358 | etot = -9.13334910702415 +821000 ekin = 1.61915909096608 | erot = 1.36404110714174 | epot = -12.1165493048155 | etot = -9.13334910670769 +822000 ekin = 1.62172343975879 | erot = 1.36925913745439 | epot = -12.1243316837311 | etot = -9.1333491065179 +823000 ekin = 1.63427494813185 | erot = 1.38616632187947 | epot = -12.1537903765206 | etot = -9.13334910650931 +824000 ekin = 1.65698382619249 | erot = 1.41459711182067 | epot = -12.2049300447062 | etot = -9.13334910669302 +825000 ekin = 1.68854753275391 | erot = 1.45301631838177 | epot = -12.2749129581741 | etot = -9.13334910703845 +826000 ekin = 1.72638863498139 | erot = 1.49875661575832 | epot = -12.3584943582278 | etot = -9.13334910748809 +827000 ekin = 1.7671042338297 | erot = 1.54839439230476 | epot = -12.4488477341105 | etot = -9.13334910797603 +828000 ekin = 1.8069848233623 | erot = 1.59818184897738 | epot = -12.5385157807839 | etot = -9.13334910844426 +829000 ekin = 1.84246939972193 | erot = 1.64447465714772 | epot = -12.6202931657147 | etot = -9.13334910884503 +830000 ekin = 1.87048980345312 | erot = 1.68412933436257 | epot = -12.6879682469559 | etot = -9.13334910914018 +831000 ekin = 1.88871335829486 | erot = 1.71486645415863 | epot = -12.7369289217531 | etot = -9.13334910929959 +832000 ekin = 1.8956991679299 | erot = 1.73558694750314 | epot = -12.7646352247374 | etot = -9.13334910930432 +833000 ekin = 1.89096344936275 | erot = 1.74659447550954 | epot = -12.7709070340259 | etot = -9.13334910915363 +834000 ekin = 1.87493429544978 | erot = 1.74964392180032 | epot = -12.757927326139 | etot = -9.13334910888886 +835000 ekin = 1.84878280513717 | erot = 1.7476202730817 | epot = -12.7297521867426 | etot = -9.13334910852377 +836000 ekin = 1.81414476908622 | erot = 1.74421722089262 | epot = -12.6917110981184 | etot = -9.13334910813955 +837000 ekin = 1.77277875466035 | erot = 1.74335285140424 | epot = -12.649480713868 | etot = -9.13334910780345 +838000 ekin = 1.72624445529917 | erot = 1.74841404793899 | epot = -12.6080076108044 | etot = -9.1333491075663 +839000 ekin = 1.67568816109172 | erot = 1.76165550556133 | epot = -12.5706927741081 | etot = -9.13334910745503 +840000 ekin = 1.62179135097772 | erot = 1.78387657047957 | epot = -12.5390170289133 | etot = -9.13334910745602 +841000 ekin = 1.56488441149642 | erot = 1.81456573945265 | epot = -12.5127992584871 | etot = -9.13334910753799 +842000 ekin = 1.50517399561483 | erot = 1.85205645867799 | epot = -12.4905795619901 | etot = -9.1333491076973 +843000 ekin = 1.44300548282572 | erot = 1.89358112525555 | epot = -12.4699357158877 | etot = -9.13334910780638 +844000 ekin = 1.37906620629623 | erot = 1.93639685189906 | epot = -12.4488121660662 | etot = -9.1333491078709 +845000 ekin = 1.31446352832021 | erot = 1.97812996440304 | epot = -12.4259426005943 | etot = -9.13334910787105 +846000 ekin = 1.25068692328186 | erot = 2.0170023495777 | epot = -12.4010383806625 | etot = -9.13334910780295 +847000 ekin = 1.18947724706781 | erot = 2.05204320496021 | epot = -12.3748695597031 | etot = -9.13334910767511 +848000 ekin = 1.13265732503597 | erot = 2.08314733282525 | epot = -12.3491537653654 | etot = -9.13334910750421 +849000 ekin = 1.08197657768912 | erot = 2.11099249699057 | epot = -12.3263181819891 | etot = -9.13334910730939 +850000 ekin = 1.03899924536999 | erot = 2.13684654288889 | epot = -12.3091948953714 | etot = -9.13334910711252 +851000 ekin = 1.00503792488698 | erot = 2.16230618703386 | epot = -12.3006932188552 | etot = -9.13334910693433 +852000 ekin = 0.981116857862461 | erot = 2.18901371777386 | epot = -12.3034796824288 | etot = -9.13334910679252 +853000 ekin = 0.967947652214265 | erot = 2.21839549976 | epot = -12.3196922586772 | etot = -9.13334910670291 +854000 ekin = 0.965908910680345 | erot = 2.25145766404042 | epot = -12.350715681394 | etot = -9.13334910667321 +855000 ekin = 0.975031148285144 | erot = 2.28866143870958 | epot = -12.3970416937005 | etot = -9.13334910670573 +856000 ekin = 0.994993726111922 | erot = 2.32988587268686 | epot = -12.458228705595 | etot = -9.13334910679624 +857000 ekin = 1.02514000045526 | erot = 2.37447147766155 | epot = -12.5329605850519 | etot = -9.1333491069351 +858000 ekin = 1.06451194042811 | erot = 2.42132581265304 | epot = -12.6191868601907 | etot = -9.13334910710959 +859000 ekin = 1.11189872921032 | erot = 2.4690621764797 | epot = -12.7143100129972 | etot = -9.13334910730715 +860000 ekin = 1.16588800432851 | erot = 2.51613734357938 | epot = -12.8153744554262 | etot = -9.1333491075183 +861000 ekin = 1.22490604810107 | erot = 2.56095681693497 | epot = -12.9192119727746 | etot = -9.13334910773851 +862000 ekin = 1.28723632581143 | erot = 2.60192847235753 | epot = -13.0225139061385 | etot = -9.13334910796952 +863000 ekin = 1.3510143193897 | erot = 2.63746581473987 | epot = -13.1218292423449 | etot = -9.13334910821536 +864000 ekin = 1.41420820519538 | erot = 2.66596355872735 | epot = -13.213520872402 | etot = -9.13334910847929 +865000 ekin = 1.47460562929754 | erot = 2.68578195462017 | epot = -13.2937366926771 | etot = -9.13334910875935 +866000 ekin = 1.52983303721746 | erot = 2.69527584724675 | epot = -13.3584579935089 | etot = -9.13334910904468 +867000 ekin = 1.57743376517692 | erot = 2.69288933093158 | epot = -13.4036722054228 | etot = -9.1333491093143 +868000 ekin = 1.61502389037981 | erot = 2.67731200497068 | epot = -13.4256850048896 | etot = -9.13334910953911 +869000 ekin = 1.64053051308534 | erot = 2.64766625523692 | epot = -13.4215458780077 | etot = -9.13334910968546 +870000 ekin = 1.65249590024961 | erot = 2.60367561911745 | epot = -13.3895206290897 | etot = -9.13334910972266 +871000 ekin = 1.65040511753298 | erot = 2.54576053409616 | epot = -13.3295147612589 | etot = -9.13334910962978 +872000 ekin = 1.63497077369899 | erot = 2.47502461258462 | epot = -13.2433444956856 | etot = -9.133349109402 +873000 ekin = 1.60829551084935 | erot = 2.39312864666234 | epot = -13.1347732665654 | etot = -9.13334910905374 +874000 ekin = 1.57383856496055 | erot = 2.30208675131772 | epot = -13.0092744248964 | etot = -9.13334910861812 +875000 ekin = 1.53613967510654 | erot = 2.20404109160993 | epot = -12.8735298748602 | etot = -9.13334910814374 +876000 ekin = 1.50030007469727 | erot = 2.10106901465442 | epot = -12.7347181970396 | etot = -9.13334910768791 +877000 ekin = 1.47128183648615 | erot = 1.9950559248475 | epot = -12.5996868686408 | etot = -9.13334910730713 +878000 ekin = 1.45315269233919 | erot = 1.88764504252361 | epot = -12.4741468419076 | etot = -9.13334910704481 +879000 ekin = 1.44845009592096 | erot = 1.78026193724247 | epot = -12.3620611400824 | etot = -9.13334910691899 +880000 ekin = 1.45783397194371 | erot = 1.67420503622043 | epot = -12.2653881150816 | etot = -9.13334910691747 +881000 ekin = 1.48012455417244 | erot = 1.57078382964924 | epot = -12.184257490823 | etot = -9.13334910700136 +882000 ekin = 1.51270015737959 | erot = 1.47147015193218 | epot = -12.1175194164301 | etot = -9.13334910711833 +883000 ekin = 1.55211568292956 | erot = 1.3780124488386 | epot = -12.0634772389891 | etot = -9.13334910722097 +884000 ekin = 1.59475301551035 | erot = 1.29246300163619 | epot = -12.0205651244261 | etot = -9.13334910727952 +885000 ekin = 1.63734681493634 | erot = 1.21709221485511 | epot = -11.9877881370758 | etot = -9.13334910728433 +886000 ekin = 1.67731211301505 | erot = 1.15420415260406 | epot = -11.964865372863 | etot = -9.13334910724389 +887000 ekin = 1.71288068346796 | erot = 1.10590165063358 | epot = -11.9521314412762 | etot = -9.13334910717465 +888000 ekin = 1.74309500658037 | erot = 1.0738583453026 | epot = -11.950302458979 | etot = -9.13334910709607 +889000 ekin = 1.76770969092178 | erot = 1.05913784423415 | epot = -11.9601966421833 | etot = -9.13334910702742 +890000 ekin = 1.78703240996917 | erot = 1.06207375034143 | epot = -11.9824552672978 | etot = -9.1333491069872 +891000 ekin = 1.80172329225239 | erot = 1.0822074746527 | epot = -12.0172798738974 | etot = -9.13334910699232 +892000 ekin = 1.81257293682803 | erot = 1.11828058017375 | epot = -12.0642026240573 | etot = -9.13334910705554 +893000 ekin = 1.82028982711245 | erot = 1.16828769624483 | epot = -12.1219266305377 | etot = -9.13334910718043 +894000 ekin = 1.82533649727562 | erot = 1.22960280171444 | epot = -12.1882884063505 | etot = -9.13334910736046 +895000 ekin = 1.82785071658345 | erot = 1.29918775471572 | epot = -12.2603875788748 | etot = -9.13334910757561 +896000 ekin = 1.82766966746167 | erot = 1.37387583337395 | epot = -12.3348946086319 | etot = -9.13334910779625 +897000 ekin = 1.82444603805884 | erot = 1.450698935459 | epot = -12.4084940815071 | etot = -9.1333491079893 +898000 ekin = 1.81781661002986 | erot = 1.52720356358779 | epot = -12.4783692817442 | etot = -9.13334910812654 +899000 ekin = 1.80756915106169 | erot = 1.60168843031701 | epot = -12.542606689571 | etot = -9.13334910819232 +900000 ekin = 1.79375843952035 | erot = 1.67330364935026 | epot = -12.6004111970587 | etot = -9.13334910818809 +901000 ekin = 1.77674318471729 | erot = 1.74197941470073 | epot = -12.6520717075493 | etot = -9.13334910813131 +902000 ekin = 1.75714245724149 | erot = 1.80819394413506 | epot = -12.6986855094274 | etot = -9.13334910805086 +903000 ekin = 1.73573344436742 | erot = 1.87263325997332 | epot = -12.7417158123196 | etot = -9.13334910797882 +904000 ekin = 1.71332625903819 | erot = 1.93582474199559 | epot = -12.7825001089758 | etot = -9.13334910794204 +905000 ekin = 1.69065428565829 | erot = 1.99783248447312 | epot = -12.8218358780868 | etot = -9.13334910795542 +906000 ekin = 1.66831072851898 | erot = 2.0580838142567 | epot = -12.8597436507951 | etot = -9.1333491080194 +907000 ekin = 1.64674588300155 | erot = 2.11535919829805 | epot = -12.8954541894192 | etot = -9.13334910811959 +908000 ekin = 1.62631907110854 | erot = 2.16793324018485 | epot = -12.9276014195275 | etot = -9.1333491082341 +909000 ekin = 1.60738004097872 | erot = 2.21381581989075 | epot = -12.9545449692098 | etot = -9.13334910834033 +910000 ekin = 1.59034402489554 | erot = 2.25102295606656 | epot = -12.9747160893832 | etot = -9.13334910842113 +911000 ekin = 1.5757278270972 | erot = 2.27781488088298 | epot = -12.9868918164479 | etot = -9.1333491084677 +912000 ekin = 1.56413054682574 | erot = 2.29287003009408 | epot = -12.9903496853987 | etot = -9.1333491084789 +913000 ekin = 1.55616398737313 | erot = 2.29539983338945 | epot = -12.9849129292197 | etot = -9.13334910845709 +914000 ekin = 1.55235379274234 | erot = 2.28522760390945 | epot = -12.9709305050575 | etot = -9.13334910840569 +915000 ekin = 1.55303636075931 | erot = 2.26284508700303 | epot = -12.9492305560909 | etot = -9.13334910832854 +916000 ekin = 1.55827003373402 | erot = 2.22943339363176 | epot = -12.9210525355978 | etot = -9.13334910823199 +917000 ekin = 1.56776924055919 | erot = 2.18681551600403 | epot = -12.8879338646899 | etot = -9.13334910812669 +918000 ekin = 1.58086450735616 | erot = 2.13731406707604 | epot = -12.8515276824606 | etot = -9.13334910802844 +919000 ekin = 1.59649190921356 | erot = 2.08351907894305 | epot = -12.8133600961094 | etot = -9.13334910795276 +920000 ekin = 1.61321892883215 | erot = 2.02800735916391 | epot = -12.7745753959083 | etot = -9.13334910791224 +921000 ekin = 1.62931395437166 | erot = 1.97307497750016 | epot = -12.7357380397844 | etot = -9.1333491079126 +922000 ekin = 1.64286104745973 | erot = 1.92053870339868 | epot = -12.6967488588085 | etot = -9.1333491079501 +923000 ekin = 1.6519123439022 | erot = 1.87163759206758 | epot = -12.6568990439832 | etot = -9.13334910801338 +924000 ekin = 1.65466206200493 | erot = 1.82703710611869 | epot = -12.6150482762095 | etot = -9.13334910808586 +925000 ekin = 1.64962158355265 | erot = 1.78691680127086 | epot = -12.5698874929728 | etot = -9.13334910814926 +926000 ekin = 1.63577435705081 | erot = 1.75111283229508 | epot = -12.5202362975322 | etot = -9.13334910818633 +927000 ekin = 1.61269412580165 | erot = 1.71928618606909 | epot = -12.4653294200535 | etot = -9.13334910818274 +928000 ekin = 1.58061327337614 | erot = 1.69109387512271 | epot = -12.4050562566278 | etot = -9.1333491081289 +929000 ekin = 1.54043465717785 | erot = 1.66634444993334 | epot = -12.3401282151314 | etot = -9.13334910802019 +930000 ekin = 1.49368612296071 | erot = 1.64511875929312 | epot = -12.272153990113 | etot = -9.13334910785914 +931000 ekin = 1.44242020034653 | erot = 1.62783092394405 | epot = -12.2036002319477 | etot = -9.13334910765707 +932000 ekin = 1.38906420476601 | erot = 1.61520048768548 | epot = -12.1376137998864 | etot = -9.13334910743492 +933000 ekin = 1.33622958394485 | erot = 1.6081156841091 | epot = -12.0776943752761 | etot = -9.13334910722217 +934000 ekin = 1.28649486980888 | erot = 1.60739378973688 | epot = -12.0272377665998 | etot = -9.13334910705402 +935000 ekin = 1.24218246522804 | erot = 1.6134791908439 | epot = -11.9890107630357 | etot = -9.13334910696378 +936000 ekin = 1.20515312894639 | erot = 1.62614770367122 | epot = -11.9646499395944 | etot = -9.13334910697676 +937000 ekin = 1.17664231212851 | erot = 1.6442958335604 | epot = -11.9542872527933 | etot = -9.13334910710437 +938000 ekin = 1.15716006416317 | erot = 1.66588444176712 | epot = -11.9563936132696 | etot = -9.13334910733934 +939000 ekin = 1.14647171706266 | erot = 1.6881032683341 | epot = -11.9679240930434 | etot = -9.13334910764666 +940000 ekin = 1.14367004076054 | erot = 1.70771457435669 | epot = -11.9847337231134 | etot = -9.13334910799618 +941000 ekin = 1.1473388455791 | erot = 1.72149292702196 | epot = -12.0021808809227 | etot = -9.13334910832164 +942000 ekin = 1.15580134675009 | erot = 1.72687300442719 | epot = -12.0160234597396 | etot = -9.13334910856235 +943000 ekin = 1.16743729508088 | erot = 1.72249936628187 | epot = -12.0232857700279 | etot = -9.13334910866513 +944000 ekin = 1.18103106469623 | erot = 1.7085871246677 | epot = -12.0229672979652 | etot = -9.13334910860128 +945000 ekin = 1.1960680444943 | erot = 1.68696892709797 | epot = -12.0163860799751 | etot = -9.13334910838281 +946000 ekin = 1.21284058105875 | erot = 1.66075870252106 | epot = -12.0069483916519 | etot = -9.13334910807212 +947000 ekin = 1.23222210569487 | erot = 1.63367011142218 | epot = -11.9992413248878 | etot = -9.13334910777077 +948000 ekin = 1.25509690713185 | erot = 1.60916358074283 | epot = -11.9976095954608 | etot = -9.13334910758613 +949000 ekin = 1.28167104219273 | erot = 1.5896908039578 | epot = -12.0047109537303 | etot = -9.13334910757972 +950000 ekin = 1.31105510037397 | erot = 1.57628415675868 | epot = -12.0206883648703 | etot = -9.13334910773768 +951000 ekin = 1.34140314928571 | erot = 1.56859135850371 | epot = -12.0433436157719 | etot = -9.13334910798252 +952000 ekin = 1.37054117669372 | erot = 1.56526000758929 | epot = -12.069150292504 | etot = -9.13334910822102 +953000 ekin = 1.39670348102587 | erot = 1.56444621741211 | epot = -12.0944988068298 | etot = -9.13334910839183 +954000 ekin = 1.41897529239146 | erot = 1.56423287012898 | epot = -12.1165572710023 | etot = -9.13334910848183 +955000 ekin = 1.43729048071804 | erot = 1.5628747995038 | epot = -12.1335143887331 | etot = -9.13334910851122 +956000 ekin = 1.45211066333914 | erot = 1.55892938544642 | epot = -12.1443891572912 | etot = -9.13334910850569 +957000 ekin = 1.46402190624319 | erot = 1.55132217592857 | epot = -12.1486931906549 | etot = -9.13334910848318 +958000 ekin = 1.47342593726502 | erot = 1.53954965708395 | epot = -12.1463247027848 | etot = -9.13334910843584 +959000 ekin = 1.48038578495474 | erot = 1.52394133598125 | epot = -12.137676229295 | etot = -9.13334910835898 +960000 ekin = 1.4846060403427 | erot = 1.50575363434298 | epot = -12.1237087829308 | etot = -9.13334910824516 +961000 ekin = 1.48549975935911 | erot = 1.48721075409997 | epot = -12.1060596215514 | etot = -9.13334910809229 +962000 ekin = 1.48229853495805 | erot = 1.47141202581677 | epot = -12.0870596686812 | etot = -9.1333491079064 +963000 ekin = 1.47417603271195 | erot = 1.46210240866553 | epot = -12.069627549079 | etot = -9.13334910770149 +964000 ekin = 1.46036644523782 | erot = 1.46332191689043 | epot = -12.0570374696247 | etot = -9.13334910749646 +965000 ekin = 1.44026662180513 | erot = 1.4789632478734 | epot = -12.052578976996 | etot = -9.13334910731744 +966000 ekin = 1.41351583398992 | erot = 1.51227943253497 | epot = -12.0591443737153 | etot = -9.13334910719041 +967000 ekin = 1.38005134110581 | erot = 1.56539665065099 | epot = -12.0787970988967 | etot = -9.13334910713991 +968000 ekin = 1.34025482723033 | erot = 1.63885686280376 | epot = -12.1124607972101 | etot = -9.13334910717598 +969000 ekin = 1.2947692198018 | erot = 1.73132793714239 | epot = -12.1594462642669 | etot = -9.13334910732274 +970000 ekin = 1.24442005391699 | erot = 1.83972520716413 | epot = -12.2174943686209 | etot = -9.13334910753978 +971000 ekin = 1.19046696426425 | erot = 1.95943091413493 | epot = -12.2832469861951 | etot = -9.13334910779591 +972000 ekin = 1.13463097113061 | erot = 2.08475088506706 | epot = -12.3527309642468 | etot = -9.13334910804911 +973000 ekin = 1.07911059567514 | erot = 2.20953944506054 | epot = -12.4219991489933 | etot = -9.13334910825765 +974000 ekin = 1.02657367041436 | erot = 2.32774347844032 | epot = -12.4876662572788 | etot = -9.13334910842407 +975000 ekin = 0.979977932768793 | erot = 2.43392801407682 | epot = -12.5472550553323 | etot = -9.13334910848667 +976000 ekin = 0.942304887102471 | erot = 2.52399013958441 | epot = -12.5996441351603 | etot = -9.13334910847343 +977000 ekin = 0.916335295709716 | erot = 2.59517570126148 | epot = -12.6448601053816 | etot = -9.13334910841042 +978000 ekin = 0.904316422895417 | erot = 2.64601698758899 | epot = -12.6836825188159 | etot = -9.13334910833152 +979000 ekin = 0.907654941512151 | erot = 2.67612704045885 | epot = -12.7171310902396 | etot = -9.13334910826861 +980000 ekin = 0.926700183438725 | erot = 2.68592744663146 | epot = -12.7459767383145 | etot = -9.13334910824436 +981000 ekin = 0.960659745241547 | erot = 2.67638285525772 | epot = -12.770391708766 | etot = -9.13334910826674 +982000 ekin = 1.00766017971382 | erot = 2.64879736698571 | epot = -12.7898066550302 | etot = -9.13334910833062 +983000 ekin = 1.06493892794389 | erot = 2.60470505313269 | epot = -12.8029930894938 | etot = -9.13334910841725 +984000 ekin = 1.12913508942468 | erot = 2.54586103452334 | epot = -12.808345232448 | etot = -9.13334910849994 +985000 ekin = 1.19663599746289 | erot = 2.47431116848726 | epot = -12.8042962744991 | etot = -9.13334910854893 +986000 ekin = 1.2639316426873 | erot = 2.39249159635318 | epot = -12.7897723475801 | etot = -9.13334910853965 +987000 ekin = 1.32792910237771 | erot = 2.30329384114304 | epot = -12.7645720519798 | etot = -9.13334910845902 +988000 ekin = 1.38618594053593 | erot = 2.2100370453855 | epot = -12.7295720942306 | etot = -9.13334910830914 +989000 ekin = 1.43703663167589 | erot = 2.11631776633422 | epot = -12.6867035061176 | etot = -9.13334910810747 +990000 ekin = 1.47960743029125 | erot = 2.02574976473974 | epot = -12.6387063029119 | etot = -9.13334910788087 +991000 ekin = 1.51373724656088 | erot = 1.94164272474697 | epot = -12.5887290789682 | etot = -9.13334910766035 +992000 ekin = 1.53983818596799 | erot = 1.86668512513884 | epot = -12.5398724185799 | etot = -9.1333491074731 +993000 ekin = 1.55873490678584 | erot = 1.80268982002861 | epot = -12.4947738341534 | etot = -9.13334910733891 +994000 ekin = 1.57151651520304 | erot = 1.7504391420354 | epot = -12.4553047645059 | etot = -9.13334910726744 +995000 ekin = 1.57942173441972 | erot = 1.70964079466343 | epot = -12.4224116363426 | etot = -9.13334910725948 +996000 ekin = 1.58376261679052 | erot = 1.67898574509867 | epot = -12.3960974691973 | etot = -9.13334910730809 +997000 ekin = 1.58587878582325 | erot = 1.65629050257133 | epot = -12.3755183957957 | etot = -9.13334910740111 +998000 ekin = 1.58710748478689 | erot = 1.63870906507373 | epot = -12.3591656573833 | etot = -9.13334910752265 +999000 ekin = 1.58875603207076 | erot = 1.62299637534363 | epot = -12.3451015150712 | etot = -9.13334910765678 +1000000 ekin = 1.59207001222984 | erot = 1.60581739803193 | epot = -12.3312365180429 | etot = -9.13334910778118 + 1000000 0.11793111 -1.2674127 0.034288999 -1.0739167 -1.3883882e-05 64000 +Loop time of 12.2549 on 4 procs for 1000000 steps with 10 atoms + +Performance: 70502.380 tau/day, 81599.976 timesteps/s +99.6% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 4.621 | 6.1682 | 7.6888 | 57.8 | 50.33 +Bond | 0.23368 | 0.29564 | 0.38327 | 11.2 | 2.41 +Neigh | 0.01308 | 0.013114 | 0.013149 | 0.0 | 0.11 +Comm | 1.714 | 1.885 | 2.078 | 9.8 | 15.38 +Output | 0.080169 | 0.082844 | 0.086603 | 0.8 | 0.68 +Modify | 0.53188 | 0.62981 | 0.73082 | 12.3 | 5.14 +Other | | 3.18 | | | 25.95 + +Nlocal: 2.50000 ave 4 max 1 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Nghost: 7.50000 ave 9 max 6 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Neighs: 16.7500 ave 26 max 8 min +Histogram: 2 0 0 0 0 0 0 0 0 2 + +Total # of neighbors = 67 +Ave neighs/atom = 6.7000000 +Ave special neighs/atom = 3.6000000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.1.* nocoeff +System init for write_data ... +Total wall time: 0:00:12 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.1 deleted file mode 100644 index 42c22b9f76..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.1 +++ /dev/null @@ -1,1175 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - - - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex1 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 10 atoms - reading velocities ... - 10 velocities - 10 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 8 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.002 seconds -set atom * mass 3.1575 - 10 settings made for mass - -group all type 1 4 -10 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna/fene -bond_coeff * 2.0 0.25 0.7525 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk -pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 - -# NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 1.9560004 - ghost atom cutoff = 2.5 - binsize = 0.97800022, bins = 41 41 41 - 5 neighbor lists, perpetual/occasional/extra = 5 0 0 - (1) pair oxdna/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -0 ekin = 0 | erot = 0 | epot = -14.6424332448164 | etot = -14.6424332448164 -Per MPI rank memory allocation (min/avg/max) = 7.883 | 7.883 | 7.883 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.4711818 0.0069384985 -1.4642433 2.5836586e-06 -1000 ekin = 0.00113448721737003 | erot = 0.00413455947734281 | epot = -14.6477022915193 | etot = -14.6424332448246 -2000 ekin = 0.00449927223902336 | erot = 0.0164446434455805 | epot = -14.6633771605337 | etot = -14.6424332448491 -3000 ekin = 0.00997964450841065 | erot = 0.0366523356056461 | epot = -14.6890652250033 | etot = -14.6424332448892 -4000 ekin = 0.0173888111295073 | erot = 0.0643039804300224 | epot = -14.7241260365031 | etot = -14.6424332449436 -5000 ekin = 0.0264744514136619 | erot = 0.0987844033142069 | epot = -14.7676920997383 | etot = -14.6424332450104 -6000 ekin = 0.0369277948556079 | erot = 0.139336571052566 | epot = -14.8186976109956 | etot = -14.6424332450875 -7000 ekin = 0.04839505571915 | erot = 0.185086295692081 | epot = -14.8759145965832 | etot = -14.642433245172 -8000 ekin = 0.0604909336920643 | erot = 0.235071307523532 | epot = -14.9379954864767 | etot = -14.6424332452611 -9000 ekin = 0.0728137406440561 | erot = 0.288273694501538 | epot = -15.003520680497 | etot = -14.6424332453514 -10000 ekin = 0.0849615563085878 | erot = 0.343654369293473 | epot = -15.0710491710418 | etot = -14.6424332454398 -11000 ekin = 0.0965486715045649 | erot = 0.400187932108223 | epot = -15.1391698491357 | etot = -14.6424332455229 -12000 ekin = 0.10722146628289 | erot = 0.456896095459165 | epot = -15.20655080734 | etot = -14.642433245598 -13000 ekin = 0.116672809719548 | erot = 0.512877765427643 | epot = -15.2719838208099 | etot = -14.6424332456627 -14000 ekin = 0.12465407373104 | erot = 0.567333962045116 | epot = -15.3344212814913 | etot = -14.6424332457151 -15000 ekin = 0.13098393968427 | erot = 0.619586028256667 | epot = -15.3930032136954 | etot = -14.6424332457544 -16000 ekin = 0.135553354544872 | erot = 0.669086028489761 | epot = -15.447072628815 | etot = -14.6424332457804 -17000 ekin = 0.138326263958247 | erot = 0.715418858085449 | epot = -15.4961783678372 | etot = -14.6424332457935 -18000 ekin = 0.139336096664052 | erot = 0.758296324627745 | epot = -15.5400656670872 | etot = -14.6424332457954 -19000 ekin = 0.138678360045177 | erot = 0.797544234275864 | epot = -15.5786558401088 | etot = -14.6424332457878 -20000 ekin = 0.136500074655373 | erot = 0.83308420441103 | epot = -15.6120175248394 | etot = -14.642433245773 -21000 ekin = 0.132987065285671 | erot = 0.864912408452581 | epot = -15.6403327194916 | etot = -14.6424332457533 -22000 ekin = 0.128350288213556 | erot = 0.893077649557994 | epot = -15.6638611835027 | etot = -14.6424332457311 -23000 ekin = 0.122812385135508 | erot = 0.917661024683965 | epot = -15.6829066555277 | etot = -14.6424332457083 -24000 ekin = 0.116595521408284 | erot = 0.938759014332098 | epot = -15.6977877814267 | etot = -14.6424332456863 -25000 ekin = 0.109911323474816 | erot = 0.956471207347239 | epot = -15.7088157764882 | etot = -14.6424332456662 -26000 ekin = 0.102953426207644 | erot = 0.970893163953205 | epot = -15.7162798358091 | etot = -14.6424332456483 -27000 ekin = 0.0958928250746637 | erot = 0.982114250194058 | epot = -15.7204403209013 | etot = -14.6424332456325 -28000 ekin = 0.0888759410950343 | erot = 0.990219731539854 | epot = -15.7215289182535 | etot = -14.6424332456186 -29000 ekin = 0.0820250748773376 | erot = 0.995296041202929 | epot = -15.719754361686 | etot = -14.6424332456058 -30000 ekin = 0.0754407616839748 | erot = 0.997437949320997 | epot = -15.7153119565981 | etot = -14.6424332455932 -31000 ekin = 0.0692054432610605 | erot = 0.996756332762286 | epot = -15.7083950216035 | etot = -14.6424332455802 -32000 ekin = 0.0633878377978472 | erot = 0.993385345349225 | epot = -15.699206428713 | etot = -14.6424332455659 -33000 ekin = 0.0580474070871663 | erot = 0.987487973309971 | epot = -15.6879686259471 | etot = -14.64243324555 -34000 ekin = 0.0532383791888181 | erot = 0.979259192921751 | epot = -15.6749308176426 | etot = -14.642433245532 -35000 ekin = 0.0490128758307997 | erot = 0.968926197407229 | epot = -15.66037231875 | etot = -14.642433245512 -36000 ekin = 0.0454228081410748 | erot = 0.956745409625975 | epot = -15.6446014632576 | etot = -14.6424332454906 -37000 ekin = 0.0425203357176439 | erot = 0.942996238000726 | epot = -15.6279498191869 | etot = -14.6424332454685 -38000 ekin = 0.0403568280949571 | erot = 0.927971766616668 | epot = -15.6107618401582 | etot = -14.6424332454465 -39000 ekin = 0.0389804214212713 | erot = 0.911966804110017 | epot = -15.5933804709572 | etot = -14.642433245426 -40000 ekin = 0.0384324238856427 | erot = 0.895263959562923 | epot = -15.5761296288567 | etot = -14.6424332454081 -41000 ekin = 0.0387429860408528 | erot = 0.878118672838279 | epot = -15.5592949042733 | etot = -14.6424332453942 -42000 ekin = 0.0399266053637511 | erot = 0.860744395135508 | epot = -15.5431042458848 | etot = -14.6424332453855 -43000 ekin = 0.0419781561011213 | erot = 0.843299365355989 | epot = -15.52771076684 | etot = -14.6424332453829 -44000 ekin = 0.0448701894086714 | erot = 0.82587660331255 | epot = -15.5131800381078 | etot = -14.6424332453866 -45000 ekin = 0.0485521857411517 | erot = 0.808498758184885 | epot = -15.4994841893228 | etot = -14.6424332453968 -46000 ekin = 0.0529522094031971 | erot = 0.791119212186815 | epot = -15.4865046670025 | etot = -14.6424332454125 -47000 ekin = 0.0579809824236746 | erot = 0.773630265882156 | epot = -15.4740444937379 | etot = -14.6424332454321 -48000 ekin = 0.0635377846493077 | erot = 0.755878310836116 | epot = -15.4618493409392 | etot = -14.6424332454537 -49000 ekin = 0.069516912445729 | erot = 0.737684732482671 | epot = -15.4496348904037 | etot = -14.6424332454753 -50000 ekin = 0.0758129058454751 | erot = 0.718870126218106 | epot = -15.4371162775587 | etot = -14.6424332454952 -51000 ekin = 0.0823226638641914 | erot = 0.699278599518873 | epot = -15.4240345088949 | etot = -14.6424332455118 -52000 ekin = 0.0889431481334987 | erot = 0.678798807098492 | epot = -15.4101752007567 | etot = -14.6424332455248 -53000 ekin = 0.0955646689255783 | erot = 0.657379086770007 | epot = -15.3953770012299 | etot = -14.6424332455343 -54000 ekin = 0.102061477509349 | erot = 0.635035489168657 | epot = -15.3795302122191 | etot = -14.6424332455411 -55000 ekin = 0.108282960174 | erot = 0.611853171347175 | epot = -15.362569377067 | etot = -14.6424332455459 -56000 ekin = 0.114049426281782 | erot = 0.587982945924791 | epot = -15.344465617755 | etot = -14.6424332455484 -57000 ekin = 0.119155806186855 | erot = 0.56363525592402 | epot = -15.3252243076595 | etot = -14.6424332455486 -58000 ekin = 0.123384552305435 | erot = 0.539073355224031 | epot = -15.3048911530747 | etot = -14.6424332455452 -59000 ekin = 0.126526300954941 | erot = 0.514606324860987 | epot = -15.2835658713528 | etot = -14.6424332455369 -60000 ekin = 0.128404399836503 | erot = 0.490581338842511 | epot = -15.2614189842015 | etot = -14.6424332455224 -61000 ekin = 0.128898142362337 | erot = 0.467373892403714 | epot = -15.2387052802675 | etot = -14.6424332455015 -62000 ekin = 0.127959880290302 | erot = 0.445374820089113 | epot = -15.2157679458544 | etot = -14.6424332454749 -63000 ekin = 0.125622870624954 | erot = 0.424973765390048 | epot = -15.1930298814588 | etot = -14.6424332454438 -64000 ekin = 0.121999044843202 | erot = 0.406539918574853 | epot = -15.1709722088285 | etot = -14.6424332454104 -65000 ekin = 0.117268056619303 | erot = 0.390401831022836 | epot = -15.1501031330193 | etot = -14.6424332453771 -66000 ekin = 0.111660385257243 | erot = 0.376828594081003 | epot = -15.1309222246847 | etot = -14.6424332453465 -67000 ekin = 0.105437746905135 | erot = 0.366014539812687 | epot = -15.1138855320383 | etot = -14.6424332453205 -68000 ekin = 0.0988737375607857 | erot = 0.358069014156216 | epot = -15.0993759970176 | etot = -14.6424332453006 -69000 ekin = 0.0922368286502244 | erot = 0.353011948772493 | epot = -15.0876820227105 | etot = -14.6424332452877 -70000 ekin = 0.0857769015274457 | erot = 0.350775174164874 | epot = -15.0789853209744 | etot = -14.6424332452821 -71000 ekin = 0.0797156921642124 | erot = 0.35120884424483 | epot = -15.0733577816925 | etot = -14.6424332452834 -72000 ekin = 0.0742409440406404 | erot = 0.354092037745959 | epot = -15.0707662270775 | etot = -14.6424332452909 -73000 ekin = 0.069503749870144 | erot = 0.359146526959529 | epot = -15.0710835221333 | etot = -14.6424332453037 -74000 ekin = 0.0656184497423043 | erot = 0.36605276987658 | epot = -15.0741044649392 | etot = -14.6424332453203 -75000 ekin = 0.0626644690389273 | erot = 0.37446729003154 | epot = -15.07956500441 | etot = -14.6424332453395 -76000 ekin = 0.0606895535086071 | erot = 0.384040683400773 | epot = -15.0871634822692 | etot = -14.6424332453599 -77000 ekin = 0.0597139401235039 | erot = 0.394435495890113 | epot = -15.0965826813933 | etot = -14.6424332453797 -78000 ekin = 0.0597350629869167 | erot = 0.405343151479122 | epot = -15.1075114598641 | etot = -14.6424332453981 -79000 ekin = 0.0607324264355599 | erot = 0.416499017639979 | epot = -15.1196646894891 | etot = -14.6424332454136 -80000 ekin = 0.0626722904949853 | erot = 0.427694630236173 | epot = -15.1328001661567 | etot = -14.6424332454256 -81000 ekin = 0.0655118235328824 | erot = 0.438786127846776 | epot = -15.1467311968131 | etot = -14.6424332454334 -82000 ekin = 0.0692024020835959 | erot = 0.449698113828529 | epot = -15.1613337613492 | etot = -14.6424332454371 -83000 ekin = 0.0736917936906687 | erot = 0.460422490739007 | epot = -15.1765475298665 | etot = -14.6424332454368 -84000 ekin = 0.0789250526546792 | erot = 0.471012272293637 | epot = -15.1923705703818 | etot = -14.6424332454335 -85000 ekin = 0.0848440878750104 | erot = 0.481570908649218 | epot = -15.2088482419521 | etot = -14.6424332454279 -86000 ekin = 0.0913860133254689 | erot = 0.492238169205271 | epot = -15.226057427952 | etot = -14.6424332454213 -87000 ekin = 0.0984805441200107 | erot = 0.503174014616583 | epot = -15.2440878041518 | etot = -14.6424332454152 -88000 ekin = 0.106046830304303 | erot = 0.514542076496116 | epot = -15.2630221522109 | etot = -14.6424332454105 -89000 ekin = 0.113990204127989 | erot = 0.526494309539271 | epot = -15.2829177590758 | etot = -14.6424332454086 -90000 ekin = 0.122199339151899 | erot = 0.539158097285764 | epot = -15.3037906818476 | etot = -14.64243324541 -91000 ekin = 0.130544275971407 | erot = 0.552626637865788 | epot = -15.3256041592523 | etot = -14.6424332454151 -92000 ekin = 0.138875666148818 | erot = 0.566952900962214 | epot = -15.3482618125354 | etot = -14.6424332454244 -93000 ekin = 0.147025440614644 | erot = 0.58214693373749 | epot = -15.3716056197896 | etot = -14.6424332454375 -94000 ekin = 0.154808946847823 | erot = 0.598175891801268 | epot = -15.3954180841032 | etot = -14.6424332454541 -95000 ekin = 0.162028449602152 | erot = 0.6149659424539 | epot = -15.4194276375298 | etot = -14.6424332454737 -96000 ekin = 0.168477779667818 | erot = 0.632405154082103 | epot = -15.4433161792458 | etot = -14.6424332454959 -97000 ekin = 0.173947863026719 | erot = 0.6503466316284 | epot = -15.4667277401751 | etot = -14.64243324552 -98000 ekin = 0.178232875004241 | erot = 0.668611435746027 | epot = -15.4892775562957 | etot = -14.6424332455454 -99000 ekin = 0.181136831926352 | erot = 0.686991165056287 | epot = -15.5105612425543 | etot = -14.6424332455716 -100000 ekin = 0.182480533643596 | erot = 0.705250413407857 | epot = -15.5301641926494 | etot = -14.642433245598 -101000 ekin = 0.182108871451933 | erot = 0.723129571003271 | epot = -15.5476716880789 | etot = -14.6424332456237 -102000 ekin = 0.179898581170267 | erot = 0.740348571090405 | epot = -15.5626803979087 | etot = -14.642433245648 -103000 ekin = 0.175766517608083 | erot = 0.756612167825933 | epot = -15.5748119311038 | etot = -14.6424332456698 -104000 ekin = 0.169678431535444 | erot = 0.771617166851702 | epot = -15.5837288440751 | etot = -14.6424332456879 -105000 ekin = 0.161658036036865 | erot = 0.7850617429621 | epot = -15.5891530246999 | etot = -14.642433245701 -106000 ekin = 0.151795867650478 | erot = 0.796656613424693 | epot = -15.5908857267828 | etot = -14.6424332457076 -107000 ekin = 0.140257112952728 | erot = 0.806137449197324 | epot = -15.5888278078567 | etot = -14.6424332457066 -108000 ekin = 0.127287240201243 | erot = 0.813277564481201 | epot = -15.5829980503796 | etot = -14.6424332456971 -109000 ekin = 0.113214025490919 | erot = 0.817899691734526 | epot = -15.5735469629039 | etot = -14.6424332456785 -110000 ekin = 0.0984444823805245 | erot = 0.819885578054015 | epot = -15.5607633060855 | etot = -14.642433245651 -111000 ekin = 0.0834553769364607 | erot = 0.819182262545871 | epot = -15.5450708850979 | etot = -14.6424332456156 -112000 ekin = 0.0687764915871071 | erot = 0.815804215094497 | epot = -15.5270139522555 | etot = -14.6424332455739 -113000 ekin = 0.0549665904028951 | erot = 0.809830999844525 | epot = -15.5072308357758 | etot = -14.6424332455284 -114000 ekin = 0.0425830583120669 | erot = 0.801400700351035 | epot = -15.4864170041451 | etot = -14.642433245482 -115000 ekin = 0.032147280213268 | erot = 0.790699910049129 | epot = -15.4652804357002 | etot = -14.6424332454378 -116000 ekin = 0.0241087780345819 | erot = 0.777951546674794 | epot = -15.4444935701084 | etot = -14.642433245399 -117000 ekin = 0.0188117102728978 | erot = 0.763402004774129 | epot = -15.4246469604153 | etot = -14.6424332453683 -118000 ekin = 0.0164673894159088 | erot = 0.747309167857022 | epot = -15.4062098026202 | etot = -14.6424332453473 -119000 ekin = 0.0171359296532941 | erot = 0.72993256457545 | epot = -15.3895017395656 | etot = -14.6424332453369 -120000 ekin = 0.0207190822430537 | erot = 0.711526526250299 | epot = -15.3746788538304 | etot = -14.642433245337 -121000 ekin = 0.0269649552319852 | erot = 0.692336677373468 | epot = -15.3617348779521 | etot = -14.6424332453466 -122000 ekin = 0.035483922029777 | erot = 0.67259957021413 | epot = -15.3505167376078 | etot = -14.6424332453639 -123000 ekin = 0.0457738626451396 | erot = 0.652544850165462 | epot = -15.3407519581969 | etot = -14.6424332453863 -124000 ekin = 0.0572521324296494 | erot = 0.632399068066162 | epot = -15.3320844459073 | etot = -14.6424332454115 -125000 ekin = 0.069291373600259 | erot = 0.61239015618606 | epot = -15.324114775223 | etot = -14.6424332454366 -126000 ekin = 0.0812564128172871 | erot = 0.592751635109631 | epot = -15.3164412933861 | etot = -14.6424332454592 -127000 ekin = 0.0925398817823739 | erot = 0.573725774407947 | epot = -15.3086989016674 | etot = -14.642433245477 -128000 ekin = 0.102594692018531 | erot = 0.555565138943754 | epot = -15.3005930764508 | etot = -14.6424332454885 -129000 ekin = 0.110961953873463 | erot = 0.538532171478064 | epot = -15.2919273708439 | etot = -14.6424332454924 -130000 ekin = 0.117293279472126 | erot = 0.522896664453456 | epot = -15.2826231894135 | etot = -14.6424332454879 -131000 ekin = 0.121366644774015 | erot = 0.508931150171097 | epot = -15.2727310404202 | etot = -14.6424332454751 -132000 ekin = 0.123095155538849 | erot = 0.496904390905147 | epot = -15.2624327918983 | etot = -14.6424332454543 -133000 ekin = 0.122528239670492 | erot = 0.48707328299654 | epot = -15.2520347680937 | etot = -14.6424332454267 -134000 ekin = 0.119845042600695 | erot = 0.479673601169304 | epot = -15.2419518891638 | etot = -14.6424332453938 -135000 ekin = 0.115340171966309 | erot = 0.474910093714655 | epot = -15.2326835110385 | etot = -14.6424332453575 -136000 ekin = 0.10940241928465 | erot = 0.472946484072585 | epot = -15.2247821486776 | etot = -14.6424332453204 -137000 ekin = 0.102487634021819 | erot = 0.473895929917062 | epot = -15.2188168092236 | etot = -14.6424332452848 -138000 ekin = 0.0950874634047241 | erot = 0.477812435582801 | epot = -15.2153331442408 | etot = -14.6424332452533 -139000 ekin = 0.0876961121512828 | erot = 0.484683617748065 | epot = -15.2148129751279 | etot = -14.6424332452285 -140000 ekin = 0.0807775418431644 | erot = 0.494425108537532 | epot = -15.2176358955931 | etot = -14.6424332452124 -141000 ekin = 0.0747355681577843 | erot = 0.506876770807999 | epot = -15.2240455841725 | etot = -14.6424332452067 -142000 ekin = 0.0698891098450152 | erot = 0.521800821238859 | epot = -15.2341231762965 | etot = -14.6424332452126 -143000 ekin = 0.0664544171866109 | erot = 0.538881922424141 | epot = -15.2477695848412 | etot = -14.6424332452305 -144000 ekin = 0.0645355104692138 | erot = 0.557729316020268 | epot = -15.2646980717496 | etot = -14.6424332452601 -145000 ekin = 0.0641233595162975 | erot = 0.577881111412676 | epot = -15.2844377162296 | etot = -14.6424332453007 -146000 ekin = 0.065103607751526 | erot = 0.598810893851671 | epot = -15.3063477469538 | etot = -14.6424332453506 -147000 ekin = 0.067271957897368 | erot = 0.619936843681793 | epot = -15.3296420469867 | etot = -14.6424332454076 -148000 ekin = 0.070355749269213 | erot = 0.640633538190949 | epot = -15.3534225329294 | etot = -14.6424332454693 -149000 ekin = 0.0740398128642513 | erot = 0.660246523237734 | epot = -15.3767195816347 | etot = -14.6424332455327 -150000 ekin = 0.0779944201058762 | erot = 0.678109590376207 | epot = -15.398537256077 | etot = -14.6424332455949 -151000 ekin = 0.0819030604172403 | erot = 0.693564488648145 | epot = -15.4179007947184 | etot = -14.642433245653 -152000 ekin = 0.0854878938552698 | erot = 0.705982563003937 | epot = -15.4339037025634 | etot = -14.6424332457042 -153000 ekin = 0.0885310147328597 | erot = 0.714787575382121 | epot = -15.4457518358609 | etot = -14.6424332457459 -154000 ekin = 0.090890101288761 | erot = 0.719478762727545 | epot = -15.4528021097924 | etot = -14.6424332457761 -155000 ekin = 0.0925075703714592 | erot = 0.719653046097743 | epot = -15.4545938622626 | etot = -14.6424332457934 -156000 ekin = 0.0934129479728876 | erot = 0.715025243754007 | epot = -15.4508714375239 | etot = -14.642433245797 -157000 ekin = 0.093718743577964 | erot = 0.705445163946351 | epot = -15.4415971533109 | etot = -14.6424332457866 -158000 ekin = 0.0936106185393401 | erot = 0.690910554325733 | epot = -15.4269544186277 | etot = -14.6424332457627 -159000 ekin = 0.0933330174010976 | erot = 0.67157505165981 | epot = -15.407341314787 | etot = -14.6424332457261 -160000 ekin = 0.0931716565242302 | erot = 0.647750492120669 | epot = -15.3833553943233 | etot = -14.6424332456784 -161000 ekin = 0.093434329623141 | erot = 0.619903194016607 | epot = -15.3557707692612 | etot = -14.6424332456214 -162000 ekin = 0.0944314104804151 | erot = 0.588644098979629 | epot = -15.3255087550172 | etot = -14.6424332455572 -163000 ekin = 0.0964572425739466 | erot = 0.554712943453935 | epot = -15.293603431516 | etot = -14.6424332454881 -164000 ekin = 0.0997733472806099 | erot = 0.51895691856195 | epot = -15.2611635112594 | etot = -14.6424332454168 -165000 ekin = 0.104594102019908 | erot = 0.482304549422441 | epot = -15.2293318967882 | etot = -14.6424332453459 -166000 ekin = 0.111075276516248 | erot = 0.445735768512404 | epot = -15.1992442903064 | etot = -14.6424332452778 -167000 ekin = 0.119305597513578 | erot = 0.410249354728338 | epot = -15.1719881974571 | etot = -14.6424332452152 -168000 ekin = 0.129301354725085 | erot = 0.376829046178766 | epot = -15.1485636460642 | etot = -14.6424332451603 -169000 ekin = 0.141003965789751 | erot = 0.346409702527123 | epot = -15.129846913432 | etot = -14.6424332451151 -170000 ekin = 0.154280377439944 | erot = 0.319844892417983 | epot = -15.1165585149393 | etot = -14.6424332450814 -171000 ekin = 0.168926178621547 | erot = 0.29787722160694 | epot = -15.109236645289 | etot = -14.6424332450605 -172000 ekin = 0.184671319364516 | erot = 0.281112611137265 | epot = -15.1082171755549 | etot = -14.6424332450532 -173000 ekin = 0.201188345437126 | erot = 0.269999595570288 | epot = -15.1136211860671 | etot = -14.6424332450597 -174000 ekin = 0.218103052207045 | erot = 0.264814547402998 | epot = -15.1253508446899 | etot = -14.6424332450799 -175000 ekin = 0.235007413035636 | erot = 0.265653545950127 | epot = -15.1430942040986 | etot = -14.6424332451128 -176000 ekin = 0.25147453426793 | erot = 0.272431389432275 | epot = -15.1663391688573 | etot = -14.642433245157 -177000 ekin = 0.267075225143454 | erot = 0.284887984978814 | epot = -15.1943964553329 | etot = -14.6424332452106 -178000 ekin = 0.281395553895307 | erot = 0.302602030915426 | epot = -15.2264308300819 | etot = -14.6424332452711 -179000 ekin = 0.294054514411889 | erot = 0.325011526057921 | epot = -15.2614992858055 | etot = -14.6424332453357 -180000 ekin = 0.304720692896967 | erot = 0.351440214935869 | epot = -15.2985941532343 | etot = -14.6424332454015 -181000 ekin = 0.313126658918453 | erot = 0.381128639602711 | epot = -15.3366885439866 | etot = -14.6424332454655 -182000 ekin = 0.31907977582365 | erot = 0.413268071114184 | epot = -15.374781092463 | etot = -14.6424332455251 -183000 ekin = 0.322468290005793 | erot = 0.447035301736757 | epot = -15.4119368373208 | etot = -14.6424332455782 -184000 ekin = 0.323261947554702 | erot = 0.48162615508047 | epot = -15.4473213482582 | etot = -14.6424332456231 -185000 ekin = 0.321506983530858 | erot = 0.516285658867847 | epot = -15.4802258880574 | etot = -14.6424332456587 -186000 ekin = 0.317316057633713 | erot = 0.550333132629142 | epot = -15.5100824359478 | etot = -14.642433245685 -187000 ekin = 0.310854440590115 | erot = 0.583180936761995 | epot = -15.5364686230541 | etot = -14.642433245702 -188000 ekin = 0.302324329763978 | erot = 0.614346238385449 | epot = -15.55910381386 | etot = -14.6424332457106 -189000 ekin = 0.291949445197146 | erot = 0.643455779012842 | epot = -15.5778384699217 | etot = -14.6424332457117 -190000 ekin = 0.279961942768283 | erot = 0.670244185704452 | epot = -15.5926393741794 | etot = -14.6424332457066 -191000 ekin = 0.266593185653692 | erot = 0.694546781233374 | epot = -15.6035732125832 | etot = -14.6424332456962 -192000 ekin = 0.25206914162339 | erot = 0.716288088787003 | epot = -15.6107904760917 | etot = -14.6424332456813 -193000 ekin = 0.236610293254171 | erot = 0.73546730224254 | epot = -15.6145108411597 | etot = -14.642433245663 -194000 ekin = 0.220435149405134 | erot = 0.752141943027135 | epot = -15.615010338074 | etot = -14.6424332456418 -195000 ekin = 0.203765880093363 | erot = 0.766410799029957 | epot = -15.6126099247417 | etot = -14.6424332456184 -196000 ekin = 0.186834339037387 | erot = 0.778397083250795 | epot = -15.6076646678817 | etot = -14.6424332455935 -197000 ekin = 0.169886782294202 | erot = 0.788232586070606 | epot = -15.6005526139326 | etot = -14.6424332455678 -198000 ekin = 0.153185871078003 | erot = 0.796043434538988 | epot = -15.5916625511591 | etot = -14.6424332455421 -199000 ekin = 0.137008972987419 | erot = 0.801937915798975 | epot = -15.5813801343039 | etot = -14.6424332455175 -200000 ekin = 0.121642272364818 | erot = 0.80599667326165 | epot = -15.5700721911217 | etot = -14.6424332454952 -201000 ekin = 0.107370722656495 | erot = 0.808265456806725 | epot = -15.5580694249396 | etot = -14.6424332454764 -202000 ekin = 0.0944644042392259 | erot = 0.808750524309999 | epot = -15.5456481740113 | etot = -14.642433245462 -203000 ekin = 0.0831623790894052 | erot = 0.807416772443545 | epot = -15.5330123969864 | etot = -14.6424332454535 -204000 ekin = 0.0736556272335603 | erot = 0.804188725419786 | epot = -15.5202775981049 | etot = -14.6424332454515 -205000 ekin = 0.0660710401675988 | erot = 0.798954607355857 | epot = -15.50745889298 | etot = -14.6424332454565 -206000 ekin = 0.0604586317681712 | erot = 0.791573809424193 | epot = -15.4944656866606 | etot = -14.6424332454683 -207000 ekin = 0.0567840026883055 | erot = 0.781888054798429 | epot = -15.4811053029727 | etot = -14.642433245486 -208000 ekin = 0.0549275971601587 | erot = 0.769736381379669 | epot = -15.4670972240478 | etot = -14.6424332455079 -209000 ekin = 0.0546914447538068 | erot = 0.754973659533921 | epot = -15.4520983498196 | etot = -14.6424332455319 -210000 ekin = 0.0558130126775254 | erot = 0.737491764374774 | epot = -15.4357380226072 | etot = -14.6424332455549 -211000 ekin = 0.0579847210238465 | erot = 0.717241838880044 | epot = -15.417659805478 | etot = -14.6424332455741 -212000 ekin = 0.0608768356205403 | erot = 0.694255492639204 | epot = -15.3975655738466 | etot = -14.6424332455869 -213000 ekin = 0.0641610427083153 | erot = 0.66866247616333 | epot = -15.3752567644623 | etot = -14.6424332455907 -214000 ekin = 0.0675321043587494 | erot = 0.640702495517984 | epot = -15.3506678454611 | etot = -14.6424332455844 -215000 ekin = 0.070725533636796 | erot = 0.610729417267914 | epot = -15.3238881964721 | etot = -14.6424332455674 -216000 ekin = 0.0735300437834149 | erot = 0.579207054837064 | epot = -15.2951703441606 | etot = -14.6424332455401 -217000 ekin = 0.0757943994895872 | erot = 0.54669681320896 | epot = -15.2649244582023 | etot = -14.6424332455037 -218000 ekin = 0.0774290394184588 | erot = 0.513838451215604 | epot = -15.2337007360941 | etot = -14.6424332454601 -219000 ekin = 0.0784033323162054 | erot = 0.481325894960068 | epot = -15.2021624726878 | etot = -14.6424332454115 -220000 ekin = 0.0787395495628487 | erot = 0.449880299616969 | epot = -15.17105309454 | etot = -14.6424332453602 -221000 ekin = 0.0785046319692735 | erot = 0.420222425154563 | epot = -15.1411603024324 | etot = -14.6424332453086 -222000 ekin = 0.0778006814288913 | erot = 0.393045972165166 | epot = -15.113279898853 | etot = -14.642433245259 -223000 ekin = 0.0767549035403158 | erot = 0.368992968905282 | epot = -15.0881811176588 | etot = -14.6424332452132 -224000 ekin = 0.0755095293719617 | erot = 0.348631757026545 | epot = -15.0665745315715 | etot = -14.642433245173 -225000 ekin = 0.0742120885681049 | erot = 0.332437700423087 | epot = -15.0490830341314 | etot = -14.6424332451402 -226000 ekin = 0.0730063028703793 | erot = 0.320776497496347 | epot = -15.0362160454828 | etot = -14.642433245116 -227000 ekin = 0.072023814089001 | erot = 0.313889923623746 | epot = -15.0283469828147 | etot = -14.6424332451019 -228000 ekin = 0.0713769419944288 | erot = 0.311883945242982 | epot = -15.0256941323359 | etot = -14.6424332450985 -229000 ekin = 0.0711526728859999 | erot = 0.314719386436034 | epot = -15.0283053044286 | etot = -14.6424332451066 -230000 ekin = 0.0714080974064536 | erot = 0.322205638587354 | epot = -15.0360469811206 | etot = -14.6424332451268 -231000 ekin = 0.0721675361185164 | erot = 0.333998222200299 | epot = -15.0485990034776 | etot = -14.6424332451587 -232000 ekin = 0.0734216022897964 | erot = 0.349601270465511 | epot = -15.0654561179572 | etot = -14.6424332452019 -233000 ekin = 0.0751284397495126 | erot = 0.368376135876537 | epot = -15.0859378208814 | etot = -14.6424332452553 -234000 ekin = 0.0772173235430297 | erot = 0.389557254435315 | epot = -15.1092078232955 | etot = -14.6424332453172 -235000 ekin = 0.0795947059788122 | erot = 0.412276079792818 | epot = -15.134304031156 | etot = -14.6424332453844 -236000 ekin = 0.0821526186131207 | erot = 0.435593295650776 | epot = -15.1601791597182 | etot = -14.6424332454543 -237000 ekin = 0.0847791014223481 | erot = 0.458538653868279 | epot = -15.1857510008135 | etot = -14.6424332455229 -238000 ekin = 0.0873700423841474 | erot = 0.480156759890556 | epot = -15.2099600478608 | etot = -14.6424332455861 -239000 ekin = 0.0898415153120355 | erot = 0.499556095556555 | epot = -15.2318308565087 | etot = -14.6424332456401 -240000 ekin = 0.0921414623518661 | erot = 0.515957735404873 | epot = -15.250532443438 | etot = -14.6424332456813 -241000 ekin = 0.094259449012787 | erot = 0.528739776890155 | epot = -15.2654324716098 | etot = -14.6424332457068 -242000 ekin = 0.096233280586619 | erot = 0.537473606139462 | epot = -15.276140132441 | etot = -14.6424332457149 -243000 ekin = 0.0981515319325847 | erot = 0.5419487859829 | epot = -15.2825335636204 | etot = -14.642433245705 -244000 ekin = 0.100151482350113 | erot = 0.542184479376325 | epot = -15.2847692074041 | etot = -14.6424332456777 -245000 ekin = 0.102412491094949 | erot = 0.538426702319087 | epot = -15.283272439049 | etot = -14.6424332456349 -246000 ekin = 0.10514539554429 | erot = 0.531132085867033 | epot = -15.2787107269906 | etot = -14.6424332455793 -247000 ekin = 0.108578961411818 | erot = 0.520939994206916 | epot = -15.271952201133 | etot = -14.6424332455143 -248000 ekin = 0.112944688754722 | erot = 0.50863565229477 | epot = -15.2640135864931 | etot = -14.6424332454436 -249000 ekin = 0.118461348905716 | erot = 0.495107336752456 | epot = -15.2560019310293 | etot = -14.6424332453711 -250000 ekin = 0.12532051071417 | erot = 0.481300713195499 | epot = -15.2490544692103 | etot = -14.6424332453007 -251000 ekin = 0.133674056956426 | erot = 0.468173145421963 | epot = -15.2442804476139 | etot = -14.6424332452355 -252000 ekin = 0.143624355874462 | erot = 0.456650355971893 | epot = -15.2427079570251 | etot = -14.6424332451787 -253000 ekin = 0.155217400156355 | erot = 0.447587277163441 | epot = -15.2452379224524 | etot = -14.6424332451326 -254000 ekin = 0.168438906846642 | erot = 0.441734376015304 | epot = -15.2526065279605 | etot = -14.6424332450986 -255000 ekin = 0.183213121646742 | erot = 0.439710227351497 | epot = -15.2653565940763 | etot = -14.642433245078 -256000 ekin = 0.199403908834931 | erot = 0.441980689731482 | epot = -15.283817843638 | etot = -14.6424332450716 -257000 ekin = 0.216817638464837 | erot = 0.448844730303129 | epot = -15.3080956138476 | etot = -14.6424332450796 -258000 ekin = 0.235207399038858 | erot = 0.460426746273211 | epot = -15.3380673904137 | etot = -14.6424332451016 -259000 ekin = 0.254278151369372 | erot = 0.476675120646291 | epot = -15.3733865171527 | etot = -14.642433245137 -260000 ekin = 0.273692576680298 | erot = 0.497366691704061 | epot = -15.4134925135692 | etot = -14.6424332451849 -261000 ekin = 0.293077534076616 | erot = 0.522116767902342 | epot = -15.4576275472227 | etot = -14.6424332452438 -262000 ekin = 0.312031202024067 | erot = 0.550394247117877 | epot = -15.5048586944538 | etot = -14.6424332453119 -263000 ekin = 0.330131107619695 | erot = 0.581541281995867 | epot = -15.5541056350029 | etot = -14.6424332453873 -264000 ekin = 0.346943319973868 | erot = 0.614796773442828 | epot = -15.6041733388843 | etot = -14.6424332454676 -265000 ekin = 0.362033078258367 | erot = 0.649322794992396 | epot = -15.6537891188012 | etot = -14.6424332455505 -266000 ekin = 0.374977027500513 | erot = 0.684232889055324 | epot = -15.7016431621889 | etot = -14.6424332456331 -267000 ekin = 0.385377045185317 | erot = 0.718621072058556 | epot = -15.7464313629566 | etot = -14.6424332457127 -268000 ekin = 0.392875374680224 | erot = 0.75159036946148 | epot = -15.7868989899282 | etot = -14.6424332457865 -269000 ekin = 0.397170471139203 | erot = 0.782279784271994 | epot = -15.8218835012632 | etot = -14.642433245852 -270000 ekin = 0.39803266202809 | erot = 0.80988877167351 | epot = -15.8503546796086 | etot = -14.642433245907 -271000 ekin = 0.395318487598737 | erot = 0.833698516709663 | epot = -15.8714502502579 | etot = -14.6424332459495 -272000 ekin = 0.388982474352171 | erot = 0.853089551908401 | epot = -15.8845052722386 | etot = -14.6424332459781 -273000 ekin = 0.379085147931464 | erot = 0.867555470405014 | epot = -15.8890738643282 | etot = -14.6424332459917 -274000 ekin = 0.365796322193278 | erot = 0.876712662629274 | epot = -15.8849422308128 | etot = -14.6424332459903 -275000 ekin = 0.349393082921568 | erot = 0.880306121913762 | epot = -15.8721324508092 | etot = -14.6424332459739 -276000 ekin = 0.330252358905702 | erot = 0.878211432148943 | epot = -15.8508970369982 | etot = -14.6424332459435 -277000 ekin = 0.308838461220239 | erot = 0.870433084876928 | epot = -15.8217047919976 | etot = -14.6424332459005 -278000 ekin = 0.285686394604133 | erot = 0.857099294885134 | epot = -15.7852189353358 | etot = -14.6424332458465 -279000 ekin = 0.261382042766456 | erot = 0.838453513181018 | epot = -15.7422688017312 | etot = -14.6424332457837 -280000 ekin = 0.236540473325989 | erot = 0.814842890587939 | epot = -15.6938166096284 | etot = -14.6424332457145 -281000 ekin = 0.21178360260805 | erot = 0.78670403285838 | epot = -15.6409208811075 | etot = -14.6424332456411 -282000 ekin = 0.187718337271923 | erot = 0.754546508157667 | epot = -15.5846980909958 | etot = -14.6424332455662 -283000 ekin = 0.164916115090819 | erot = 0.71893470884518 | epot = -15.5262840694281 | etot = -14.6424332454921 -284000 ekin = 0.143894549221734 | erot = 0.680468811939341 | epot = -15.4667966065823 | etot = -14.6424332454212 -285000 ekin = 0.125101678372309 | erot = 0.639765701847639 | epot = -15.4073006255757 | etot = -14.6424332453557 -286000 ekin = 0.108903164107404 | erot = 0.597440790010452 | epot = -15.3487771994147 | etot = -14.6424332452969 -287000 ekin = 0.0955726645551871 | erot = 0.554091668604971 | epot = -15.2920975784065 | etot = -14.6424332452464 -288000 ekin = 0.0852855448006991 | erot = 0.510284456822087 | epot = -15.2380032468277 | etot = -14.6424332452049 -289000 ekin = 0.0781160413102893 | erot = 0.466543535623136 | epot = -15.1870928221065 | etot = -14.6424332451731 -290000 ekin = 0.0740379578618401 | erot = 0.42334512758908 | epot = -15.1398163306018 | etot = -14.6424332451509 -291000 ekin = 0.07292891006337 | erot = 0.381114879437427 | epot = -15.0964770346384 | etot = -14.6424332451376 -292000 ekin = 0.074578035792751 | erot = 0.340229271737877 | epot = -15.0572405526631 | etot = -14.6424332451324 -293000 ekin = 0.0786969407539187 | erot = 0.301020346548478 | epot = -15.0221505324364 | etot = -14.642433245134 -294000 ekin = 0.0849334564702348 | erot = 0.263782947588673 | epot = -14.9911496491996 | etot = -14.6424332451407 -295000 ekin = 0.0928875723607527 | erot = 0.228783448806945 | epot = -14.9641042663184 | etot = -14.6424332451507 -296000 ekin = 0.10212869750719 | erot = 0.19626884038739 | epot = -14.9408307830571 | etot = -14.6424332451625 -297000 ekin = 0.112213252496714 | erot = 0.166475068218874 | epot = -14.92112156589 | etot = -14.6424332451744 -298000 ekin = 0.122701527066799 | erot = 0.139633685446924 | epot = -14.9047684576991 | etot = -14.6424332451854 -299000 ekin = 0.133172792910571 | erot = 0.115976150690183 | epot = -14.8915821887951 | etot = -14.6424332451943 -300000 ekin = 0.14323783970709 | erot = 0.0957354521215423 | epot = -14.8814065370293 | etot = -14.6424332452007 -301000 ekin = 0.152548387988443 | erot = 0.0791450908732833 | epot = -14.8741267240661 | etot = -14.6424332452044 -302000 ekin = 0.16080318429946 | erot = 0.0664357608562006 | epot = -14.8696721903613 | etot = -14.6424332452056 -303000 ekin = 0.167750948486619 | erot = 0.0578302677257533 | epot = -14.868014461417 | etot = -14.6424332452046 -304000 ekin = 0.173190665587062 | erot = 0.0535373136372916 | epot = -14.8691612244265 | etot = -14.6424332452021 -305000 ekin = 0.176969952948875 | erot = 0.053744740290904 | epot = -14.8731479384385 | etot = -14.6424332451987 -306000 ekin = 0.17898236329054 | erot = 0.0586126977876512 | epot = -14.8800283062731 | etot = -14.6424332451949 -307000 ekin = 0.179164502944013 | erot = 0.0682670321056721 | epot = -14.8898647802412 | etot = -14.6424332451915 -308000 ekin = 0.177493763288032 | erot = 0.0827930029186384 | epot = -14.9027200113955 | etot = -14.6424332451889 -309000 ekin = 0.173987301150973 | erot = 0.102229291870626 | epot = -14.9186498382088 | etot = -14.6424332451872 -310000 ekin = 0.168702678647183 | erot = 0.126562162216031 | epot = -14.9376980860501 | etot = -14.6424332451869 -311000 ekin = 0.161740297008921 | erot = 0.155719593406505 | epot = -14.9598931356033 | etot = -14.6424332451879 -312000 ekin = 0.15324744012493 | erot = 0.189565237977707 | epot = -14.985245923293 | etot = -14.6424332451904 -313000 ekin = 0.143423389996968 | erot = 0.227892126760359 | epot = -15.0137487619517 | etot = -14.6424332451944 -314000 ekin = 0.132524706018471 | erot = 0.270416174780379 | epot = -15.0453741259986 | etot = -14.6424332451997 -315000 ekin = 0.120869409552547 | erot = 0.316769708289002 | epot = -15.0800723630487 | etot = -14.6424332452072 -316000 ekin = 0.108838546104732 | erot = 0.3664954379943 | epot = -15.117767229316 | etot = -14.642433245217 -317000 ekin = 0.0968734934277273 | erot = 0.419041536809115 | epot = -15.1583482754667 | etot = -14.6424332452299 -318000 ekin = 0.0854675378549808 | erot = 0.473758725764069 | epot = -15.2016595088657 | etot = -14.6424332452466 -319000 ekin = 0.0751507271451904 | erot = 0.529900497448209 | epot = -15.2474844698619 | etot = -14.6424332452685 -320000 ekin = 0.0664678443364339 | erot = 0.586627760739843 | epot = -15.2955288503729 | etot = -14.6424332452966 -321000 ekin = 0.0599504590563242 | erot = 0.643019202691524 | epot = -15.3454029070797 | etot = -14.6424332453318 -322000 ekin = 0.0560852142799999 | erot = 0.698088453267007 | epot = -15.3966069129217 | etot = -14.6424332453747 -323000 ekin = 0.0552815181248962 | erot = 0.750808639916083 | epot = -15.4485234034659 | etot = -14.6424332454249 -324000 ekin = 0.0578423255205682 | erot = 0.800144112657402 | epot = -15.5004196836594 | etot = -14.6424332454815 -325000 ekin = 0.0639414864634509 | erot = 0.845088070114915 | epot = -15.5514628021208 | etot = -14.6424332455424 -326000 ekin = 0.0736101694210092 | erot = 0.884703689967185 | epot = -15.6007471049934 | etot = -14.6424332456052 -327000 ekin = 0.0867333560897029 | erot = 0.918165419812939 | epot = -15.6473320215696 | etot = -14.642433245667 -328000 ekin = 0.103055779603997 | erot = 0.944796600223848 | epot = -15.6902856255527 | etot = -14.6424332457249 -329000 ekin = 0.122195446170794 | erot = 0.964099781594435 | epot = -15.7287284735416 | etot = -14.6424332457764 -330000 ekin = 0.143662406710256 | erot = 0.975776996237332 | epot = -15.7618726487672 | etot = -14.6424332458196 -331000 ekin = 0.166880785133597 | erot = 0.979738667517973 | epot = -15.7890526985047 | etot = -14.6424332458531 -332000 ekin = 0.191212923969949 | erot = 0.976101405902857 | epot = -15.8097475757491 | etot = -14.6424332458763 -333000 ekin = 0.215985355319607 | erot = 0.965176233539026 | epot = -15.8235948347474 | etot = -14.6424332458887 -334000 ekin = 0.24051665683118 | erot = 0.94744948511249 | epot = -15.8303993878336 | etot = -14.64243324589 -335000 ekin = 0.264146896086271 | erot = 0.923558676868031 | epot = -15.8301388188342 | etot = -14.6424332458799 -336000 ekin = 0.286267467754269 | erot = 0.894265184760613 | epot = -15.8229658983735 | etot = -14.6424332458586 -337000 ekin = 0.306349134750126 | erot = 0.860424939336685 | epot = -15.809207319913 | etot = -14.6424332458262 -338000 ekin = 0.323965497674733 | erot = 0.822957838322781 | epot = -15.7893565817813 | etot = -14.6424332457838 -339000 ekin = 0.338809250789021 | erot = 0.782816380150505 | epot = -15.7640588766724 | etot = -14.6424332457329 -340000 ekin = 0.350699444233775 | erot = 0.74095414130314 | epot = -15.7340868312126 | etot = -14.6424332456757 -341000 ekin = 0.359579293536528 | erot = 0.698295027831883 | epot = -15.7003075669831 | etot = -14.6424332456146 -342000 ekin = 0.365505462154955 | erot = 0.655704542035024 | epot = -15.6636432497426 | etot = -14.6424332455526 -343000 ekin = 0.36863083266141 | erot = 0.613964463465585 | epot = -15.6250285416196 | etot = -14.6424332454926 -344000 ekin = 0.369183369589239 | erot = 0.57375227308083 | epot = -15.5853688881069 | etot = -14.6424332454368 -345000 ekin = 0.367443732824309 | erot = 0.535626361233186 | epot = -15.5455033394448 | etot = -14.6424332453873 -346000 ekin = 0.363723933131786 | erot = 0.500017626276236 | epot = -15.5061748047535 | etot = -14.6424332453455 -347000 ekin = 0.35834870527769 | erot = 0.4672275854273 | epot = -15.468009536017 | etot = -14.642433245312 -348000 ekin = 0.351640582954847 | erot = 0.437432666908131 | epot = -15.4315064951499 | etot = -14.6424332452869 -349000 ekin = 0.34390902469482 | erot = 0.410693986169958 | epot = -15.3970362561344 | etot = -14.6424332452696 -350000 ekin = 0.335443435968795 | erot = 0.386971649880754 | epot = -15.3648483311092 | etot = -14.6424332452597 -351000 ekin = 0.326509584093778 | erot = 0.366142474251534 | epot = -15.3350853036005 | etot = -14.6424332452552 -352000 ekin = 0.317348699022206 | erot = 0.348019930401133 | epot = -15.3078018746784 | etot = -14.642433245255 -353000 ekin = 0.308178466648759 | erot = 0.332375117501959 | epot = -15.2829868294085 | etot = -14.6424332452578 -354000 ekin = 0.299195119854398 | erot = 0.318957598139 | epot = -15.2605859632553 | etot = -14.6424332452619 -355000 ekin = 0.290575888248861 | erot = 0.307515001370351 | epot = -15.2405241348854 | etot = -14.6424332452662 -356000 ekin = 0.282481160312499 | erot = 0.297810406217201 | epot = -15.2227248117992 | etot = -14.6424332452695 -357000 ekin = 0.275055828993794 | erot = 0.289636664277844 | epot = -15.2071257385429 | etot = -14.6424332452713 -358000 ekin = 0.268429427254947 | erot = 0.282827006912201 | epot = -15.1936896794382 | etot = -14.6424332452711 -359000 ekin = 0.262714810201774 | erot = 0.277261507857975 | epot = -15.1824095633287 | etot = -14.642433245269 -360000 ekin = 0.258005302569451 | erot = 0.272869227748628 | epot = -15.1733077755836 | etot = -14.6424332452655 -361000 ekin = 0.2543704006218 | erot = 0.26962613780198 | epot = -15.1664297836851 | etot = -14.6424332452613 -362000 ekin = 0.251850290178673 | erot = 0.267549186087919 | epot = -15.1618327215239 | etot = -14.6424332452573 -363000 ekin = 0.250449609862776 | erot = 0.266687109597444 | epot = -15.159569964715 | etot = -14.6424332452548 -364000 ekin = 0.250131041863364 | erot = 0.267108788857685 | epot = -15.1596730759762 | etot = -14.6424332452551 -365000 ekin = 0.250809442162096 | erot = 0.268890073927981 | epot = -15.1621327613494 | etot = -14.6424332452593 -366000 ekin = 0.252347318763382 | erot = 0.27210007300604 | epot = -15.1668806370379 | etot = -14.6424332452684 -367000 ekin = 0.254552520178544 | erot = 0.276787886819364 | epot = -15.1737736522811 | etot = -14.6424332452832 -368000 ekin = 0.25717899615333 | erot = 0.28297069952372 | epot = -15.1825829409812 | etot = -14.6424332453042 -369000 ekin = 0.259931424908739 | erot = 0.290624011143398 | epot = -15.1929886813831 | etot = -14.642433245331 -370000 ekin = 0.262474349326661 | erot = 0.299674631814961 | epot = -15.2045822265049 | etot = -14.6424332453633 -371000 ekin = 0.264446209428328 | erot = 0.309996869297309 | epot = -15.2168763241252 | etot = -14.6424332453996 -372000 ekin = 0.265478281861457 | erot = 0.321412142686622 | epot = -15.2293236699864 | etot = -14.6424332454383 -373000 ekin = 0.265218028290062 | erot = 0.333692059448684 | epot = -15.2413433332161 | etot = -14.6424332454774 -374000 ekin = 0.263355721247738 | erot = 0.346564809671242 | epot = -15.2523537764331 | etot = -14.6424332455141 -375000 ekin = 0.259652497500791 | erot = 0.359724567998139 | epot = -15.2618103110451 | etot = -14.6424332455462 -376000 ekin = 0.253967268934329 | erot = 0.372843454384676 | epot = -15.2692439688901 | etot = -14.6424332455711 -377000 ekin = 0.246279333497668 | erot = 0.385585491299172 | epot = -15.2742980703837 | etot = -14.6424332455868 -378000 ekin = 0.236703249874173 | erot = 0.397621906702945 | epot = -15.2767584021691 | etot = -14.642433245592 -379000 ekin = 0.225492756940715 | erot = 0.40864706693682 | epot = -15.2765730694637 | etot = -14.6424332455862 -380000 ekin = 0.213031377534926 | erot = 0.418394279001937 | epot = -15.2738589021068 | etot = -14.64243324557 -381000 ekin = 0.199808877311648 | erot = 0.426650676217097 | epot = -15.2688927990735 | etot = -14.6424332455448 -382000 ekin = 0.186384809014953 | erot = 0.433270396060973 | epot = -15.2620884505889 | etot = -14.642433245513 -383000 ekin = 0.173342616140324 | erot = 0.438185279055512 | epot = -15.2539611406731 | etot = -14.6424332454773 -384000 ekin = 0.161239700828068 | erot = 0.441412371407278 | epot = -15.2450853176757 | etot = -14.6424332454403 -385000 ekin = 0.15055995464472 | erot = 0.443057612556829 | epot = -15.2360508126064 | etot = -14.6424332454049 -386000 ekin = 0.141675129696858 | erot = 0.443315241526512 | epot = -15.2274236165962 | etot = -14.6424332453728 -387000 ekin = 0.134820015696242 | erot = 0.442462667351568 | epot = -15.219715928393 | etot = -14.6424332453452 -388000 ekin = 0.130083976412365 | erot = 0.440850813515941 | epot = -15.2133680352507 | etot = -14.6424332453224 -389000 ekin = 0.127418570237209 | erot = 0.438890246280336 | epot = -15.2087420618216 | etot = -14.6424332453041 -390000 ekin = 0.126658423092949 | erot = 0.437033702086702 | epot = -15.2061253704692 | etot = -14.6424332452896 -391000 ekin = 0.127550804261054 | erot = 0.435755902066146 | epot = -15.2057399516053 | etot = -14.6424332452781 -392000 ekin = 0.129788752936042 | erot = 0.435531744058158 | epot = -15.2077537422634 | etot = -14.6424332452692 -393000 ekin = 0.133043055316548 | erot = 0.436814065077171 | epot = -15.2122903656559 | etot = -14.6424332452622 -394000 ekin = 0.13698956146631 | erot = 0.440012156509963 | epot = -15.2194349632336 | etot = -14.6424332452574 -395000 ekin = 0.141329833042578 | erot = 0.445472096884894 | epot = -15.2292351751821 | etot = -14.6424332452547 -396000 ekin = 0.145804542777388 | erot = 0.453459767648299 | epot = -15.2416975556806 | etot = -14.6424332452549 -397000 ekin = 0.150200153188693 | erot = 0.464147173461362 | epot = -15.2567805719085 | etot = -14.6424332452585 -398000 ekin = 0.154350089766171 | erot = 0.477602441558455 | epot = -15.2743857765907 | etot = -14.642433245266 -399000 ekin = 0.158131920622385 | erot = 0.493783661155615 | epot = -15.2943488270562 | etot = -14.6424332452782 -400000 ekin = 0.161462056173815 | erot = 0.512536568006289 | epot = -15.3164318694755 | etot = -14.6424332452954 -401000 ekin = 0.164289301181092 | erot = 0.533595989002424 | epot = -15.3403185355012 | etot = -14.6424332453177 -402000 ekin = 0.166588323050712 | erot = 0.556590928839782 | epot = -15.3656124972355 | etot = -14.642433245345 -403000 ekin = 0.168353810379714 | erot = 0.581053183644432 | epot = -15.3918402394011 | etot = -14.642433245377 -404000 ekin = 0.169595821301209 | erot = 0.606429376023235 | epot = -15.4184584427372 | etot = -14.6424332454128 -405000 ekin = 0.170336578562032 | erot = 0.632096292540657 | epot = -15.444866116554 | etot = -14.6424332454513 -406000 ekin = 0.170608761978825 | erot = 0.65737934451492 | epot = -15.4704213519851 | etot = -14.6424332454913 -407000 ekin = 0.170455178567339 | erot = 0.681573854094692 | epot = -15.4944622781935 | etot = -14.6424332455315 -408000 ekin = 0.169929554809768 | erot = 0.703968692151365 | epot = -15.5163314925311 | etot = -14.64243324557 -409000 ekin = 0.169098093451402 | erot = 0.723871579521667 | epot = -15.5354029185781 | etot = -14.642433245605 -410000 ekin = 0.168041369040766 | erot = 0.740635137248604 | epot = -15.5511097519242 | etot = -14.6424332456348 -411000 ekin = 0.166856102809042 | erot = 0.753682569971378 | epot = -15.5629719184381 | etot = -14.6424332456577 -412000 ekin = 0.165656359033244 | erot = 0.762531725093222 | epot = -15.5706213297988 | etot = -14.6424332456723 -413000 ekin = 0.164573741711754 | erot = 0.766816218739629 | epot = -15.5738232061291 | etot = -14.6424332456777 -414000 ekin = 0.16375624095788 | erot = 0.76630237757158 | epot = -15.5724918642026 | etot = -14.6424332456731 -415000 ekin = 0.163365479945841 | erot = 0.760900920224475 | epot = -15.5666996458289 | etot = -14.6424332456586 -416000 ekin = 0.163572240094564 | erot = 0.750672586698962 | epot = -15.556678072428 | etot = -14.6424332456344 -417000 ekin = 0.164550286199959 | erot = 0.735827297890632 | epot = -15.5428108296923 | etot = -14.6424332456017 -418000 ekin = 0.166468663393417 | erot = 0.716716857299964 | epot = -15.5256187662552 | etot = -14.6424332455618 -419000 ekin = 0.169482781127086 | erot = 0.693821649098622 | epot = -15.5057376757421 | etot = -14.6424332455164 -420000 ekin = 0.173724722667741 | erot = 0.667732191682839 | epot = -15.4838901598183 | etot = -14.6424332454677 -421000 ekin = 0.179293310761204 | erot = 0.639126725581036 | epot = -15.4608532817599 | etot = -14.6424332454176 -422000 ekin = 0.186244514521543 | erot = 0.608746211198846 | epot = -15.4374239710891 | etot = -14.6424332453687 -423000 ekin = 0.19458279814717 | erot = 0.57736816557662 | epot = -15.4143842090468 | etot = -14.642433245323 -424000 ekin = 0.204253993032132 | erot = 0.545780680985193 | epot = -15.3924679192997 | etot = -14.6424332452824 -425000 ekin = 0.215140228919715 | erot = 0.514757766830946 | epot = -15.372331240999 | etot = -14.6424332452483 -426000 ekin = 0.227057395200036 | erot = 0.485036881514114 | epot = -15.3545275219361 | etot = -14.6424332452219 -427000 ekin = 0.239755526228613 | erot = 0.45729922156058 | epot = -15.3394879929935 | etot = -14.6424332452043 -428000 ekin = 0.252922416271937 | erot = 0.432153058133966 | epot = -15.3275087196017 | etot = -14.6424332451958 -429000 ekin = 0.26619066718155 | erot = 0.410120192007268 | epot = -15.318744104385 | etot = -14.6424332451962 -430000 ekin = 0.279148248287638 | erot = 0.391625457761839 | epot = -15.313206951255 | etot = -14.6424332452055 -431000 ekin = 0.291352495295118 | erot = 0.376989149810355 | epot = -15.310774890328 | etot = -14.6424332452226 -432000 ekin = 0.302347287571226 | erot = 0.366422254466054 | epot = -15.3112027872841 | etot = -14.6424332452468 -433000 ekin = 0.311682921771869 | erot = 0.360024429012261 | epot = -15.31414059606 | etot = -14.6424332452759 -434000 ekin = 0.318937954387437 | erot = 0.357784738270616 | epot = -15.3191559379665 | etot = -14.6424332453085 -435000 ekin = 0.323742037714879 | erot = 0.359585207272693 | epot = -15.3257604903309 | etot = -14.6424332453433 -436000 ekin = 0.325798554031361 | erot = 0.365207245305615 | epot = -15.3334390447156 | etot = -14.6424332453787 -437000 ekin = 0.324905697097351 | erot = 0.3743409223498 | epot = -15.3416798648587 | etot = -14.6424332454115 -438000 ekin = 0.320974589858406 | erot = 0.386596930160279 | epot = -15.3500047654589 | etot = -14.6424332454403 -439000 ekin = 0.314043077746411 | erot = 0.401520852185304 | epot = -15.3579971753956 | etot = -14.6424332454639 -440000 ekin = 0.304283988020589 | erot = 0.418609132213777 | epot = -15.3653263657149 | etot = -14.6424332454805 -441000 ekin = 0.292006859111662 | erot = 0.43732591619283 | epot = -15.3717660207935 | etot = -14.642433245489 -442000 ekin = 0.277652365815121 | erot = 0.457119792518649 | epot = -15.3772054038233 | etot = -14.6424332454895 -443000 ekin = 0.261778853590793 | erot = 0.477439412175561 | epot = -15.3816515112488 | etot = -14.6424332454825 -444000 ekin = 0.245040553434287 | erot = 0.497747053376211 | epot = -15.3852208522799 | etot = -14.6424332454694 -445000 ekin = 0.228157260420329 | erot = 0.517529408202232 | epot = -15.3881199140743 | etot = -14.6424332454517 -446000 ekin = 0.21187568172941 | erot = 0.536305196856337 | epot = -15.3906141240179 | etot = -14.6424332454322 -447000 ekin = 0.196923472681482 | erot = 0.553629632753198 | epot = -15.3929863508487 | etot = -14.642433245414 -448000 ekin = 0.183958277880817 | erot = 0.569096233370736 | epot = -15.3954877566523 | etot = -14.6424332454007 -449000 ekin = 0.173515771313228 | erot = 0.5823369471514 | epot = -15.3982859638601 | etot = -14.6424332453955 -450000 ekin = 0.165962361199431 | erot = 0.593021970145669 | epot = -15.4014175767459 | etot = -14.6424332454008 -451000 ekin = 0.161459280835244 | erot = 0.600860851249224 | epot = -15.4047533775022 | etot = -14.6424332454178 -452000 ekin = 0.159944578253892 | erot = 0.605606408076117 | epot = -15.4079842317756 | etot = -14.6424332454456 -453000 ekin = 0.16113765311534 | erot = 0.607062496367839 | epot = -15.410633394965 | etot = -14.6424332454818 -454000 ekin = 0.164567591513356 | erot = 0.605095779305886 | epot = -15.4120966163412 | etot = -14.642433245522 -455000 ekin = 0.169622334209554 | erot = 0.599650455421075 | epot = -15.4117060351916 | etot = -14.642433245561 -456000 ekin = 0.175611802350678 | erot = 0.590763702894336 | epot = -15.4088087508385 | etot = -14.6424332455934 -457000 ekin = 0.18183562198226 | erot = 0.578578749363001 | epot = -15.40284761696 | etot = -14.6424332456148 -458000 ekin = 0.187645727030885 | erot = 0.563352302649156 | epot = -15.3934312753017 | etot = -14.6424332456216 -459000 ekin = 0.192495880384903 | erot = 0.54545371714944 | epot = -15.380382843147 | etot = -14.6424332456127 -460000 ekin = 0.195973381637231 | erot = 0.525354597711837 | epot = -15.3637612249374 | etot = -14.6424332455883 -461000 ekin = 0.19781192099122 | erot = 0.503609203464113 | epot = -15.3438543700065 | etot = -14.6424332455512 -462000 ekin = 0.197887724919132 | erot = 0.48082756028462 | epot = -15.3211485307077 | etot = -14.642433245504 -463000 ekin = 0.196203198485173 | erot = 0.457644248438995 | epot = -15.2962806923752 | etot = -14.642433245451 -464000 ekin = 0.192863034125907 | erot = 0.434686220431767 | epot = -15.2699824999538 | etot = -14.6424332453961 -465000 ekin = 0.188047435822224 | erot = 0.412542760093908 | epot = -15.2430234412587 | etot = -14.6424332453426 -466000 ekin = 0.181986107552777 | erot = 0.391740010674779 | epot = -15.2161593635208 | etot = -14.6424332452933 -467000 ekin = 0.174935400197989 | erot = 0.372721626737635 | epot = -15.1900902721858 | etot = -14.6424332452502 -468000 ekin = 0.167159826102147 | erot = 0.355836258353843 | epot = -15.1654293296706 | etot = -14.6424332452146 -469000 ekin = 0.158918218022594 | erot = 0.341331890767393 | epot = -15.142683353977 | etot = -14.642433245187 -470000 ekin = 0.15045418565321 | erot = 0.329356584635604 | epot = -15.122244015456 | etot = -14.6424332451672 -471000 ekin = 0.141990180749419 | erot = 0.319964871778363 | epot = -15.1043882976826 | etot = -14.6424332451548 -472000 ekin = 0.133724353868213 | erot = 0.313128906246296 | epot = -15.0892865052631 | etot = -14.6424332451486 -473000 ekin = 0.125829398101872 | erot = 0.30875339232503 | epot = -15.0770160355745 | etot = -14.6424332451476 -474000 ekin = 0.118452666363189 | erot = 0.306693264414343 | epot = -15.0675791759279 | etot = -14.6424332451504 -475000 ekin = 0.111716976218893 | erot = 0.306773053291024 | epot = -15.0609232746654 | etot = -14.6424332451555 -476000 ekin = 0.105721655633223 | erot = 0.308806833537924 | epot = -15.0569617343329 | etot = -14.6424332451618 -477000 ekin = 0.100543523675712 | erot = 0.312617617130677 | epot = -15.0555943859742 | etot = -14.6424332451678 -478000 ekin = 0.0962376398644513 | erot = 0.318055055635923 | epot = -15.0567259406731 | etot = -14.6424332451728 -479000 ekin = 0.0928377950023785 | erot = 0.325010357031079 | epot = -15.0602813972093 | etot = -14.6424332451759 -480000 ekin = 0.090356854634411 | erot = 0.33342742776467 | epot = -15.0662175275758 | etot = -14.6424332451768 -481000 ekin = 0.0887871989354817 | erot = 0.343309423711643 | epot = -15.0745298678222 | etot = -14.6424332451751 -482000 ekin = 0.0881016191313876 | erot = 0.354720133059481 | epot = -15.0852549973622 | etot = -14.6424332451713 -483000 ekin = 0.0882551127429665 | erot = 0.367779908275322 | epot = -15.0984682661839 | etot = -14.6424332451656 -484000 ekin = 0.0891880440123839 | erot = 0.382656193510897 | epot = -15.1142774826821 | etot = -14.6424332451588 -485000 ekin = 0.0908310739090705 | erot = 0.399549033149946 | epot = -15.1328133522104 | etot = -14.6424332451514 -486000 ekin = 0.0931120890965814 | erot = 0.418672269927034 | epot = -15.154217604168 | etot = -14.6424332451444 -487000 ekin = 0.095965052636228 | erot = 0.440231422325024 | epot = -15.1786297200999 | etot = -14.6424332451386 -488000 ekin = 0.0993402613831294 | erot = 0.46439945138847 | epot = -15.2061729579066 | etot = -14.642433245135 -489000 ekin = 0.103214957393527 | erot = 0.491291775407073 | epot = -15.2369399779351 | etot = -14.6424332451345 -490000 ekin = 0.107602676592558 | erot = 0.520941965501705 | epot = -15.2709778872323 | etot = -14.6424332451381 -491000 ekin = 0.112559247659628 | erot = 0.553279563920015 | epot = -15.3082720567265 | etot = -14.6424332451469 -492000 ekin = 0.118183136718373 | erot = 0.588111425310959 | epot = -15.3487278071917 | etot = -14.6424332451624 -493000 ekin = 0.124608040121095 | erot = 0.625107908280837 | epot = -15.392149193588 | etot = -14.642433245186 -494000 ekin = 0.131986393307407 | erot = 0.663795156036258 | epot = -15.4382147945633 | etot = -14.6424332452196 -495000 ekin = 0.140463823895335 | erot = 0.703554605722134 | epot = -15.4864516748823 | etot = -14.6424332452649 -496000 ekin = 0.150146408031538 | erot = 0.743630741562818 | epot = -15.5362103949173 | etot = -14.642433245323 -497000 ekin = 0.16106457906771 | erot = 0.783147917316484 | epot = -15.5866457417788 | etot = -14.6424332453946 -498000 ekin = 0.17313921915462 | erot = 0.821136754970969 | epot = -15.6367092196046 | etot = -14.642433245479 -499000 ekin = 0.186156317831562 | erot = 0.856570103854254 | epot = -15.6851596672598 | etot = -14.642433245574 -500000 ekin = 0.199756195068111 | erot = 0.888407758271 | epot = -15.7305971990146 | etot = -14.6424332456755 -501000 ekin = 0.213441517837515 | erot = 0.91564807872929 | epot = -15.7715228423448 | etot = -14.642433245778 -502000 ekin = 0.226605416599129 | erot = 0.937383433645168 | epot = -15.8064220961188 | etot = -14.6424332458745 -503000 ekin = 0.238577508979587 | erot = 0.952855183120512 | epot = -15.833865938058 | etot = -14.6424332459579 -504000 ekin = 0.248682347019072 | erot = 0.961503066783608 | epot = -15.852618659824 | etot = -14.6424332460214 -505000 ekin = 0.256302488972932 | erot = 0.963003656361611 | epot = -15.8617393913938 | etot = -14.6424332460593 -506000 ekin = 0.260937583147984 | erot = 0.957293217915285 | epot = -15.8606640471316 | etot = -14.6424332460684 -507000 ekin = 0.262251679303336 | erot = 0.944571918253111 | epot = -15.849256843604 | etot = -14.6424332460476 -508000 ekin = 0.260103184115659 | erot = 0.925288564928836 | epot = -15.8278249950432 | etot = -14.6424332459987 -509000 ekin = 0.254554875284732 | erot = 0.900107536932193 | epot = -15.7970956581424 | etot = -14.6424332459255 -510000 ekin = 0.245864483352383 | erot = 0.869861717979723 | epot = -15.7581594471658 | etot = -14.6424332458337 -511000 ekin = 0.234458914530911 | erot = 0.835496660120876 | epot = -15.7123888203816 | etot = -14.6424332457298 -512000 ekin = 0.220896820243761 | erot = 0.798011684060442 | epot = -15.6613417499246 | etot = -14.6424332456204 -513000 ekin = 0.205824805091364 | erot = 0.758403224573062 | epot = -15.6066612751764 | etot = -14.642433245512 -514000 ekin = 0.189932244119323 | erot = 0.717614706855288 | epot = -15.5499801963845 | etot = -14.6424332454099 -515000 ekin = 0.17390874820257 | erot = 0.676495918867881 | epot = -15.4928379123889 | etot = -14.6424332453184 -516000 ekin = 0.158407108511426 | erot = 0.635773516021008 | epot = -15.4366138697731 | etot = -14.6424332452406 -517000 ekin = 0.14401335018595 | erot = 0.596033149114218 | epot = -15.3824797444788 | etot = -14.6424332451787 -518000 ekin = 0.131224514119687 | erot = 0.557712825685522 | epot = -15.3313705849381 | etot = -14.6424332451329 -519000 ekin = 0.120434042407135 | erot = 0.521106495594791 | epot = -15.283973783105 | etot = -14.6424332451031 -520000 ekin = 0.111924165177655 | erot = 0.486376443197342 | epot = -15.2407338534629 | etot = -14.6424332450879 -521000 ekin = 0.105864424816476 | erot = 0.453572806058521 | epot = -15.2018704759605 | etot = -14.6424332450855 -522000 ekin = 0.102315362067652 | erot = 0.422658367130085 | epot = -15.1674069742913 | etot = -14.6424332450936 -523000 ekin = 0.101236366465111 | erot = 0.393536647096003 | epot = -15.1372062586706 | etot = -14.6424332451095 -524000 ekin = 0.102496717236374 | erot = 0.366081244307575 | epot = -15.1110112066745 | etot = -14.6424332451305 -525000 ekin = 0.105888887335369 | erot = 0.340164343214287 | epot = -15.0884864757035 | etot = -14.6424332451539 -526000 ekin = 0.111143247849981 | erot = 0.315682368378401 | epot = -15.069258861406 | etot = -14.6424332451776 -527000 ekin = 0.117943398961218 | erot = 0.292576937806713 | epot = -15.0529535819675 | etot = -14.6424332451996 -528000 ekin = 0.12594147425438 | erot = 0.270849598243415 | epot = -15.0392243177162 | etot = -14.6424332452184 -529000 ekin = 0.134772916008765 | erot = 0.250569317238797 | epot = -15.0277754784806 | etot = -14.642433245233 -530000 ekin = 0.144070383401974 | erot = 0.231872340651149 | epot = -15.0183759692965 | etot = -14.6424332452434 -531000 ekin = 0.15347660196879 | erot = 0.214954741433796 | epot = -15.0108645886522 | etot = -14.6424332452496 -532000 ekin = 0.162656054077 | erot = 0.200058697647209 | epot = -15.0051479969762 | etot = -14.642433245252 -533000 ekin = 0.171305419079586 | erot = 0.187454143182299 | epot = -15.0011928075133 | etot = -14.6424332452514 -534000 ekin = 0.179162595538566 | erot = 0.177417842692211 | epot = -14.9990136834797 | etot = -14.6424332452489 -535000 ekin = 0.186014006484961 | erot = 0.170212094440673 | epot = -14.9986593461708 | etot = -14.6424332452451 -536000 ekin = 0.191699759238903 | erot = 0.166065149224394 | epot = -15.0001981537044 | etot = -14.6424332452411 -537000 ekin = 0.196116169930247 | erot = 0.165155084977408 | epot = -15.003704500145 | etot = -14.6424332452374 -538000 ekin = 0.199215220532698 | erot = 0.16759836456926 | epot = -15.0092468303366 | etot = -14.6424332452346 -539000 ekin = 0.201000709668931 | erot = 0.173443713615155 | epot = -15.0168776685175 | etot = -14.6424332452334 -540000 ekin = 0.201521164037735 | erot = 0.182671367030103 | epot = -15.0266257763018 | etot = -14.642433245234 -541000 ekin = 0.200859940141597 | erot = 0.195197211440054 | epot = -15.0384903968184 | etot = -14.6424332452368 -542000 ekin = 0.199123298889485 | erot = 0.210880936221537 | epot = -15.0524374803529 | etot = -14.6424332452419 -543000 ekin = 0.196427519384797 | erot = 0.229537017788178 | epot = -15.0683977824221 | etot = -14.6424332452491 -544000 ekin = 0.192886294946265 | erot = 0.250947202002037 | epot = -15.0862667422075 | etot = -14.6424332452592 -545000 ekin = 0.188599710888657 | erot = 0.274873110236047 | epot = -15.105906066396 | etot = -14.6424332452713 -546000 ekin = 0.183646045244013 | erot = 0.301067663120938 | epot = -15.1271469536504 | etot = -14.6424332452855 -547000 ekin = 0.178077473819967 | erot = 0.329284179376605 | epot = -15.1497948984979 | etot = -14.6424332453014 -548000 ekin = 0.171920510268461 | erot = 0.359282253787744 | epot = -15.1736360093748 | etot = -14.6424332453186 -549000 ekin = 0.165181670578861 | erot = 0.390829837836081 | epot = -15.1984447537512 | etot = -14.6424332453363 -550000 ekin = 0.157858408655945 | erot = 0.423701326923182 | epot = -15.2239929809331 | etot = -14.642433245354 -551000 ekin = 0.149954809005839 | erot = 0.457671882722358 | epot = -15.2500599370991 | etot = -14.6424332453709 -552000 ekin = 0.141500835822421 | erot = 0.492508662666581 | epot = -15.2764427438753 | etot = -14.6424332453863 -553000 ekin = 0.132573145480449 | erot = 0.527960055130409 | epot = -15.3029664460102 | etot = -14.6424332453994 -554000 ekin = 0.123314645146745 | erot = 0.563744383275535 | epot = -15.3294922738321 | etot = -14.6424332454099 -555000 ekin = 0.113949270900184 | erot = 0.599539792629149 | epot = -15.3559223089468 | etot = -14.6424332454175 -556000 ekin = 0.104788088804101 | erot = 0.634977129568617 | epot = -15.3821984637955 | etot = -14.6424332454228 -557000 ekin = 0.096223065473816 | erot = 0.669637513728817 | epot = -15.4082938246293 | etot = -14.6424332454266 -558000 ekin = 0.0887059614381205 | erot = 0.703055990484285 | epot = -15.4341951973531 | etot = -14.6424332454307 -559000 ekin = 0.0827118847691962 | erot = 0.734732129427077 | epot = -15.4598772596334 | etot = -14.6424332454371 -560000 ekin = 0.0786899547209169 | erot = 0.764147748401263 | epot = -15.4852709485701 | etot = -14.6424332454479 -561000 ekin = 0.0770067720584255 | erot = 0.790791153077886 | epot = -15.5102311706012 | etot = -14.6424332454649 -562000 ekin = 0.0778911706718282 | erot = 0.814186471630634 | epot = -15.5345108877914 | etot = -14.6424332454889 -563000 ekin = 0.0813901113631115 | erot = 0.83392592548433 | epot = -15.557749282367 | etot = -14.6424332455196 -564000 ekin = 0.0873448530183196 | erot = 0.849702302566903 | epot = -15.57948040114 | etot = -14.6424332455547 -565000 ekin = 0.0953935152513145 | erot = 0.861338569498428 | epot = -15.5991653303408 | etot = -14.6424332455911 -566000 ekin = 0.105001366117329 | erot = 0.868811531658717 | epot = -15.6162461434001 | etot = -14.642433245624 -567000 ekin = 0.115514789209051 | erot = 0.872266750929858 | epot = -15.6302147857878 | etot = -14.6424332456489 -568000 ekin = 0.126230320989268 | erot = 0.872022546763063 | epot = -15.6406861134137 | etot = -14.6424332456614 -569000 ekin = 0.136467575204541 | erot = 0.868561781940356 | epot = -15.6474626028035 | etot = -14.6424332456586 -570000 ekin = 0.14563482322856 | erot = 0.862511177265558 | epot = -15.6505792461336 | etot = -14.6424332456395 -571000 ekin = 0.153278250259509 | erot = 0.854608991359196 | epot = -15.6503204872237 | etot = -14.642433245605 -572000 ekin = 0.159109636953315 | erot = 0.84566291861986 | epot = -15.6472058011309 | etot = -14.6424332455578 -573000 ekin = 0.163011362016618 | erot = 0.836500892323047 | epot = -15.6419454998422 | etot = -14.6424332455025 -574000 ekin = 0.165021239079159 | erot = 0.827918058208187 | epot = -15.635372542732 | etot = -14.6424332454446 -575000 ekin = 0.165302195907322 | erot = 0.820623479706763 | epot = -15.6283589210038 | etot = -14.6424332453898 -576000 ekin = 0.164102988099574 | erot = 0.815190165400983 | epot = -15.621726398844 | etot = -14.6424332453435 -577000 ekin = 0.161716152385172 | erot = 0.812011817945883 | epot = -15.6161612156416 | etot = -14.6424332453106 -578000 ekin = 0.158438569369477 | erot = 0.811269345695122 | epot = -15.6121411603591 | etot = -14.6424332452945 -579000 ekin = 0.154538688866709 | erot = 0.812909695780285 | epot = -15.6098816299442 | etot = -14.6424332452972 -580000 ekin = 0.150232988451571 | erot = 0.816638977240369 | epot = -15.609305211011 | etot = -14.642433245319 -581000 ekin = 0.145672809811868 | erot = 0.821931135408533 | epot = -15.6100371905791 | etot = -14.6424332453587 -582000 ekin = 0.140941476788303 | erot = 0.828052590347458 | epot = -15.6114273125488 | etot = -14.6424332454131 -583000 ekin = 0.136060602595946 | erot = 0.834102246892096 | epot = -15.6125960949662 | etot = -14.6424332454781 -584000 ekin = 0.131003759893458 | erot = 0.839065139153303 | epot = -15.6125021445952 | etot = -14.6424332455484 -585000 ekin = 0.12571521648007 | erot = 0.841876757443486 | epot = -15.6100252195418 | etot = -14.6424332456182 -586000 ekin = 0.120131224766287 | erot = 0.841493945660819 | epot = -15.6040584161085 | etot = -14.6424332456814 -587000 ekin = 0.11420138056985 | erot = 0.836967317747627 | epot = -15.5936019440499 | etot = -14.6424332457324 -588000 ekin = 0.107907808224915 | erot = 0.827509595977126 | epot = -15.5778506499685 | etot = -14.6424332457665 -589000 ekin = 0.101280337908428 | erot = 0.812554260667712 | epot = -15.5562678443564 | etot = -14.6424332457802 -590000 ekin = 0.0944063548781052 | erot = 0.791799488415071 | epot = -15.5286390890649 | etot = -14.6424332457717 -591000 ekin = 0.0874345511050671 | erot = 0.765233519218362 | epot = -15.4951013160642 | etot = -14.6424332457407 -592000 ekin = 0.0805723392089649 | erot = 0.733139214280964 | epot = -15.4561447991789 | etot = -14.642433245689 -593000 ekin = 0.0740771594091136 | erot = 0.696077455345172 | epot = -15.4125878603738 | etot = -14.6424332456195 -594000 ekin = 0.0682423089615399 | erot = 0.654850963355347 | epot = -15.3655265178539 | etot = -14.642433245537 -595000 ekin = 0.0633782539034779 | erot = 0.610451848321571 | epot = -15.3162633476718 | etot = -14.6424332454467 -596000 ekin = 0.0597906540673611 | erot = 0.563997548399802 | epot = -15.2662214478219 | etot = -14.6424332453547 -597000 ekin = 0.0577565493650921 | erot = 0.516660644083595 | epot = -15.2168504387157 | etot = -14.642433245267 -598000 ekin = 0.0575003158564784 | erot = 0.469598294353525 | epot = -15.1695318553992 | etot = -14.6424332451892 -599000 ekin = 0.0591710965315349 | erot = 0.423886769451421 | epot = -15.125491111109 | etot = -14.6424332451261 -600000 ekin = 0.0628234356919278 | erot = 0.380465849282147 | epot = -15.0857225300552 | etot = -14.6424332450811 -601000 ekin = 0.0684027903404539 | erot = 0.340096852289996 | epot = -15.0509328876871 | etot = -14.6424332450566 -602000 ekin = 0.0757374499151871 | erot = 0.303336891509908 | epot = -15.0215075864782 | etot = -14.6424332450531 -603000 ekin = 0.0845381560125591 | erot = 0.27053072625361 | epot = -14.9975021273357 | etot = -14.6424332450695 -604000 ekin = 0.0944063594091915 | erot = 0.241820347964647 | epot = -14.9786599524771 | etot = -14.6424332451032 -605000 ekin = 0.104851562461362 | erot = 0.217171224792199 | epot = -14.9644560324035 | etot = -14.64243324515 -606000 ekin = 0.115317556390045 | erot = 0.196412930357212 | epot = -14.9541637319514 | etot = -14.6424332452042 -607000 ekin = 0.125216580352904 | erot = 0.179290709848448 | epot = -14.9469405354612 | etot = -14.6424332452598 -608000 ekin = 0.133969542489652 | erot = 0.165523445158619 | epot = -14.9419262329586 | etot = -14.6424332453103 -609000 ekin = 0.141049537027137 | erot = 0.154862582265986 | epot = -14.9383453646425 | etot = -14.6424332453493 -610000 ekin = 0.146025095174201 | erot = 0.147146040889238 | epot = -14.9356043814352 | etot = -14.6424332453717 -611000 ekin = 0.148599079333767 | erot = 0.142341118194411 | epot = -14.933373442902 | etot = -14.6424332453738 -612000 ekin = 0.148639027540153 | erot = 0.140571068728021 | epot = -14.9316433416219 | etot = -14.6424332453538 -613000 ekin = 0.146195193891304 | erot = 0.142121441396014 | epot = -14.9307498805999 | etot = -14.6424332453126 -614000 ekin = 0.141503544703229 | erot = 0.147424293659367 | epot = -14.931361083616 | etot = -14.6424332452534 -615000 ekin = 0.134972482668101 | erot = 0.157020849768253 | epot = -14.9344265776178 | etot = -14.6424332451814 -616000 ekin = 0.127153892886448 | erot = 0.171505679771477 | epot = -14.9410928177618 | etot = -14.6424332451039 -617000 ekin = 0.118700960496736 | erot = 0.191457667913385 | epot = -14.9525918734389 | etot = -14.6424332450288 -618000 ekin = 0.110316794782069 | erot = 0.217364584488849 | epot = -14.9701146242352 | etot = -14.6424332449643 -619000 ekin = 0.10269894266683 | erot = 0.249548776230041 | epot = -14.9946809638151 | etot = -14.6424332449182 -620000 ekin = 0.0964852203328795 | erot = 0.288101317489107 | epot = -15.0270197827187 | etot = -14.6424332448967 -621000 ekin = 0.0922059091544532 | erot = 0.332831044362015 | epot = -15.0674701984206 | etot = -14.6424332449041 -622000 ekin = 0.0902463647123495 | erot = 0.38323345185745 | epot = -15.1159130615123 | etot = -14.6424332449425 -623000 ekin = 0.0908226920728683 | erot = 0.438482716260395 | epot = -15.1717386533448 | etot = -14.6424332450115 -624000 ekin = 0.093971606254935 | erot = 0.497448307332334 | epot = -15.2338531586955 | etot = -14.6424332451083 -625000 ekin = 0.0995541611253139 | erot = 0.558735886776706 | epot = -15.3007232931298 | etot = -14.6424332452277 -626000 ekin = 0.107271859328534 | erot = 0.620750477448395 | epot = -15.3704555821401 | etot = -14.6424332453632 -627000 ekin = 0.116692826740249 | erot = 0.681778220893157 | epot = -15.4409042931398 | etot = -14.6424332455064 -628000 ekin = 0.127285245275924 | erot = 0.740081431761873 | epot = -15.5097999226864 | etot = -14.6424332456486 -629000 ekin = 0.138455039155856 | erot = 0.794000196763613 | epot = -15.5748884817005 | etot = -14.642433245781 -630000 ekin = 0.149584842938721 | erot = 0.842052640234425 | epot = -15.6340707290684 | etot = -14.6424332458952 -631000 ekin = 0.160071499854236 | erot = 0.883025442873649 | epot = -15.6855301887126 | etot = -14.6424332459847 -632000 ekin = 0.169359720293564 | erot = 0.91604650342356 | epot = -15.7278394697617 | etot = -14.6424332460446 -633000 ekin = 0.176970053692923 | erot = 0.940632922939441 | epot = -15.7600362227046 | etot = -14.6424332460723 -634000 ekin = 0.182519961289934 | erot = 0.956709735134031 | epot = -15.7816629424917 | etot = -14.6424332460677 -635000 ekin = 0.185737466035253 | erot = 0.964597760207907 | epot = -15.7927684722764 | etot = -14.6424332460332 -636000 ekin = 0.18646751930257 | erot = 0.964972204259268 | epot = -15.793872969535 | etot = -14.6424332459731 -637000 ekin = 0.184671774603444 | erot = 0.958796660380516 | epot = -15.7859016808771 | etot = -14.6424332458931 -638000 ekin = 0.18042282577675 | erot = 0.947239527077747 | epot = -15.7700955986542 | etot = -14.6424332457997 -639000 ekin = 0.173894119063336 | erot = 0.931581224201453 | epot = -15.7479085889647 | etot = -14.6424332456999 -640000 ekin = 0.165346701826116 | erot = 0.913120838758794 | epot = -15.7209007861851 | etot = -14.6424332456002 -641000 ekin = 0.155113786101916 | erot = 0.89309006009493 | epot = -15.690637091703 | etot = -14.6424332455061 -642000 ekin = 0.143583869242389 | erot = 0.87258071031098 | epot = -15.6585978249756 | etot = -14.6424332454222 -643000 ekin = 0.131182953687747 | erot = 0.852490168058439 | epot = -15.6261063670979 | etot = -14.6424332453517 -644000 ekin = 0.118356305759423 | erot = 0.833486853993461 | epot = -15.5942764050496 | etot = -14.6424332452967 -645000 ekin = 0.105550209083462 | erot = 0.815995971214927 | epot = -15.5639794255562 | etot = -14.6424332452578 -646000 ekin = 0.0931942744180316 | erot = 0.800204061932273 | epot = -15.5358315815851 | etot = -14.6424332452348 -647000 ekin = 0.0816850001788887 | erot = 0.786079744440846 | epot = -15.5101979898461 | etot = -14.6424332452264 -648000 ekin = 0.0713713598428991 | erot = 0.773407243192036 | epot = -15.4872118482655 | etot = -14.6424332452306 -649000 ekin = 0.0625431628711377 | erot = 0.761828976528719 | epot = -15.4668053846447 | etot = -14.6424332452448 -650000 ekin = 0.0554227735500933 | erot = 0.75089345341146 | epot = -15.4487494722279 | etot = -14.6424332452664 -651000 ekin = 0.0501605027659751 | erot = 0.740104978445454 | epot = -15.4326987265037 | etot = -14.6424332452922 -652000 ekin = 0.0468336713668763 | erot = 0.728972100417424 | epot = -15.4182390171038 | etot = -14.6424332453195 -653000 ekin = 0.0454490492582802 | erot = 0.717052285941716 | epot = -15.4049345805454 | etot = -14.6424332453455 -654000 ekin = 0.0459481524955786 | erot = 0.703990869780758 | epot = -15.392372267644 | etot = -14.6424332453677 -655000 ekin = 0.0482147495301334 | erot = 0.689552835103776 | epot = -15.3802008300181 | etot = -14.6424332453842 -656000 ekin = 0.0520838761279773 | erot = 0.673646332746782 | epot = -15.3681634542682 | etot = -14.6424332453934 -657000 ekin = 0.0573516620866903 | erot = 0.656337023113106 | epot = -15.3561219305943 | etot = -14.6424332453945 -658000 ekin = 0.0637853134946501 | erot = 0.637852348217965 | epot = -15.3440709070998 | etot = -14.6424332453872 -659000 ekin = 0.071132670288702 | erot = 0.618574815847019 | epot = -15.3321407315078 | etot = -14.6424332453721 -660000 ekin = 0.0791308828115974 | erot = 0.599023454708769 | epot = -15.3205875828708 | etot = -14.6424332453504 -661000 ekin = 0.0875139366244701 | erot = 0.579822939748188 | epot = -15.3097701216973 | etot = -14.6424332453246 -662000 ekin = 0.0960190004205403 | erot = 0.561660610348952 | epot = -15.3001128560671 | etot = -14.6424332452976 -663000 ekin = 0.104391848885285 | erot = 0.545232746056431 | epot = -15.2920578402148 | etot = -14.642433245273 -664000 ekin = 0.112391863389559 | erot = 0.531182949320054 | epot = -15.2860080579644 | etot = -14.6424332452547 -665000 ekin = 0.119797262719833 | erot = 0.520037124798717 | epot = -15.2822676327648 | etot = -14.6424332452462 -666000 ekin = 0.126411190061272 | erot = 0.512141060962375 | epot = -15.2809854962742 | etot = -14.6424332452505 -667000 ekin = 0.132069035722133 | erot = 0.507607681730257 | epot = -15.2821099627219 | etot = -14.6424332452695 -668000 ekin = 0.136646914538578 | erot = 0.50628131575487 | epot = -15.2853614755967 | etot = -14.6424332453033 -669000 ekin = 0.14007061600892 | erot = 0.507725566171504 | epot = -15.290229427531 | etot = -14.6424332453506 -670000 ekin = 0.142323740902298 | erot = 0.511239425097736 | epot = -15.2959964114079 | etot = -14.6424332454078 -671000 ekin = 0.143453306298631 | erot = 0.515903234043245 | epot = -15.3017897858122 | etot = -14.6424332454703 -672000 ekin = 0.143571012728183 | erot = 0.520652256715692 | epot = -15.3066565149759 | etot = -14.642433245532 -673000 ekin = 0.142848733833163 | erot = 0.524371563353989 | epot = -15.309653542774 | etot = -14.6424332455869 -674000 ekin = 0.141507613274597 | erot = 0.526002362927265 | epot = -15.3099432218308 | etot = -14.6424332456289 -675000 ekin = 0.139801302823325 | erot = 0.52464762902093 | epot = -15.3068821774981 | etot = -14.6424332456538 -676000 ekin = 0.137995095209364 | erot = 0.51966443903789 | epot = -15.3000927799057 | etot = -14.6424332456584 -677000 ekin = 0.136343677284965 | erot = 0.510732098514629 | epot = -15.2895090214414 | etot = -14.6424332456418 -678000 ekin = 0.135070664123434 | erot = 0.497888575253593 | epot = -15.275392484982 | etot = -14.6424332456049 -679000 ekin = 0.134352810446671 | erot = 0.481532294130257 | epot = -15.2583183501274 | etot = -14.6424332455504 -680000 ekin = 0.134310862658399 | erot = 0.462390968603737 | epot = -15.2391350767444 | etot = -14.6424332454823 -681000 ekin = 0.135007638926426 | erot = 0.441462941784009 | epot = -15.2189038261157 | etot = -14.6424332454053 -682000 ekin = 0.136452461528327 | erot = 0.419938865037714 | epot = -15.1988245718906 | etot = -14.6424332453245 -683000 ekin = 0.138609887401881 | erot = 0.399112293315981 | epot = -15.180155425963 | etot = -14.6424332452451 -684000 ekin = 0.141410065652151 | erot = 0.380287181763355 | epot = -15.1641304925875 | etot = -14.642433245172 -685000 ekin = 0.144758102725857 | erot = 0.364688846300657 | epot = -15.1518801941363 | etot = -14.6424332451098 -686000 ekin = 0.148540467122566 | erot = 0.353383275615777 | epot = -15.1443569878012 | etot = -14.6424332450628 -687000 ekin = 0.152627512101214 | erot = 0.347208212231946 | epot = -15.1422689693676 | etot = -14.6424332450344 -688000 ekin = 0.156872371009962 | erot = 0.34671840827179 | epot = -15.1460240243092 | etot = -14.6424332450275 -689000 ekin = 0.161107527975645 | erot = 0.352146941115415 | epot = -15.1556877141346 | etot = -14.6424332450435 -690000 ekin = 0.165141087380615 | erot = 0.363384304941253 | epot = -15.1709586374049 | etot = -14.642433245083 -691000 ekin = 0.16875504264815 | erot = 0.379976931154794 | epot = -15.1911652189476 | etot = -14.6424332451446 -692000 ekin = 0.171707649701913 | erot = 0.401146558394978 | epot = -15.2152874533223 | etot = -14.6424332452254 -693000 ekin = 0.173741393440548 | erot = 0.425831232784737 | epot = -15.242005871546 | etot = -14.6424332453207 -694000 ekin = 0.174597110621582 | erot = 0.452747528135183 | epot = -15.2697778841809 | etot = -14.6424332454241 -695000 ekin = 0.174033757468543 | erot = 0.480471830916593 | epot = -15.2969388339132 | etot = -14.6424332455281 -696000 ekin = 0.171852263360719 | erot = 0.507536398151815 | epot = -15.3218219071368 | etot = -14.6424332456242 -697000 ekin = 0.167921065286729 | erot = 0.532533688686105 | epot = -15.3428879996772 | etot = -14.6424332457043 -698000 ekin = 0.162200409472839 | erot = 0.554220619917834 | epot = -15.3588542751518 | etot = -14.6424332457611 -699000 ekin = 0.154762415711639 | erot = 0.571613361020687 | epot = -15.368809022521 | etot = -14.6424332457887 -700000 ekin = 0.145804230005146 | erot = 0.584063387080839 | epot = -15.3723008628696 | etot = -14.6424332457836 -701000 ekin = 0.13565226955545 | erot = 0.591306922714551 | epot = -15.3693924380152 | etot = -14.6424332457452 -702000 ekin = 0.124756460204928 | erot = 0.593482464342697 | epot = -15.3606721702232 | etot = -14.6424332456756 -703000 ekin = 0.113674325949402 | erot = 0.59111440185125 | epot = -15.3472219733801 | etot = -14.6424332455794 -704000 ekin = 0.103045675944469 | erot = 0.585064323191519 | epot = -15.3305432445998 | etot = -14.6424332454638 -705000 ekin = 0.0935593581959462 | erot = 0.576454826530277 | epot = -15.3124474300635 | etot = -14.6424332453373 -706000 ekin = 0.0859140824288432 | erot = 0.566573150252908 | epot = -15.2949204778911 | etot = -14.6424332452093 -707000 ekin = 0.0807756759568232 | erot = 0.55676342760618 | epot = -15.279972348653 | etot = -14.64243324509 -708000 ekin = 0.0787333622616465 | erot = 0.54831685528832 | epot = -15.2694834625381 | etot = -14.6424332449882 -709000 ekin = 0.0802577669172614 | erot = 0.542368667951201 | epot = -15.2650596797804 | etot = -14.642433244912 -710000 ekin = 0.0856633545554371 | erot = 0.539809747046566 | epot = -15.2679063464696 | etot = -14.6424332448676 -711000 ekin = 0.0950778519056249 | erot = 0.541219180888583 | epot = -15.2787302776533 | etot = -14.642433244859 -712000 ekin = 0.108420876625254 | erot = 0.546822307908553 | epot = -15.2976764294217 | etot = -14.6424332448878 -713000 ekin = 0.125393451698048 | erot = 0.556476834654628 | epot = -15.3243035313057 | etot = -14.642433244953 -714000 ekin = 0.145479367624672 | erot = 0.569687600116107 | epot = -15.3576002127918 | etot = -14.642433245051 -715000 ekin = 0.167958541120004 | erot = 0.585648522299775 | epot = -15.396040308596 | etot = -14.6424332451762 -716000 ekin = 0.191931735854258 | erot = 0.603308292528111 | epot = -15.4376732737035 | etot = -14.6424332453212 -717000 ekin = 0.216355400179739 | erot = 0.621454592033966 | epot = -15.4802432376909 | etot = -14.6424332454772 -718000 ekin = 0.240085056513045 | erot = 0.638810139728873 | epot = -15.5213284418766 | etot = -14.6424332456347 -719000 ekin = 0.261925698577652 | erot = 0.654132895984068 | epot = -15.5584918403458 | etot = -14.6424332457841 -720000 ekin = 0.280687969313521 | erot = 0.666312379865826 | epot = -15.5894335950958 | etot = -14.6424332459165 -721000 ekin = 0.295249345590636 | erot = 0.674454385927398 | epot = -15.6121369775414 | etot = -14.6424332460234 -722000 ekin = 0.304619886334687 | erot = 0.677947410255859 | epot = -15.6250005426882 | etot = -14.6424332460976 -723000 ekin = 0.308011983728321 | erot = 0.676505724572276 | epot = -15.6269509544342 | etot = -14.6424332461336 -724000 ekin = 0.304912667284023 | erot = 0.670186105902545 | epot = -15.6175320193137 | etot = -14.6424332461272 -725000 ekin = 0.295155116710468 | erot = 0.659377522493427 | epot = -15.5969658852801 | etot = -14.6424332460762 -726000 ekin = 0.278983134898227 | erot = 0.644765363163313 | epot = -15.5661817440425 | etot = -14.6424332459809 -727000 ekin = 0.257098790791736 | erot = 0.62727386036856 | epot = -15.5268058970048 | etot = -14.6424332458445 -728000 ekin = 0.230680158271606 | erot = 0.607992016186632 | epot = -15.4811054201315 | etot = -14.6424332456733 -729000 ekin = 0.201354496272774 | erot = 0.58808946404084 | epot = -15.4318772057915 | etot = -14.6424332454779 -730000 ekin = 0.171114103975002 | erot = 0.568729214722098 | epot = -15.3822765639698 | etot = -14.6424332452727 -731000 ekin = 0.142168923907796 | erot = 0.550984135076758 | epot = -15.33558630406 | etot = -14.6424332450754 -732000 ekin = 0.116742007096204 | erot = 0.535763349049472 | epot = -15.2949386010509 | etot = -14.6424332449052 -733000 ekin = 0.096829302753487 | erot = 0.523753647326654 | epot = -15.2630161948605 | etot = -14.6424332447804 -734000 ekin = 0.0839596135584424 | erot = 0.515379592342729 | epot = -15.2417724506162 | etot = -14.642433244715 -735000 ekin = 0.0789983701762927 | erot = 0.510784464199122 | epot = -15.2322160790918 | etot = -14.6424332447164 -736000 ekin = 0.0820355551920711 | erot = 0.509832642268435 | epot = -15.2343014422439 | etot = -14.6424332447834 -737000 ekin = 0.0923827123854171 | erot = 0.512132550856583 | epot = -15.2469485081483 | etot = -14.6424332449063 -738000 ekin = 0.108680448513047 | erot = 0.517077971027771 | epot = -15.2681916646097 | etot = -14.6424332450689 -739000 ekin = 0.12909371568261 | erot = 0.523904364926295 | epot = -15.2954313258598 | etot = -14.6424332452509 -740000 ekin = 0.151555277793257 | erot = 0.531755895778738 | epot = -15.325744419004 | etot = -14.642433245432 -741000 ekin = 0.174012721805987 | erot = 0.539758083452137 | epot = -15.3562040508521 | etot = -14.642433245594 -742000 ekin = 0.194640916830775 | erot = 0.54709054969783 | epot = -15.3841647122517 | etot = -14.6424332457231 -743000 ekin = 0.211995737397994 | erot = 0.55305412533586 | epot = -15.4074831085444 | etot = -14.6424332458105 -744000 ekin = 0.225100508722061 | erot = 0.557126762308091 | epot = -15.4246605168829 | etot = -14.6424332458528 -745000 ekin = 0.233469424485911 | erot = 0.559003260237678 | epot = -15.4349059305744 | etot = -14.6424332458508 -746000 ekin = 0.237079913464194 | erot = 0.558614810498956 | epot = -15.4381279697723 | etot = -14.6424332458091 -747000 ekin = 0.236308652984083 | erot = 0.556125790082259 | epot = -15.4348676888015 | etot = -14.6424332457352 -748000 ekin = 0.231845097887127 | erot = 0.551907079329901 | epot = -15.4261854228554 | etot = -14.6424332456383 -749000 ekin = 0.224593843483487 | erot = 0.5464873600296 | epot = -15.4135144490423 | etot = -14.6424332455292 -750000 ekin = 0.215574369391546 | erot = 0.540486233484958 | epot = -15.3984938482955 | etot = -14.6424332454189 -751000 ekin = 0.20582458342619 | erot = 0.53453535676443 | epot = -15.3827931855088 | etot = -14.6424332453181 -752000 ekin = 0.196313335741677 | erot = 0.52919581521799 | epot = -15.3679423961961 | etot = -14.6424332452364 -753000 ekin = 0.187866475787172 | erot = 0.524881252730799 | epot = -15.3551809736992 | etot = -14.6424332451812 -754000 ekin = 0.181110613625732 | erot = 0.521796491095835 | epot = -15.3453403498786 | etot = -14.642433245157 -755000 ekin = 0.176438042203831 | erot = 0.519900210804112 | epot = -15.338771498173 | etot = -14.6424332451651 -756000 ekin = 0.173994962646518 | erot = 0.518897676281033 | epot = -15.3353258841305 | etot = -14.642433245203 -757000 ekin = 0.173693190270087 | erot = 0.518265706177492 | epot = -15.3343921417126 | etot = -14.642433245265 -758000 ekin = 0.175243155014324 | erot = 0.517307659815626 | epot = -15.3349840601728 | etot = -14.6424332453429 -759000 ekin = 0.178203703092592 | erot = 0.515231902157781 | epot = -15.3358688506772 | etot = -14.6424332454268 -760000 ekin = 0.182042463548471 | erot = 0.511243837941775 | epot = -15.335719546997 | etot = -14.6424332455067 -761000 ekin = 0.186199747761037 | erot = 0.504639825540337 | epot = -15.3332728188748 | etot = -14.6424332455734 -762000 ekin = 0.190149235945093 | erot = 0.494891409026847 | epot = -15.3274738905913 | etot = -14.6424332456194 -763000 ekin = 0.193449921094621 | erot = 0.481710238280717 | epot = -15.3175934050151 | etot = -14.6424332456397 -764000 ekin = 0.195785552426502 | erot = 0.465087294345954 | epot = -15.3033060924046 | etot = -14.6424332456321 -765000 ekin = 0.196989678184887 | erot = 0.445303873487528 | epot = -15.2847267972695 | etot = -14.6424332455971 -766000 ekin = 0.19705591918301 | erot = 0.42291544028873 | epot = -15.2624046050093 | etot = -14.6424332455375 -767000 ekin = 0.196134076494091 | erot = 0.398712320920873 | epot = -15.2372796428729 | etot = -14.642433245458 -768000 ekin = 0.194513096652852 | erot = 0.373662938957262 | epot = -15.2106092809747 | etot = -14.6424332453646 -769000 ekin = 0.192592017627679 | erot = 0.348845887485153 | epot = -15.1838711503774 | etot = -14.6424332452645 -770000 ekin = 0.190840163686972 | erot = 0.325376840212764 | epot = -15.1586502490652 | etot = -14.6424332451654 -771000 ekin = 0.1897483972283 | erot = 0.304335529901141 | epot = -15.1365171722047 | etot = -14.6424332450753 -772000 ekin = 0.189774341851613 | erot = 0.286697153922667 | epot = -15.1189047407758 | etot = -14.6424332450016 -773000 ekin = 0.191286034501537 | erot = 0.27327185783823 | epot = -15.1069911372904 | etot = -14.6424332449506 -774000 ekin = 0.194510000609521 | erot = 0.264655458971911 | epot = -15.1015987045092 | etot = -14.6424332449277 -775000 ekin = 0.199490639679884 | erot = 0.261194193157477 | epot = -15.1031180777726 | etot = -14.6424332449353 -776000 ekin = 0.206067477066043 | erot = 0.262965803936856 | epot = -15.1114665259764 | etot = -14.6424332449735 -777000 ekin = 0.213875019086207 | erot = 0.269778568413728 | epot = -15.1260868325396 | etot = -14.6424332450396 -778000 ekin = 0.222366868965229 | erot = 0.281188790676708 | epot = -15.1459889047703 | etot = -14.6424332451284 -779000 ekin = 0.230862102269011 | erot = 0.296535944175866 | epot = -15.1698312916772 | etot = -14.6424332452323 -780000 ekin = 0.238608567019495 | erot = 0.314993169090641 | epot = -15.1960349814528 | etot = -14.6424332453427 -781000 ekin = 0.244855557741785 | erot = 0.335629445234115 | epot = -15.2229182484261 | etot = -14.6424332454502 -782000 ekin = 0.248927612478623 | erot = 0.357478674283284 | epot = -15.2488395323078 | etot = -14.6424332455459 -783000 ekin = 0.250291897529631 | erot = 0.379610269023857 | epot = -15.2723354121756 | etot = -14.6424332456221 -784000 ekin = 0.248613283253181 | erot = 0.401195731117766 | epot = -15.2922422600437 | etot = -14.6424332456728 -785000 ekin = 0.243793133450733 | erot = 0.421566090460907 | epot = -15.3077924696054 | etot = -14.6424332456938 -786000 ekin = 0.235989501852441 | erot = 0.440255905200996 | epot = -15.3186786527368 | etot = -14.6424332456834 -787000 ekin = 0.225617610784245 | erot = 0.457030673426574 | epot = -15.3250815298531 | etot = -14.6424332456423 -788000 ekin = 0.213330260901315 | erot = 0.471895861690424 | epot = -15.3276593681654 | etot = -14.6424332455737 -789000 ekin = 0.199978499676675 | erot = 0.485087183877963 | epot = -15.3274989290377 | etot = -14.6424332454831 -790000 ekin = 0.186553834702789 | erot = 0.497043141238414 | epot = -15.326030221319 | etot = -14.6424332453778 -791000 ekin = 0.174114766792182 | erot = 0.508362048566067 | epot = -15.3249100606251 | etot = -14.6424332452668 -792000 ekin = 0.163702420431755 | erot = 0.519746739177836 | epot = -15.3258824047693 | etot = -14.6424332451597 -793000 ekin = 0.156252224966481 | erot = 0.531940822987091 | epot = -15.3306262930197 | etot = -14.6424332450661 -794000 ekin = 0.152510350035455 | erot = 0.545660777313313 | epot = -15.3406043723436 | etot = -14.6424332449949 -795000 ekin = 0.152964251159066 | erot = 0.561528326979781 | epot = -15.3569258230916 | etot = -14.6424332449528 -796000 ekin = 0.15779574735844 | erot = 0.580007578777105 | epot = -15.3802365710801 | etot = -14.6424332449446 -797000 ekin = 0.16686245785925 | erot = 0.601351255568902 | epot = -15.4106469584001 | etot = -14.6424332449719 -798000 ekin = 0.179709603433403 | erot = 0.625560121844854 | epot = -15.447702970312 | etot = -14.6424332450337 -799000 ekin = 0.19560996606243 | erot = 0.652359247175797 | epot = -15.4904024583644 | etot = -14.6424332451262 -800000 ekin = 0.213626158791752 | erot = 0.681194021872627 | epot = -15.5372534259076 | etot = -14.6424332452433 -801000 ekin = 0.232687040193831 | erot = 0.711247726385194 | epot = -15.5863680119562 | etot = -14.6424332453772 -802000 ekin = 0.251669429106228 | erot = 0.741480919834361 | epot = -15.6355835944599 | etot = -14.6424332455193 -803000 ekin = 0.269477067858276 | erot = 0.770691008419008 | epot = -15.6826013219375 | etot = -14.6424332456602 -804000 ekin = 0.285110541457411 | erot = 0.797588259155916 | epot = -15.7251320464043 | etot = -14.642433245791 -805000 ekin = 0.297723982505673 | erot = 0.820882528796815 | epot = -15.7610397572057 | etot = -14.6424332459032 -806000 ekin = 0.30666638768647 | erot = 0.839373432910558 | epot = -15.7884730665871 | etot = -14.6424332459901 -807000 ekin = 0.311506975554916 | erot = 0.852035914442971 | epot = -15.8059761360442 | etot = -14.6424332460463 -808000 ekin = 0.312045176252063 | erot = 0.858093398525486 | epot = -15.8125718208464 | etot = -14.6424332460689 -809000 ekin = 0.30830664238606 | erot = 0.857071970756237 | epot = -15.8078118591993 | etot = -14.642433246057 -810000 ekin = 0.300527220558558 | erot = 0.848831113926852 | epot = -15.7917915804976 | etot = -14.6424332460122 -811000 ekin = 0.28912720441781 | erot = 0.833569138620822 | epot = -15.7651295889765 | etot = -14.6424332459379 -812000 ekin = 0.2746784275983 | erot = 0.811804116492284 | epot = -15.7289157899297 | etot = -14.6424332458392 -813000 ekin = 0.257866835579241 | erot = 0.784333459542523 | epot = -15.684633540844 | etot = -14.6424332457223 -814000 ekin = 0.23945308058914 | erot = 0.752176980196793 | epot = -15.63406330638 | etot = -14.6424332455941 -815000 ekin = 0.220233415146368 | erot = 0.716509170267457 | epot = -15.5791758308754 | etot = -14.6424332454616 -816000 ekin = 0.20100275104127 | erot = 0.678586569749112 | epot = -15.5220225661217 | etot = -14.6424332453314 -817000 ekin = 0.182521261074943 | erot = 0.639675603866084 | epot = -15.4646301101505 | etot = -14.6424332452094 -818000 ekin = 0.165485401522765 | erot = 0.600985363832454 | epot = -15.4089040104563 | etot = -14.642433245101 -819000 ekin = 0.150503789775692 | erot = 0.563608719249991 | epot = -15.3565457540359 | etot = -14.6424332450102 -820000 ekin = 0.138078032174242 | erot = 0.528474068972577 | epot = -15.308985346087 | etot = -14.6424332449401 -821000 ekin = 0.128588386726507 | erot = 0.496309093117288 | epot = -15.2673307247366 | etot = -14.6424332448928 -822000 ekin = 0.122284066133886 | erot = 0.467617125514411 | epot = -15.2323344365174 | etot = -14.6424332448691 -823000 ekin = 0.119278020922195 | erot = 0.44266622847641 | epot = -15.2043774942678 | etot = -14.6424332448692 -824000 ekin = 0.119546158602377 | erot = 0.42149068273525 | epot = -15.1834700862294 | etot = -14.6424332448917 -825000 ekin = 0.122931110514134 | erot = 0.403904342219283 | epot = -15.1692686976682 | etot = -14.6424332449348 -826000 ekin = 0.129150803764817 | erot = 0.389525074994505 | epot = -15.1611091237546 | etot = -14.6424332449952 -827000 ekin = 0.137812176400569 | erot = 0.377809252264071 | epot = -15.158054673734 | etot = -14.6424332450694 -828000 ekin = 0.148430331610645 | erot = 0.368094906955542 | epot = -15.1589584837187 | etot = -14.6424332451525 -829000 ekin = 0.160453205764771 | erot = 0.359651737504109 | epot = -15.162538188508 | etot = -14.6424332452391 -830000 ekin = 0.173291382900576 | erot = 0.351735589536987 | epot = -15.1674602177612 | etot = -14.6424332453236 -831000 ekin = 0.186352012967387 | erot = 0.343644456321394 | epot = -15.172429714689 | etot = -14.6424332454002 -832000 ekin = 0.199074924610329 | erot = 0.334772487912646 | epot = -15.1762806579866 | etot = -14.6424332454636 -833000 ekin = 0.210968084885631 | erot = 0.324658115180747 | epot = -15.1780594455754 | etot = -14.6424332455091 -834000 ekin = 0.221638757262098 | erot = 0.313022323434907 | epot = -15.1770943262305 | etot = -14.6424332455335 -835000 ekin = 0.230816330006855 | erot = 0.299793483319955 | epot = -15.1730430588624 | etot = -14.6424332455356 -836000 ekin = 0.238363132178622 | erot = 0.285116039954994 | epot = -15.1659124176498 | etot = -14.6424332455161 -837000 ekin = 0.244270841534611 | erot = 0.269341751254713 | epot = -15.1560458382673 | etot = -14.642433245478 -838000 ekin = 0.248642320238308 | erot = 0.253003904099878 | epot = -15.144079469764 | etot = -14.6424332454258 -839000 ekin = 0.25166156932901 | erot = 0.236776758984113 | epot = -15.1308715736783 | etot = -14.6424332453652 -840000 ekin = 0.253557306828157 | erot = 0.221424057159315 | epot = -15.11741460929 | etot = -14.6424332453026 -841000 ekin = 0.254567562695185 | erot = 0.207741475742172 | epot = -15.1047422836805 | etot = -14.6424332452432 -842000 ekin = 0.254912814680605 | erot = 0.196498262353501 | epot = -15.0938443222254 | etot = -14.6424332451913 -843000 ekin = 0.254783130761291 | erot = 0.18838292178676 | epot = -15.0855992976977 | etot = -14.6424332451496 -844000 ekin = 0.254340789692194 | erot = 0.183956927272137 | epot = -15.0807309620835 | etot = -14.6424332451192 -845000 ekin = 0.253734932885203 | erot = 0.183619247980828 | epot = -15.0797874259659 | etot = -14.6424332450999 -846000 ekin = 0.253120504189253 | erot = 0.187583282240151 | epot = -15.0831370315206 | etot = -14.6424332450911 -847000 ekin = 0.25267165008145 | erot = 0.195866742639383 | epot = -15.0909716378134 | etot = -14.6424332450925 -848000 ekin = 0.252580915304042 | erot = 0.208294222463338 | epot = -15.1033083828718 | etot = -14.6424332451044 -849000 ekin = 0.25303996684305 | erot = 0.224511555531943 | epot = -15.1199847675022 | etot = -14.6424332451272 -850000 ekin = 0.254204001794731 | erot = 0.244010590097857 | epot = -15.1406478370545 | etot = -14.6424332451619 -851000 ekin = 0.256148339024686 | erot = 0.26616256360269 | epot = -15.1647441478359 | etot = -14.6424332452085 -852000 ekin = 0.258829686440298 | erot = 0.290257858698357 | epot = -15.1915207904045 | etot = -14.6424332452658 -853000 ekin = 0.262064657830092 | erot = 0.315549558168062 | epot = -15.2200474613289 | etot = -14.6424332453308 -854000 ekin = 0.265534116125796 | erot = 0.341297947737011 | epot = -15.2492653092615 | etot = -14.6424332453987 -855000 ekin = 0.268815174658096 | erot = 0.366813004431933 | epot = -15.2780614245538 | etot = -14.6424332454637 -856000 ekin = 0.271435486960135 | erot = 0.391492007902975 | epot = -15.3053607403827 | etot = -14.6424332455196 -857000 ekin = 0.272939108069148 | erot = 0.414849750475493 | epot = -15.3302221041057 | etot = -14.642433245561 -858000 ekin = 0.272951155046116 | erot = 0.43653939069067 | epot = -15.3519237913208 | etot = -14.642433245584 -859000 ekin = 0.271229880682587 | erot = 0.456362750062525 | epot = -15.3700258763315 | etot = -14.6424332455864 -860000 ekin = 0.267698633839444 | erot = 0.474269718464337 | epot = -15.3844015978728 | etot = -14.642433245569 -861000 ekin = 0.262455001757546 | erot = 0.490347316011832 | epot = -15.395235563303 | etot = -14.6424332455336 -862000 ekin = 0.255758797180207 | erot = 0.504799761303166 | epot = -15.4029918039675 | etot = -14.6424332454841 -863000 ekin = 0.248003564343611 | erot = 0.517921532816755 | epot = -15.4083583425855 | etot = -14.6424332454251 -864000 ekin = 0.23967765558561 | erot = 0.530065823507455 | epot = -15.4121767244549 | etot = -14.6424332453618 -865000 ekin = 0.23132088944464 | erot = 0.541610953537996 | epot = -15.4153650882815 | etot = -14.6424332452989 -866000 ekin = 0.223481813674061 | erot = 0.552927233335028 | epot = -15.41884229225 | etot = -14.6424332452409 -867000 ekin = 0.216679174488308 | erot = 0.564346499434596 | epot = -15.4234589191144 | etot = -14.6424332451915 -868000 ekin = 0.211369750013263 | erot = 0.576136138940125 | epot = -15.4299391341069 | etot = -14.6424332451535 -869000 ekin = 0.207923502302183 | erot = 0.588478941151671 | epot = -15.4388356885827 | etot = -14.6424332451288 -870000 ekin = 0.206606152993329 | erot = 0.601459626889461 | epot = -15.4504990250012 | etot = -14.6424332451184 -871000 ekin = 0.207568796750739 | erot = 0.615058451103504 | epot = -15.4650604929769 | etot = -14.6424332451226 -872000 ekin = 0.210843969893675 | erot = 0.629151875756264 | epot = -15.4824290907906 | etot = -14.6424332451407 -873000 ekin = 0.216347593110829 | erot = 0.643519970829237 | epot = -15.5023008091114 | etot = -14.6424332451714 -874000 ekin = 0.223886305134919 | erot = 0.657859909725313 | epot = -15.5241794600729 | etot = -14.6424332452126 -875000 ekin = 0.233169807544942 | erot = 0.671804662204777 | epot = -15.5474077150118 | etot = -14.6424332452621 -876000 ekin = 0.243827877956003 | erot = 0.684945735793168 | epot = -15.5712068590658 | etot = -14.6424332453167 -877000 ekin = 0.255431632539201 | erot = 0.696858567347312 | epot = -15.5947234452596 | etot = -14.6424332453731 -878000 ekin = 0.267518408507603 | erot = 0.707128927381253 | epot = -15.6170805813169 | etot = -14.642433245428 -879000 ekin = 0.279619300254697 | erot = 0.715378495713559 | epot = -15.6374310414462 | etot = -14.642433245478 -880000 ekin = 0.291287955017646 | erot = 0.721287639191614 | epot = -15.6550088397293 | etot = -14.64243324552 -881000 ekin = 0.30212877846337 | erot = 0.724613422803328 | epot = -15.6691754468184 | etot = -14.6424332455517 -882000 ekin = 0.31182230406922 | erot = 0.725201068169744 | epot = -15.6794566178103 | etot = -14.6424332455713 -883000 ekin = 0.32014524378975 | erot = 0.722987481097383 | epot = -15.6855659704652 | etot = -14.6424332455781 -884000 ekin = 0.326982762202525 | erot = 0.71799612015275 | epot = -15.6874121279281 | etot = -14.6424332455729 -885000 ekin = 0.332330882217529 | erot = 0.710323349666018 | epot = -15.6850874774407 | etot = -14.6424332455572 -886000 ekin = 0.336287673337269 | erot = 0.700117442970509 | epot = -15.6788383618419 | etot = -14.6424332455341 -887000 ekin = 0.339032964158867 | erot = 0.687552454431532 | epot = -15.6690186640977 | etot = -14.6424332455073 -888000 ekin = 0.340797654552277 | erot = 0.672800100940224 | epot = -15.6560310009735 | etot = -14.642433245481 -889000 ekin = 0.341825106167264 | erot = 0.656003407097172 | epot = -15.6402617587239 | etot = -14.6424332454594 -890000 ekin = 0.34232834758349 | erot = 0.637256013160967 | epot = -15.6220176061905 | etot = -14.642433245446 -891000 ekin = 0.342447730500064 | erot = 0.616590618565621 | epot = -15.6014715945091 | etot = -14.6424332454435 -892000 ekin = 0.342214057419122 | erot = 0.593979026502071 | epot = -15.5786263293741 | etot = -14.6424332454529 -893000 ekin = 0.341522004916641 | erot = 0.569344767729577 | epot = -15.55330001812 | etot = -14.6424332454737 -894000 ekin = 0.34011793412299 | erot = 0.54258751991292 | epot = -15.5251386995396 | etot = -14.6424332455037 -895000 ekin = 0.337605044786632 | erot = 0.513616778977975 | epot = -15.4936550693037 | etot = -14.6424332455391 -896000 ekin = 0.333467462875063 | erot = 0.48239077517222 | epot = -15.4582914836221 | etot = -14.6424332455748 -897000 ekin = 0.327113397523359 | erot = 0.44895570900175 | epot = -15.4185023521299 | etot = -14.6424332456048 -898000 ekin = 0.31793601762133 | erot = 0.413480165458452 | epot = -15.3738494287026 | etot = -14.6424332456228 -899000 ekin = 0.305389123796087 | erot = 0.376280077469223 | epot = -15.3241024468879 | etot = -14.6424332456226 -900000 ekin = 0.289072881395307 | erot = 0.337830752319189 | epot = -15.2693368793129 | etot = -14.6424332455984 -901000 ekin = 0.268822686259832 | erot = 0.298764046957366 | epot = -15.2100199787633 | etot = -14.6424332455461 -902000 ekin = 0.244791653969177 | erot = 0.259850521117947 | epot = -15.1470754205501 | etot = -14.642433245463 -903000 ekin = 0.217514571462771 | erot = 0.2219680472104 | epot = -15.0819158640225 | etot = -14.6424332453494 -904000 ekin = 0.187939204411673 | erot = 0.186059692012536 | epot = -15.0164321416331 | etot = -14.6424332452089 -905000 ekin = 0.157410847731541 | erot = 0.153084564883788 | epot = -14.9529286576644 | etot = -14.642433245049 -906000 ekin = 0.127599356271593 | erot = 0.123965703545267 | epot = -14.8939983046982 | etot = -14.6424332448813 -907000 ekin = 0.100365589130959 | erot = 0.0995389863896934 | epot = -14.8423378202412 | etot = -14.6424332447206 -908000 ekin = 0.0775759855948257 | erot = 0.0805066337401618 | epot = -14.800515863918 | etot = -14.642433244583 -909000 ekin = 0.060887695003573 | erot = 0.0673982354567931 | epot = -14.7707191749444 | etot = -14.642433244484 -910000 ekin = 0.051538292299 | erot = 0.0605415547707063 | epot = -14.7545130915056 | etot = -14.6424332444358 -911000 ekin = 0.0501789452911415 | erot = 0.060044698962114 | epot = -14.7526568886979 | etot = -14.6424332444447 -912000 ekin = 0.0567846925755186 | erot = 0.0657906450223113 | epot = -14.7650085821073 | etot = -14.6424332445095 -913000 ekin = 0.0706603747974273 | erot = 0.0774445361857558 | epot = -14.7905381556057 | etot = -14.6424332446226 -914000 ekin = 0.0905398584141984 | erot = 0.0944735694284727 | epot = -14.8274466726133 | etot = -14.6424332447706 -915000 ekin = 0.114756144633711 | erot = 0.116178630204803 | epot = -14.8733680197762 | etot = -14.6424332449377 -916000 ekin = 0.141447043407485 | erot = 0.141736093135474 | epot = -14.9256163816503 | etot = -14.6424332451073 -917000 ekin = 0.168758535424653 | erot = 0.170247440484187 | epot = -14.9814392211744 | etot = -14.6424332452655 -918000 ekin = 0.195014913443802 | erot = 0.200793639363233 | epot = -15.0382417982084 | etot = -14.6424332454014 -919000 ekin = 0.218837422087009 | erot = 0.232490666330172 | epot = -15.093761333925 | etot = -14.6424332455079 -920000 ekin = 0.239206641026131 | erot = 0.26454226708574 | epot = -15.1461821536939 | etot = -14.642433245582 -921000 ekin = 0.255474577150064 | erot = 0.296286050795975 | epot = -15.1941938735697 | etot = -14.6424332456236 -922000 ekin = 0.267338631216169 | erot = 0.327229363199175 | epot = -15.2370012400502 | etot = -14.6424332456349 -923000 ekin = 0.274791412213632 | erot = 0.357072039931877 | epot = -15.2742966977651 | etot = -14.6424332456196 -924000 ekin = 0.278059017514887 | erot = 0.385714059427459 | epot = -15.3062063225249 | etot = -14.6424332455826 -925000 ekin = 0.277537405166048 | erot = 0.413247220090753 | epot = -15.333217870786 | etot = -14.6424332455292 -926000 ekin = 0.273733135235252 | erot = 0.439931173657219 | epot = -15.3560975543576 | etot = -14.6424332454651 -927000 ekin = 0.267211859637779 | erot = 0.466155363878472 | epot = -15.3758004689124 | etot = -14.6424332453961 -928000 ekin = 0.25855584753175 | erot = 0.492389553499223 | epot = -15.3933786463589 | etot = -14.6424332453279 -929000 ekin = 0.248330567887068 | erot = 0.519126582978688 | epot = -15.4098903961314 | etot = -14.6424332452656 -930000 ekin = 0.237059747160937 | erot = 0.54682171162893 | epot = -15.426314704004 | etot = -14.6424332452141 -931000 ekin = 0.225208144800282 | erot = 0.575833282920741 | epot = -15.4434746728982 | etot = -14.6424332451772 -932000 ekin = 0.213171319360079 | erot = 0.606369490848937 | epot = -15.4619740553667 | etot = -14.6424332451577 -933000 ekin = 0.20127172299004 | erot = 0.63844569037598 | epot = -15.4821506585232 | etot = -14.6424332451571 -934000 ekin = 0.189760460104316 | erot = 0.671856006696139 | epot = -15.5040497119762 | etot = -14.6424332451757 -935000 ekin = 0.178823941832674 | erot = 0.70616199658427 | epot = -15.527419183629 | etot = -14.6424332452121 -936000 ekin = 0.168594479109506 | erot = 0.740699865834002 | epot = -15.5517275902073 | etot = -14.6424332452638 -937000 ekin = 0.159163635629787 | erot = 0.774606336202774 | epot = -15.5762032171595 | etot = -14.6424332453269 -938000 ekin = 0.15059697191027 | erot = 0.806861786792913 | epot = -15.5998920041001 | etot = -14.6424332453969 -939000 ekin = 0.14294871162838 | erot = 0.836347883523471 | epot = -15.6217298406203 | etot = -14.6424332454684 -940000 ekin = 0.136274889167807 | erot = 0.861915676025906 | epot = -15.6406238107299 | etot = -14.6424332455362 -941000 ekin = 0.130643703196332 | erot = 0.882459199117971 | epot = -15.6555361479093 | etot = -14.642433245595 -942000 ekin = 0.126142088158943 | erot = 0.89698906517013 | epot = -15.6655643989695 | etot = -14.6424332456404 -943000 ekin = 0.122877886109216 | erot = 0.904700444357472 | epot = -15.6700115761356 | etot = -14.6424332456689 -944000 ekin = 0.120977407411876 | erot = 0.905030230236174 | epot = -15.6684408833264 | etot = -14.6424332456784 -945000 ekin = 0.120578563691194 | erot = 0.897699054745601 | epot = -15.6607108641049 | etot = -14.6424332456681 -946000 ekin = 0.121820103594628 | erot = 0.88273507092903 | epot = -15.6469884201622 | etot = -14.6424332456386 -947000 ekin = 0.124827761130735 | erot = 0.860477935597424 | epot = -15.6277389423202 | etot = -14.642433245592 -948000 ekin = 0.129698334170688 | erot = 0.831563037039339 | epot = -15.6036946167418 | etot = -14.6424332455318 -949000 ekin = 0.136482857560386 | erot = 0.796887554723775 | epot = -15.5758036577462 | etot = -14.6424332454621 -950000 ekin = 0.145170138933456 | erot = 0.757561255989872 | epot = -15.5451646403111 | etot = -14.6424332453878 -951000 ekin = 0.155672002997282 | erot = 0.714845916095117 | epot = -15.5129511644064 | etot = -14.642433245314 -952000 ekin = 0.167811650838071 | erot = 0.67008783325117 | epot = -15.480332729335 | etot = -14.6424332452457 -953000 ekin = 0.1813165794726 | erot = 0.62464809521225 | epot = -15.4483979198723 | etot = -14.6424332451874 -954000 ekin = 0.19581750070188 | erot = 0.57983508069521 | epot = -15.4180858265396 | etot = -14.6424332451425 -955000 ekin = 0.21085460687665 | erot = 0.536843219767247 | epot = -15.3901310717574 | etot = -14.6424332451135 -956000 ekin = 0.225892299836444 | erot = 0.496701376788955 | epot = -15.3650269217267 | etot = -14.6424332451013 -957000 ekin = 0.240343066496815 | erot = 0.460233438090351 | epot = -15.3430097496926 | etot = -14.6424332451055 -958000 ekin = 0.253600493836713 | erot = 0.428032849889673 | epot = -15.3240665888504 | etot = -14.642433245124 -959000 ekin = 0.26508043374484 | erot = 0.400452005453744 | epot = -15.3079656843521 | etot = -14.6424332451535 -960000 ekin = 0.274268068126469 | erot = 0.3776065494438 | epot = -15.2943078627599 | etot = -14.6424332451896 -961000 ekin = 0.280767177999005 | erot = 0.359393861243336 | epot = -15.2825942844696 | etot = -14.6424332452273 -962000 ekin = 0.284346484058609 | erot = 0.345524198810109 | epot = -15.2723039281299 | etot = -14.6424332452611 -963000 ekin = 0.284976816085041 | erot = 0.335562232322697 | epot = -15.2629722936944 | etot = -14.6424332452867 -964000 ekin = 0.282852494243525 | erot = 0.32897598649065 | epot = -15.2542617260345 | etot = -14.6424332453003 -965000 ekin = 0.278391086611735 | erot = 0.325189577593081 | epot = -15.2460139095051 | etot = -14.6424332453002 -966000 ekin = 0.272207924676681 | erot = 0.32363564014577 | epot = -15.2382768101091 | etot = -14.6424332452866 -967000 ekin = 0.265065367869008 | erot = 0.323803079983236 | epot = -15.2313016931137 | etot = -14.6424332452614 -968000 ekin = 0.25780129371369 | erot = 0.325275872287489 | epot = -15.2255104112296 | etot = -14.6424332452284 -969000 ekin = 0.251245661475409 | erot = 0.327759142573897 | epot = -15.2214380492417 | etot = -14.6424332451924 -970000 ekin = 0.246137008995692 | erot = 0.331089781179722 | epot = -15.2196600353337 | etot = -14.6424332451582 -971000 ekin = 0.243051319619915 | erot = 0.335230325664632 | epot = -15.2207148904151 | etot = -14.6424332451306 -972000 ekin = 0.242353409643559 | erot = 0.340246678804852 | epot = -15.2250333335614 | etot = -14.642433245113 -973000 ekin = 0.244176338167963 | erot = 0.346272190711359 | epot = -15.2328817739871 | etot = -14.6424332451077 -974000 ekin = 0.248428661663719 | erot = 0.353462430362792 | epot = -15.2443243371426 | etot = -14.6424332451161 -975000 ekin = 0.254824314808527 | erot = 0.361946299431624 | epot = -15.2592038593783 | etot = -14.6424332451381 -976000 ekin = 0.262926848825399 | erot = 0.371779749930863 | epot = -15.2771398439293 | etot = -14.6424332451731 -977000 ekin = 0.272199235334822 | erot = 0.382908123264924 | epot = -15.2975406038191 | etot = -14.6424332452194 -978000 ekin = 0.282052066854486 | erot = 0.395142048097982 | epot = -15.3196273602273 | etot = -14.6424332452748 -979000 ekin = 0.291885751915432 | erot = 0.408150081471576 | epot = -15.3424690787237 | etot = -14.6424332453367 -980000 ekin = 0.301125083790032 | erot = 0.421469125222411 | epot = -15.365027454414 | etot = -14.6424332454016 -981000 ekin = 0.309246535916151 | erot = 0.434531423655712 | epot = -15.3862112050375 | etot = -14.6424332454657 -982000 ekin = 0.315799497488435 | erot = 0.446704965615556 | epot = -15.4049377086287 | etot = -14.6424332455247 -983000 ekin = 0.320422573217695 | erot = 0.457342632742344 | epot = -15.4201984515349 | etot = -14.6424332455749 -984000 ekin = 0.322855465254384 | erot = 0.465834622597573 | epot = -15.4311233334643 | etot = -14.6424332456124 -985000 ekin = 0.322946302470594 | erot = 0.471658590972097 | epot = -15.4370381390772 | etot = -14.6424332456345 -986000 ekin = 0.32065391780096 | erot = 0.47442255658858 | epot = -15.437509720029 | etot = -14.6424332456394 -987000 ekin = 0.316044627357463 | erot = 0.473896755513782 | epot = -15.432374628498 | etot = -14.6424332456268 -988000 ekin = 0.309283477264372 | erot = 0.470032116943487 | epot = -15.421748839805 | etot = -14.6424332455972 -989000 ekin = 0.300620522165357 | erot = 0.462964620620384 | epot = -15.4060183883382 | etot = -14.6424332455525 -990000 ekin = 0.290373280688083 | erot = 0.453006262993474 | epot = -15.3858127891769 | etot = -14.6424332454953 -991000 ekin = 0.27890691570339 | erot = 0.440624526217875 | epot = -15.3619646873503 | etot = -14.642433245429 -992000 ekin = 0.266613826413786 | erot = 0.426413006889876 | epot = -15.3354600786606 | etot = -14.642433245357 -993000 ekin = 0.253894212446129 | erot = 0.411056197523116 | epot = -15.3073836552521 | etot = -14.6424332452828 -994000 ekin = 0.241138837000641 | erot = 0.3952913723868 | epot = -15.2788634545973 | etot = -14.6424332452098 -995000 ekin = 0.228714768908433 | erot = 0.379870207853254 | epot = -15.2510182219026 | etot = -14.6424332451409 -996000 ekin = 0.216954417472708 | erot = 0.365522282704992 | epot = -15.2249099452563 | etot = -14.6424332450786 -997000 ekin = 0.206147766459094 | erot = 0.352922066135596 | epot = -15.2015030776196 | etot = -14.6424332450249 -998000 ekin = 0.196537413161582 | erot = 0.342660495987547 | epot = -15.1816311541306 | etot = -14.6424332449815 -999000 ekin = 0.188315843917336 | erot = 0.335221830001114 | epot = -15.1659709188676 | etot = -14.6424332449491 -1000000 ekin = 0.1816243230724 | erot = 0.33096613964385 | epot = -15.155023707645 | etot = -14.6424332449287 - 1000000 0.013453654 -1.5270261 0.011523695 -1.4973399 -8.4815516e-05 -Loop time of 15.696 on 1 procs for 1000000 steps with 10 atoms - -Performance: 55045.770 tau/day, 63710.382 timesteps/s -99.6% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 11.973 | 11.973 | 11.973 | 0.0 | 76.28 -Bond | 0.57492 | 0.57492 | 0.57492 | 0.0 | 3.66 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 0.18391 | 0.18391 | 0.18391 | 0.0 | 1.17 -Output | 8e-06 | 8e-06 | 8e-06 | 0.0 | 0.00 -Modify | 2.7068 | 2.7068 | 2.7068 | 0.0 | 17.25 -Other | | 0.2573 | | | 1.64 - -Nlocal: 10.0 ave 10.0 max 10.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 37.0 ave 37.0 max 37.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 37 -Ave neighs/atom = 3.7 -Ave special neighs/atom = 3.6 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:15 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.4 deleted file mode 100644 index ec5364e4bb..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.30Jun20.duplex1.g++.4 +++ /dev/null @@ -1,1175 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - - - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex1 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 10 atoms - reading velocities ... - 10 velocities - 10 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 8 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.003 seconds -set atom * mass 3.1575 - 10 settings made for mass - -group all type 1 4 -10 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna/fene -bond_coeff * 2.0 0.25 0.7525 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk -pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 - -# NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 1.9560004 - ghost atom cutoff = 2.5 - binsize = 0.97800022, bins = 41 41 41 - 5 neighbor lists, perpetual/occasional/extra = 5 0 0 - (1) pair oxdna/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -0 ekin = 0 | erot = 0 | epot = -14.6424332448164 | etot = -14.6424332448164 -Per MPI rank memory allocation (min/avg/max) = 7.605 | 7.662 | 7.719 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.4711818 0.0069384985 -1.4642433 2.5836586e-06 -1000 ekin = 0.00113448721737009 | erot = 0.0041345594773427 | epot = -14.6477022915193 | etot = -14.6424332448246 -2000 ekin = 0.00449927223902292 | erot = 0.0164446434455803 | epot = -14.6633771605337 | etot = -14.6424332448491 -3000 ekin = 0.00997964450840756 | erot = 0.0366523356056466 | epot = -14.6890652250033 | etot = -14.6424332448892 -4000 ekin = 0.017388811129498 | erot = 0.0643039804300251 | epot = -14.7241260365031 | etot = -14.6424332449436 -5000 ekin = 0.0264744514136422 | erot = 0.0987844033142134 | epot = -14.7676920997383 | etot = -14.6424332450104 -6000 ekin = 0.0369277948555727 | erot = 0.13933657105258 | epot = -14.8186976109956 | etot = -14.6424332450875 -7000 ekin = 0.0483950557190949 | erot = 0.185086295692109 | epot = -14.8759145965832 | etot = -14.642433245172 -8000 ekin = 0.0604909336919856 | erot = 0.235071307523581 | epot = -14.9379954864767 | etot = -14.6424332452611 -9000 ekin = 0.0728137406439518 | erot = 0.288273694501615 | epot = -15.003520680497 | etot = -14.6424332453514 -10000 ekin = 0.0849615563084574 | erot = 0.343654369293589 | epot = -15.0710491710418 | etot = -14.6424332454398 -11000 ekin = 0.0965486715044103 | erot = 0.400187932108393 | epot = -15.1391698491357 | etot = -14.6424332455229 -12000 ekin = 0.107221466282716 | erot = 0.456896095459393 | epot = -15.2065508073401 | etot = -14.642433245598 -13000 ekin = 0.116672809719361 | erot = 0.512877765427945 | epot = -15.27198382081 | etot = -14.6424332456627 -14000 ekin = 0.124654073730849 | erot = 0.567333962045501 | epot = -15.3344212814915 | etot = -14.6424332457151 -15000 ekin = 0.130983939684084 | erot = 0.619586028257145 | epot = -15.3930032136957 | etot = -14.6424332457544 -16000 ekin = 0.135553354544703 | erot = 0.66908602849033 | epot = -15.4470726288154 | etot = -14.6424332457804 -17000 ekin = 0.138326263958104 | erot = 0.715418858086098 | epot = -15.4961783678378 | etot = -14.6424332457936 -18000 ekin = 0.139336096663942 | erot = 0.758296324628463 | epot = -15.5400656670878 | etot = -14.6424332457954 -19000 ekin = 0.138678360045107 | erot = 0.797544234276633 | epot = -15.5786558401095 | etot = -14.6424332457878 -20000 ekin = 0.136500074655344 | erot = 0.833084204411832 | epot = -15.6120175248401 | etot = -14.642433245773 -21000 ekin = 0.13298706528568 | erot = 0.864912408453387 | epot = -15.6403327194924 | etot = -14.6424332457533 -22000 ekin = 0.128350288213599 | erot = 0.893077649558743 | epot = -15.6638611835035 | etot = -14.6424332457311 -23000 ekin = 0.122812385135574 | erot = 0.917661024684626 | epot = -15.6829066555285 | etot = -14.6424332457083 -24000 ekin = 0.116595521408358 | erot = 0.938759014332623 | epot = -15.6977877814273 | etot = -14.6424332456863 -25000 ekin = 0.109911323474882 | erot = 0.956471207347589 | epot = -15.7088157764886 | etot = -14.6424332456661 -26000 ekin = 0.102953426207684 | erot = 0.970893163953319 | epot = -15.7162798358093 | etot = -14.6424332456483 -27000 ekin = 0.0958928250746599 | erot = 0.982114250193934 | epot = -15.7204403209012 | etot = -14.6424332456326 -28000 ekin = 0.0888759410949697 | erot = 0.990219731539457 | epot = -15.721528918253 | etot = -14.6424332456186 -29000 ekin = 0.0820250748771988 | erot = 0.995296041202221 | epot = -15.7197543616852 | etot = -14.6424332456058 -30000 ekin = 0.0754407616837521 | erot = 0.997437949319969 | epot = -15.7153119565969 | etot = -14.6424332455932 -31000 ekin = 0.0692054432607507 | erot = 0.996756332760959 | epot = -15.708395021602 | etot = -14.6424332455803 -32000 ekin = 0.0633878377974527 | erot = 0.993385345347641 | epot = -15.6992064287111 | etot = -14.642433245566 -33000 ekin = 0.0580474070866972 | erot = 0.987487973308198 | epot = -15.6879686259451 | etot = -14.6424332455502 -34000 ekin = 0.0532383791882911 | erot = 0.979259192919845 | epot = -15.6749308176403 | etot = -14.6424332455322 -35000 ekin = 0.0490128758302368 | erot = 0.968926197405304 | epot = -15.6603723187477 | etot = -14.6424332455122 -36000 ekin = 0.0454228081405029 | erot = 0.9567454096241 | epot = -15.6446014632554 | etot = -14.6424332454908 -37000 ekin = 0.0425203357170925 | erot = 0.942996237999004 | epot = -15.6279498191848 | etot = -14.6424332454687 -38000 ekin = 0.0403568280944576 | erot = 0.927971766615168 | epot = -15.6107618401563 | etot = -14.6424332454467 -39000 ekin = 0.0389804214208548 | erot = 0.911966804108811 | epot = -15.5933804709558 | etot = -14.6424332454262 -40000 ekin = 0.0384324238853382 | erot = 0.89526395956208 | epot = -15.5761296288558 | etot = -14.6424332454084 -41000 ekin = 0.038742986040685 | erot = 0.878118672837852 | epot = -15.559294904273 | etot = -14.6424332453944 -42000 ekin = 0.0399266053637394 | erot = 0.860744395135542 | epot = -15.543104245885 | etot = -14.6424332453857 -43000 ekin = 0.0419781561012778 | erot = 0.843299365356476 | epot = -15.5277107668409 | etot = -14.6424332453831 -44000 ekin = 0.044870189409001 | erot = 0.825876603313475 | epot = -15.5131800381094 | etot = -14.6424332453869 -45000 ekin = 0.0485521857416515 | erot = 0.808498758186206 | epot = -15.4994841893249 | etot = -14.642433245397 -46000 ekin = 0.0529522094038557 | erot = 0.791119212188469 | epot = -15.486504667005 | etot = -14.6424332454127 -47000 ekin = 0.0579809824244727 | erot = 0.773630265884061 | epot = -15.4740444937409 | etot = -14.6424332454323 -48000 ekin = 0.063537784650219 | erot = 0.755878310838164 | epot = -15.4618493409424 | etot = -14.642433245454 -49000 ekin = 0.0695169124467211 | erot = 0.737684732484754 | epot = -15.4496348904071 | etot = -14.6424332454756 -50000 ekin = 0.0758129058465106 | erot = 0.71887012622011 | epot = -15.437116277562 | etot = -14.6424332454954 -51000 ekin = 0.0823226638652303 | erot = 0.699278599520668 | epot = -15.424034508898 | etot = -14.6424332455121 -52000 ekin = 0.0889431481345008 | erot = 0.678798807099979 | epot = -15.4101752007595 | etot = -14.642433245525 -53000 ekin = 0.0955646689265035 | erot = 0.657379086771082 | epot = -15.3953770012322 | etot = -14.6424332455346 -54000 ekin = 0.102061477510161 | erot = 0.635035489169246 | epot = -15.3795302122208 | etot = -14.6424332455414 -55000 ekin = 0.108282960174666 | erot = 0.611853171347221 | epot = -15.362569377068 | etot = -14.6424332455461 -56000 ekin = 0.114049426282278 | erot = 0.587982945924278 | epot = -15.3444656177552 | etot = -14.6424332455487 -57000 ekin = 0.119155806187163 | erot = 0.563635255922936 | epot = -15.3252243076589 | etot = -14.6424332455488 -58000 ekin = 0.123384552305545 | erot = 0.539073355222423 | epot = -15.3048911530734 | etot = -14.6424332455455 -59000 ekin = 0.126526300954853 | erot = 0.514606324858908 | epot = -15.2835658713509 | etot = -14.6424332455371 -60000 ekin = 0.128404399836228 | erot = 0.490581338840041 | epot = -15.261418984199 | etot = -14.6424332455227 -61000 ekin = 0.128898142361895 | erot = 0.467373892400967 | epot = -15.2387052802647 | etot = -14.6424332455018 -62000 ekin = 0.127959880289724 | erot = 0.445374820086214 | epot = -15.2157679458512 | etot = -14.6424332454752 -63000 ekin = 0.125622870624276 | erot = 0.424973765387136 | epot = -15.1930298814554 | etot = -14.642433245444 -64000 ekin = 0.121999044842464 | erot = 0.406539918572064 | epot = -15.1709722088251 | etot = -14.6424332454106 -65000 ekin = 0.117268056618549 | erot = 0.390401831020304 | epot = -15.1501031330161 | etot = -14.6424332453772 -66000 ekin = 0.111660385256518 | erot = 0.376828594078844 | epot = -15.1309222246819 | etot = -14.6424332453465 -67000 ekin = 0.105437746904479 | erot = 0.366014539811003 | epot = -15.1138855320359 | etot = -14.6424332453205 -68000 ekin = 0.0988737375602367 | erot = 0.358069014155073 | epot = -15.0993759970159 | etot = -14.6424332453006 -69000 ekin = 0.0922368286498106 | erot = 0.353011948771939 | epot = -15.0876820227094 | etot = -14.6424332452876 -70000 ekin = 0.085776901527188 | erot = 0.350775174164926 | epot = -15.0789853209741 | etot = -14.642433245282 -71000 ekin = 0.0797156921641233 | erot = 0.351208844245479 | epot = -15.0733577816928 | etot = -14.6424332452832 -72000 ekin = 0.0742409440407214 | erot = 0.354092037747167 | epot = -15.0707662270785 | etot = -14.6424332452906 -73000 ekin = 0.0695037498703868 | erot = 0.359146526961236 | epot = -15.0710835221349 | etot = -14.6424332453033 -74000 ekin = 0.0656184497426901 | erot = 0.366052769878701 | epot = -15.0741044649413 | etot = -14.6424332453199 -75000 ekin = 0.0626644690394278 | erot = 0.374467290033983 | epot = -15.0795650044125 | etot = -14.642433245339 -76000 ekin = 0.060689553509186 | erot = 0.384040683403435 | epot = -15.087163482272 | etot = -14.6424332453594 -77000 ekin = 0.0597139401241187 | erot = 0.39443549589289 | epot = -15.0965826813962 | etot = -14.6424332453792 -78000 ekin = 0.0597350629875202 | erot = 0.405343151481915 | epot = -15.107511459867 | etot = -14.6424332453976 -79000 ekin = 0.0607324264361026 | erot = 0.416499017642699 | epot = -15.1196646894919 | etot = -14.6424332454131 -80000 ekin = 0.0626722904954167 | erot = 0.42769463023874 | epot = -15.1328001661592 | etot = -14.6424332454251 -81000 ekin = 0.0655118235331535 | erot = 0.438786127849123 | epot = -15.1467311968152 | etot = -14.6424332454329 -82000 ekin = 0.0692024020836612 | erot = 0.449698113830619 | epot = -15.1613337613509 | etot = -14.6424332454367 -83000 ekin = 0.0736917936904891 | erot = 0.46042249074083 | epot = -15.1765475298676 | etot = -14.6424332454363 -84000 ekin = 0.0789250526542213 | erot = 0.471012272295178 | epot = -15.1923705703823 | etot = -14.6424332454329 -85000 ekin = 0.084844087874249 | erot = 0.481570908650499 | epot = -15.2088482419521 | etot = -14.6424332454274 -86000 ekin = 0.0913860133243872 | erot = 0.492238169206333 | epot = -15.2260574279515 | etot = -14.6424332454208 -87000 ekin = 0.0984805441186009 | erot = 0.503174014617464 | epot = -15.2440878041507 | etot = -14.6424332454146 -88000 ekin = 0.106046830302566 | erot = 0.514542076496851 | epot = -15.2630221522094 | etot = -14.64243324541 -89000 ekin = 0.113990204125935 | erot = 0.526494309539917 | epot = -15.2829177590739 | etot = -14.642433245408 -90000 ekin = 0.122199339149548 | erot = 0.539158097286353 | epot = -15.3037906818453 | etot = -14.6424332454094 -91000 ekin = 0.130544275968788 | erot = 0.552626637866356 | epot = -15.3256041592498 | etot = -14.6424332454146 -92000 ekin = 0.138875666145967 | erot = 0.566952900962782 | epot = -15.3482618125326 | etot = -14.6424332454239 -93000 ekin = 0.147025440611607 | erot = 0.582146933738072 | epot = -15.3716056197866 | etot = -14.642433245437 -94000 ekin = 0.154808946844651 | erot = 0.598175891801872 | epot = -15.3954180841001 | etot = -14.6424332454536 -95000 ekin = 0.162028449598904 | erot = 0.614965942454512 | epot = -15.4194276375267 | etot = -14.6424332454733 -96000 ekin = 0.168477779664558 | erot = 0.632405154082716 | epot = -15.4433161792427 | etot = -14.6424332454954 -97000 ekin = 0.173947863023514 | erot = 0.650346631629012 | epot = -15.466727740172 | etot = -14.6424332455195 -98000 ekin = 0.17823287500116 | erot = 0.668611435746641 | epot = -15.4892775562927 | etot = -14.6424332455449 -99000 ekin = 0.181136831923464 | erot = 0.686991165056919 | epot = -15.5105612425515 | etot = -14.6424332455712 -100000 ekin = 0.182480533640968 | erot = 0.70525041340853 | epot = -15.530164192647 | etot = -14.6424332455975 -101000 ekin = 0.182108871449626 | erot = 0.723129571004015 | epot = -15.5476716880769 | etot = -14.6424332456233 -102000 ekin = 0.179898581168333 | erot = 0.740348571091266 | epot = -15.5626803979072 | etot = -14.6424332456476 -103000 ekin = 0.175766517606564 | erot = 0.756612167826943 | epot = -15.5748119311029 | etot = -14.6424332456694 -104000 ekin = 0.169678431534366 | erot = 0.771617166852901 | epot = -15.5837288440747 | etot = -14.6424332456875 -105000 ekin = 0.16165803603624 | erot = 0.785061742963522 | epot = -15.5891530247003 | etot = -14.6424332457006 -106000 ekin = 0.1517958676503 | erot = 0.79665661342635 | epot = -15.5908857267839 | etot = -14.6424332457072 -107000 ekin = 0.140257112952973 | erot = 0.806137449199221 | epot = -15.5888278078584 | etot = -14.6424332457062 -108000 ekin = 0.12728724020187 | erot = 0.813277564483295 | epot = -15.5829980503819 | etot = -14.6424332456967 -109000 ekin = 0.113214025491873 | erot = 0.817899691736779 | epot = -15.5735469629067 | etot = -14.6424332456781 -110000 ekin = 0.098444482381739 | erot = 0.81988557805637 | epot = -15.5607633060887 | etot = -14.6424332456506 -111000 ekin = 0.0834553769378614 | erot = 0.819182262548248 | epot = -15.5450708851013 | etot = -14.6424332456151 -112000 ekin = 0.0687764915886159 | erot = 0.815804215096793 | epot = -15.5270139522589 | etot = -14.6424332455735 -113000 ekin = 0.0549665904044352 | erot = 0.809830999846637 | epot = -15.5072308357791 | etot = -14.642433245528 -114000 ekin = 0.0425830583135686 | erot = 0.801400700352864 | epot = -15.486417004148 | etot = -14.6424332454816 -115000 ekin = 0.032147280214672 | erot = 0.790699910050555 | epot = -15.4652804357027 | etot = -14.6424332454374 -116000 ekin = 0.0241087780358436 | erot = 0.777951546675731 | epot = -15.4444935701102 | etot = -14.6424332453986 -117000 ekin = 0.0188117102739906 | erot = 0.763402004774535 | epot = -15.4246469604164 | etot = -14.6424332453679 -118000 ekin = 0.0164673894168239 | erot = 0.747309167856823 | epot = -15.4062098026205 | etot = -14.6424332453469 -119000 ekin = 0.0171359296540405 | erot = 0.729932564574684 | epot = -15.3895017395652 | etot = -14.6424332453365 -120000 ekin = 0.0207190822436557 | erot = 0.711526526248979 | epot = -15.3746788538292 | etot = -14.6424332453366 -121000 ekin = 0.0269649552324791 | erot = 0.692336677371669 | epot = -15.3617348779504 | etot = -14.6424332453462 -122000 ekin = 0.0354839220302067 | erot = 0.67259957021192 | epot = -15.3505167376056 | etot = -14.6424332453635 -123000 ekin = 0.0457738626455522 | erot = 0.652544850162972 | epot = -15.3407519581945 | etot = -14.642433245386 -124000 ekin = 0.0572521324300914 | erot = 0.632399068063522 | epot = -15.3320844459048 | etot = -14.6424332454111 -125000 ekin = 0.0692913736007718 | erot = 0.612390156183436 | epot = -15.3241147752205 | etot = -14.6424332454363 -126000 ekin = 0.0812564128179042 | erot = 0.592751635107165 | epot = -15.3164412933838 | etot = -14.6424332454588 -127000 ekin = 0.0925398817831167 | erot = 0.573725774405778 | epot = -15.3086989016655 | etot = -14.6424332454767 -128000 ekin = 0.102594692019408 | erot = 0.555565138942016 | epot = -15.3005930764496 | etot = -14.6424332454881 -129000 ekin = 0.11096195387447 | erot = 0.538532171476867 | epot = -15.2919273708433 | etot = -14.642433245492 -130000 ekin = 0.117293279473245 | erot = 0.522896664452867 | epot = -15.2826231894136 | etot = -14.6424332454875 -131000 ekin = 0.121366644775215 | erot = 0.508931150171148 | epot = -15.2727310404211 | etot = -14.6424332454747 -132000 ekin = 0.123095155540091 | erot = 0.496904390905846 | epot = -15.2624327918999 | etot = -14.642433245454 -133000 ekin = 0.122528239671734 | erot = 0.487073282997867 | epot = -15.2520347680959 | etot = -14.6424332454263 -134000 ekin = 0.119845042601894 | erot = 0.479673601171197 | epot = -15.2419518891665 | etot = -14.6424332453934 -135000 ekin = 0.115340171967421 | erot = 0.474910093717031 | epot = -15.2326835110416 | etot = -14.6424332453571 -136000 ekin = 0.109402419285642 | erot = 0.472946484075328 | epot = -15.224782148681 | etot = -14.64243324532 -137000 ekin = 0.102487634022665 | erot = 0.473895929920059 | epot = -15.2188168092271 | etot = -14.6424332452844 -138000 ekin = 0.0950874634054126 | erot = 0.477812435585917 | epot = -15.2153331442443 | etot = -14.6424332452529 -139000 ekin = 0.0876961121518134 | erot = 0.484683617751174 | epot = -15.2148129751312 | etot = -14.6424332452282 -140000 ekin = 0.0807775418435475 | erot = 0.494425108540512 | epot = -15.2176358955961 | etot = -14.642433245212 -141000 ekin = 0.0747355681580414 | erot = 0.506876770810756 | epot = -15.2240455841751 | etot = -14.6424332452063 -142000 ekin = 0.0698891098451744 | erot = 0.521800821241298 | epot = -15.2341231762987 | etot = -14.6424332452123 -143000 ekin = 0.0664544171867047 | erot = 0.538881922426197 | epot = -15.247769584843 | etot = -14.6424332452301 -144000 ekin = 0.0645355104692778 | erot = 0.557729316021908 | epot = -15.2646980717509 | etot = -14.6424332452598 -145000 ekin = 0.0641233595163661 | erot = 0.577881111413867 | epot = -15.2844377162306 | etot = -14.6424332453003 -146000 ekin = 0.0651036077516285 | erot = 0.598810893852426 | epot = -15.3063477469543 | etot = -14.6424332453502 -147000 ekin = 0.0672719578975283 | erot = 0.619936843682121 | epot = -15.3296420469869 | etot = -14.6424332454073 -148000 ekin = 0.0703557492694452 | erot = 0.640633538190891 | epot = -15.3534225329293 | etot = -14.6424332454689 -149000 ekin = 0.0740398128645613 | erot = 0.66024652323733 | epot = -15.3767195816343 | etot = -14.6424332455324 -150000 ekin = 0.077994420106261 | erot = 0.678109590375523 | epot = -15.3985372560764 | etot = -14.6424332455946 -151000 ekin = 0.0819030604176878 | erot = 0.693564488647254 | epot = -15.4179007947176 | etot = -14.6424332456527 -152000 ekin = 0.08548789385576 | erot = 0.705982563002905 | epot = -15.4339037025625 | etot = -14.6424332457038 -153000 ekin = 0.0885310147333655 | erot = 0.714787575381006 | epot = -15.4457518358599 | etot = -14.6424332457455 -154000 ekin = 0.0908901012892495 | erot = 0.719478762726426 | epot = -15.4528021097914 | etot = -14.6424332457757 -155000 ekin = 0.0925075703718949 | erot = 0.719653046096655 | epot = -15.4545938622616 | etot = -14.642433245793 -156000 ekin = 0.0934129479732331 | erot = 0.71502524375301 | epot = -15.4508714375228 | etot = -14.6424332457966 -157000 ekin = 0.0937187435781837 | erot = 0.7054451639455 | epot = -15.4415971533099 | etot = -14.6424332457862 -158000 ekin = 0.0936106185394034 | erot = 0.690910554325068 | epot = -15.4269544186268 | etot = -14.6424332457623 -159000 ekin = 0.0933330174009798 | erot = 0.671575051659369 | epot = -15.4073413147861 | etot = -14.6424332457258 -160000 ekin = 0.0931716565239132 | erot = 0.647750492120475 | epot = -15.3833553943224 | etot = -14.6424332456781 -161000 ekin = 0.0934343296226144 | erot = 0.619903194016677 | epot = -15.3557707692603 | etot = -14.642433245621 -162000 ekin = 0.0944314104796785 | erot = 0.588644098979961 | epot = -15.3255087550165 | etot = -14.6424332455568 -163000 ekin = 0.0964572425730066 | erot = 0.554712943454524 | epot = -15.2936034315153 | etot = -14.6424332454878 -164000 ekin = 0.0997733472794833 | erot = 0.51895691856277 | epot = -15.2611635112587 | etot = -14.6424332454165 -165000 ekin = 0.104594102018619 | erot = 0.482304549423464 | epot = -15.2293318967876 | etot = -14.6424332453455 -166000 ekin = 0.111075276514824 | erot = 0.445735768513581 | epot = -15.1992442903059 | etot = -14.6424332452775 -167000 ekin = 0.119305597512052 | erot = 0.410249354729612 | epot = -15.1719881974565 | etot = -14.6424332452149 -168000 ekin = 0.12930135472349 | erot = 0.376829046180065 | epot = -15.1485636460635 | etot = -14.64243324516 -169000 ekin = 0.141003965788119 | erot = 0.346409702528372 | epot = -15.1298469134313 | etot = -14.6424332451148 -170000 ekin = 0.154280377438306 | erot = 0.319844892419105 | epot = -15.1165585149385 | etot = -14.6424332450811 -171000 ekin = 0.168926178619928 | erot = 0.297877221607854 | epot = -15.1092366452879 | etot = -14.6424332450601 -172000 ekin = 0.184671319362937 | erot = 0.281112611137901 | epot = -15.1082171755536 | etot = -14.6424332450527 -173000 ekin = 0.201188345435602 | erot = 0.269999595570589 | epot = -15.1136211860655 | etot = -14.6424332450593 -174000 ekin = 0.218103052205587 | erot = 0.264814547402911 | epot = -15.1253508446879 | etot = -14.6424332450794 -175000 ekin = 0.235007413034244 | erot = 0.265653545949627 | epot = -15.1430942040962 | etot = -14.6424332451123 -176000 ekin = 0.251474534266602 | erot = 0.272431389431356 | epot = -15.1663391688545 | etot = -14.6424332451566 -177000 ekin = 0.267075225142183 | erot = 0.284887984977502 | epot = -15.1943964553298 | etot = -14.6424332452101 -178000 ekin = 0.281395553894085 | erot = 0.302602030913778 | epot = -15.2264308300785 | etot = -14.6424332452706 -179000 ekin = 0.294054514410707 | erot = 0.325011526056011 | epot = -15.2614992858019 | etot = -14.6424332453351 -180000 ekin = 0.304720692895811 | erot = 0.351440214933808 | epot = -15.2985941532306 | etot = -14.6424332454009 -181000 ekin = 0.313126658917312 | erot = 0.381128639600623 | epot = -15.3366885439829 | etot = -14.6424332454649 -182000 ekin = 0.319079775822514 | erot = 0.413268071112208 | epot = -15.3747810924592 | etot = -14.6424332455245 -183000 ekin = 0.322468290004655 | erot = 0.447035301735044 | epot = -15.4119368373172 | etot = -14.6424332455775 -184000 ekin = 0.323261947553556 | erot = 0.481626155079162 | epot = -15.4473213482551 | etot = -14.6424332456224 -185000 ekin = 0.321506983529697 | erot = 0.516285658867075 | epot = -15.4802258880548 | etot = -14.642433245658 -186000 ekin = 0.317316057632531 | erot = 0.550333132629024 | epot = -15.5100824359458 | etot = -14.6424332456842 -187000 ekin = 0.310854440588904 | erot = 0.583180936762622 | epot = -15.5364686230528 | etot = -14.6424332457012 -188000 ekin = 0.30232432976273 | erot = 0.614346238386881 | epot = -15.5591038138594 | etot = -14.6424332457098 -189000 ekin = 0.291949445195852 | erot = 0.643455779015098 | epot = -15.5778384699219 | etot = -14.6424332457109 -190000 ekin = 0.279961942766932 | erot = 0.670244185707524 | epot = -15.5926393741803 | etot = -14.6424332457058 -191000 ekin = 0.266593185652274 | erot = 0.694546781237202 | epot = -15.6035732125848 | etot = -14.6424332456953 -192000 ekin = 0.252069141621896 | erot = 0.716288088791507 | epot = -15.6107904760939 | etot = -14.6424332456805 -193000 ekin = 0.2366102932526 | erot = 0.735467302247593 | epot = -15.6145108411624 | etot = -14.6424332456622 -194000 ekin = 0.220435149403491 | erot = 0.75214194303258 | epot = -15.6150103380771 | etot = -14.642433245641 -195000 ekin = 0.203765880091661 | erot = 0.766410799035626 | epot = -15.6126099247449 | etot = -14.6424332456176 -196000 ekin = 0.186834339035651 | erot = 0.778397083256526 | epot = -15.6076646678849 | etot = -14.6424332455927 -197000 ekin = 0.169886782292464 | erot = 0.788232586076187 | epot = -15.6005526139357 | etot = -14.642433245567 -198000 ekin = 0.153185871076301 | erot = 0.796043434544246 | epot = -15.5916625511619 | etot = -14.6424332455413 -199000 ekin = 0.137008972985795 | erot = 0.801937915803759 | epot = -15.5813801343063 | etot = -14.6424332455168 -200000 ekin = 0.121642272363314 | erot = 0.805996673265824 | epot = -15.5700721911236 | etot = -14.6424332454944 -201000 ekin = 0.107370722655147 | erot = 0.808265456810171 | epot = -15.5580694249409 | etot = -14.6424332454756 -202000 ekin = 0.0944644042380589 | erot = 0.808750524312638 | epot = -15.545648174012 | etot = -14.6424332454613 -203000 ekin = 0.0831623790884324 | erot = 0.807416772445363 | epot = -15.5330123969865 | etot = -14.6424332454527 -204000 ekin = 0.0736556272327789 | erot = 0.804188725420783 | epot = -15.5202775981043 | etot = -14.6424332454507 -205000 ekin = 0.066071040166988 | erot = 0.79895460735607 | epot = -15.5074588929788 | etot = -14.6424332454557 -206000 ekin = 0.0604586317676951 | erot = 0.79157380942372 | epot = -15.494465686659 | etot = -14.6424332454675 -207000 ekin = 0.0567840026879156 | erot = 0.781888054797388 | epot = -15.4811053029705 | etot = -14.6424332454852 -208000 ekin = 0.0549275971597975 | erot = 0.769736381378222 | epot = -15.4670972240452 | etot = -14.6424332455072 -209000 ekin = 0.054691444753414 | erot = 0.754973659532252 | epot = -15.4520983498168 | etot = -14.6424332455311 -210000 ekin = 0.0558130126770424 | erot = 0.737491764373083 | epot = -15.4357380226042 | etot = -14.6424332455541 -211000 ekin = 0.0579847210232219 | erot = 0.717241838878542 | epot = -15.4176598054751 | etot = -14.6424332455734 -212000 ekin = 0.0608768356197334 | erot = 0.694255492638095 | epot = -15.3975655738439 | etot = -14.642433245586 -213000 ekin = 0.0641610427072994 | erot = 0.66866247616279 | epot = -15.37525676446 | etot = -14.6424332455899 -214000 ekin = 0.0675321043575128 | erot = 0.64070249551818 | epot = -15.3506678454593 | etot = -14.6424332455836 -215000 ekin = 0.0707255336353422 | erot = 0.610729417268954 | epot = -15.3238881964709 | etot = -14.6424332455666 -216000 ekin = 0.0735300437817614 | erot = 0.579207054839019 | epot = -15.2951703441601 | etot = -14.6424332455393 -217000 ekin = 0.0757943994877641 | erot = 0.546696813211868 | epot = -15.2649244582025 | etot = -14.6424332455029 -218000 ekin = 0.0774290394165078 | erot = 0.51383845121943 | epot = -15.2337007360952 | etot = -14.6424332454593 -219000 ekin = 0.0784033323141758 | erot = 0.481325894964748 | epot = -15.2021624726897 | etot = -14.6424332454108 -220000 ekin = 0.0787395495607948 | erot = 0.449880299622387 | epot = -15.1710530945427 | etot = -14.6424332453595 -221000 ekin = 0.0785046319672525 | erot = 0.420222425160561 | epot = -15.1411603024357 | etot = -14.6424332453079 -222000 ekin = 0.0778006814269618 | erot = 0.393045972171563 | epot = -15.1132798988567 | etot = -14.6424332452582 -223000 ekin = 0.0767549035385332 | erot = 0.368992968911871 | epot = -15.0881811176628 | etot = -14.6424332452124 -224000 ekin = 0.0755095293703771 | erot = 0.348631757033118 | epot = -15.0665745315758 | etot = -14.6424332451723 -225000 ekin = 0.0742120885667612 | erot = 0.332437700429432 | epot = -15.0490830341357 | etot = -14.6424332451395 -226000 ekin = 0.0730063028693098 | erot = 0.320776497502258 | epot = -15.0362160454869 | etot = -14.6424332451153 -227000 ekin = 0.0720238140882299 | erot = 0.313889923629038 | epot = -15.0283469828185 | etot = -14.6424332451012 -228000 ekin = 0.0713769419939713 | erot = 0.311883945247486 | epot = -15.0256941323393 | etot = -14.6424332450978 -229000 ekin = 0.0711526728858612 | erot = 0.314719386439623 | epot = -15.0283053044314 | etot = -14.6424332451059 -230000 ekin = 0.0714080974066282 | erot = 0.32220563858993 | epot = -15.0360469811226 | etot = -14.6424332451261 -231000 ekin = 0.0721675361189904 | erot = 0.333998222201802 | epot = -15.0485990034788 | etot = -14.6424332451581 -232000 ekin = 0.073421602290549 | erot = 0.349601270465942 | epot = -15.0654561179577 | etot = -14.6424332452012 -233000 ekin = 0.0751284397505166 | erot = 0.368376135875933 | epot = -15.0859378208811 | etot = -14.6424332452547 -234000 ekin = 0.0772173235442522 | erot = 0.389557254433757 | epot = -15.1092078232945 | etot = -14.6424332453165 -235000 ekin = 0.0795947059802171 | erot = 0.412276079790421 | epot = -15.1343040311544 | etot = -14.6424332453838 -236000 ekin = 0.0821526186146683 | erot = 0.435593295647697 | epot = -15.160179159716 | etot = -14.6424332454537 -237000 ekin = 0.0847791014239972 | erot = 0.458538653864687 | epot = -15.1857510008109 | etot = -14.6424332455222 -238000 ekin = 0.087370042385855 | erot = 0.480156759886663 | epot = -15.209960047858 | etot = -14.6424332455854 -239000 ekin = 0.0898415153137564 | erot = 0.49955609555256 | epot = -15.2318308565057 | etot = -14.6424332456394 -240000 ekin = 0.0921414623535534 | erot = 0.515957735400968 | epot = -15.2505324434352 | etot = -14.6424332456807 -241000 ekin = 0.094259449014392 | erot = 0.528739776886534 | epot = -15.2654324716071 | etot = -14.6424332457062 -242000 ekin = 0.0962332805880934 | erot = 0.537473606136267 | epot = -15.2761401324386 | etot = -14.6424332457143 -243000 ekin = 0.0981515319338797 | erot = 0.541948785980249 | epot = -15.2825335636184 | etot = -14.6424332457043 -244000 ekin = 0.100151482351181 | erot = 0.542184479374293 | epot = -15.2847692074025 | etot = -14.642433245677 -245000 ekin = 0.102412491095747 | erot = 0.53842670231772 | epot = -15.2832724390477 | etot = -14.6424332456343 -246000 ekin = 0.105145395544779 | erot = 0.531132085866326 | epot = -15.2787107269898 | etot = -14.6424332455787 -247000 ekin = 0.108578961411965 | erot = 0.520939994206832 | epot = -15.2719522011324 | etot = -14.6424332455137 -248000 ekin = 0.112944688754503 | erot = 0.50863565229522 | epot = -15.2640135864927 | etot = -14.6424332454429 -249000 ekin = 0.118461348905117 | erot = 0.495107336753362 | epot = -15.256001931029 | etot = -14.6424332453705 -250000 ekin = 0.125320510713189 | erot = 0.48130071319677 | epot = -15.24905446921 | etot = -14.6424332453 -251000 ekin = 0.13367405695507 | erot = 0.468173145423505 | epot = -15.2442804476135 | etot = -14.6424332452349 -252000 ekin = 0.14362435587275 | erot = 0.456650355973621 | epot = -15.2427079570245 | etot = -14.6424332451781 -253000 ekin = 0.155217400154316 | erot = 0.447587277165273 | epot = -15.2452379224515 | etot = -14.6424332451319 -254000 ekin = 0.168438906844309 | erot = 0.441734376017195 | epot = -15.2526065279595 | etot = -14.642433245098 -255000 ekin = 0.183213121644152 | erot = 0.43971022735342 | epot = -15.265356594075 | etot = -14.6424332450774 -256000 ekin = 0.199403908832121 | erot = 0.441980689733431 | epot = -15.2838178436366 | etot = -14.642433245071 -257000 ekin = 0.216817638461841 | erot = 0.448844730305144 | epot = -15.308095613846 | etot = -14.642433245079 -258000 ekin = 0.235207399035704 | erot = 0.460426746275348 | epot = -15.3380673904121 | etot = -14.642433245101 -259000 ekin = 0.254278151366077 | erot = 0.476675120648602 | epot = -15.3733865171511 | etot = -14.6424332451364 -260000 ekin = 0.27369257667687 | erot = 0.497366691706637 | epot = -15.4134925135677 | etot = -14.6424332451842 -261000 ekin = 0.293077534073047 | erot = 0.522116767905255 | epot = -15.4576275472214 | etot = -14.6424332452431 -262000 ekin = 0.312031202020343 | erot = 0.550394247121191 | epot = -15.5048586944528 | etot = -14.6424332453112 -263000 ekin = 0.330131107615792 | erot = 0.58154128199962 | epot = -15.5541056350021 | etot = -14.6424332453866 -264000 ekin = 0.346943319969756 | erot = 0.61479677344706 | epot = -15.6041733388837 | etot = -14.6424332454669 -265000 ekin = 0.362033078254018 | erot = 0.649322794997101 | epot = -15.6537891188009 | etot = -14.6424332455498 -266000 ekin = 0.374977027495908 | erot = 0.684232889060489 | epot = -15.7016431621888 | etot = -14.6424332456324 -267000 ekin = 0.385377045180443 | erot = 0.718621072064117 | epot = -15.7464313629566 | etot = -14.642433245712 -268000 ekin = 0.392875374675087 | erot = 0.75159036946736 | epot = -15.7868989899283 | etot = -14.6424332457858 -269000 ekin = 0.397170471133826 | erot = 0.782279784278077 | epot = -15.8218835012632 | etot = -14.6424332458513 -270000 ekin = 0.39803266202252 | erot = 0.809888771679688 | epot = -15.8503546796085 | etot = -14.6424332459063 -271000 ekin = 0.395318487593041 | erot = 0.833698516715799 | epot = -15.8714502502577 | etot = -14.6424332459488 -272000 ekin = 0.388982474346436 | erot = 0.85308955191437 | epot = -15.8845052722382 | etot = -14.6424332459774 -273000 ekin = 0.379085147925793 | erot = 0.867555470410658 | epot = -15.8890738643275 | etot = -14.6424332459911 -274000 ekin = 0.365796322187783 | erot = 0.876712662634482 | epot = -15.8849422308119 | etot = -14.6424332459896 -275000 ekin = 0.349393082916365 | erot = 0.880306121918412 | epot = -15.872132450808 | etot = -14.6424332459733 -276000 ekin = 0.330252358900911 | erot = 0.878211432152944 | epot = -15.8508970369967 | etot = -14.6424332459429 -277000 ekin = 0.308838461215969 | erot = 0.87043308488023 | epot = -15.821704791996 | etot = -14.6424332458998 -278000 ekin = 0.285686394600485 | erot = 0.857099294887703 | epot = -15.7852189353341 | etot = -14.6424332458459 -279000 ekin = 0.26138204276351 | erot = 0.838453513182823 | epot = -15.7422688017294 | etot = -14.642433245783 -280000 ekin = 0.236540473323807 | erot = 0.814842890588987 | epot = -15.6938166096265 | etot = -14.6424332457138 -281000 ekin = 0.211783602606672 | erot = 0.786704032858688 | epot = -15.6409208811058 | etot = -14.6424332456404 -282000 ekin = 0.18771833727137 | erot = 0.754546508157259 | epot = -15.5846980909942 | etot = -14.6424332455655 -283000 ekin = 0.164916115091084 | erot = 0.718934708844117 | epot = -15.5262840694266 | etot = -14.6424332454914 -284000 ekin = 0.143894549222789 | erot = 0.680468811937684 | epot = -15.466796606581 | etot = -14.6424332454205 -285000 ekin = 0.125101678374108 | erot = 0.639765701845435 | epot = -15.4073006255745 | etot = -14.642433245355 -286000 ekin = 0.108903164109883 | erot = 0.597440790007762 | epot = -15.3487771994138 | etot = -14.6424332452962 -287000 ekin = 0.0955726645582656 | erot = 0.554091668601873 | epot = -15.2920975784058 | etot = -14.6424332452456 -288000 ekin = 0.0852855448042878 | erot = 0.51028445681865 | epot = -15.2380032468271 | etot = -14.6424332452042 -289000 ekin = 0.0781160413142908 | erot = 0.466543535619429 | epot = -15.187092822106 | etot = -14.6424332451723 -290000 ekin = 0.0740379578661526 | erot = 0.423345127585162 | epot = -15.1398163306014 | etot = -14.6424332451501 -291000 ekin = 0.07292891006789 | erot = 0.38111487943337 | epot = -15.0964770346382 | etot = -14.6424332451369 -292000 ekin = 0.0745780357973755 | erot = 0.340229271733751 | epot = -15.0572405526629 | etot = -14.6424332451317 -293000 ekin = 0.0786969407585494 | erot = 0.301020346544363 | epot = -15.0221505324362 | etot = -14.6424332451333 -294000 ekin = 0.0849334564747798 | erot = 0.263782947584644 | epot = -14.9911496491993 | etot = -14.6424332451399 -295000 ekin = 0.0928875723651302 | erot = 0.22878344880309 | epot = -14.9641042663181 | etot = -14.6424332451499 -296000 ekin = 0.102128697511331 | erot = 0.196268840383788 | epot = -14.9408307830568 | etot = -14.6424332451617 -297000 ekin = 0.11221325250056 | erot = 0.166475068215614 | epot = -14.9211215658898 | etot = -14.6424332451737 -298000 ekin = 0.122701527070309 | erot = 0.139633685444085 | epot = -14.904768457699 | etot = -14.6424332451846 -299000 ekin = 0.133172792913717 | erot = 0.115976150687844 | epot = -14.8915821887951 | etot = -14.6424332451935 -300000 ekin = 0.143237839709864 | erot = 0.0957354521197658 | epot = -14.8814065370295 | etot = -14.6424332451999 -301000 ekin = 0.152548387990851 | erot = 0.07914509087212 | epot = -14.8741267240666 | etot = -14.6424332452037 -302000 ekin = 0.160803184301524 | erot = 0.0664357608556835 | epot = -14.8696721903621 | etot = -14.6424332452049 -303000 ekin = 0.167750948488374 | erot = 0.0578302677258914 | epot = -14.8680144614182 | etot = -14.6424332452039 -304000 ekin = 0.173190665588555 | erot = 0.0535373136380679 | epot = -14.8691612244281 | etot = -14.6424332452015 -305000 ekin = 0.176969952950159 | erot = 0.0537447402922713 | epot = -14.8731479384405 | etot = -14.6424332451981 -306000 ekin = 0.178982363291678 | erot = 0.0586126977895342 | epot = -14.8800283062756 | etot = -14.6424332451944 -307000 ekin = 0.179164502945068 | erot = 0.0682670321079694 | epot = -14.8898647802439 | etot = -14.6424332451909 -308000 ekin = 0.177493763289069 | erot = 0.0827930029212249 | epot = -14.9027200113985 | etot = -14.6424332451882 -309000 ekin = 0.173987301152049 | erot = 0.10222929187336 | epot = -14.918649838212 | etot = -14.6424332451866 -310000 ekin = 0.168702678648352 | erot = 0.126562162218755 | epot = -14.9376980860534 | etot = -14.6424332451863 -311000 ekin = 0.161740297010225 | erot = 0.15571959340906 | epot = -14.9598931356066 | etot = -14.6424332451873 -312000 ekin = 0.153247440126399 | erot = 0.189565237979944 | epot = -14.9852459232961 | etot = -14.6424332451897 -313000 ekin = 0.143423389998623 | erot = 0.227892126762149 | epot = -15.0137487619545 | etot = -14.6424332451937 -314000 ekin = 0.132524706020311 | erot = 0.270416174781616 | epot = -15.045374126001 | etot = -14.6424332451991 -315000 ekin = 0.120869409554559 | erot = 0.31676970828961 | epot = -15.0800723630507 | etot = -14.6424332452065 -316000 ekin = 0.108838546106885 | erot = 0.366495437994255 | epot = -15.1177672293175 | etot = -14.6424332452163 -317000 ekin = 0.0968734934299726 | erot = 0.419041536808435 | epot = -15.1583482754675 | etot = -14.6424332452291 -318000 ekin = 0.0854675378572541 | erot = 0.473758725762824 | epot = -15.201659508866 | etot = -14.6424332452459 -319000 ekin = 0.0751507271474133 | erot = 0.529900497446511 | epot = -15.2474844698617 | etot = -14.6424332452678 -320000 ekin = 0.0664678443385179 | erot = 0.586627760737852 | epot = -15.2955288503723 | etot = -14.6424332452959 -321000 ekin = 0.0599504590581751 | erot = 0.643019202689424 | epot = -15.3454029070787 | etot = -14.6424332453311 -322000 ekin = 0.0560852142815241 | erot = 0.69808845326502 | epot = -15.3966069129205 | etot = -14.642433245374 -323000 ekin = 0.0552815181260046 | erot = 0.750808639914442 | epot = -15.4485234034646 | etot = -14.6424332454242 -324000 ekin = 0.0578423255211838 | erot = 0.800144112656325 | epot = -15.5004196836582 | etot = -14.6424332454807 -325000 ekin = 0.0639414864635107 | erot = 0.845088070114621 | epot = -15.5514628021198 | etot = -14.6424332455416 -326000 ekin = 0.0736101694204692 | erot = 0.884703689967839 | epot = -15.6007471049927 | etot = -14.6424332456044 -327000 ekin = 0.0867333560885398 | erot = 0.918165419814672 | epot = -15.6473320215695 | etot = -14.6424332456662 -328000 ekin = 0.103055779602205 | erot = 0.944796600226729 | epot = -15.690285625553 | etot = -14.6424332457241 -329000 ekin = 0.122195446168384 | erot = 0.964099781598493 | epot = -15.7287284735425 | etot = -14.6424332457756 -330000 ekin = 0.143662406707253 | erot = 0.975776996242511 | epot = -15.7618726487686 | etot = -14.6424332458188 -331000 ekin = 0.16688078513004 | erot = 0.979738667524168 | epot = -15.7890526985066 | etot = -14.6424332458524 -332000 ekin = 0.191212923965886 | erot = 0.976101405909884 | epot = -15.8097475757513 | etot = -14.6424332458756 -333000 ekin = 0.215985355315093 | erot = 0.965176233546684 | epot = -15.8235948347498 | etot = -14.642433245888 -334000 ekin = 0.240516656826274 | erot = 0.947449485120535 | epot = -15.830399387836 | etot = -14.6424332458892 -335000 ekin = 0.26414689608104 | erot = 0.923558676876203 | epot = -15.8301388188364 | etot = -14.6424332458792 -336000 ekin = 0.286267467748786 | erot = 0.89426518476866 | epot = -15.8229658983752 | etot = -14.6424332458578 -337000 ekin = 0.306349134744468 | erot = 0.860424939344321 | epot = -15.8092073199142 | etot = -14.6424332458254 -338000 ekin = 0.323965497668976 | erot = 0.822957838329794 | epot = -15.7893565817818 | etot = -14.642433245783 -339000 ekin = 0.338809250783254 | erot = 0.78281638015672 | epot = -15.7640588766721 | etot = -14.6424332457321 -340000 ekin = 0.35069944422809 | erot = 0.74095414130838 | epot = -15.7340868312114 | etot = -14.6424332456749 -341000 ekin = 0.359579293531018 | erot = 0.698295027836038 | epot = -15.7003075669809 | etot = -14.6424332456139 -342000 ekin = 0.365505462149712 | erot = 0.655704542038074 | epot = -15.6636432497397 | etot = -14.6424332455519 -343000 ekin = 0.368630832656515 | erot = 0.613964463467531 | epot = -15.6250285416158 | etot = -14.6424332454918 -344000 ekin = 0.369183369584766 | erot = 0.573752273081695 | epot = -15.5853688881025 | etot = -14.642433245436 -345000 ekin = 0.367443732820324 | erot = 0.535626361233062 | epot = -15.5455033394399 | etot = -14.6424332453865 -346000 ekin = 0.363723933128335 | erot = 0.500017626275246 | epot = -15.5061748047482 | etot = -14.6424332453447 -347000 ekin = 0.3583487052748 | erot = 0.467227585425602 | epot = -15.4680095360115 | etot = -14.6424332453111 -348000 ekin = 0.351640582952522 | erot = 0.437432666905881 | epot = -15.4315064951445 | etot = -14.6424332452861 -349000 ekin = 0.343909024693046 | erot = 0.41069398616734 | epot = -15.3970362561291 | etot = -14.6424332452687 -350000 ekin = 0.335443435967543 | erot = 0.386971649877949 | epot = -15.3648483311043 | etot = -14.6424332452588 -351000 ekin = 0.326509584093005 | erot = 0.366142474248723 | epot = -15.335085303596 | etot = -14.6424332452543 -352000 ekin = 0.317348699021852 | erot = 0.348019930398485 | epot = -15.3078018746744 | etot = -14.6424332452541 -353000 ekin = 0.30817846664876 | erot = 0.332375117499618 | epot = -15.2829868294052 | etot = -14.6424332452568 -354000 ekin = 0.299195119854683 | erot = 0.318957598137097 | epot = -15.2605859632527 | etot = -14.6424332452609 -355000 ekin = 0.290575888249358 | erot = 0.307515001368969 | epot = -15.2405241348835 | etot = -14.6424332452652 -356000 ekin = 0.282481160313138 | erot = 0.29781040621641 | epot = -15.222724811798 | etot = -14.6424332452685 -357000 ekin = 0.275055828994515 | erot = 0.289636664277668 | epot = -15.2071257385424 | etot = -14.6424332452703 -358000 ekin = 0.268429427255696 | erot = 0.282827006912643 | epot = -15.1936896794384 | etot = -14.6424332452701 -359000 ekin = 0.262714810202509 | erot = 0.277261507859007 | epot = -15.1824095633295 | etot = -14.642433245268 -360000 ekin = 0.258005302570141 | erot = 0.272869227750186 | epot = -15.1733077755848 | etot = -14.6424332452644 -361000 ekin = 0.254370400622431 | erot = 0.269626137803972 | epot = -15.1664297836866 | etot = -14.6424332452602 -362000 ekin = 0.251850290179243 | erot = 0.267549186090239 | epot = -15.1618327215257 | etot = -14.6424332452562 -363000 ekin = 0.250449609863295 | erot = 0.266687109599965 | epot = -15.159569964717 | etot = -14.6424332452537 -364000 ekin = 0.250131041863855 | erot = 0.267108788860278 | epot = -15.1596730759782 | etot = -14.642433245254 -365000 ekin = 0.250809442162592 | erot = 0.268890073930502 | epot = -15.1621327613513 | etot = -14.6424332452582 -366000 ekin = 0.252347318763925 | erot = 0.272100073008351 | epot = -15.1668806370397 | etot = -14.6424332452674 -367000 ekin = 0.254552520179183 | erot = 0.276787886821331 | epot = -15.1737736522827 | etot = -14.6424332452822 -368000 ekin = 0.257178996154117 | erot = 0.282970699525226 | epot = -15.1825829409825 | etot = -14.6424332453031 -369000 ekin = 0.25993142490973 | erot = 0.290624011144342 | epot = -15.1929886813841 | etot = -14.64243324533 -370000 ekin = 0.262474349327911 | erot = 0.299674631815262 | epot = -15.2045822265054 | etot = -14.6424332453622 -371000 ekin = 0.264446209429889 | erot = 0.309996869296908 | epot = -15.2168763241254 | etot = -14.6424332453986 -372000 ekin = 0.265478281863369 | erot = 0.321412142685491 | epot = -15.2293236699861 | etot = -14.6424332454373 -373000 ekin = 0.265218028292355 | erot = 0.333692059446813 | epot = -15.2413433332155 | etot = -14.6424332454763 -374000 ekin = 0.263355721250425 | erot = 0.346564809668647 | epot = -15.2523537764322 | etot = -14.6424332455131 -375000 ekin = 0.259652497503873 | erot = 0.359724567994869 | epot = -15.2618103110439 | etot = -14.6424332455452 -376000 ekin = 0.253967268937784 | erot = 0.372843454380806 | epot = -15.2692439688887 | etot = -14.6424332455701 -377000 ekin = 0.246279333501453 | erot = 0.385585491294785 | epot = -15.274298070382 | etot = -14.6424332455858 -378000 ekin = 0.236703249878221 | erot = 0.397621906698152 | epot = -15.2767584021673 | etot = -14.6424332455909 -379000 ekin = 0.225492756944939 | erot = 0.408647066931743 | epot = -15.2765730694618 | etot = -14.6424332455852 -380000 ekin = 0.213031377539219 | erot = 0.418394278996712 | epot = -15.2738589021049 | etot = -14.642433245569 -381000 ekin = 0.199808877315892 | erot = 0.426650676211857 | epot = -15.2688927990715 | etot = -14.6424332455438 -382000 ekin = 0.186384809019024 | erot = 0.433270396055851 | epot = -15.2620884505868 | etot = -14.642433245512 -383000 ekin = 0.173342616144098 | erot = 0.438185279050645 | epot = -15.253961140671 | etot = -14.6424332454763 -384000 ekin = 0.161239700831436 | erot = 0.441412371402807 | epot = -15.2450853176736 | etot = -14.6424332454394 -385000 ekin = 0.150559954647593 | erot = 0.443057612552847 | epot = -15.2360508126044 | etot = -14.6424332454039 -386000 ekin = 0.141675129699177 | erot = 0.443315241523115 | epot = -15.2274236165942 | etot = -14.6424332453719 -387000 ekin = 0.134820015697985 | erot = 0.442462667348824 | epot = -15.2197159283911 | etot = -14.6424332453443 -388000 ekin = 0.130083976413548 | erot = 0.440850813513903 | epot = -15.2133680352489 | etot = -14.6424332453215 -389000 ekin = 0.127418570237884 | erot = 0.43889024627901 | epot = -15.2087420618201 | etot = -14.6424332453032 -390000 ekin = 0.126658423093201 | erot = 0.437033702086081 | epot = -15.206125370468 | etot = -14.6424332452887 -391000 ekin = 0.127550804260996 | erot = 0.435755902066197 | epot = -15.2057399516044 | etot = -14.6424332452772 -392000 ekin = 0.129788752935801 | erot = 0.435531744058798 | epot = -15.2077537422629 | etot = -14.6424332452683 -393000 ekin = 0.133043055316258 | erot = 0.436814065078314 | epot = -15.2122903656559 | etot = -14.6424332452613 -394000 ekin = 0.136989561466103 | erot = 0.440012156511496 | epot = -15.219434963234 | etot = -14.6424332452564 -395000 ekin = 0.141329833042571 | erot = 0.445472096886692 | epot = -15.2292351751829 | etot = -14.6424332452537 -396000 ekin = 0.145804542777683 | erot = 0.453459767650238 | epot = -15.2416975556817 | etot = -14.6424332452538 -397000 ekin = 0.150200153189368 | erot = 0.464147173463313 | epot = -15.2567805719101 | etot = -14.6424332452574 -398000 ekin = 0.154350089767281 | erot = 0.477602441560301 | epot = -15.2743857765925 | etot = -14.6424332452649 -399000 ekin = 0.158131920623958 | erot = 0.493783661157258 | epot = -15.2943488270584 | etot = -14.6424332452772 -400000 ekin = 0.161462056175852 | erot = 0.512536568007644 | epot = -15.3164318694779 | etot = -14.6424332452944 -401000 ekin = 0.164289301183563 | erot = 0.533595989003439 | epot = -15.3403185355037 | etot = -14.6424332453167 -402000 ekin = 0.166588323053565 | erot = 0.556590928840414 | epot = -15.3656124972379 | etot = -14.642433245344 -403000 ekin = 0.168353810382881 | erot = 0.581053183644676 | epot = -15.3918402394035 | etot = -14.6424332453759 -404000 ekin = 0.169595821304602 | erot = 0.606429376023105 | epot = -15.4184584427394 | etot = -14.6424332454117 -405000 ekin = 0.17033657856555 | erot = 0.632096292540194 | epot = -15.4448661165559 | etot = -14.6424332454502 -406000 ekin = 0.170608761982357 | erot = 0.65737934451417 | epot = -15.4704213519868 | etot = -14.6424332454902 -407000 ekin = 0.170455178570774 | erot = 0.681573854093745 | epot = -15.4944622781949 | etot = -14.6424332455304 -408000 ekin = 0.169929554812993 | erot = 0.703968692150315 | epot = -15.5163314925321 | etot = -14.6424332455688 -409000 ekin = 0.169098093454308 | erot = 0.723871579520606 | epot = -15.5354029185787 | etot = -14.6424332456038 -410000 ekin = 0.168041369043254 | erot = 0.740635137247646 | epot = -15.5511097519244 | etot = -14.6424332456335 -411000 ekin = 0.166856102811026 | erot = 0.753682569970607 | epot = -15.562971918438 | etot = -14.6424332456564 -412000 ekin = 0.165656359034654 | erot = 0.762531725092731 | epot = -15.5706213297983 | etot = -14.642433245671 -413000 ekin = 0.164573741712539 | erot = 0.766816218739469 | epot = -15.5738232061283 | etot = -14.6424332456763 -414000 ekin = 0.163756240958007 | erot = 0.766302377571818 | epot = -15.5724918642016 | etot = -14.6424332456718 -415000 ekin = 0.163365479945299 | erot = 0.760900920225133 | epot = -15.5666996458276 | etot = -14.6424332456572 -416000 ekin = 0.163572240093361 | erot = 0.750672586700048 | epot = -15.5566780724264 | etot = -14.642433245633 -417000 ekin = 0.164550286198126 | erot = 0.735827297892139 | epot = -15.5428108296904 | etot = -14.6424332456002 -418000 ekin = 0.166468663391001 | erot = 0.716716857301867 | epot = -15.525618766253 | etot = -14.6424332455601 -419000 ekin = 0.169482781124152 | erot = 0.69382164910087 | epot = -15.5057376757396 | etot = -14.6424332455146 -420000 ekin = 0.173724722664366 | erot = 0.667732191685369 | epot = -15.4838901598155 | etot = -14.6424332454658 -421000 ekin = 0.179293310757479 | erot = 0.639126725583771 | epot = -15.4608532817569 | etot = -14.6424332454157 -422000 ekin = 0.186244514517565 | erot = 0.608746211201693 | epot = -15.4374239710859 | etot = -14.6424332453666 -423000 ekin = 0.194582798143041 | erot = 0.577368165579506 | epot = -15.4143842090433 | etot = -14.6424332453207 -424000 ekin = 0.204253993027957 | erot = 0.545780680988036 | epot = -15.392467919296 | etot = -14.64243324528 -425000 ekin = 0.215140228915595 | erot = 0.514757766833673 | epot = -15.372331240995 | etot = -14.6424332452458 -426000 ekin = 0.227057395196063 | erot = 0.485036881516669 | epot = -15.354527521932 | etot = -14.6424332452193 -427000 ekin = 0.239755526224872 | erot = 0.457299221562912 | epot = -15.3394879929894 | etot = -14.6424332452017 -428000 ekin = 0.252922416268501 | erot = 0.432153058136047 | epot = -15.3275087195977 | etot = -14.6424332451931 -429000 ekin = 0.266190667178472 | erot = 0.410120192009091 | epot = -15.318744104381 | etot = -14.6424332451935 -430000 ekin = 0.279148248284958 | erot = 0.391625457763427 | epot = -15.3132069512512 | etot = -14.6424332452028 -431000 ekin = 0.291352495292848 | erot = 0.37698914981175 | epot = -15.3107748903245 | etot = -14.6424332452199 -432000 ekin = 0.302347287569357 | erot = 0.36642225446733 | epot = -15.3112027872808 | etot = -14.6424332452441 -433000 ekin = 0.311682921770362 | erot = 0.360024429013509 | epot = -15.314140596057 | etot = -14.6424332452732 -434000 ekin = 0.318937954386234 | erot = 0.357784738271935 | epot = -15.3191559379639 | etot = -14.6424332453058 -435000 ekin = 0.323742037713894 | erot = 0.359585207274212 | epot = -15.3257604903287 | etot = -14.6424332453406 -436000 ekin = 0.325798554030488 | erot = 0.36520724530746 | epot = -15.3334390447139 | etot = -14.642433245376 -437000 ekin = 0.324905697096464 | erot = 0.374340922352109 | epot = -15.3416798648574 | etot = -14.6424332454088 -438000 ekin = 0.32097458985737 | erot = 0.386596930163185 | epot = -15.3500047654581 | etot = -14.6424332454376 -439000 ekin = 0.314043077745088 | erot = 0.401520852188919 | epot = -15.3579971753952 | etot = -14.6424332454612 -440000 ekin = 0.304283988018852 | erot = 0.418609132218188 | epot = -15.3653263657148 | etot = -14.6424332454778 -441000 ekin = 0.292006859109402 | erot = 0.437325916198087 | epot = -15.3717660207938 | etot = -14.6424332454863 -442000 ekin = 0.277652365812265 | erot = 0.457119792524783 | epot = -15.3772054038239 | etot = -14.6424332454868 -443000 ekin = 0.261778853587313 | erot = 0.477439412182564 | epot = -15.3816515112497 | etot = -14.6424332454798 -444000 ekin = 0.245040553430208 | erot = 0.497747053384035 | epot = -15.385220852281 | etot = -14.6424332454667 -445000 ekin = 0.228157260415726 | erot = 0.51752940821079 | epot = -15.3881199140755 | etot = -14.642433245449 -446000 ekin = 0.211875681724409 | erot = 0.536305196865493 | epot = -15.3906141240194 | etot = -14.6424332454295 -447000 ekin = 0.196923472676251 | erot = 0.553629632762795 | epot = -15.3929863508504 | etot = -14.6424332454113 -448000 ekin = 0.183958277875555 | erot = 0.569096233380591 | epot = -15.3954877566542 | etot = -14.642433245398 -449000 ekin = 0.17351577130814 | erot = 0.582336947161301 | epot = -15.3982859638623 | etot = -14.6424332453928 -450000 ekin = 0.165962361194715 | erot = 0.593021970155398 | epot = -15.4014175767483 | etot = -14.6424332453982 -451000 ekin = 0.161459280831074 | erot = 0.600860851258547 | epot = -15.4047533775047 | etot = -14.6424332454151 -452000 ekin = 0.159944578250399 | erot = 0.605606408084822 | epot = -15.4079842317782 | etot = -14.642433245443 -453000 ekin = 0.161137653112611 | erot = 0.607062496375706 | epot = -15.4106333949674 | etot = -14.6424332454791 -454000 ekin = 0.164567591511427 | erot = 0.605095779312731 | epot = -15.4120966163435 | etot = -14.6424332455193 -455000 ekin = 0.169622334208412 | erot = 0.59965045542677 | epot = -15.4117060351935 | etot = -14.6424332455583 -456000 ekin = 0.17561180235027 | erot = 0.590763702898776 | epot = -15.4088087508398 | etot = -14.6424332455907 -457000 ekin = 0.181835621982501 | erot = 0.578578749366117 | epot = -15.4028476169607 | etot = -14.6424332456121 -458000 ekin = 0.187645727031673 | erot = 0.563352302650952 | epot = -15.3934312753015 | etot = -14.6424332456189 -459000 ekin = 0.192495880386129 | erot = 0.545453717149971 | epot = -15.3803828431461 | etot = -14.64243324561 -460000 ekin = 0.195973381638787 | erot = 0.525354597711217 | epot = -15.3637612249357 | etot = -14.6424332455857 -461000 ekin = 0.197811920993003 | erot = 0.503609203462485 | epot = -15.343854370004 | etot = -14.6424332455485 -462000 ekin = 0.197887724921051 | erot = 0.480827560282181 | epot = -15.3211485307045 | etot = -14.6424332455013 -463000 ekin = 0.19620319848715 | erot = 0.457644248435948 | epot = -15.2962806923714 | etot = -14.6424332454483 -464000 ekin = 0.192863034127873 | erot = 0.434686220428325 | epot = -15.2699824999496 | etot = -14.6424332453934 -465000 ekin = 0.188047435824123 | erot = 0.412542760090272 | epot = -15.2430234412543 | etot = -14.6424332453399 -466000 ekin = 0.181986107554568 | erot = 0.391740010671155 | epot = -15.2161593635163 | etot = -14.6424332452906 -467000 ekin = 0.174935400199636 | erot = 0.372721626734198 | epot = -15.1900902721814 | etot = -14.6424332452475 -468000 ekin = 0.167159826103628 | erot = 0.355836258350725 | epot = -15.1654293296662 | etot = -14.6424332452119 -469000 ekin = 0.158918218023891 | erot = 0.341331890764694 | epot = -15.1426833539729 | etot = -14.6424332451843 -470000 ekin = 0.150454185654314 | erot = 0.329356584633373 | epot = -15.1222440154522 | etot = -14.6424332451645 -471000 ekin = 0.141990180750326 | erot = 0.319964871776615 | epot = -15.104388297679 | etot = -14.6424332451521 -472000 ekin = 0.133724353868926 | erot = 0.313128906245008 | epot = -15.0892865052598 | etot = -14.6424332451459 -473000 ekin = 0.125829398102403 | erot = 0.308753392324136 | epot = -15.0770160355714 | etot = -14.6424332451449 -474000 ekin = 0.118452666363553 | erot = 0.306693264413754 | epot = -15.0675791759249 | etot = -14.6424332451476 -475000 ekin = 0.111716976219115 | erot = 0.30677305329061 | epot = -15.0609232746625 | etot = -14.6424332451527 -476000 ekin = 0.105721655633337 | erot = 0.308806833537562 | epot = -15.0569617343299 | etot = -14.642433245159 -477000 ekin = 0.100543523675758 | erot = 0.312617617130229 | epot = -15.0555943859711 | etot = -14.6424332451651 -478000 ekin = 0.0962376398644811 | erot = 0.31805505563526 | epot = -15.0567259406697 | etot = -14.64243324517 -479000 ekin = 0.0928377950024532 | erot = 0.325010357030093 | epot = -15.0602813972057 | etot = -14.6424332451731 -480000 ekin = 0.0903568546345998 | erot = 0.333427427763264 | epot = -15.0662175275719 | etot = -14.642433245174 -481000 ekin = 0.0887871989358601 | erot = 0.343309423709768 | epot = -15.074529867818 | etot = -14.6424332451724 -482000 ekin = 0.0881016191320375 | erot = 0.354720133057113 | epot = -15.0852549973577 | etot = -14.6424332451685 -483000 ekin = 0.0882551127439699 | erot = 0.367779908272474 | epot = -15.0984682661793 | etot = -14.6424332451629 -484000 ekin = 0.0891880440138163 | erot = 0.382656193507622 | epot = -15.1142774826775 | etot = -14.642433245156 -485000 ekin = 0.0908310739109982 | erot = 0.399549033146323 | epot = -15.132813352206 | etot = -14.6424332451486 -486000 ekin = 0.0931120890990551 | erot = 0.41867226992318 | epot = -15.1542176041638 | etot = -14.6424332451416 -487000 ekin = 0.095965052639277 | erot = 0.440231422321074 | epot = -15.1786297200962 | etot = -14.6424332451358 -488000 ekin = 0.0993402613867534 | erot = 0.464399451384565 | epot = -15.2061729579035 | etot = -14.6424332451322 -489000 ekin = 0.103214957397693 | erot = 0.491291775403353 | epot = -15.2369399779327 | etot = -14.6424332451317 -490000 ekin = 0.107602676597199 | erot = 0.520941965498321 | epot = -15.2709778872308 | etot = -14.6424332451353 -491000 ekin = 0.112559247664636 | erot = 0.553279563917093 | epot = -15.3082720567258 | etot = -14.6424332451441 -492000 ekin = 0.11818313672361 | erot = 0.588111425308605 | epot = -15.3487278071918 | etot = -14.6424332451596 -493000 ekin = 0.124608040126391 | erot = 0.625107908279146 | epot = -15.3921491935888 | etot = -14.6424332451833 -494000 ekin = 0.131986393312571 | erot = 0.663795156035298 | epot = -15.4382147945647 | etot = -14.6424332452168 -495000 ekin = 0.140463823900169 | erot = 0.703554605721933 | epot = -15.4864516748842 | etot = -14.6424332452621 -496000 ekin = 0.150146408035849 | erot = 0.743630741563392 | epot = -15.5362103949194 | etot = -14.6424332453202 -497000 ekin = 0.161064579071324 | erot = 0.783147917317811 | epot = -15.586645741781 | etot = -14.6424332453918 -498000 ekin = 0.173139219157391 | erot = 0.821136754973018 | epot = -15.6367092196067 | etot = -14.6424332454763 -499000 ekin = 0.186156317833388 | erot = 0.856570103856968 | epot = -15.6851596672616 | etot = -14.6424332455712 -500000 ekin = 0.199756195068939 | erot = 0.888407758274321 | epot = -15.730597199016 | etot = -14.6424332456728 -501000 ekin = 0.213441517837342 | erot = 0.915648078733143 | epot = -15.7715228423457 | etot = -14.6424332457753 -502000 ekin = 0.226605416598005 | erot = 0.937383433649483 | epot = -15.8064220961193 | etot = -14.6424332458719 -503000 ekin = 0.238577508977599 | erot = 0.952855183125227 | epot = -15.8338659380581 | etot = -14.6424332459553 -504000 ekin = 0.248682347016338 | erot = 0.961503066788675 | epot = -15.8526186598237 | etot = -14.6424332460187 -505000 ekin = 0.256302488969596 | erot = 0.963003656366976 | epot = -15.8617393913932 | etot = -14.6424332460566 -506000 ekin = 0.260937583144194 | erot = 0.957293217920897 | epot = -15.8606640471307 | etot = -14.6424332460656 -507000 ekin = 0.262251679299244 | erot = 0.944571918258912 | epot = -15.849256843603 | etot = -14.6424332460448 -508000 ekin = 0.260103184111408 | erot = 0.925288564934742 | epot = -15.8278249950421 | etot = -14.6424332459959 -509000 ekin = 0.25455487528045 | erot = 0.900107536938111 | epot = -15.7970956581414 | etot = -14.6424332459228 -510000 ekin = 0.245864483348181 | erot = 0.869861717985596 | epot = -15.7581594471648 | etot = -14.642433245831 -511000 ekin = 0.234458914526881 | erot = 0.835496660126654 | epot = -15.7123888203807 | etot = -14.6424332457271 -512000 ekin = 0.220896820239973 | erot = 0.798011684066058 | epot = -15.6613417499238 | etot = -14.6424332456178 -513000 ekin = 0.205824805087872 | erot = 0.758403224578473 | epot = -15.6066612751758 | etot = -14.6424332455094 -514000 ekin = 0.189932244116162 | erot = 0.717614706860426 | epot = -15.5499801963839 | etot = -14.6424332454073 -515000 ekin = 0.173908748199766 | erot = 0.676495918872675 | epot = -15.4928379123882 | etot = -14.6424332453158 -516000 ekin = 0.158407108508993 | erot = 0.635773516025409 | epot = -15.4366138697724 | etot = -14.642433245238 -517000 ekin = 0.144013350183893 | erot = 0.59603314911818 | epot = -15.3824797444781 | etot = -14.642433245176 -518000 ekin = 0.131224514118005 | erot = 0.557712825688994 | epot = -15.3313705849372 | etot = -14.6424332451302 -519000 ekin = 0.120434042405824 | erot = 0.521106495597738 | epot = -15.283973783104 | etot = -14.6424332451004 -520000 ekin = 0.111924165176706 | erot = 0.486376443199764 | epot = -15.2407338534617 | etot = -14.6424332450853 -521000 ekin = 0.105864424815879 | erot = 0.453572806060429 | epot = -15.2018704759591 | etot = -14.6424332450828 -522000 ekin = 0.102315362067395 | erot = 0.422658367131502 | epot = -15.1674069742898 | etot = -14.6424332450909 -523000 ekin = 0.101236366465181 | erot = 0.393536647096984 | epot = -15.137206258669 | etot = -14.6424332451068 -524000 ekin = 0.102496717236757 | erot = 0.366081244308208 | epot = -15.1110112066728 | etot = -14.6424332451278 -525000 ekin = 0.105888887336051 | erot = 0.340164343214671 | epot = -15.0884864757019 | etot = -14.6424332451512 -526000 ekin = 0.111143247850943 | erot = 0.315682368378665 | epot = -15.0692588614045 | etot = -14.6424332451749 -527000 ekin = 0.117943398962438 | erot = 0.29257693780699 | epot = -15.0529535819665 | etot = -14.642433245197 -528000 ekin = 0.12594147425583 | erot = 0.270849598243837 | epot = -15.0392243177155 | etot = -14.6424332452158 -529000 ekin = 0.134772916010411 | erot = 0.250569317239496 | epot = -15.0277754784804 | etot = -14.6424332452305 -530000 ekin = 0.144070383403777 | erot = 0.231872340652232 | epot = -15.0183759692968 | etot = -14.6424332452408 -531000 ekin = 0.153476601970705 | erot = 0.214954741435346 | epot = -15.010864588653 | etot = -14.6424332452469 -532000 ekin = 0.162656054078974 | erot = 0.20005869764927 | epot = -15.0051479969776 | etot = -14.6424332452493 -533000 ekin = 0.171305419081562 | erot = 0.187454143184885 | epot = -15.0011928075152 | etot = -14.6424332452488 -534000 ekin = 0.179162595540481 | erot = 0.1774178426953 | epot = -14.9990136834821 | etot = -14.6424332452463 -535000 ekin = 0.186014006486751 | erot = 0.170212094444198 | epot = -14.9986593461735 | etot = -14.6424332452426 -536000 ekin = 0.191699759240504 | erot = 0.16606514922825 | epot = -15.0001981537073 | etot = -14.6424332452386 -537000 ekin = 0.1961161699316 | erot = 0.165155084981448 | epot = -15.0037045001479 | etot = -14.6424332452348 -538000 ekin = 0.199215220533753 | erot = 0.167598364573304 | epot = -15.0092468303391 | etot = -14.642433245232 -539000 ekin = 0.201000709669645 | erot = 0.173443713619011 | epot = -15.0168776685194 | etot = -14.6424332452308 -540000 ekin = 0.20152116403808 | erot = 0.182671367033565 | epot = -15.0266257763029 | etot = -14.6424332452312 -541000 ekin = 0.200859940141561 | erot = 0.195197211442919 | epot = -15.0384903968184 | etot = -14.642433245234 -542000 ekin = 0.199123298889081 | erot = 0.210880936223622 | epot = -15.0524374803517 | etot = -14.642433245239 -543000 ekin = 0.196427519384058 | erot = 0.229537017789335 | epot = -15.0683977824196 | etot = -14.6424332452462 -544000 ekin = 0.192886294945247 | erot = 0.250947202002153 | epot = -15.0862667422037 | etot = -14.6424332452563 -545000 ekin = 0.18859971088744 | erot = 0.274873110235068 | epot = -15.105906066391 | etot = -14.6424332452685 -546000 ekin = 0.183646045242699 | erot = 0.301067663118862 | epot = -15.1271469536444 | etot = -14.6424332452828 -547000 ekin = 0.178077473818675 | erot = 0.329284179373474 | epot = -15.149794898491 | etot = -14.6424332452988 -548000 ekin = 0.171920510267319 | erot = 0.359282253783652 | epot = -15.173636009367 | etot = -14.642433245316 -549000 ekin = 0.165181670578008 | erot = 0.390829837831177 | epot = -15.1984447537429 | etot = -14.6424332453337 -550000 ekin = 0.157858408655514 | erot = 0.42370132691765 | epot = -15.2239929809246 | etot = -14.6424332453514 -551000 ekin = 0.149954809005953 | erot = 0.457671882716406 | epot = -15.2500599370906 | etot = -14.6424332453683 -552000 ekin = 0.141500835823185 | erot = 0.492508662660431 | epot = -15.2764427438672 | etot = -14.6424332453836 -553000 ekin = 0.132573145481933 | erot = 0.527960055124278 | epot = -15.302966446003 | etot = -14.6424332453968 -554000 ekin = 0.123314645148986 | erot = 0.563744383269626 | epot = -15.3294922738258 | etot = -14.6424332454072 -555000 ekin = 0.113949270903175 | erot = 0.599539792623648 | epot = -15.3559223089416 | etot = -14.6424332454148 -556000 ekin = 0.104788088807786 | erot = 0.634977129563658 | epot = -15.3821984637915 | etot = -14.64243324542 -557000 ekin = 0.0962230654780946 | erot = 0.669637513724504 | epot = -15.4082938246265 | etot = -14.6424332454239 -558000 ekin = 0.0887059614428478 | erot = 0.70305599048067 | epot = -15.4341951973515 | etot = -14.642433245428 -559000 ekin = 0.082711884774194 | erot = 0.734732129424159 | epot = -15.4598772596328 | etot = -14.6424332454344 -560000 ekin = 0.0786899547259911 | erot = 0.764147748398984 | epot = -15.4852709485702 | etot = -14.6424332454453 -561000 ekin = 0.0770067720633791 | erot = 0.790791153076129 | epot = -15.5102311706017 | etot = -14.6424332454622 -562000 ekin = 0.0778911706764789 | erot = 0.814186471629281 | epot = -15.5345108877919 | etot = -14.6424332454862 -563000 ekin = 0.0813901113673084 | erot = 0.83392592548323 | epot = -15.5577492823674 | etot = -14.6424332455168 -564000 ekin = 0.0873448530219544 | erot = 0.849702302565905 | epot = -15.5794804011399 | etot = -14.642433245552 -565000 ekin = 0.0953935152543308 | erot = 0.861338569497384 | epot = -15.59916533034 | etot = -14.6424332455883 -566000 ekin = 0.105001366119722 | erot = 0.868811531657507 | epot = -15.6162461433985 | etot = -14.6424332456212 -567000 ekin = 0.11551478921087 | erot = 0.872266750928371 | epot = -15.6302147857853 | etot = -14.6424332456461 -568000 ekin = 0.126230320990598 | erot = 0.872022546761245 | epot = -15.6406861134104 | etot = -14.6424332456586 -569000 ekin = 0.1364675752055 | erot = 0.868561781938193 | epot = -15.6474626027995 | etot = -14.6424332456558 -570000 ekin = 0.145634823229284 | erot = 0.862511177263077 | epot = -15.650579246129 | etot = -14.6424332456367 -571000 ekin = 0.153278250260132 | erot = 0.854608991356468 | epot = -15.6503204872187 | etot = -14.6424332456021 -572000 ekin = 0.159109636953965 | erot = 0.845662918617004 | epot = -15.6472058011259 | etot = -14.6424332455549 -573000 ekin = 0.163011362017409 | erot = 0.836500892320213 | epot = -15.6419454998373 | etot = -14.6424332454997 -574000 ekin = 0.165021239080183 | erot = 0.82791805820557 | epot = -15.6353725427275 | etot = -14.6424332454418 -575000 ekin = 0.165302195908647 | erot = 0.820623479704516 | epot = -15.6283589210001 | etot = -14.6424332453869 -576000 ekin = 0.164102988101242 | erot = 0.815190165399292 | epot = -15.6217263988412 | etot = -14.6424332453406 -577000 ekin = 0.161716152387198 | erot = 0.812011817944906 | epot = -15.6161612156399 | etot = -14.6424332453078 -578000 ekin = 0.15843856937185 | erot = 0.811269345694985 | epot = -15.6121411603585 | etot = -14.6424332452916 -579000 ekin = 0.154538688869395 | erot = 0.812909695781084 | epot = -15.6098816299448 | etot = -14.6424332452944 -580000 ekin = 0.150232988454514 | erot = 0.816638977242154 | epot = -15.6093052110128 | etot = -14.6424332453162 -581000 ekin = 0.145672809814998 | erot = 0.82193113541131 | epot = -15.6100371905821 | etot = -14.6424332453558 -582000 ekin = 0.140941476791536 | erot = 0.828052590351175 | epot = -15.6114273125529 | etot = -14.6424332454102 -583000 ekin = 0.136060602599188 | erot = 0.834102246896661 | epot = -15.6125960949711 | etot = -14.6424332454752 -584000 ekin = 0.131003759896606 | erot = 0.839065139158589 | epot = -15.6125021446008 | etot = -14.6424332455456 -585000 ekin = 0.125715216483023 | erot = 0.841876757449347 | epot = -15.6100252195477 | etot = -14.6424332456153 -586000 ekin = 0.120131224768948 | erot = 0.841493945667052 | epot = -15.6040584161145 | etot = -14.6424332456785 -587000 ekin = 0.114201380572127 | erot = 0.836967317754023 | epot = -15.5936019440556 | etot = -14.6424332457295 -588000 ekin = 0.10790780822673 | erot = 0.827509595983478 | epot = -15.5778506499738 | etot = -14.6424332457636 -589000 ekin = 0.101280337909716 | erot = 0.812554260673813 | epot = -15.5562678443608 | etot = -14.6424332457773 -590000 ekin = 0.0944063548788227 | erot = 0.791799488420743 | epot = -15.5286390890684 | etot = -14.6424332457688 -591000 ekin = 0.0874345511051893 | erot = 0.765233519223455 | epot = -15.4951013160664 | etot = -14.6424332457378 -592000 ekin = 0.0805723392084907 | erot = 0.733139214285358 | epot = -15.4561447991799 | etot = -14.642433245686 -593000 ekin = 0.0740771594080655 | erot = 0.696077455348817 | epot = -15.4125878603734 | etot = -14.6424332456166 -594000 ekin = 0.0682423089599614 | erot = 0.654850963358217 | epot = -15.3655265178521 | etot = -14.642433245534 -595000 ekin = 0.0633782539014331 | erot = 0.610451848323659 | epot = -15.3162633476688 | etot = -14.6424332454437 -596000 ekin = 0.0597906540649347 | erot = 0.563997548401148 | epot = -15.2662214478178 | etot = -14.6424332453517 -597000 ekin = 0.0577565493623858 | erot = 0.516660644084273 | epot = -15.2168504387106 | etot = -14.642433245264 -598000 ekin = 0.0575003158536081 | erot = 0.469598294353632 | epot = -15.1695318553934 | etot = -14.6424332451862 -599000 ekin = 0.0591710965286251 | erot = 0.423886769451064 | epot = -15.1254911111027 | etot = -14.642433245123 -600000 ekin = 0.0628234356891045 | erot = 0.380465849281436 | epot = -15.0857225300487 | etot = -14.6424332450781 -601000 ekin = 0.0684027903378417 | erot = 0.340096852289044 | epot = -15.0509328876805 | etot = -14.6424332450536 -602000 ekin = 0.0757374499129008 | erot = 0.303336891508804 | epot = -15.0215075864718 | etot = -14.6424332450501 -603000 ekin = 0.0845381560106984 | erot = 0.270530726252426 | epot = -14.9975021273296 | etot = -14.6424332450665 -604000 ekin = 0.0944063594078355 | erot = 0.241820347963454 | epot = -14.9786599524715 | etot = -14.6424332451002 -605000 ekin = 0.104851562460566 | erot = 0.217171224791036 | epot = -14.9644560323985 | etot = -14.6424332451469 -606000 ekin = 0.115317556389835 | erot = 0.196412930356103 | epot = -14.954163731947 | etot = -14.6424332452011 -607000 ekin = 0.125216580353275 | erot = 0.179290709847405 | epot = -14.9469405354574 | etot = -14.6424332452567 -608000 ekin = 0.133969542490564 | erot = 0.165523445157646 | epot = -14.9419262329554 | etot = -14.6424332453072 -609000 ekin = 0.141049537028518 | erot = 0.15486258226509 | epot = -14.9383453646398 | etot = -14.6424332453462 -610000 ekin = 0.146025095175949 | erot = 0.147146040888439 | epot = -14.935604381433 | etot = -14.6424332453686 -611000 ekin = 0.148599079335757 | erot = 0.142341118193739 | epot = -14.9333734429002 | etot = -14.6424332453707 -612000 ekin = 0.148639027542241 | erot = 0.140571068727528 | epot = -14.9316433416205 | etot = -14.6424332453507 -613000 ekin = 0.146195193893338 | erot = 0.142121441395774 | epot = -14.9307498805986 | etot = -14.6424332453095 -614000 ekin = 0.141503544705058 | erot = 0.147424293659482 | epot = -14.9313610836148 | etot = -14.6424332452503 -615000 ekin = 0.134972482669589 | erot = 0.157020849768843 | epot = -14.9344265776168 | etot = -14.6424332451783 -616000 ekin = 0.127153892887477 | erot = 0.17150567977268 | epot = -14.9410928177609 | etot = -14.6424332451008 -617000 ekin = 0.118700960497215 | erot = 0.191457667915335 | epot = -14.9525918734382 | etot = -14.6424332450256 -618000 ekin = 0.110316794781948 | erot = 0.21736458449167 | epot = -14.9701146242348 | etot = -14.6424332449612 -619000 ekin = 0.102698942666097 | erot = 0.249548776233835 | epot = -14.994680963815 | etot = -14.6424332449151 -620000 ekin = 0.0964852203315631 | erot = 0.288101317493937 | epot = -15.0270197827191 | etot = -14.6424332448936 -621000 ekin = 0.0922059091526162 | erot = 0.332831044367888 | epot = -15.0674701984216 | etot = -14.6424332449011 -622000 ekin = 0.090246364710084 | erot = 0.383233451864307 | epot = -15.1159130615138 | etot = -14.6424332449395 -623000 ekin = 0.0908226920702867 | erot = 0.438482716268118 | epot = -15.1717386533468 | etot = -14.6424332450084 -624000 ekin = 0.0939716062521641 | erot = 0.497448307340739 | epot = -15.2338531586981 | etot = -14.6424332451052 -625000 ekin = 0.0995541611224816 | erot = 0.558735886785548 | epot = -15.3007232931327 | etot = -14.6424332452247 -626000 ekin = 0.107271859325762 | erot = 0.620750477457381 | epot = -15.3704555821432 | etot = -14.6424332453601 -627000 ekin = 0.116692826737646 | erot = 0.681778220901968 | epot = -15.440904293143 | etot = -14.6424332455034 -628000 ekin = 0.127285245273582 | erot = 0.740081431770171 | epot = -15.5097999226893 | etot = -14.6424332456456 -629000 ekin = 0.138455039153843 | erot = 0.794000196771077 | epot = -15.5748884817029 | etot = -14.6424332457779 -630000 ekin = 0.149584842937087 | erot = 0.84205264024076 | epot = -15.63407072907 | etot = -14.6424332458922 -631000 ekin = 0.160071499853009 | erot = 0.88302544287862 | epot = -15.6855301887133 | etot = -14.6424332459817 -632000 ekin = 0.169359720292754 | erot = 0.916046503426999 | epot = -15.7278394697613 | etot = -14.6424332460416 -633000 ekin = 0.176970053692527 | erot = 0.94063292294126 | epot = -15.7600362227031 | etot = -14.6424332460693 -634000 ekin = 0.182519961289934 | erot = 0.956709735134238 | epot = -15.7816629424889 | etot = -14.6424332460647 -635000 ekin = 0.185737466035627 | erot = 0.964597760206567 | epot = -15.7927684722724 | etot = -14.6424332460302 -636000 ekin = 0.186467519303287 | erot = 0.964972204256552 | epot = -15.79387296953 | etot = -14.6424332459701 -637000 ekin = 0.184671774604466 | erot = 0.958796660376671 | epot = -15.7859016808713 | etot = -14.6424332458901 -638000 ekin = 0.180422825778035 | erot = 0.947239527073052 | epot = -15.7700955986478 | etot = -14.6424332457967 -639000 ekin = 0.173894119064837 | erot = 0.931581224196235 | epot = -15.747908588958 | etot = -14.642433245697 -640000 ekin = 0.165346701827782 | erot = 0.91312083875339 | epot = -15.7209007861784 | etot = -14.6424332455972 -641000 ekin = 0.155113786103692 | erot = 0.893090060089671 | epot = -15.6906370916964 | etot = -14.6424332455031 -642000 ekin = 0.143583869244217 | erot = 0.872580710306169 | epot = -15.6585978249696 | etot = -14.6424332454192 -643000 ekin = 0.131182953689566 | erot = 0.852490168054334 | epot = -15.6261063670926 | etot = -14.6424332453487 -644000 ekin = 0.118356305761173 | erot = 0.833486853990269 | epot = -15.5942764050451 | etot = -14.6424332452937 -645000 ekin = 0.105550209085081 | erot = 0.815995971212791 | epot = -15.5639794255527 | etot = -14.6424332452548 -646000 ekin = 0.0931942744194625 | erot = 0.800204061931269 | epot = -15.5358315815826 | etot = -14.6424332452318 -647000 ekin = 0.0816850001800769 | erot = 0.786079744440999 | epot = -15.5101979898444 | etot = -14.6424332452233 -648000 ekin = 0.0713713598437978 | erot = 0.773407243193285 | epot = -15.4872118482646 | etot = -14.6424332452275 -649000 ekin = 0.0625431628717075 | erot = 0.761828976530965 | epot = -15.4668053846445 | etot = -14.6424332452418 -650000 ekin = 0.0554227735503044 | erot = 0.750893453414529 | epot = -15.4487494722282 | etot = -14.6424332452633 -651000 ekin = 0.0501605027658098 | erot = 0.74010497844913 | epot = -15.4326987265041 | etot = -14.6424332452892 -652000 ekin = 0.0468336713663308 | erot = 0.728972100421486 | epot = -15.4182390171043 | etot = -14.6424332453165 -653000 ekin = 0.0454490492573673 | erot = 0.717052285945908 | epot = -15.4049345805457 | etot = -14.6424332453424 -654000 ekin = 0.0459481524943306 | erot = 0.703990869784824 | epot = -15.3923722676438 | etot = -14.6424332453647 -655000 ekin = 0.048214749528602 | erot = 0.689552835107499 | epot = -15.3802008300172 | etot = -14.6424332453811 -656000 ekin = 0.0520838761262338 | erot = 0.673646332749968 | epot = -15.3681634542667 | etot = -14.6424332453905 -657000 ekin = 0.0573516620848271 | erot = 0.656337023115609 | epot = -15.356121930592 | etot = -14.6424332453915 -658000 ekin = 0.0637853134927773 | erot = 0.637852348219684 | epot = -15.3440709070967 | etot = -14.6424332453842 -659000 ekin = 0.0711326702869463 | erot = 0.618574815847903 | epot = -15.3321407315039 | etot = -14.642433245369 -660000 ekin = 0.0791308828100933 | erot = 0.59902345470884 | epot = -15.3205875828664 | etot = -14.6424332453475 -661000 ekin = 0.0875139366233532 | erot = 0.57982293974752 | epot = -15.3097701216927 | etot = -14.6424332453218 -662000 ekin = 0.096019000419939 | erot = 0.56166061034769 | epot = -15.3001128560625 | etot = -14.6424332452949 -663000 ekin = 0.104391848885312 | erot = 0.545232746054744 | epot = -15.2920578402104 | etot = -14.6424332452703 -664000 ekin = 0.1123918633903 | erot = 0.531182949318153 | epot = -15.2860080579606 | etot = -14.6424332452521 -665000 ekin = 0.119797262721338 | erot = 0.52003712479683 | epot = -15.2822676327618 | etot = -14.6424332452437 -666000 ekin = 0.126411190063547 | erot = 0.512141060960723 | epot = -15.2809854962723 | etot = -14.642433245248 -667000 ekin = 0.132069035725132 | erot = 0.507607681729055 | epot = -15.2821099627211 | etot = -14.6424332452669 -668000 ekin = 0.136646914542203 | erot = 0.506281315754288 | epot = -15.2853614755971 | etot = -14.6424332453006 -669000 ekin = 0.140070616013021 | erot = 0.50772556617166 | epot = -15.2902294275324 | etot = -14.6424332453477 -670000 ekin = 0.142323740906679 | erot = 0.511239425098687 | epot = -15.2959964114102 | etot = -14.6424332454048 -671000 ekin = 0.143453306303064 | erot = 0.515903234044996 | epot = -15.3017897858152 | etot = -14.6424332454671 -672000 ekin = 0.143571012732418 | erot = 0.520652256718186 | epot = -15.3066565149793 | etot = -14.6424332455287 -673000 ekin = 0.142848733836954 | erot = 0.524371563357074 | epot = -15.3096535427774 | etot = -14.6424332455834 -674000 ekin = 0.141507613277718 | erot = 0.526002362930759 | epot = -15.3099432218339 | etot = -14.6424332456254 -675000 ekin = 0.13980130282559 | erot = 0.524647629024632 | epot = -15.3068821775003 | etot = -14.6424332456501 -676000 ekin = 0.137995095210639 | erot = 0.519664439041565 | epot = -15.3000927799068 | etot = -14.6424332456546 -677000 ekin = 0.136343677285182 | erot = 0.510732098518056 | epot = -15.2895090214411 | etot = -14.6424332456378 -678000 ekin = 0.1350706641226 | erot = 0.49788857525657 | epot = -15.2753924849801 | etot = -14.6424332456009 -679000 ekin = 0.134352810444862 | erot = 0.481532294132637 | epot = -15.2583183501238 | etot = -14.6424332455463 -680000 ekin = 0.13431086265575 | erot = 0.462390968605425 | epot = -15.2391350767393 | etot = -14.6424332454781 -681000 ekin = 0.135007638923122 | erot = 0.441462941784965 | epot = -15.218903826109 | etot = -14.6424332454009 -682000 ekin = 0.136452461524589 | erot = 0.419938865037975 | epot = -15.1988245718825 | etot = -14.6424332453199 -683000 ekin = 0.138609887397947 | erot = 0.399112293315654 | epot = -15.1801554259539 | etot = -14.6424332452403 -684000 ekin = 0.141410065648264 | erot = 0.380287181762594 | epot = -15.1641304925779 | etot = -14.6424332451671 -685000 ekin = 0.144758102722244 | erot = 0.364688846299647 | epot = -15.1518801941267 | etot = -14.6424332451049 -686000 ekin = 0.14854046711943 | erot = 0.353383275614745 | epot = -15.144356987792 | etot = -14.6424332450578 -687000 ekin = 0.152627512098722 | erot = 0.347208212231136 | epot = -15.1422689693591 | etot = -14.6424332450292 -688000 ekin = 0.156872371008243 | erot = 0.346718408271441 | epot = -15.1460240243019 | etot = -14.6424332450222 -689000 ekin = 0.161107527974782 | erot = 0.352146941115747 | epot = -15.1556877141288 | etot = -14.6424332450382 -690000 ekin = 0.16514108738065 | erot = 0.363384304942447 | epot = -15.1709586374008 | etot = -14.6424332450777 -691000 ekin = 0.168755042649082 | erot = 0.379976931156971 | epot = -15.1911652189453 | etot = -14.6424332451393 -692000 ekin = 0.171707649703694 | erot = 0.401146558398203 | epot = -15.2152874533219 | etot = -14.64243324522 -693000 ekin = 0.173741393443093 | erot = 0.425831232789035 | epot = -15.2420058715475 | etot = -14.6424332453154 -694000 ekin = 0.174597110624773 | erot = 0.452747528140487 | epot = -15.2697778841841 | etot = -14.6424332454189 -695000 ekin = 0.174033757472237 | erot = 0.480471830922762 | epot = -15.2969388339179 | etot = -14.6424332455229 -696000 ekin = 0.171852263364752 | erot = 0.50753639815869 | epot = -15.3218219071425 | etot = -14.6424332456191 -697000 ekin = 0.167921065290924 | erot = 0.532533688693483 | epot = -15.3428879996837 | etot = -14.6424332456993 -698000 ekin = 0.162200409477016 | erot = 0.554220619925494 | epot = -15.3588542751586 | etot = -14.6424332457561 -699000 ekin = 0.154762415715625 | erot = 0.571613361028384 | epot = -15.3688090225278 | etot = -14.6424332457837 -700000 ekin = 0.14580423000878 | erot = 0.584063387088342 | epot = -15.3723008628759 | etot = -14.6424332457788 -701000 ekin = 0.135652269558589 | erot = 0.591306922721675 | epot = -15.3693924380207 | etot = -14.6424332457404 -702000 ekin = 0.124756460207458 | erot = 0.593482464349287 | epot = -15.3606721702276 | etot = -14.6424332456708 -703000 ekin = 0.11367432595124 | erot = 0.591114401857202 | epot = -15.3472219733832 | etot = -14.6424332455747 -704000 ekin = 0.10304567594557 | erot = 0.585064323196779 | epot = -15.3305432446014 | etot = -14.6424332454591 -705000 ekin = 0.093559358196298 | erot = 0.576454826534863 | epot = -15.3124474300637 | etot = -14.6424332453326 -706000 ekin = 0.0859140824284676 | erot = 0.566573150256884 | epot = -15.2949204778901 | etot = -14.6424332452047 -707000 ekin = 0.0807756759557719 | erot = 0.556763427609663 | epot = -15.2799723486508 | etot = -14.6424332450854 -708000 ekin = 0.0787333622599937 | erot = 0.548316855291462 | epot = -15.269483462535 | etot = -14.6424332449836 -709000 ekin = 0.0802577669150991 | erot = 0.542368667954137 | epot = -15.2650596797766 | etot = -14.6424332449074 -710000 ekin = 0.0856633545528662 | erot = 0.539809747049451 | epot = -15.2679063464654 | etot = -14.642433244863 -711000 ekin = 0.0950778519027508 | erot = 0.541219180891539 | epot = -15.2787302776488 | etot = -14.6424332448545 -712000 ekin = 0.10842087662218 | erot = 0.546822307911647 | epot = -15.2976764294171 | etot = -14.6424332448833 -713000 ekin = 0.125393451694867 | erot = 0.556476834657881 | epot = -15.3243035313012 | etot = -14.6424332449484 -714000 ekin = 0.145479367621472 | erot = 0.569687600119496 | epot = -15.3576002127874 | etot = -14.6424332450464 -715000 ekin = 0.167958541116859 | erot = 0.585648522303218 | epot = -15.3960403085917 | etot = -14.6424332451716 -716000 ekin = 0.191931735851232 | erot = 0.60330829253147 | epot = -15.4376732736993 | etot = -14.6424332453166 -717000 ekin = 0.216355400176894 | erot = 0.621454592037079 | epot = -15.4802432376866 | etot = -14.6424332454726 -718000 ekin = 0.24008505651044 | erot = 0.638810139731556 | epot = -15.521328441872 | etot = -14.64243324563 -719000 ekin = 0.261925698575349 | erot = 0.654132895986116 | epot = -15.558491840341 | etot = -14.6424332457795 -720000 ekin = 0.280687969311591 | erot = 0.666312379867061 | epot = -15.5894335950905 | etot = -14.6424332459119 -721000 ekin = 0.295249345589153 | erot = 0.674454385927668 | epot = -15.6121369775356 | etot = -14.6424332460188 -722000 ekin = 0.304619886333733 | erot = 0.67794741025506 | epot = -15.6250005426818 | etot = -14.642433246093 -723000 ekin = 0.308011983727977 | erot = 0.676505724570366 | epot = -15.6269509544273 | etot = -14.642433246129 -724000 ekin = 0.304912667284364 | erot = 0.670186105899516 | epot = -15.6175320193064 | etot = -14.6424332461225 -725000 ekin = 0.295155116711556 | erot = 0.659377522489347 | epot = -15.5969658852725 | etot = -14.6424332460716 -726000 ekin = 0.278983134900095 | erot = 0.644765363158316 | epot = -15.5661817440347 | etot = -14.6424332459763 -727000 ekin = 0.257098790794367 | erot = 0.627273860362841 | epot = -15.5268058969971 | etot = -14.6424332458399 -728000 ekin = 0.230680158274935 | erot = 0.607992016180396 | epot = -15.481105420124 | etot = -14.6424332456687 -729000 ekin = 0.201354496276678 | erot = 0.588089464034347 | epot = -15.4318772057843 | etot = -14.6424332454733 -730000 ekin = 0.171114103979303 | erot = 0.568729214715612 | epot = -15.382276563963 | etot = -14.6424332452681 -731000 ekin = 0.142168923912273 | erot = 0.55098413507054 | epot = -15.3355863040536 | etot = -14.6424332450708 -732000 ekin = 0.11674200710062 | erot = 0.535763349043798 | epot = -15.294938601045 | etot = -14.6424332449006 -733000 ekin = 0.096829302757611 | erot = 0.523753647321743 | epot = -15.263016194855 | etot = -14.6424332447757 -734000 ekin = 0.0839596135620853 | erot = 0.515379592338737 | epot = -15.2417724506111 | etot = -14.6424332447103 -735000 ekin = 0.0789983701793321 | erot = 0.510784464196176 | epot = -15.2322160790871 | etot = -14.6424332447116 -736000 ekin = 0.0820355551944618 | erot = 0.509832642266591 | epot = -15.2343014422397 | etot = -14.6424332447787 -737000 ekin = 0.0923827123871921 | erot = 0.51213255085583 | epot = -15.2469485081446 | etot = -14.6424332449015 -738000 ekin = 0.108680448514306 | erot = 0.517077971028045 | epot = -15.2681916646065 | etot = -14.6424332450641 -739000 ekin = 0.12909371568349 | erot = 0.523904364927467 | epot = -15.2954313258571 | etot = -14.6424332452461 -740000 ekin = 0.151555277793912 | erot = 0.531755895780646 | epot = -15.3257444190018 | etot = -14.6424332454272 -741000 ekin = 0.174012721806563 | erot = 0.539758083454575 | epot = -15.3562040508503 | etot = -14.6424332455892 -742000 ekin = 0.194640916831384 | erot = 0.547090549700596 | epot = -15.3841647122502 | etot = -14.6424332457182 -743000 ekin = 0.211995737398717 | erot = 0.553054125338761 | epot = -15.4074831085432 | etot = -14.6424332458057 -744000 ekin = 0.22510050872294 | erot = 0.557126762310943 | epot = -15.4246605168818 | etot = -14.6424332458479 -745000 ekin = 0.233469424486957 | erot = 0.559003260240344 | epot = -15.4349059305732 | etot = -14.6424332458459 -746000 ekin = 0.2370799134654 | erot = 0.558614810501353 | epot = -15.438127969771 | etot = -14.6424332458043 -747000 ekin = 0.236308652985431 | erot = 0.556125790084381 | epot = -15.4348676888002 | etot = -14.6424332457304 -748000 ekin = 0.231845097888603 | erot = 0.551907079331795 | epot = -15.426185422854 | etot = -14.6424332456336 -749000 ekin = 0.224593843485089 | erot = 0.546487360031397 | epot = -15.4135144490409 | etot = -14.6424332455244 -750000 ekin = 0.215574369393293 | erot = 0.540486233486826 | epot = -15.3984938482942 | etot = -14.6424332454141 -751000 ekin = 0.205824583428116 | erot = 0.534535356766581 | epot = -15.382793185508 | etot = -14.6424332453133 -752000 ekin = 0.196313335743831 | erot = 0.529195815220672 | epot = -15.367942396196 | etot = -14.6424332452315 -753000 ekin = 0.187866475789607 | erot = 0.524881252734243 | epot = -15.3551809737002 | etot = -14.6424332451763 -754000 ekin = 0.181110613628491 | erot = 0.521796491100216 | epot = -15.3453403498808 | etot = -14.6424332451521 -755000 ekin = 0.176438042206941 | erot = 0.519900210809565 | epot = -15.3387714981766 | etot = -14.6424332451601 -756000 ekin = 0.173994962649976 | erot = 0.518897676287607 | epot = -15.3353258841355 | etot = -14.642433245198 -757000 ekin = 0.173693190273855 | erot = 0.518265706185164 | epot = -15.334392141719 | etot = -14.6424332452599 -758000 ekin = 0.175243155018327 | erot = 0.517307659824269 | epot = -15.3349840601804 | etot = -14.6424332453378 -759000 ekin = 0.178203703096713 | erot = 0.515231902167182 | epot = -15.3358688506856 | etot = -14.6424332454217 -760000 ekin = 0.182042463552564 | erot = 0.511243837951639 | epot = -15.3357195470058 | etot = -14.6424332455016 -761000 ekin = 0.186199747764933 | erot = 0.504639825550332 | epot = -15.3332728188834 | etot = -14.6424332455682 -762000 ekin = 0.190149235948613 | erot = 0.494891409036607 | epot = -15.3274738905993 | etot = -14.6424332456141 -763000 ekin = 0.193449921097585 | erot = 0.481710238289879 | epot = -15.3175934050219 | etot = -14.6424332456345 -764000 ekin = 0.195785552428752 | erot = 0.465087294354156 | epot = -15.3033060924098 | etot = -14.6424332456268 -765000 ekin = 0.196989678186294 | erot = 0.445303873494492 | epot = -15.2847267972726 | etot = -14.6424332455918 -766000 ekin = 0.197055919183484 | erot = 0.422915440294251 | epot = -15.26240460501 | etot = -14.6424332455322 -767000 ekin = 0.19613407649359 | erot = 0.398712320924831 | epot = -15.2372796428711 | etot = -14.6424332454526 -768000 ekin = 0.194513096651386 | erot = 0.373662938959647 | epot = -15.2106092809703 | etot = -14.6424332453593 -769000 ekin = 0.192592017625304 | erot = 0.348845887486037 | epot = -15.1838711503705 | etot = -14.6424332452592 -770000 ekin = 0.190840163683791 | erot = 0.325376840212305 | epot = -15.1586502490562 | etot = -14.6424332451601 -771000 ekin = 0.189748397224452 | erot = 0.304335529899573 | epot = -15.136517172194 | etot = -14.64243324507 -772000 ekin = 0.189774341847263 | erot = 0.286697153920281 | epot = -15.1189047407638 | etot = -14.6424332449962 -773000 ekin = 0.191286034496866 | erot = 0.273271857835351 | epot = -15.1069911372776 | etot = -14.6424332449453 -774000 ekin = 0.194510000604709 | erot = 0.264655458968876 | epot = -15.101598704496 | etot = -14.6424332449224 -775000 ekin = 0.199490639675106 | erot = 0.261194193154614 | epot = -15.1031180777597 | etot = -14.64243324493 -776000 ekin = 0.206067477061454 | erot = 0.262965803934464 | epot = -15.1114665259641 | etot = -14.6424332449682 -777000 ekin = 0.213875019081943 | erot = 0.269778568412073 | epot = -15.1260868325284 | etot = -14.6424332450344 -778000 ekin = 0.222366868961404 | erot = 0.281188790675987 | epot = -15.1459889047605 | etot = -14.6424332451231 -779000 ekin = 0.230862102265719 | erot = 0.296535944176208 | epot = -15.169831291669 | etot = -14.6424332452271 -780000 ekin = 0.238608567016806 | erot = 0.31499316909211 | epot = -15.1960349814464 | etot = -14.6424332453374 -781000 ekin = 0.244855557739756 | erot = 0.335629445236695 | epot = -15.2229182484214 | etot = -14.6424332454449 -782000 ekin = 0.248927612477286 | erot = 0.357478674286886 | epot = -15.2488395323048 | etot = -14.6424332455406 -783000 ekin = 0.250291897528993 | erot = 0.379610269028342 | epot = -15.2723354121742 | etot = -14.6424332456169 -784000 ekin = 0.248613283253222 | erot = 0.401195731122937 | epot = -15.2922422600437 | etot = -14.6424332456676 -785000 ekin = 0.243793133451402 | erot = 0.421566090466529 | epot = -15.3077924696065 | etot = -14.6424332456886 -786000 ekin = 0.23598950185365 | erot = 0.44025590520682 | epot = -15.3186786527387 | etot = -14.6424332456782 -787000 ekin = 0.225617610785865 | erot = 0.457030673432359 | epot = -15.3250815298553 | etot = -14.6424332456371 -788000 ekin = 0.213330260903178 | erot = 0.471895861695948 | epot = -15.3276593681676 | etot = -14.6424332455685 -789000 ekin = 0.199978499678579 | erot = 0.485087183883026 | epot = -15.3274989290395 | etot = -14.6424332454779 -790000 ekin = 0.186553834704508 | erot = 0.49704314124288 | epot = -15.32603022132 | etot = -14.6424332453726 -791000 ekin = 0.174114766793481 | erot = 0.508362048569847 | epot = -15.3249100606249 | etot = -14.6424332452616 -792000 ekin = 0.163702420432414 | erot = 0.519746739180895 | epot = -15.3258824047679 | etot = -14.6424332451546 -793000 ekin = 0.156252224966309 | erot = 0.53194082298947 | epot = -15.3306262930168 | etot = -14.642433245061 -794000 ekin = 0.152510350034315 | erot = 0.545660777315094 | epot = -15.3406043723391 | etot = -14.6424332449897 -795000 ekin = 0.152964251156891 | erot = 0.5615283269811 | epot = -15.3569258230857 | etot = -14.6424332449477 -796000 ekin = 0.157795747355246 | erot = 0.580007578778131 | epot = -15.3802365710729 | etot = -14.6424332449395 -797000 ekin = 0.166862457855134 | erot = 0.601351255569813 | epot = -15.4106469583918 | etot = -14.6424332449668 -798000 ekin = 0.179709603428539 | erot = 0.62556012184583 | epot = -15.4477029703029 | etot = -14.6424332450285 -799000 ekin = 0.195609966057053 | erot = 0.652359247176983 | epot = -15.490402458355 | etot = -14.642433245121 -800000 ekin = 0.213626158786136 | erot = 0.68119402187417 | epot = -15.5372534258983 | etot = -14.642433245238 -801000 ekin = 0.232687040188266 | erot = 0.711247726387183 | epot = -15.5863680119474 | etot = -14.642433245372 -802000 ekin = 0.251669429100998 | erot = 0.741480919836821 | epot = -15.6355835944519 | etot = -14.642433245514 -803000 ekin = 0.269477067853637 | erot = 0.770691008421927 | epot = -15.6826013219306 | etot = -14.642433245655 -804000 ekin = 0.285110541453573 | erot = 0.797588259159231 | epot = -15.7251320463985 | etot = -14.6424332457857 -805000 ekin = 0.297723982502801 | erot = 0.820882528800413 | epot = -15.7610397572012 | etot = -14.6424332458979 -806000 ekin = 0.306666387684663 | erot = 0.839373432914301 | epot = -15.7884730665838 | etot = -14.6424332459848 -807000 ekin = 0.311506975554225 | erot = 0.852035914446659 | epot = -15.8059761360419 | etot = -14.642433246041 -808000 ekin = 0.312045176252483 | erot = 0.858093398528957 | epot = -15.812571820845 | etot = -14.6424332460636 -809000 ekin = 0.308306642387543 | erot = 0.857071970759347 | epot = -15.8078118591986 | etot = -14.6424332460517 -810000 ekin = 0.300527220561017 | erot = 0.848831113929473 | epot = -15.7917915804974 | etot = -14.6424332460069 -811000 ekin = 0.289127204421129 | erot = 0.833569138622877 | epot = -15.7651295889766 | etot = -14.6424332459326 -812000 ekin = 0.274678427602343 | erot = 0.811804116493732 | epot = -15.72891578993 | etot = -14.6424332458339 -813000 ekin = 0.257866835583857 | erot = 0.784333459543394 | epot = -15.6846335408442 | etot = -14.642433245717 -814000 ekin = 0.23945308059417 | erot = 0.752176980197134 | epot = -15.6340633063801 | etot = -14.6424332455888 -815000 ekin = 0.220233415151649 | erot = 0.716509170267373 | epot = -15.5791758308753 | etot = -14.6424332454563 -816000 ekin = 0.201002751046645 | erot = 0.678586569748774 | epot = -15.5220225661215 | etot = -14.6424332453261 -817000 ekin = 0.182521261080257 | erot = 0.639675603865673 | epot = -15.4646301101501 | etot = -14.6424332452042 -818000 ekin = 0.16548540152787 | erot = 0.600985363832187 | epot = -15.4089040104558 | etot = -14.6424332450958 -819000 ekin = 0.15050378978045 | erot = 0.563608719250084 | epot = -15.3565457540356 | etot = -14.642433245005 -820000 ekin = 0.138078032178526 | erot = 0.528474068973221 | epot = -15.3089853460867 | etot = -14.6424332449349 -821000 ekin = 0.1285883867302 | erot = 0.496309093118672 | epot = -15.2673307247365 | etot = -14.6424332448876 -822000 ekin = 0.12228406613689 | erot = 0.467617125516686 | epot = -15.2323344365175 | etot = -14.6424332448639 -823000 ekin = 0.119278020924427 | erot = 0.442666228479689 | epot = -15.204377494268 | etot = -14.6424332448639 -824000 ekin = 0.119546158603772 | erot = 0.421490682739598 | epot = -15.1834700862299 | etot = -14.6424332448865 -825000 ekin = 0.122931110514646 | erot = 0.403904342224695 | epot = -15.1692686976689 | etot = -14.6424332449295 -826000 ekin = 0.129150803764422 | erot = 0.389525075000924 | epot = -15.1611091237554 | etot = -14.64243324499 -827000 ekin = 0.137812176399265 | erot = 0.377809252271385 | epot = -15.1580546737348 | etot = -14.6424332450642 -828000 ekin = 0.148430331608458 | erot = 0.368094906963596 | epot = -15.1589584837193 | etot = -14.6424332451472 -829000 ekin = 0.160453205761757 | erot = 0.3596517375127 | epot = -15.1625381885084 | etot = -14.6424332452339 -830000 ekin = 0.173291382896823 | erot = 0.351735589545891 | epot = -15.1674602177611 | etot = -14.6424332453184 -831000 ekin = 0.186352012963015 | erot = 0.343644456330365 | epot = -15.1724297146884 | etot = -14.642433245395 -832000 ekin = 0.199074924605492 | erot = 0.334772487921431 | epot = -15.1762806579853 | etot = -14.6424332454584 -833000 ekin = 0.210968084880519 | erot = 0.324658115189106 | epot = -15.1780594455734 | etot = -14.6424332455038 -834000 ekin = 0.22163875725694 | erot = 0.313022323442632 | epot = -15.1770943262278 | etot = -14.6424332455283 -835000 ekin = 0.230816330001906 | erot = 0.299793483326875 | epot = -15.1730430588591 | etot = -14.6424332455304 -836000 ekin = 0.238363132174156 | erot = 0.285116039960992 | epot = -15.165912417646 | etot = -14.6424332455109 -837000 ekin = 0.244270841530906 | erot = 0.269341751259717 | epot = -15.1560458382634 | etot = -14.6424332454728 -838000 ekin = 0.248642320235629 | erot = 0.253003904103877 | epot = -15.1440794697601 | etot = -14.6424332454206 -839000 ekin = 0.251661569327587 | erot = 0.236776758987145 | epot = -15.1308715736748 | etot = -14.6424332453601 -840000 ekin = 0.253557306828163 | erot = 0.221424057161458 | epot = -15.117414609287 | etot = -14.6424332452974 -841000 ekin = 0.254567562696712 | erot = 0.207741475743549 | epot = -15.1047422836783 | etot = -14.642433245238 -842000 ekin = 0.254912814683648 | erot = 0.19649826235426 | epot = -15.093844322224 | etot = -14.6424332451861 -843000 ekin = 0.254783130765732 | erot = 0.18838292178705 | epot = -15.0855992976972 | etot = -14.6424332451444 -844000 ekin = 0.254340789697802 | erot = 0.183956927272122 | epot = -15.0807309620839 | etot = -14.642433245114 -845000 ekin = 0.253734932891637 | erot = 0.183619247980649 | epot = -15.079787425967 | etot = -14.6424332450947 -846000 ekin = 0.25312050419609 | erot = 0.187583282239926 | epot = -15.0831370315219 | etot = -14.6424332450859 -847000 ekin = 0.252671650088207 | erot = 0.195866742639201 | epot = -15.0909716378148 | etot = -14.6424332450873 -848000 ekin = 0.252580915310227 | erot = 0.208294222463247 | epot = -15.1033083828726 | etot = -14.6424332450991 -849000 ekin = 0.253039966848203 | erot = 0.224511555531949 | epot = -15.1199847675021 | etot = -14.642433245122 -850000 ekin = 0.254204001798466 | erot = 0.244010590097926 | epot = -15.1406478370531 | etot = -14.6424332451567 -851000 ekin = 0.25614833902674 | erot = 0.266162563602757 | epot = -15.1647441478328 | etot = -14.6424332452033 -852000 ekin = 0.258829686440543 | erot = 0.290257858698332 | epot = -15.1915207903994 | etot = -14.6424332452605 -853000 ekin = 0.262064657828545 | erot = 0.315549558167831 | epot = -15.2200474613219 | etot = -14.6424332453255 -854000 ekin = 0.265534116122616 | erot = 0.341297947736459 | epot = -15.2492653092525 | etot = -14.6424332453934 -855000 ekin = 0.26881517465356 | erot = 0.366813004430954 | epot = -15.2780614245429 | etot = -14.6424332454584 -856000 ekin = 0.2714354869546 | erot = 0.391492007901482 | epot = -15.3053607403704 | etot = -14.6424332455143 -857000 ekin = 0.272939108063026 | erot = 0.414849750473433 | epot = -15.3302221040922 | etot = -14.6424332455557 -858000 ekin = 0.272951155039827 | erot = 0.436539390688028 | epot = -15.3519237913065 | etot = -14.6424332455787 -859000 ekin = 0.27122988067654 | erot = 0.456362750059338 | epot = -15.370025876317 | etot = -14.6424332455811 -860000 ekin = 0.267698633834005 | erot = 0.474269718460678 | epot = -15.3844015978584 | etot = -14.6424332455637 -861000 ekin = 0.262455001753023 | erot = 0.490347316007822 | epot = -15.3952355632891 | etot = -14.6424332455283 -862000 ekin = 0.255758797176847 | erot = 0.504799761298972 | epot = -15.4029918039546 | etot = -14.6424332454788 -863000 ekin = 0.248003564341593 | erot = 0.517921532812577 | epot = -15.408358342574 | etot = -14.6424332454198 -864000 ekin = 0.239677655585047 | erot = 0.530065823503499 | epot = -15.412176724445 | etot = -14.6424332453565 -865000 ekin = 0.23132088944558 | erot = 0.541610953534477 | epot = -15.4153650882737 | etot = -14.6424332452936 -866000 ekin = 0.223481813676492 | erot = 0.552927233332167 | epot = -15.4188422922443 | etot = -14.6424332452356 -867000 ekin = 0.21667917449216 | erot = 0.564346499432584 | epot = -15.4234589191109 | etot = -14.6424332451862 -868000 ekin = 0.211369750018423 | erot = 0.576136138939141 | epot = -15.4299391341058 | etot = -14.6424332451482 -869000 ekin = 0.207923502308487 | erot = 0.588478941151825 | epot = -15.4388356885839 | etot = -14.6424332451236 -870000 ekin = 0.206606153000579 | erot = 0.601459626890824 | epot = -15.4504990250046 | etot = -14.6424332451132 -871000 ekin = 0.207568796758706 | erot = 0.615058451106102 | epot = -15.4650604929822 | etot = -14.6424332451174 -872000 ekin = 0.210843969902103 | erot = 0.629151875760072 | epot = -15.4824290907977 | etot = -14.6424332451355 -873000 ekin = 0.216347593119445 | erot = 0.643519970834179 | epot = -15.5023008091198 | etot = -14.6424332451662 -874000 ekin = 0.223886305143434 | erot = 0.657859909731246 | epot = -15.5241794600821 | etot = -14.6424332452075 -875000 ekin = 0.233169807553067 | erot = 0.671804662211551 | epot = -15.5474077150215 | etot = -14.6424332452569 -876000 ekin = 0.243827877963456 | erot = 0.684945735800616 | epot = -15.5712068590756 | etot = -14.6424332453115 -877000 ekin = 0.255431632545719 | erot = 0.696858567355222 | epot = -15.5947234452689 | etot = -14.642433245368 -878000 ekin = 0.267518408512945 | erot = 0.707128927389438 | epot = -15.6170805813253 | etot = -14.6424332454229 -879000 ekin = 0.279619300258663 | erot = 0.715378495721848 | epot = -15.6374310414535 | etot = -14.642433245473 -880000 ekin = 0.291287955020082 | erot = 0.721287639199831 | epot = -15.655008839735 | etot = -14.6424332455151 -881000 ekin = 0.302128778464172 | erot = 0.724613422811349 | epot = -15.6691754468222 | etot = -14.6424332455467 -882000 ekin = 0.311822304068348 | erot = 0.72520106817747 | epot = -15.6794566178122 | etot = -14.6424332455663 -883000 ekin = 0.32014524378723 | erot = 0.722987481104759 | epot = -15.6855659704652 | etot = -14.6424332455732 -884000 ekin = 0.326982762198449 | erot = 0.717996120159773 | epot = -15.6874121279262 | etot = -14.642433245568 -885000 ekin = 0.332330882212052 | erot = 0.710323349672674 | epot = -15.6850874774371 | etot = -14.6424332455524 -886000 ekin = 0.336287673330606 | erot = 0.700117442976865 | epot = -15.6788383618368 | etot = -14.6424332455294 -887000 ekin = 0.339032964151287 | erot = 0.687552454437637 | epot = -15.6690186640915 | etot = -14.6424332455026 -888000 ekin = 0.340797654544087 | erot = 0.672800100946149 | epot = -15.6560310009666 | etot = -14.6424332454764 -889000 ekin = 0.341825106158792 | erot = 0.656003407102967 | epot = -15.6402617587166 | etot = -14.6424332454548 -890000 ekin = 0.34232834757507 | erot = 0.637256013166648 | epot = -15.6220176061832 | etot = -14.6424332454415 -891000 ekin = 0.342447730492025 | erot = 0.616590618571196 | epot = -15.6014715945022 | etot = -14.642433245439 -892000 ekin = 0.342214057411764 | erot = 0.593979026507483 | epot = -15.5786263293677 | etot = -14.6424332454484 -893000 ekin = 0.341522004910226 | erot = 0.569344767734754 | epot = -15.5533000181142 | etot = -14.6424332454692 -894000 ekin = 0.340117934117732 | erot = 0.542587519917767 | epot = -15.5251386995347 | etot = -14.6424332454992 -895000 ekin = 0.337605044782691 | erot = 0.513616778982377 | epot = -15.4936550692997 | etot = -14.6424332455346 -896000 ekin = 0.333467462872541 | erot = 0.482390775176039 | epot = -15.4582914836189 | etot = -14.6424332455703 -897000 ekin = 0.327113397522298 | erot = 0.448955709004864 | epot = -15.4185023521275 | etot = -14.6424332456003 -898000 ekin = 0.317936017621705 | erot = 0.413480165460747 | epot = -15.3738494287008 | etot = -14.6424332456183 -899000 ekin = 0.305389123797813 | erot = 0.376280077470634 | epot = -15.3241024468866 | etot = -14.6424332456181 -900000 ekin = 0.289072881398238 | erot = 0.337830752319679 | epot = -15.2693368793119 | etot = -14.642433245594 -901000 ekin = 0.268822686263766 | erot = 0.298764046956941 | epot = -15.2100199787623 | etot = -14.6424332455416 -902000 ekin = 0.244791653973854 | erot = 0.259850521116686 | epot = -15.147075420549 | etot = -14.6424332454585 -903000 ekin = 0.217514571467877 | erot = 0.2219680472084 | epot = -15.0819158640211 | etot = -14.6424332453448 -904000 ekin = 0.187939204416865 | erot = 0.18605969200996 | epot = -15.016432141631 | etot = -14.6424332452042 -905000 ekin = 0.157410847736454 | erot = 0.153084564880819 | epot = -14.9529286576615 | etot = -14.6424332450442 -906000 ekin = 0.127599356275869 | erot = 0.123965703542124 | epot = -14.8939983046943 | etot = -14.6424332448764 -907000 ekin = 0.100365589134273 | erot = 0.0995389863865968 | epot = -14.8423378202365 | etot = -14.6424332447156 -908000 ekin = 0.0775759855969076 | erot = 0.0805066337373332 | epot = -14.8005158639122 | etot = -14.6424332445779 -909000 ekin = 0.060887695004245 | erot = 0.0673982354544352 | epot = -14.7707191749376 | etot = -14.6424332444789 -910000 ekin = 0.051538292298201 | erot = 0.0605415547689986 | epot = -14.7545130914979 | etot = -14.6424332444307 -911000 ekin = 0.0501789452889314 | erot = 0.0600446989611976 | epot = -14.7526568886895 | etot = -14.6424332444394 -912000 ekin = 0.0567846925720761 | erot = 0.0657906450222932 | epot = -14.7650085820985 | etot = -14.6424332445042 -913000 ekin = 0.0706603747930264 | erot = 0.0774445361866898 | epot = -14.7905381555969 | etot = -14.6424332446172 -914000 ekin = 0.0905398584091763 | erot = 0.0944735694303653 | epot = -14.8274466726047 | etot = -14.6424332447652 -915000 ekin = 0.114756144628428 | erot = 0.116178630207615 | epot = -14.8733680197682 | etot = -14.6424332449321 -916000 ekin = 0.141447043402292 | erot = 0.141736093139118 | epot = -14.9256163816431 | etot = -14.6424332451017 -917000 ekin = 0.168758535419861 | erot = 0.170247440488538 | epot = -14.9814392211683 | etot = -14.6424332452599 -918000 ekin = 0.195014913439662 | erot = 0.200793639368136 | epot = -15.0382417982035 | etot = -14.6424332453957 -919000 ekin = 0.218837422083706 | erot = 0.232490666335444 | epot = -15.0937613339213 | etot = -14.6424332455022 -920000 ekin = 0.239206641023781 | erot = 0.264542267091206 | epot = -15.1461821536913 | etot = -14.6424332455763 -921000 ekin = 0.255474577148722 | erot = 0.29628605080145 | epot = -15.1941938735681 | etot = -14.6424332456179 -922000 ekin = 0.26733863121584 | erot = 0.327229363204498 | epot = -15.2370012400495 | etot = -14.6424332456292 -923000 ekin = 0.274791412214288 | erot = 0.357072039936907 | epot = -15.2742966977651 | etot = -14.6424332456139 -924000 ekin = 0.278059017516471 | erot = 0.385714059432095 | epot = -15.3062063225254 | etot = -14.6424332455768 -925000 ekin = 0.277537405168489 | erot = 0.413247220094928 | epot = -15.3332178707869 | etot = -14.6424332455235 -926000 ekin = 0.273733135238468 | erot = 0.439931173660914 | epot = -15.3560975543588 | etot = -14.6424332454594 -927000 ekin = 0.26721185964169 | erot = 0.466155363881716 | epot = -15.3758004689138 | etot = -14.6424332453904 -928000 ekin = 0.258555847536273 | erot = 0.492389553502083 | epot = -15.3933786463605 | etot = -14.6424332453221 -929000 ekin = 0.248330567892114 | erot = 0.519126582981251 | epot = -15.4098903961332 | etot = -14.6424332452599 -930000 ekin = 0.237059747166417 | erot = 0.546821711631313 | epot = -15.4263147040061 | etot = -14.6424332452084 -931000 ekin = 0.225208144806099 | erot = 0.575833282923054 | epot = -15.4434746729006 | etot = -14.6424332451714 -932000 ekin = 0.213171319366128 | erot = 0.606369490851291 | epot = -15.4619740553693 | etot = -14.6424332451519 -933000 ekin = 0.201271722996209 | erot = 0.638445690378466 | epot = -15.482150658526 | etot = -14.6424332451513 -934000 ekin = 0.189760460110485 | erot = 0.671856006698808 | epot = -15.5040497119792 | etot = -14.6424332451699 -935000 ekin = 0.178823941838717 | erot = 0.706161996587126 | epot = -15.5274191836321 | etot = -14.6424332452063 -936000 ekin = 0.168594479115294 | erot = 0.740699865837039 | epot = -15.5517275902103 | etot = -14.6424332452579 -937000 ekin = 0.159163635635195 | erot = 0.774606336205919 | epot = -15.5762032171622 | etot = -14.6424332453211 -938000 ekin = 0.150596971915171 | erot = 0.806861786796075 | epot = -15.5998920041023 | etot = -14.6424332453911 -939000 ekin = 0.142948711632666 | erot = 0.836347883526529 | epot = -15.6217298406219 | etot = -14.6424332454627 -940000 ekin = 0.136274889171384 | erot = 0.861915676028721 | epot = -15.6406238107305 | etot = -14.6424332455304 -941000 ekin = 0.130643703199134 | erot = 0.882459199120404 | epot = -15.6555361479088 | etot = -14.6424332455893 -942000 ekin = 0.126142088160929 | erot = 0.896989065172066 | epot = -15.6655643989677 | etot = -14.6424332456347 -943000 ekin = 0.122877886110378 | erot = 0.904700444358843 | epot = -15.6700115761325 | etot = -14.6424332456633 -944000 ekin = 0.12097740741224 | erot = 0.905030230236918 | epot = -15.6684408833219 | etot = -14.6424332456728 -945000 ekin = 0.120578563690818 | erot = 0.897699054745715 | epot = -15.660710864099 | etot = -14.6424332456625 -946000 ekin = 0.121820103593603 | erot = 0.882735070928584 | epot = -15.6469884201552 | etot = -14.642433245633 -947000 ekin = 0.124827761129181 | erot = 0.860477935596529 | epot = -15.6277389423121 | etot = -14.6424332455864 -948000 ekin = 0.129698334168747 | erot = 0.831563037038142 | epot = -15.6036946167331 | etot = -14.6424332455262 -949000 ekin = 0.136482857558223 | erot = 0.796887554722467 | epot = -15.5758036577371 | etot = -14.6424332454564 -950000 ekin = 0.145170138931244 | erot = 0.757561255988665 | epot = -15.545164640302 | etot = -14.6424332453821 -951000 ekin = 0.155672002995198 | erot = 0.714845916094193 | epot = -15.5129511643977 | etot = -14.6424332453083 -952000 ekin = 0.167811650836288 | erot = 0.670087833250747 | epot = -15.4803327293271 | etot = -14.64243324524 -953000 ekin = 0.181316579471282 | erot = 0.62464809521251 | epot = -15.4483979198655 | etot = -14.6424332451817 -954000 ekin = 0.195817500701168 | erot = 0.579835080696309 | epot = -15.4180858265343 | etot = -14.6424332451368 -955000 ekin = 0.210854606876659 | erot = 0.536843219769282 | epot = -15.3901310717537 | etot = -14.6424332451077 -956000 ekin = 0.225892299837258 | erot = 0.49670137679197 | epot = -15.3650269217247 | etot = -14.6424332450955 -957000 ekin = 0.240343066498473 | erot = 0.460233438094331 | epot = -15.3430097496925 | etot = -14.6424332450997 -958000 ekin = 0.253600493839208 | erot = 0.428032849894538 | epot = -15.324066588852 | etot = -14.6424332451182 -959000 ekin = 0.26508043374811 | erot = 0.400452005459373 | epot = -15.3079656843552 | etot = -14.6424332451478 -960000 ekin = 0.274268068130398 | erot = 0.377606549450015 | epot = -15.2943078627643 | etot = -14.6424332451839 -961000 ekin = 0.280767178003419 | erot = 0.359393861249926 | epot = -15.2825942844748 | etot = -14.6424332452215 -962000 ekin = 0.284346484063279 | erot = 0.345524198816832 | epot = -15.2723039281355 | etot = -14.6424332452554 -963000 ekin = 0.284976816089691 | erot = 0.3355622323293 | epot = -15.2629722936999 | etot = -14.6424332452809 -964000 ekin = 0.282852494247854 | erot = 0.328975986496892 | epot = -15.2542617260392 | etot = -14.6424332452945 -965000 ekin = 0.278391086615428 | erot = 0.325189577598743 | epot = -15.2460139095086 | etot = -14.6424332452944 -966000 ekin = 0.272207924679439 | erot = 0.323635640150665 | epot = -15.2382768101109 | etot = -14.6424332452808 -967000 ekin = 0.265065367870575 | erot = 0.323803079987219 | epot = -15.2313016931133 | etot = -14.6424332452555 -968000 ekin = 0.257801293713888 | erot = 0.325275872290492 | epot = -15.2255104112269 | etot = -14.6424332452225 -969000 ekin = 0.251245661474162 | erot = 0.327759142575902 | epot = -15.2214380492365 | etot = -14.6424332451864 -970000 ekin = 0.24613700899304 | erot = 0.331089781180773 | epot = -15.2196600353261 | etot = -14.6424332451523 -971000 ekin = 0.243051319616021 | erot = 0.335230325664833 | epot = -15.2207148904054 | etot = -14.6424332451246 -972000 ekin = 0.242353409638695 | erot = 0.340246678804358 | epot = -15.22503333355 | etot = -14.6424332451069 -973000 ekin = 0.244176338162489 | erot = 0.346272190710356 | epot = -15.2328817739745 | etot = -14.6424332451017 -974000 ekin = 0.248428661658042 | erot = 0.353462430361478 | epot = -15.2443243371296 | etot = -14.6424332451101 -975000 ekin = 0.254824314803068 | erot = 0.361946299430202 | epot = -15.2592038593654 | etot = -14.6424332451321 -976000 ekin = 0.262926848820545 | erot = 0.371779749929518 | epot = -15.2771398439171 | etot = -14.642433245167 -977000 ekin = 0.27219923533091 | erot = 0.382908123263806 | epot = -15.297540603808 | etot = -14.6424332452133 -978000 ekin = 0.282052066851764 | erot = 0.395142048097211 | epot = -15.3196273602177 | etot = -14.6424332452688 -979000 ekin = 0.291885751914043 | erot = 0.408150081471225 | epot = -15.3424690787159 | etot = -14.6424332453306 -980000 ekin = 0.301125083790016 | erot = 0.421469125222495 | epot = -15.365027454408 | etot = -14.6424332453955 -981000 ekin = 0.309246535917451 | erot = 0.434531423656212 | epot = -15.3862112050333 | etot = -14.6424332454596 -982000 ekin = 0.315799497490911 | erot = 0.446704965616411 | epot = -15.404937708626 | etot = -14.6424332455187 -983000 ekin = 0.32042257322114 | erot = 0.457342632743475 | epot = -15.4201984515335 | etot = -14.6424332455688 -984000 ekin = 0.322855465258551 | erot = 0.465834622598882 | epot = -15.4311233334638 | etot = -14.6424332456063 -985000 ekin = 0.322946302475207 | erot = 0.47165859097348 | epot = -15.4370381390771 | etot = -14.6424332456284 -986000 ekin = 0.320653917805744 | erot = 0.474422556589946 | epot = -15.4375097200291 | etot = -14.6424332456334 -987000 ekin = 0.316044627362153 | erot = 0.473896755515053 | epot = -15.4323746284979 | etot = -14.6424332456207 -988000 ekin = 0.309283477268727 | erot = 0.470032116944613 | epot = -15.4217488398044 | etot = -14.6424332455911 -989000 ekin = 0.300620522169168 | erot = 0.462964620621354 | epot = -15.4060183883369 | etot = -14.6424332455464 -990000 ekin = 0.290373280691188 | erot = 0.453006262994313 | epot = -15.3858127891748 | etot = -14.6424332454893 -991000 ekin = 0.278906915705663 | erot = 0.440624526218637 | epot = -15.3619646873472 | etot = -14.6424332454229 -992000 ekin = 0.266613826415146 | erot = 0.426413006890641 | epot = -15.3354600786566 | etot = -14.6424332453509 -993000 ekin = 0.253894212446534 | erot = 0.411056197524004 | epot = -15.3073836552473 | etot = -14.6424332452767 -994000 ekin = 0.24113883700009 | erot = 0.395291372387941 | epot = -15.2788634545917 | etot = -14.6424332452037 -995000 ekin = 0.22871476890696 | erot = 0.379870207854789 | epot = -15.2510182218965 | etot = -14.6424332451348 -996000 ekin = 0.216954417470376 | erot = 0.365522282707067 | epot = -15.2249099452499 | etot = -14.6424332450725 -997000 ekin = 0.206147766455999 | erot = 0.352922066138332 | epot = -15.2015030776131 | etot = -14.6424332450188 -998000 ekin = 0.196537413157836 | erot = 0.342660495991062 | epot = -15.1816311541242 | etot = -14.6424332449753 -999000 ekin = 0.18831584391307 | erot = 0.335221830005501 | epot = -15.1659709188615 | etot = -14.642433244943 -1000000 ekin = 0.181624323067755 | erot = 0.330966139649165 | epot = -15.1550237076395 | etot = -14.6424332449226 - 1000000 0.013453654 -1.5270261 0.011523695 -1.4973399 -8.4815516e-05 -Loop time of 16.5005 on 4 procs for 1000000 steps with 10 atoms - -Performance: 52362.058 tau/day, 60604.234 timesteps/s -99.5% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 0.51373 | 5.7702 | 10.408 | 174.5 | 34.97 -Bond | 0.084405 | 0.27056 | 0.44162 | 28.3 | 1.64 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 1.7403 | 2.0946 | 2.4247 | 18.8 | 12.69 -Output | 4e-05 | 6e-05 | 7.1e-05 | 0.0 | 0.00 -Modify | 0.17451 | 0.87938 | 1.53 | 58.2 | 5.33 -Other | | 7.486 | | | 45.37 - -Nlocal: 2.5 ave 5.0 max 0.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 -Nghost: 7.5 ave 10.0 max 5.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 -Neighs: 16.0 ave 30.0 max 0.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 - -Total # of neighbors = 64 -Ave neighs/atom = 6.4 -Ave special neighs/atom = 3.6 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:16 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/data.duplex2 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/data.duplex2 index 72872d431a..8c985708ca 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/data.duplex2 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/data.duplex2 @@ -1,15 +1,14 @@ -# LAMMPS data file +LAMMPS data file via write_data, version 27 May 2021 + 16 atoms -16 ellipsoids -13 bonds - 4 atom types +13 bonds 1 bond types +16 ellipsoids -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi Masses @@ -18,79 +17,75 @@ Masses 3 3.1575 4 3.1575 -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms +Atoms # hybrid -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.860249842674776e-01 -3.518234140414736e-01 3.897628551303122e-01 1 1 1 -3 3 -1.874009511073395e-01 -5.699832309147915e-01 7.795257102606244e-01 1 1 1 -4 4 1.824198365552941e-01 -5.715968887521518e-01 1.169288565390937e+00 1 1 1 -5 1 4.829362784135484e-01 -3.560513319622209e-01 1.559051420521249e+00 1 1 1 -6 2 5.999771538385027e-01 -5.235921299024461e-03 1.948814275651561e+00 1 1 1 -7 3 4.890766774371325e-01 3.475687034056071e-01 2.338577130781873e+00 1 1 1 -8 4 1.923677943514057e-01 5.683261666476170e-01 2.728339985912185e+00 1 1 1 -9 1 -1.923677943514057e-01 -5.683261666476170e-01 2.728339985912185e+00 2 1 1 -10 2 -4.890766774371324e-01 -3.475687034056071e-01 2.338577130781873e+00 2 1 1 -11 3 -5.999771538385025e-01 5.235921299024461e-03 1.948814275651561e+00 2 1 1 -12 4 -4.829362784135481e-01 3.560513319622207e-01 1.559051420521249e+00 2 1 1 -13 1 -1.824198365552940e-01 5.715968887521514e-01 1.169288565390936e+00 2 1 1 -14 2 1.874009511073395e-01 5.699832309147912e-01 7.795257102606241e-01 2 1 1 -15 3 4.860249842674773e-01 3.518234140414733e-01 3.897628551303119e-01 2 1 1 -16 4 5.999999999999995e-01 -3.330669073875470e-17 -3.330669073875470e-16 2 1 1 +1 1 -0.6133472972454725 -0.657478171669766 0.36065226351201896 1 1 3.7269849963023267 0 0 0 +2 2 -0.45262764247356363 -1.0030650534345913 0.7258693379233347 1 1 3.7269849963023267 0 0 0 +3 3 -0.0988342108522641 -1.239775807128057 1.069462285786363 1 1 3.7269849963023267 0 0 0 +4 4 0.2937771854299732 -1.2579750924899842 1.4258916086606965 1 1 3.7269849963023267 0 0 0 +5 1 0.6286896795685137 -1.0183343395119744 1.7689346339672825 1 1 3.7269849963023267 0 0 0 +6 2 0.7901522619067926 -0.6766341805565266 2.1540160705495754 1 1 3.7269849963023267 0 0 0 +7 3 0.7115777184886863 -0.40195579325143455 2.569568683291525 1 1 3.7269849963023267 0 0 0 +8 4 0.46973310377005234 -0.30251697967107033 3.0668007117519216 1 1 3.7269849963023267 0 0 0 +9 1 0.4056113349449848 -1.443775499211898 3.0590726503341124 2 1 3.7269849963023267 0 0 0 +10 2 -0.032028429059287516 -1.2947520971164723 2.7201071151392187 2 1 3.7269849963023267 0 0 0 +11 3 -0.31613855112314065 -0.908414175906161 2.4125207871782006 2 1 3.7269849963023267 0 0 0 +12 4 -0.38939391251821 -0.4866605488242819 2.006177777000426 2 1 3.7269849963023267 0 0 0 +13 1 -0.06232643040853296 -0.07155965522127403 1.5593206052730733 3 1 3.7269849963023267 0 0 0 +14 2 0.17884090390913376 -0.05516721349427172 1.021273149730912 3 1 3.7269849963023267 0 0 0 +15 3 0.4513439961906 -0.23795607383274572 0.5957328539615993 3 1 3.7269849963023267 0 0 0 +16 4 0.5077649359807965 -0.5565625134533538 0.1655875784458841 3 1 3.7269849963023267 0 0 0 -# Atom-ID, translational velocity, angular momentum Velocities -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -11 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -12 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -13 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -14 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -15 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -16 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 +1 0.05386890022865587 0.02262922525602673 0.24882291144736746 0.1772010258006941 -0.29588531700001014 -0.2624137503614725 +2 -0.03995003075629463 0.26969511063701984 -0.18986454548195664 -0.030614539375968176 -0.11769518931480599 0.040074702426473215 +3 -0.20784535295201376 -0.13628722357673043 -0.06062477950201746 -0.03676034584820381 -0.06308707793373186 -0.14798601576087625 +4 -0.23969824181316998 -0.5624721730878831 0.032474422905036715 -0.16523645965016515 0.2860623077030974 0.33543519753105877 +5 -0.16114897356828353 -0.22889697470760145 -0.13553324962649563 0.07151030852881342 -0.09415592891043179 0.13422881539312292 +6 -0.04701706588477693 0.19216715585110036 0.14588242791297215 0.09218622989776322 -0.5640128930702024 0.09287105657777776 +7 0.05098438305112513 -0.038459555522009595 -0.14244196285749675 0.3479046835475834 0.4244922695910593 -0.13582882604358357 +8 0.37827971348411926 -0.04953992506010833 0.1626392045834847 0.0442887659636129 0.07868414126013584 -0.12713600444325032 +9 0.04912038408665491 0.041260647318716696 0.012223856334495234 0.03282916621721876 -0.00012670547095256 0.155978785417696 +10 0.1939216183073483 0.11075235485381942 -0.0405050516019971 -0.17008135001813812 -0.4563093565840761 -0.30318513627039506 +11 -0.351360733920646 -0.18822419067535692 0.36147938199051305 -0.3708221604627426 -0.49108381825941216 0.09435948331955418 +12 -0.1188642917357977 0.22355282456551884 0.009265586122144348 -0.28230100188858365 0.10276485660828892 0.10175233476780697 +13 -0.1446616296238799 -0.11552059909787235 0.1331477187595642 -0.25498721890374343 0.2754663721641154 0.05806416868630132 +14 0.051547120035862544 -0.36611026510775635 -0.06630782880801242 -0.11999847173316518 0.0684476892288605 0.2161595932308759 +15 -0.20214244962091388 0.23341226933559608 0.008133374252278069 -0.17013911124135248 0.01870292260510287 -0.2682954134361106 +16 -0.19202131162868008 -0.08105295741355378 -0.0469350810885074 0.017332107652647588 -0.32876588862807693 0.1085334141225924 -# Atom-ID, shape, quaternion -Ellipsoids - -1 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.513258223252946e-01 0.000000000000000e+00 0.000000000000000e+00 3.081869234362515e-01 -3 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 8.100416404457962e-01 0.000000000000000e+00 0.000000000000000e+00 5.863723567357894e-01 -4 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.899012371043606e-01 0.000000000000000e+00 0.000000000000000e+00 8.074754054847398e-01 -5 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 3.123349185122326e-01 0.000000000000000e+00 0.000000000000000e+00 9.499720515246527e-01 -6 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 4.363309284746654e-03 0.000000000000000e+00 0.000000000000000e+00 9.999904807207346e-01 -7 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -3.040330609254902e-01 0.000000000000000e+00 0.000000000000000e+00 9.526614812535865e-01 -8 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.828323126827837e-01 0.000000000000000e+00 0.000000000000000e+00 -8.125924533816677e-01 -9 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.125924533816681e-01 5.828323126827832e-01 -0.000000000000000e+00 -10 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.526614812535864e-01 3.040330609254902e-01 0.000000000000000e+00 -11 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.999904807207346e-01 -4.363309284746654e-03 0.000000000000000e+00 -12 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.499720515246526e-01 -3.123349185122325e-01 0.000000000000000e+00 -13 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.074754054847402e-01 -5.899012371043603e-01 0.000000000000000e+00 -14 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 5.863723567357898e-01 -8.100416404457959e-01 0.000000000000000e+00 -15 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -3.081869234362514e-01 9.513258223252948e-01 0.000000000000000e+00 -16 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 2.775557561562893e-17 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology Bonds -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 5 6 -6 1 6 7 -7 1 7 8 -8 1 9 10 -9 1 10 11 -10 1 11 12 -11 1 13 14 -12 1 14 15 -13 1 15 16 +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 5 6 +6 1 6 7 +7 1 7 8 +8 1 9 10 +9 1 10 11 +10 1 11 12 +11 1 13 14 +12 1 14 15 +13 1 15 16 + +Ellipsoids + +1 1.173984503142341 1.173984503142341 1.173984503142341 0.9964752158482045 -0.053253555733239796 0.011391163807102514 -0.06380787090289707 +2 1.173984503142341 1.173984503142341 1.173984503142341 0.9369923833143513 0.11220716044648564 0.06732538499716349 0.3239168400846305 +3 1.173984503142341 1.173984503142341 1.173984503142341 0.797964932091827 0.14473096354527873 0.18374142699366386 0.5554673737937029 +4 1.173984503142341 1.173984503142341 1.173984503142341 0.5660864821344559 0.14688275499481052 0.09873742533340191 0.8051226439917721 +5 1.173984503142341 1.173984503142341 1.173984503142341 0.2533023785125306 0.12062313161679827 0.08583012223905846 0.9559922359911086 +6 1.173984503142341 1.173984503142341 1.173984503142341 -0.03855807343534716 0.08405913137017908 0.02236505169306371 0.9954632800204194 +7 1.173984503142341 1.173984503142341 1.173984503142341 -0.45592844330248017 0.1004550065061007 -0.052524745294758785 0.8827679181910482 +8 1.173984503142341 1.173984503142341 1.173984503142341 0.768021221540491 -0.009582139884533599 0.03658677589040892 -0.63930665074644 +9 1.173984503142341 1.173984503142341 1.173984503142341 -0.23299975754512345 0.688686395231341 0.6747873944883376 -0.12682324016841584 +10 1.173984503142341 1.173984503142341 1.173984503142341 -0.24662061871907232 0.8744456399178389 0.39370836087823996 -0.13970261209395163 +11 1.173984503142341 1.173984503142341 1.173984503142341 -0.087475900850909 0.977367602388229 0.14493549113095577 -0.12686307572668784 +12 1.173984503142341 1.173984503142341 1.173984503142341 -0.03181169300779214 0.9634374984140112 -0.2442360692534371 -0.10547485630879185 +13 1.173984503142341 1.173984503142341 1.173984503142341 -0.032786070696572266 0.7922941528811777 -0.6084214170523915 -0.03191282109962717 +14 1.173984503142341 1.173984503142341 1.173984503142341 0.047188686288341455 0.6316396208287698 -0.7737349519945348 0.011783095844627799 +15 1.173984503142341 1.173984503142341 1.173984503142341 -0.05869980642620335 -0.34229358203414423 0.9376740835056508 0.012519965878508689 +16 1.173984503142341 1.173984503142341 1.173984503142341 -0.08582818143150042 0.0008707732197394232 0.9939540921464659 -0.0684691735853161 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/in.duplex2 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/in.duplex2 index 8307d805c3..6a6310b7f0 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/in.duplex2 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/in.duplex2 @@ -11,11 +11,11 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 1 delay 0 check yes read_data data.duplex2 @@ -40,27 +40,16 @@ pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 # NVE ensemble -#fix 1 all nve/dot -fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" +compute quat all property/atom quatw quati quatj quatk compute erot all erotate/asphere compute ekin all ke @@ -71,10 +60,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" run 1000000 -#write_restart config.${number}.* +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 new file mode 100644 index 0000000000..f69905aa0c --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 @@ -0,0 +1,1173 @@ +LAMMPS (27 May 2021) +variable number equal 2 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex2 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 16 atoms + reading velocities ... + 16 velocities + scanning bonds ... + 2 = max bonds/atom + 16 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 13 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.003 seconds + +set atom * mass 3.1575 +Setting atom values ... + 16 settings made for mass + +group all type 1 4 +16 atoms in group all + +# oxDNA bond interactions - FENE backbone +bond_style oxdna/fene +bond_coeff * 2.0 0.25 0.7525 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk +pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 + +# NVE ensemble +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.2.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 2.9560004 + ghost atom cutoff = 3.8 + binsize = 1.4780002, bins = 28 28 28 + 4 neighbor lists, perpetual/occasional/extra = 4 0 0 + (1) pair oxdna/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +0 ekin = 2.70475393009871 | erot = 2.80172072918779 | epot = -21.9967648054699 | etot = -16.4902901461834 +Per MPI rank memory allocation (min/avg/max) = 9.326 | 9.326 | 9.326 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.12021129 -1.3914531 0.016655298 -1.2057507 5.174549e-05 64000 +1000 ekin = 2.68462004451395 | erot = 2.58605420555131 | epot = -21.8105393794712 | etot = -16.5398651294059 +2000 ekin = 2.60963739095655 | erot = 2.48175619043154 | epot = -21.6459705488588 | etot = -16.5545769674707 +3000 ekin = 2.63989588847182 | erot = 2.46363051573262 | epot = -21.5254922679992 | etot = -16.4219658637948 +4000 ekin = 2.5752038952926 | erot = 2.37178501784054 | epot = -21.4327542438291 | etot = -16.485765330696 +5000 ekin = 2.5044104280733 | erot = 2.08769632851087 | epot = -21.3521450303024 | etot = -16.7600382737182 +6000 ekin = 2.36107642071569 | erot = 2.35003179412404 | epot = -21.2782010260872 | etot = -16.5670928112474 +7000 ekin = 2.37495351372023 | erot = 2.16846238087391 | epot = -21.2534688435259 | etot = -16.7100529489317 +8000 ekin = 2.42775724176585 | erot = 2.14686490397956 | epot = -21.2553298683528 | etot = -16.6807077226074 +9000 ekin = 2.31422464867069 | erot = 1.8637862252403 | epot = -21.2852707364932 | etot = -17.1072598625822 +10000 ekin = 2.3275093348898 | erot = 1.94087852055649 | epot = -21.3429178830636 | etot = -17.0745300276173 +11000 ekin = 2.23983345215334 | erot = 2.16573111806156 | epot = -21.4294123399217 | etot = -17.0238477697068 +12000 ekin = 2.24948652666018 | erot = 2.32563449403286 | epot = -21.5368720528797 | etot = -16.9617510321867 +13000 ekin = 2.3141269026489 | erot = 2.54687184991595 | epot = -21.62467553135 | etot = -16.7636767787851 +14000 ekin = 2.30456735091101 | erot = 2.82813231901192 | epot = -21.6854822284275 | etot = -16.5527825585046 +15000 ekin = 2.41196948877884 | erot = 2.60315540839484 | epot = -21.7080540027112 | etot = -16.6929291055375 +16000 ekin = 2.32930626459584 | erot = 2.77308393740008 | epot = -21.6887196306942 | etot = -16.5863294286983 +17000 ekin = 2.39617472660391 | erot = 3.03091034756258 | epot = -21.6395184677655 | etot = -16.2124333935991 +18000 ekin = 2.3327950089553 | erot = 3.14341710049 | epot = -21.5741278170259 | etot = -16.0979157075806 +19000 ekin = 2.42845349180327 | erot = 2.98452732659579 | epot = -21.4895578941597 | etot = -16.0765770757607 +20000 ekin = 2.58234763441785 | erot = 3.33252070318004 | epot = -21.3975543217035 | etot = -15.4826859841056 +21000 ekin = 2.6449455763858 | erot = 3.32881968524127 | epot = -21.3229796202747 | etot = -15.3492143586476 +22000 ekin = 2.65030022474644 | erot = 3.26762562263436 | epot = -21.2713919939756 | etot = -15.3534661465948 +23000 ekin = 2.74232842321963 | erot = 2.85782586045795 | epot = -21.2433172110301 | etot = -15.6431629273525 +24000 ekin = 2.70913362671021 | erot = 2.5614570464177 | epot = -21.2492397215426 | etot = -15.9786490484147 +25000 ekin = 2.71785549515017 | erot = 2.45020590769023 | epot = -21.2696953560915 | etot = -16.1016339532511 +26000 ekin = 2.80969274934563 | erot = 2.57761600133559 | epot = -21.3121170333524 | etot = -15.9248082826712 +27000 ekin = 2.90228693281849 | erot = 2.52543294446069 | epot = -21.3618959826307 | etot = -15.9341761053516 +28000 ekin = 2.80577992946705 | erot = 2.42942187536901 | epot = -21.4238267965374 | etot = -16.1886249917014 +29000 ekin = 2.84024245066251 | erot = 2.37728970052671 | epot = -21.5220045306241 | etot = -16.3044723794349 +30000 ekin = 2.91820846152589 | erot = 2.5285825532428 | epot = -21.6452589795617 | etot = -16.198467964793 +31000 ekin = 3.01591597087963 | erot = 2.66934437756135 | epot = -21.7837708816784 | etot = -16.0985105332374 +32000 ekin = 3.18554066714555 | erot = 2.70126504453976 | epot = -21.9266237283442 | etot = -16.0398180166589 +33000 ekin = 3.4559109786996 | erot = 3.05486835802113 | epot = -22.0467287622724 | etot = -15.5359494255517 +34000 ekin = 3.47254829729221 | erot = 3.41663527351813 | epot = -22.1468381626759 | etot = -15.2576545918655 +35000 ekin = 3.45946416093007 | erot = 3.2177601439385 | epot = -22.2021645741413 | etot = -15.5249402692727 +36000 ekin = 3.38072119723012 | erot = 2.9889184383328 | epot = -22.202497862958 | etot = -15.8328582273951 +37000 ekin = 3.29783742910404 | erot = 2.73521555931908 | epot = -22.1657123704834 | etot = -16.1326593820603 +38000 ekin = 3.33959958296025 | erot = 2.617783203284 | epot = -22.1041970676609 | etot = -16.1468142814166 +39000 ekin = 3.23639805960126 | erot = 2.58373522106731 | epot = -22.0096421543482 | etot = -16.1895088736796 +40000 ekin = 3.11586138662875 | erot = 2.19624820863949 | epot = -21.8962581958557 | etot = -16.5841486005874 +41000 ekin = 3.04246623801461 | erot = 2.23321889509951 | epot = -21.807787363566 | etot = -16.5321022304519 +42000 ekin = 2.84983279602751 | erot = 2.80264211079703 | epot = -21.748255605817 | etot = -16.0957806989924 +43000 ekin = 2.79124232412409 | erot = 2.40517464805221 | epot = -21.704091232696 | etot = -16.5076742605197 +44000 ekin = 2.66237577064431 | erot = 2.48075679823103 | epot = -21.6865985692202 | etot = -16.5434660003448 +45000 ekin = 2.57941183432903 | erot = 2.51210561132975 | epot = -21.7100580821224 | etot = -16.6185406364637 +46000 ekin = 2.732761778313 | erot = 2.72002755015638 | epot = -21.7400457171799 | etot = -16.2872563887105 +47000 ekin = 2.64234876254598 | erot = 2.59091566156289 | epot = -21.7975985084293 | etot = -16.5643340843204 +48000 ekin = 2.59173469012523 | erot = 2.43590670780657 | epot = -21.8709604205579 | etot = -16.8433190226261 +49000 ekin = 2.72309795319076 | erot = 2.23156431391338 | epot = -21.9468429014909 | etot = -16.9921806343868 +50000 ekin = 2.84714836170718 | erot = 1.99663528516206 | epot = -22.0121784873832 | etot = -17.168394840514 +51000 ekin = 2.89884791688871 | erot = 1.91491454776677 | epot = -22.0530950349948 | etot = -17.2393325703393 +52000 ekin = 3.03617525579655 | erot = 2.19848391536796 | epot = -22.0866976985223 | etot = -16.8520385273578 +53000 ekin = 2.9917537491504 | erot = 2.39711100098148 | epot = -22.1010575333115 | etot = -16.7121927831796 +54000 ekin = 2.99574935861399 | erot = 2.32745187661848 | epot = -22.1028140124057 | etot = -16.7796127771732 +55000 ekin = 2.99570982560687 | erot = 2.49897185698991 | epot = -22.105723856857 | etot = -16.6110421742602 +56000 ekin = 2.94925439949785 | erot = 2.44012089769545 | epot = -22.0870769441157 | etot = -16.6977016469224 +57000 ekin = 2.94734500065235 | erot = 2.12984920172191 | epot = -22.0412734212001 | etot = -16.9640792188258 +58000 ekin = 2.8195513388404 | erot = 2.13458872869613 | epot = -21.9788636009448 | etot = -17.0247235334083 +59000 ekin = 2.70811531854734 | erot = 2.38980716247399 | epot = -21.8949081752973 | etot = -16.7969856942759 +60000 ekin = 2.70414157935546 | erot = 2.55940091198391 | epot = -21.7861093627115 | etot = -16.5225668713721 +61000 ekin = 2.65859389245694 | erot = 2.53396073555877 | epot = -21.6569039895118 | etot = -16.4643493614961 +62000 ekin = 2.60219558362528 | erot = 2.22515394919042 | epot = -21.5116333689022 | etot = -16.6842838360865 +63000 ekin = 2.63153399947686 | erot = 2.22422110021206 | epot = -21.3652621775789 | etot = -16.50950707789 +64000 ekin = 2.74532788694548 | erot = 2.1852310955141 | epot = -21.2714335683308 | etot = -16.3408745858712 +65000 ekin = 2.72054938384344 | erot = 2.0734388946021 | epot = -21.2024805852124 | etot = -16.4084923067669 +66000 ekin = 2.58244112846417 | erot = 2.07735193876559 | epot = -21.1764160570954 | etot = -16.5166229898656 +67000 ekin = 2.57755413160866 | erot = 2.44046690225453 | epot = -21.1906023260749 | etot = -16.1725812922117 +68000 ekin = 2.48736395314817 | erot = 2.12758461162315 | epot = -21.2185147422317 | etot = -16.6035661774604 +69000 ekin = 2.41843849956018 | erot = 2.1851511208093 | epot = -21.2498143720114 | etot = -16.6462247516419 +70000 ekin = 2.42405639999474 | erot = 1.95650329930019 | epot = -21.2748182794301 | etot = -16.8942585801352 +71000 ekin = 2.43121308276011 | erot = 1.85632548443193 | epot = -21.3045707498285 | etot = -17.0170321826365 +72000 ekin = 2.50008703688388 | erot = 1.59919455914919 | epot = -21.3493737552797 | etot = -17.2500921592466 +73000 ekin = 2.68616751062556 | erot = 1.88927937064788 | epot = -21.3998788656788 | etot = -16.8244319844054 +74000 ekin = 2.7264265029667 | erot = 1.98526997108522 | epot = -21.439395334657 | etot = -16.7276988606051 +75000 ekin = 2.82872762184215 | erot = 2.08391491924432 | epot = -21.4749344303949 | etot = -16.5622918893084 +76000 ekin = 2.90099143523702 | erot = 2.16095088121797 | epot = -21.493537150752 | etot = -16.431594834297 +77000 ekin = 3.18544250151158 | erot = 2.00037055601336 | epot = -21.4789486218772 | etot = -16.2931355643523 +78000 ekin = 3.25276485916355 | erot = 2.04037410610702 | epot = -21.4312552501158 | etot = -16.1381162848452 +79000 ekin = 3.31064968204684 | erot = 2.17606310098545 | epot = -21.3489462542885 | etot = -15.8622334712562 +80000 ekin = 3.2501731479278 | erot = 1.78411830235591 | epot = -21.2684346239655 | etot = -16.2341431736818 +81000 ekin = 3.28475664530894 | erot = 1.62694393051346 | epot = -21.2092459483416 | etot = -16.2975453725192 +82000 ekin = 3.22905109952648 | erot = 1.53744252292448 | epot = -21.2050298148134 | etot = -16.4385361923624 +83000 ekin = 3.23231520762087 | erot = 1.77352705563455 | epot = -21.2433468675554 | etot = -16.2375046043 +84000 ekin = 3.2686769392199 | erot = 1.72038623835535 | epot = -21.2969079823477 | etot = -16.3078448047725 +85000 ekin = 3.24886887492836 | erot = 1.71422228707809 | epot = -21.3487304738108 | etot = -16.3856393118043 +86000 ekin = 3.373889669088 | erot = 2.05166004106914 | epot = -21.4140353196306 | etot = -15.9884856094734 +87000 ekin = 3.32398602808484 | erot = 2.11391553019111 | epot = -21.504425162937 | etot = -16.066523604661 +88000 ekin = 3.37321522230413 | erot = 1.88481910803275 | epot = -21.6374519675633 | etot = -16.3794176372264 +89000 ekin = 3.4028784845023 | erot = 1.74012560118448 | epot = -21.7814074383675 | etot = -16.6384033526808 +90000 ekin = 3.56172892861212 | erot = 2.10522136125781 | epot = -21.9615291243627 | etot = -16.2945788344927 +91000 ekin = 3.55669957238083 | erot = 2.42086123522054 | epot = -22.1511779304613 | etot = -16.1736171228599 +92000 ekin = 3.64237791317121 | erot = 2.65970416317374 | epot = -22.3488733671942 | etot = -16.0467912908492 +93000 ekin = 3.71183685172055 | erot = 2.62133287897564 | epot = -22.5092709223126 | etot = -16.1761011916164 +94000 ekin = 3.68157545521776 | erot = 2.45531539887243 | epot = -22.6307602436275 | etot = -16.4938693895373 +95000 ekin = 3.60128502265547 | erot = 2.60141757186748 | epot = -22.7389627643835 | etot = -16.5362601698605 +96000 ekin = 3.53126429160548 | erot = 2.72315885473471 | epot = -22.8177646203461 | etot = -16.5633414740059 +97000 ekin = 3.47335877191586 | erot = 2.74980204474208 | epot = -22.859910231875 | etot = -16.6367494152171 +98000 ekin = 3.36569576671704 | erot = 2.64094316029088 | epot = -22.8536591989749 | etot = -16.847020271967 +99000 ekin = 3.17486973109326 | erot = 2.83643491109138 | epot = -22.8212456182645 | etot = -16.8099409760799 +100000 ekin = 2.98877854809339 | erot = 2.8502739133799 | epot = -22.7838710680406 | etot = -16.9448186065673 +101000 ekin = 2.80581049577987 | erot = 2.78036845929873 | epot = -22.7080420278476 | etot = -17.121863072769 +102000 ekin = 2.6114621154454 | erot = 3.14391622209056 | epot = -22.5804486115116 | etot = -16.8250702739756 +103000 ekin = 2.52473332619747 | erot = 3.13557205223547 | epot = -22.41653637854 | etot = -16.7562310001071 +104000 ekin = 2.38813618870076 | erot = 2.81177058896969 | epot = -22.2533489092942 | etot = -17.0534421316238 +105000 ekin = 2.27037902349693 | erot = 2.38822666643153 | epot = -22.0942448767488 | etot = -17.4356391868203 +106000 ekin = 2.14052224393181 | erot = 2.10858697946661 | epot = -21.9851740201844 | etot = -17.736064796786 +107000 ekin = 2.06068755794712 | erot = 2.32025367575509 | epot = -21.9181411680676 | etot = -17.5371999343654 +108000 ekin = 2.16310171427444 | erot = 2.45914268610281 | epot = -21.8972466640829 | etot = -17.2750022637057 +109000 ekin = 2.1640828140893 | erot = 2.39028083194259 | epot = -21.9223151975609 | etot = -17.367951551529 +110000 ekin = 2.27703874503424 | erot = 2.02252280342038 | epot = -21.9984748890034 | etot = -17.6989133405488 +111000 ekin = 2.42168812145141 | erot = 2.08603766327771 | epot = -22.1196725497682 | etot = -17.611946765039 +112000 ekin = 2.55041354840489 | erot = 2.05316660200929 | epot = -22.2467875616205 | etot = -17.6432074112064 +113000 ekin = 2.65118330223827 | erot = 1.8466330723311 | epot = -22.3714662854257 | etot = -17.8736499108563 +114000 ekin = 2.75066239210866 | erot = 2.06979110412732 | epot = -22.4757786127357 | etot = -17.6553251164997 +115000 ekin = 2.74969592573207 | erot = 2.2067264054263 | epot = -22.5825353241201 | etot = -17.6261129929617 +116000 ekin = 2.8331207613362 | erot = 2.23062165851058 | epot = -22.6813212117303 | etot = -17.6175787918836 +117000 ekin = 2.88175954095802 | erot = 2.38703791420885 | epot = -22.7694466083741 | etot = -17.5006491532072 +118000 ekin = 2.93568625662281 | erot = 2.26039492756772 | epot = -22.8432426400157 | etot = -17.6471614558252 +119000 ekin = 3.19523724062623 | erot = 2.22567760232914 | epot = -22.8880366342743 | etot = -17.4671217913189 +120000 ekin = 3.17008032268746 | erot = 2.25532705796801 | epot = -22.9065026704633 | etot = -17.4810952898079 +121000 ekin = 3.22925408627785 | erot = 2.4213919893106 | epot = -22.9068338710661 | etot = -17.2561877954777 +122000 ekin = 3.16756628646263 | erot = 2.29253955659867 | epot = -22.9100933328213 | etot = -17.44998748976 +123000 ekin = 3.13886988858722 | erot = 1.8737391679277 | epot = -22.9201354096178 | etot = -17.9075263531029 +124000 ekin = 3.07340133048022 | erot = 2.07486210586022 | epot = -22.9196688561523 | etot = -17.7714054198119 +125000 ekin = 3.01797638857695 | erot = 1.75538270899544 | epot = -22.9139839700498 | etot = -18.1406248724774 +126000 ekin = 2.96636842974588 | erot = 1.89046865067189 | epot = -22.9078794876244 | etot = -18.0510424072066 +127000 ekin = 2.99891017927352 | erot = 1.92488638621197 | epot = -22.8780661376738 | etot = -17.9542695721883 +128000 ekin = 3.07056715413782 | erot = 1.99149347655674 | epot = -22.8571726497158 | etot = -17.7951120190212 +129000 ekin = 3.00434595988796 | erot = 1.94814247853284 | epot = -22.8246013230694 | etot = -17.8721128846486 +130000 ekin = 2.83701493144512 | erot = 2.50342892051145 | epot = -22.760915431814 | etot = -17.4204715798574 +131000 ekin = 2.7247248423437 | erot = 2.70734329989559 | epot = -22.6636087699672 | etot = -17.2315406277279 +132000 ekin = 2.62389553593814 | erot = 2.52695276027317 | epot = -22.5087045821917 | etot = -17.3578562859804 +133000 ekin = 2.63528199515895 | erot = 2.39127524409791 | epot = -22.2966493236603 | etot = -17.2700920844034 +134000 ekin = 2.50610716876234 | erot = 2.09594811418196 | epot = -22.0718067043303 | etot = -17.469751421386 +135000 ekin = 2.48472772183192 | erot = 2.14881599404771 | epot = -21.8608678335614 | etot = -17.2273241176818 +136000 ekin = 2.5338227584519 | erot = 1.74309578227986 | epot = -21.6765558191781 | etot = -17.3996372784464 +137000 ekin = 2.57036342314514 | erot = 1.75885685985375 | epot = -21.5407454007371 | etot = -17.2115251177382 +138000 ekin = 2.52929445682248 | erot = 1.91945977351017 | epot = -21.4409011955172 | etot = -16.9921469651846 +139000 ekin = 2.57663737105064 | erot = 1.80679457632205 | epot = -21.38609742836 | etot = -17.0026654809873 +140000 ekin = 2.62053160118786 | erot = 1.51774101989578 | epot = -21.3676503668328 | etot = -17.2293777457491 +141000 ekin = 2.61189200494664 | erot = 1.55065515745556 | epot = -21.3802632860277 | etot = -17.2177161236255 +142000 ekin = 2.51798883678621 | erot = 1.67942283127788 | epot = -21.4214580445684 | etot = -17.2240463765043 +143000 ekin = 2.49892771964519 | erot = 1.52127122899841 | epot = -21.4923083558109 | etot = -17.4721094071673 +144000 ekin = 2.54740250437643 | erot = 1.82241986650816 | epot = -21.6130145049208 | etot = -17.2431921340362 +145000 ekin = 2.56862853368622 | erot = 2.1447132249399 | epot = -21.7452461002774 | etot = -17.0319043416513 +146000 ekin = 2.67329509039846 | erot = 2.25975512947158 | epot = -21.8437012603417 | etot = -16.9106510404716 +147000 ekin = 2.68893868818076 | erot = 2.5571840144698 | epot = -21.9010658016926 | etot = -16.6549430990421 +148000 ekin = 2.81386130771017 | erot = 2.59830584821738 | epot = -21.9210519662198 | etot = -16.5088848102922 +149000 ekin = 2.74990137245693 | erot = 2.32741538507083 | epot = -21.9278539711831 | etot = -16.8505372136554 +150000 ekin = 2.69038170783762 | erot = 2.42676335467437 | epot = -21.8989948167628 | etot = -16.7818497542508 +151000 ekin = 2.66678982895817 | erot = 2.39492028203052 | epot = -21.7008835367963 | etot = -16.6391734258076 +152000 ekin = 2.67029595868374 | erot = 2.53847066661996 | epot = -21.58945786599 | etot = -16.3806912406863 +153000 ekin = 2.70694158654287 | erot = 2.72265775556542 | epot = -21.7448041240556 | etot = -16.3152047819474 +154000 ekin = 2.79926075391894 | erot = 2.75974679901138 | epot = -21.8203547485968 | etot = -16.2613471956665 +155000 ekin = 2.72511299719384 | erot = 2.88818303221402 | epot = -21.7319777070927 | etot = -16.1186816776849 +156000 ekin = 2.65694010664888 | erot = 2.78004189782679 | epot = -21.6308520721291 | etot = -16.1938700676535 +157000 ekin = 2.56365508198589 | erot = 2.71035147954055 | epot = -21.5253087387144 | etot = -16.2513021771879 +158000 ekin = 2.57548107386935 | erot = 2.73764982143009 | epot = -21.4382452043716 | etot = -16.1251143090722 +159000 ekin = 2.55799392432016 | erot = 2.92697271834229 | epot = -21.3737314732345 | etot = -15.8887648305721 +160000 ekin = 2.54679486207657 | erot = 2.80531497281534 | epot = -21.3130996693774 | etot = -15.9609898344855 +161000 ekin = 2.47207886924354 | erot = 2.90722613339802 | epot = -21.2672221196592 | etot = -15.8879171170176 +162000 ekin = 2.51623650472983 | erot = 2.57045306394745 | epot = -21.2288584749409 | etot = -16.1421689062636 +163000 ekin = 2.52126404883986 | erot = 2.48352069988729 | epot = -21.2217116449117 | etot = -16.2169268961845 +164000 ekin = 2.53114565385919 | erot = 2.34165200793308 | epot = -21.2429890011701 | etot = -16.3701913393778 +165000 ekin = 2.596603432361 | erot = 2.12645014227913 | epot = -21.2869963722373 | etot = -16.5639427975971 +166000 ekin = 2.69364521809338 | erot = 2.06502693559822 | epot = -21.3443825816706 | etot = -16.585710427979 +167000 ekin = 2.72157576348883 | erot = 2.11628142912504 | epot = -21.4170430149544 | etot = -16.5791858223406 +168000 ekin = 2.74006852516301 | erot = 2.1612636068734 | epot = -21.5099197935658 | etot = -16.6085876615294 +169000 ekin = 2.84315657816748 | erot = 1.97243923170456 | epot = -21.5949265249798 | etot = -16.7793307151078 +170000 ekin = 3.06124015523346 | erot = 1.92459124184599 | epot = -21.6783552680506 | etot = -16.6925238709712 +171000 ekin = 3.21151355702384 | erot = 1.59351420769795 | epot = -21.762225949322 | etot = -16.9571981846002 +172000 ekin = 3.36544412726444 | erot = 1.67007198308074 | epot = -21.8306762430335 | etot = -16.7951601326883 +173000 ekin = 3.41001134336544 | erot = 1.87953941868176 | epot = -21.878702000715 | etot = -16.5891512386678 +174000 ekin = 3.46376447230286 | erot = 1.96688973070303 | epot = -21.9078990210446 | etot = -16.4772448180387 +175000 ekin = 3.47678931181588 | erot = 1.55890709488263 | epot = -21.88501807375 | etot = -16.8493216670515 +176000 ekin = 3.20686196070586 | erot = 1.54933373538616 | epot = -21.8330978877433 | etot = -17.0769021916513 +177000 ekin = 3.13331042952705 | erot = 1.28865733070247 | epot = -21.7390998162162 | etot = -17.3171320559867 +178000 ekin = 3.06763392821204 | erot = 1.26897291328761 | epot = -21.6342141405499 | etot = -17.2976072990502 +179000 ekin = 3.0267475315226 | erot = 1.57409428962025 | epot = -21.5270591512614 | etot = -16.9262173301185 +180000 ekin = 3.03569853606418 | erot = 1.67758058394334 | epot = -21.4169893849026 | etot = -16.7037102648951 +181000 ekin = 2.85389178964206 | erot = 1.75333728320481 | epot = -21.3395105909862 | etot = -16.7322815181393 +182000 ekin = 2.7424437130026 | erot = 1.80493411676468 | epot = -21.2869584133413 | etot = -16.739580583574 +183000 ekin = 2.76150374616111 | erot = 1.81761006388004 | epot = -21.2282765342437 | etot = -16.6491627242026 +184000 ekin = 2.69206274097713 | erot = 1.86375380676946 | epot = -21.1764923592867 | etot = -16.6206758115401 +185000 ekin = 2.62052583157023 | erot = 2.07457833425477 | epot = -21.1511718680906 | etot = -16.4560677022656 +186000 ekin = 2.54874716739377 | erot = 2.15191323422227 | epot = -21.12970319865 | etot = -16.429042797034 +187000 ekin = 2.47899352285435 | erot = 2.12131864753473 | epot = -21.1527973741677 | etot = -16.5524852037786 +188000 ekin = 2.40242843893253 | erot = 2.28274972847695 | epot = -21.2023943736364 | etot = -16.5172162062269 +189000 ekin = 2.24542511336507 | erot = 2.32237220121096 | epot = -21.2650187542766 | etot = -16.6972214397006 +190000 ekin = 2.27331885209491 | erot = 2.4610105377636 | epot = -21.3641240186242 | etot = -16.6297946287657 +191000 ekin = 2.38811474192591 | erot = 2.65597612519354 | epot = -21.4523608275388 | etot = -16.4082699604193 +192000 ekin = 2.35492395959151 | erot = 3.12866296082005 | epot = -21.5455989503755 | etot = -16.0620120299639 +193000 ekin = 2.33255266209782 | erot = 3.16650140028571 | epot = -21.6305745065443 | etot = -16.1315204441607 +194000 ekin = 2.3664165449988 | erot = 3.75512105430481 | epot = -21.7057940648226 | etot = -15.584256465519 +195000 ekin = 2.27714091943424 | erot = 4.22857583198264 | epot = -21.7506289706187 | etot = -15.2449122192018 +196000 ekin = 2.25022759887642 | erot = 4.19721047469103 | epot = -21.7392596229739 | etot = -15.2918215494065 +197000 ekin = 2.13566163028441 | erot = 3.96282097735922 | epot = -21.6861725112141 | etot = -15.5876899035705 +198000 ekin = 2.100264771743 | erot = 3.46946292854128 | epot = -21.6151658929782 | etot = -16.045438192694 +199000 ekin = 2.06841069526369 | erot = 3.02621949814231 | epot = -21.5580043865078 | etot = -16.4633741931018 +200000 ekin = 2.07457887577956 | erot = 3.1563287507984 | epot = -21.5271681184487 | etot = -16.2962604918707 +201000 ekin = 2.22865169770726 | erot = 2.68086789208483 | epot = -21.5402772694356 | etot = -16.6307576796436 +202000 ekin = 2.2134468038606 | erot = 2.70841026008599 | epot = -21.5670967607414 | etot = -16.6452396967948 +203000 ekin = 2.29378527554827 | erot = 2.48093430470295 | epot = -21.5962341727991 | etot = -16.8215145925479 +204000 ekin = 2.25828607560487 | erot = 2.50063815518558 | epot = -21.6380337966632 | etot = -16.8791095658728 +205000 ekin = 2.39913678175079 | erot = 2.62281981805075 | epot = -21.6838133695188 | etot = -16.6618567697172 +206000 ekin = 2.51393947992585 | erot = 2.55239552126186 | epot = -21.7215385309812 | etot = -16.6552035297934 +207000 ekin = 2.55579745831526 | erot = 2.31728514006586 | epot = -21.7786985680232 | etot = -16.905615969642 +208000 ekin = 2.61391306966582 | erot = 2.10777835345235 | epot = -21.7882764620354 | etot = -17.0665850389173 +209000 ekin = 2.67160585819059 | erot = 2.09388960655156 | epot = -21.8382664978829 | etot = -17.0727710331407 +210000 ekin = 2.82942438299537 | erot = 2.13327984174743 | epot = -21.9979383135577 | etot = -17.0352340888149 +211000 ekin = 2.92049266864328 | erot = 2.12124523148429 | epot = -22.2280513777038 | etot = -17.1863134775763 +212000 ekin = 3.00277061822758 | erot = 2.39488452737938 | epot = -22.4022759841391 | etot = -17.0046208385321 +213000 ekin = 3.13095859457293 | erot = 2.47163847125458 | epot = -22.5628987907077 | etot = -16.9603017248801 +214000 ekin = 3.23740343206466 | erot = 2.34793353448063 | epot = -22.7059476770017 | etot = -17.1206107104565 +215000 ekin = 3.25450904082695 | erot = 2.2622265725469 | epot = -22.8087885080489 | etot = -17.292052894675 +216000 ekin = 3.33545375500928 | erot = 2.25051135075666 | epot = -22.8910607863363 | etot = -17.3050956805704 +217000 ekin = 3.40631462781497 | erot = 2.45810884416318 | epot = -22.9502612260088 | etot = -17.0858377540307 +218000 ekin = 3.44211621843073 | erot = 2.40223178526955 | epot = -22.9724005123082 | etot = -17.128052508608 +219000 ekin = 3.35851747520084 | erot = 2.36223123268451 | epot = -22.9879332629406 | etot = -17.2671845550552 +220000 ekin = 3.2833944039116 | erot = 2.48348910158844 | epot = -22.9865937389542 | etot = -17.2197102334541 +221000 ekin = 3.19824562561904 | erot = 2.63802923468698 | epot = -22.9470020981349 | etot = -17.1107272378289 +222000 ekin = 3.05410812074653 | erot = 2.59372727399098 | epot = -22.8798801579581 | etot = -17.2320447632206 +223000 ekin = 3.01415969068795 | erot = 2.70890225393128 | epot = -22.7801464118767 | etot = -17.0570844672575 +224000 ekin = 2.97180261675446 | erot = 2.69506479286097 | epot = -22.6737182851749 | etot = -17.0068508755595 +225000 ekin = 2.90964642881874 | erot = 2.70979121573947 | epot = -22.6122851651091 | etot = -16.9928475205509 +226000 ekin = 2.79266706207817 | erot = 2.54927288052975 | epot = -22.611389662458 | etot = -17.26944971985 +227000 ekin = 2.76947170660882 | erot = 2.30328015123565 | epot = -22.6467409582568 | etot = -17.5739891004123 +228000 ekin = 2.78325047375845 | erot = 2.27271216177592 | epot = -22.7198790647036 | etot = -17.6639164291692 +229000 ekin = 2.76112130647928 | erot = 2.39217451148942 | epot = -22.800187069951 | etot = -17.6468912519823 +230000 ekin = 2.84369730914524 | erot = 2.42541769291401 | epot = -22.8608578528069 | etot = -17.5917428507477 +231000 ekin = 2.92519379372213 | erot = 2.78019508855837 | epot = -22.8903712559506 | etot = -17.1849823736701 +232000 ekin = 2.92995659411159 | erot = 2.33228808377075 | epot = -22.8760374316385 | etot = -17.6137927537562 +233000 ekin = 2.87287398890677 | erot = 2.17970441616599 | epot = -22.8206945159733 | etot = -17.7681161109006 +234000 ekin = 2.91717500618588 | erot = 2.07964949395211 | epot = -22.7337466562911 | etot = -17.7369221561531 +235000 ekin = 2.8884995634762 | erot = 1.8755917714471 | epot = -22.6649585599089 | etot = -17.9008672249856 +236000 ekin = 2.84502452090017 | erot = 1.92993964719768 | epot = -22.5730839299946 | etot = -17.7981197618968 +237000 ekin = 2.7747867075964 | erot = 2.00862555824013 | epot = -22.4470131017474 | etot = -17.6636008359109 +238000 ekin = 2.77623252972565 | erot = 1.8578135840649 | epot = -22.3442251833764 | etot = -17.7101790695858 +239000 ekin = 2.72624274520984 | erot = 1.82537539862894 | epot = -22.3075370346696 | etot = -17.7559188908308 +240000 ekin = 2.68874575599069 | erot = 2.08791431147562 | epot = -22.3178202354351 | etot = -17.5411601679688 +241000 ekin = 2.71558535720494 | erot = 2.36223789024905 | epot = -22.3776608268973 | etot = -17.2998375794433 +242000 ekin = 2.74214545076413 | erot = 2.6946745247038 | epot = -22.4730205135828 | etot = -17.0362005381149 +243000 ekin = 2.65488365755478 | erot = 3.08626659584901 | epot = -22.6054224397351 | etot = -16.8642721863313 +244000 ekin = 2.61050010484593 | erot = 3.05400040440766 | epot = -22.7622139439541 | etot = -17.0977134347005 +245000 ekin = 2.51883913658106 | erot = 3.07372030776083 | epot = -22.9307904494801 | etot = -17.3382310051382 +246000 ekin = 2.44808144989854 | erot = 2.89693270460534 | epot = -23.0903087154634 | etot = -17.7452945609595 +247000 ekin = 2.37103549600039 | erot = 2.98987101470682 | epot = -23.2167155364782 | etot = -17.8558090257709 +248000 ekin = 2.35707290060479 | erot = 2.62430509692223 | epot = -23.3107153472033 | etot = -18.3293373496762 +249000 ekin = 2.34573908311325 | erot = 2.540797635533 | epot = -23.3554639865935 | etot = -18.4689272679472 +250000 ekin = 2.19516079867449 | erot = 2.53320956727957 | epot = -23.3422435052511 | etot = -18.613873139297 +251000 ekin = 2.20157992848163 | erot = 2.54497162272741 | epot = -23.2895519821722 | etot = -18.5430004309631 +252000 ekin = 2.2945536597844 | erot = 2.27849916282306 | epot = -23.2346327540815 | etot = -18.661579931474 +253000 ekin = 2.24131781303689 | erot = 2.67744517517055 | epot = -23.1772273391452 | etot = -18.2584643509378 +254000 ekin = 2.21098192296338 | erot = 2.82095770992409 | epot = -23.1168686504973 | etot = -18.0849290176098 +255000 ekin = 2.19143060712001 | erot = 2.87369415644551 | epot = -23.0553324396616 | etot = -17.9902076760961 +256000 ekin = 2.10428673283323 | erot = 2.5284481661157 | epot = -22.989209826487 | etot = -18.3564749275381 +257000 ekin = 2.0901878769077 | erot = 2.57115406533198 | epot = -22.9241936332316 | etot = -18.262851690992 +258000 ekin = 2.19626617792815 | erot = 2.13919571497503 | epot = -22.8452199017343 | etot = -18.5097580088311 +259000 ekin = 2.21294203759051 | erot = 2.07911733890805 | epot = -22.7764097043272 | etot = -18.4843503278287 +260000 ekin = 2.22988124635537 | erot = 1.88363114769121 | epot = -22.7226746972068 | etot = -18.6091623031603 +261000 ekin = 2.23359219993357 | erot = 1.70662190809934 | epot = -22.6865933594041 | etot = -18.7463792513712 +262000 ekin = 2.41035894748686 | erot = 1.75350704630797 | epot = -22.6655731083551 | etot = -18.5017071145602 +263000 ekin = 2.54297814673108 | erot = 1.63910792627687 | epot = -22.6660944245488 | etot = -18.4840083515409 +264000 ekin = 2.6204802717585 | erot = 1.60167126997723 | epot = -22.6963818864548 | etot = -18.474230344719 +265000 ekin = 2.63395951584548 | erot = 1.61464895664043 | epot = -22.7525488508233 | etot = -18.5039403783374 +266000 ekin = 2.66249523510546 | erot = 1.90346143383775 | epot = -22.8357396370455 | etot = -18.2697829681023 +267000 ekin = 2.84840089865289 | erot = 1.96973814380149 | epot = -22.922895038939 | etot = -18.1047559964846 +268000 ekin = 2.88773992899432 | erot = 2.23404496611554 | epot = -23.0126109152364 | etot = -17.8908260201265 +269000 ekin = 2.95881152251244 | erot = 2.36308023135759 | epot = -23.0806209903755 | etot = -17.7587292365055 +270000 ekin = 3.19922667657027 | erot = 2.31987744595648 | epot = -23.0997207459547 | etot = -17.580616623428 +271000 ekin = 3.3047444353159 | erot = 2.18146213267916 | epot = -23.0923869412848 | etot = -17.6061803732897 +272000 ekin = 3.38316630950203 | erot = 2.27626381008298 | epot = -23.0565644655524 | etot = -17.3971343459674 +273000 ekin = 3.44314429393645 | erot = 2.33103394910062 | epot = -22.998686348507 | etot = -17.2245081054699 +274000 ekin = 3.29733836463975 | erot = 2.35460687412698 | epot = -22.9061895162167 | etot = -17.25424427745 +275000 ekin = 3.20483849389283 | erot = 2.17592485213268 | epot = -22.8033610976753 | etot = -17.4225977516498 +276000 ekin = 3.17952696643828 | erot = 2.53631962219392 | epot = -22.6964713302164 | etot = -16.9806247415842 +277000 ekin = 3.04779312524468 | erot = 2.63224846283753 | epot = -22.5925250147673 | etot = -16.9124834266851 +278000 ekin = 2.88882241520588 | erot = 2.44295768771974 | epot = -22.5096077221473 | etot = -17.1778276192217 +279000 ekin = 2.74458059242858 | erot = 2.34689014914025 | epot = -22.4433740610141 | etot = -17.3519033194453 +280000 ekin = 2.7554105836729 | erot = 2.40118989847531 | epot = -22.385537427078 | etot = -17.2289369449298 +281000 ekin = 2.66532300538255 | erot = 2.21704056459407 | epot = -22.3765161892643 | etot = -17.4941526192876 +282000 ekin = 2.60731940802894 | erot = 2.15906154555104 | epot = -22.3929020360192 | etot = -17.6265210824392 +283000 ekin = 2.58513425203912 | erot = 2.06481653587231 | epot = -22.408196701954 | etot = -17.7582459140426 +284000 ekin = 2.54858019457344 | erot = 2.2457247845057 | epot = -22.444591926386 | etot = -17.6502869473068 +285000 ekin = 2.55758171617785 | erot = 2.76460913859725 | epot = -22.514158659392 | etot = -17.1919678046169 +286000 ekin = 2.60821734500508 | erot = 3.16634932217223 | epot = -22.5929692498766 | etot = -16.8184025826992 +287000 ekin = 2.49254766601119 | erot = 3.15514661858264 | epot = -22.6449148716492 | etot = -16.9972205870554 +288000 ekin = 2.50066439821554 | erot = 3.49719403955153 | epot = -22.6803477105654 | etot = -16.6824892727983 +289000 ekin = 2.44598353504081 | erot = 3.34215032544747 | epot = -22.6895361095333 | etot = -16.901402249045 +290000 ekin = 2.3935982307273 | erot = 3.11268440307227 | epot = -22.6698244131813 | etot = -17.1635417793817 +291000 ekin = 2.4261701183146 | erot = 2.85487514428649 | epot = -22.6626122342503 | etot = -17.3815669716492 +292000 ekin = 2.40772687076946 | erot = 2.75801742060096 | epot = -22.6754806613924 | etot = -17.509736370022 +293000 ekin = 2.42154585346474 | erot = 2.56313321462425 | epot = -22.7028245536538 | etot = -17.7181454855648 +294000 ekin = 2.47283091667028 | erot = 2.92407822599823 | epot = -22.7233881302524 | etot = -17.3264789875839 +295000 ekin = 2.48250330737231 | erot = 2.66001264724744 | epot = -22.7516848410687 | etot = -17.6091688864489 +296000 ekin = 2.50738582337513 | erot = 2.53234484293194 | epot = -22.7873334660358 | etot = -17.7476027997287 +297000 ekin = 2.57517392062617 | erot = 2.82176475993525 | epot = -22.8071785750426 | etot = -17.4102398944812 +298000 ekin = 2.64719948459876 | erot = 2.59986611083038 | epot = -22.8000961016266 | etot = -17.5530305061974 +299000 ekin = 2.5779494927199 | erot = 2.50163391190624 | epot = -22.777423569021 | etot = -17.6978401643949 +300000 ekin = 2.54202853433729 | erot = 2.50188796046293 | epot = -22.7359935186374 | etot = -17.6920770238372 +301000 ekin = 2.53853550508124 | erot = 2.33138966267646 | epot = -22.668055568127 | etot = -17.7981304003693 +302000 ekin = 2.5416467257922 | erot = 2.35968144693469 | epot = -22.6002854710846 | etot = -17.6989572983577 +303000 ekin = 2.55152004910031 | erot = 2.25570939719572 | epot = -22.546491206588 | etot = -17.7392617602919 +304000 ekin = 2.43742201255293 | erot = 1.93302414776487 | epot = -22.4953520351471 | etot = -18.1249058748293 +305000 ekin = 2.37256740983366 | erot = 1.99906686310167 | epot = -22.4852720256445 | etot = -18.1136377527092 +306000 ekin = 2.33394239199436 | erot = 1.95361217330024 | epot = -22.4994393613202 | etot = -18.2118847960256 +307000 ekin = 2.36433385317702 | erot = 2.09819856998267 | epot = -22.5498835871989 | etot = -18.0873511640392 +308000 ekin = 2.39069887757527 | erot = 2.58247807487919 | epot = -22.6356145598506 | etot = -17.6624376073962 +309000 ekin = 2.42870516593961 | erot = 2.50601430493647 | epot = -22.7376993972852 | etot = -17.8029799264091 +310000 ekin = 2.59762961960999 | erot = 2.86657561799355 | epot = -22.8270893622473 | etot = -17.3628841246438 +311000 ekin = 2.5804504148771 | erot = 3.23112647307674 | epot = -22.8820505528211 | etot = -17.0704736648672 +312000 ekin = 2.55765290476199 | erot = 3.46227005563457 | epot = -22.8938340197387 | etot = -16.8739110593421 +313000 ekin = 2.55944192884797 | erot = 3.26655870580155 | epot = -22.8884040353445 | etot = -17.062403400695 +314000 ekin = 2.66754752507794 | erot = 3.03950571405864 | epot = -22.8258761802466 | etot = -17.11882294111 +315000 ekin = 2.73855283007325 | erot = 2.99016186621305 | epot = -22.7272216366887 | etot = -16.9985069404024 +316000 ekin = 2.80269198455225 | erot = 2.86307192976269 | epot = -22.5938909114045 | etot = -16.9281269970896 +317000 ekin = 2.93621184769342 | erot = 2.59361256238003 | epot = -22.4292070317097 | etot = -16.8993826216363 +318000 ekin = 2.8975852606956 | erot = 2.51740962219028 | epot = -22.2783865388303 | etot = -16.8633916559444 +319000 ekin = 2.91605528220967 | erot = 2.46065370098588 | epot = -22.1337044367048 | etot = -16.7569954535092 +320000 ekin = 3.07107505335126 | erot = 2.32265497319516 | epot = -21.9969159416465 | etot = -16.6031859151 +321000 ekin = 3.13741654111418 | erot = 2.10166654249781 | epot = -21.9003082194708 | etot = -16.6612251358588 +322000 ekin = 3.25007976010091 | erot = 2.45741622169982 | epot = -21.8520535793253 | etot = -16.1445575975246 +323000 ekin = 3.23909847348114 | erot = 2.53403753206016 | epot = -21.85400214387 | etot = -16.0808661383287 +324000 ekin = 3.38563358070231 | erot = 2.17311589402306 | epot = -21.900909860486 | etot = -16.3421603857606 +325000 ekin = 3.34278974993512 | erot = 2.12874487522943 | epot = -21.9500890276594 | etot = -16.4785544024948 +326000 ekin = 3.38095563952734 | erot = 1.87895018746853 | epot = -21.9795682650693 | etot = -16.7196624380734 +327000 ekin = 3.38255419804518 | erot = 2.15889018224061 | epot = -22.0134841360962 | etot = -16.4720397558104 +328000 ekin = 3.40032271527505 | erot = 2.44697536300071 | epot = -22.0234507590408 | etot = -16.176152680765 +329000 ekin = 3.42165866167045 | erot = 2.23397608707596 | epot = -21.996507984308 | etot = -16.3408732355616 +330000 ekin = 3.4049518958943 | erot = 2.16314285762149 | epot = -21.9196276290174 | etot = -16.3515328755016 +331000 ekin = 3.17548117127386 | erot = 2.09607585596631 | epot = -21.7944989890111 | etot = -16.5229419617709 +332000 ekin = 2.98417545246671 | erot = 2.49335753705494 | epot = -21.6758679740327 | etot = -16.1983349845111 +333000 ekin = 2.88789613747822 | erot = 2.25591859160928 | epot = -21.5606249971909 | etot = -16.4168102681034 +334000 ekin = 2.72802815944278 | erot = 2.34583544867019 | epot = -21.5029467999943 | etot = -16.4290831918814 +335000 ekin = 2.67984094653365 | erot = 2.55944269027805 | epot = -21.5037191469947 | etot = -16.264435510183 +336000 ekin = 2.69835695167792 | erot = 2.67075019722183 | epot = -21.5450631550405 | etot = -16.1759560061407 +337000 ekin = 2.58419106934196 | erot = 3.12853087323269 | epot = -21.6433168369331 | etot = -15.9305948943584 +338000 ekin = 2.49996061258834 | erot = 3.11218673292016 | epot = -21.7506422483336 | etot = -16.1384949028251 +339000 ekin = 2.39574216262849 | erot = 3.08063585267057 | epot = -21.8692124850348 | etot = -16.3928344697357 +340000 ekin = 2.49232794145647 | erot = 2.98019099132304 | epot = -21.9771878613075 | etot = -16.5046689285279 +341000 ekin = 2.49715634905669 | erot = 2.90079807725769 | epot = -22.0570317432504 | etot = -16.659077316936 +342000 ekin = 2.5171609306997 | erot = 2.82265055007451 | epot = -22.1164185335397 | etot = -16.7766070527655 +343000 ekin = 2.4860981088623 | erot = 2.72316461109179 | epot = -22.1874092656393 | etot = -16.9781465456852 +344000 ekin = 2.59185701101002 | erot = 2.80189377403283 | epot = -22.2240461219156 | etot = -16.8302953368728 +345000 ekin = 2.75203781955693 | erot = 2.78048504556997 | epot = -22.228777643338 | etot = -16.6962547782111 +346000 ekin = 2.81389530494876 | erot = 2.33407306131948 | epot = -22.2248537826431 | etot = -17.0768854163749 +347000 ekin = 2.93912104005356 | erot = 2.50008170041738 | epot = -22.249868336818 | etot = -16.810665596347 +348000 ekin = 2.96773185111308 | erot = 2.74343934252203 | epot = -22.2560808039813 | etot = -16.5449096103462 +349000 ekin = 3.13040986998839 | erot = 2.80190275823782 | epot = -22.2470744750917 | etot = -16.3147618468654 +350000 ekin = 3.08696501979114 | erot = 2.86847264662999 | epot = -22.2200203810507 | etot = -16.2645827146296 +351000 ekin = 3.09062650768659 | erot = 2.55040952388055 | epot = -22.2196533454769 | etot = -16.5786173139098 +352000 ekin = 3.11537871248049 | erot = 2.20508138812276 | epot = -22.2132969704675 | etot = -16.8928368698642 +353000 ekin = 3.0715606127648 | erot = 2.27110385815633 | epot = -22.1942519415341 | etot = -16.851587470613 +354000 ekin = 3.03625905361607 | erot = 2.28070870858904 | epot = -22.1756814217728 | etot = -16.8587136595677 +355000 ekin = 3.05199381136596 | erot = 2.27451340050885 | epot = -22.1583132038245 | etot = -16.8318059919496 +356000 ekin = 3.08455685206846 | erot = 2.22987943802131 | epot = -22.1433269864766 | etot = -16.8288906963869 +357000 ekin = 3.05732303271328 | erot = 2.39309407849547 | epot = -22.1193520318396 | etot = -16.6689349206308 +358000 ekin = 3.17110061451348 | erot = 2.70306029074059 | epot = -22.11823298523 | etot = -16.2440720799759 +359000 ekin = 3.16486963450215 | erot = 2.78686781955525 | epot = -22.1253692631305 | etot = -16.1736318090731 +360000 ekin = 3.13851448508919 | erot = 2.57867504445972 | epot = -22.1430585034903 | etot = -16.4258689739414 +361000 ekin = 3.10180460440794 | erot = 2.91879652221926 | epot = -22.1488150833327 | etot = -16.1282139567055 +362000 ekin = 3.05062554845321 | erot = 3.01028278746073 | epot = -22.1455190064011 | etot = -16.0846106704872 +363000 ekin = 3.05887916756222 | erot = 2.9828696644243 | epot = -22.1197448021474 | etot = -16.0779959701609 +364000 ekin = 2.97835573270404 | erot = 3.15819469882598 | epot = -22.0865889777576 | etot = -15.9500385462276 +365000 ekin = 2.91386725267312 | erot = 3.01797244564504 | epot = -22.0367345005041 | etot = -16.1048948021859 +366000 ekin = 2.84923441171891 | erot = 2.78629016923761 | epot = -21.9575039957298 | etot = -16.3219794147733 +367000 ekin = 2.68353251880636 | erot = 2.48104091468958 | epot = -21.89853718758 | etot = -16.7339637540841 +368000 ekin = 2.65983333900825 | erot = 2.52342977423081 | epot = -21.8801683018794 | etot = -16.6969051886403 +369000 ekin = 2.57098271373623 | erot = 2.1378338745132 | epot = -21.8712180667081 | etot = -17.1624014784587 +370000 ekin = 2.46719741991489 | erot = 2.19165130675154 | epot = -21.8880397158873 | etot = -17.2291909892209 +371000 ekin = 2.36101704058605 | erot = 2.37151178551908 | epot = -21.871259635484 | etot = -17.1387308093789 +372000 ekin = 2.3529234961604 | erot = 1.93814576615854 | epot = -21.8337068682175 | etot = -17.5426376058985 +373000 ekin = 2.22654652898949 | erot = 1.97312401893844 | epot = -21.7946812690266 | etot = -17.5950107210987 +374000 ekin = 2.10841533505384 | erot = 2.42321715998308 | epot = -21.7582816122237 | etot = -17.2266491171868 +375000 ekin = 2.09694600146956 | erot = 2.65841461817976 | epot = -21.7455351907437 | etot = -16.9901745710944 +376000 ekin = 2.01640282060135 | erot = 2.942674608739 | epot = -21.7585878275115 | etot = -16.7995103981711 +377000 ekin = 1.9663942011233 | erot = 3.0881995707429 | epot = -21.7692932541817 | etot = -16.7146994823155 +378000 ekin = 1.85818028079322 | erot = 2.93893488746254 | epot = -21.788829140459 | etot = -16.9917139722032 +379000 ekin = 1.80977620668718 | erot = 2.89686403333532 | epot = -21.8021607659805 | etot = -17.095520525958 +380000 ekin = 1.73240863049982 | erot = 3.31083227305493 | epot = -21.8040178365908 | etot = -16.7607769330361 +381000 ekin = 1.78593665245932 | erot = 3.00437887789568 | epot = -21.8146190159381 | etot = -17.0243034855831 +382000 ekin = 1.81833924259099 | erot = 3.29223624038112 | epot = -21.833830872214 | etot = -16.7232553892418 +383000 ekin = 1.90372822779348 | erot = 3.22237238702126 | epot = -21.8485569566827 | etot = -16.722456341868 +384000 ekin = 1.84908071228733 | erot = 3.12652639081515 | epot = -21.7977736604942 | etot = -16.8221665573917 +385000 ekin = 1.92406985540241 | erot = 2.87503823935564 | epot = -21.7109558633046 | etot = -16.9118477685465 +386000 ekin = 2.08459192251278 | erot = 2.45881013772459 | epot = -21.8127875838316 | etot = -17.2693855235942 +387000 ekin = 2.14831947455658 | erot = 2.58103233380244 | epot = -21.9657785164539 | etot = -17.2364267080948 +388000 ekin = 2.20283399392825 | erot = 2.65764672350559 | epot = -22.0644231935263 | etot = -17.2039424760924 +389000 ekin = 2.20238885724331 | erot = 2.65111850895059 | epot = -22.151623488139 | etot = -17.2981161219451 +390000 ekin = 2.24047588961193 | erot = 2.79913619901823 | epot = -22.2380523913912 | etot = -17.1984403027611 +391000 ekin = 2.27798913986011 | erot = 2.58277083989431 | epot = -22.3159667090674 | etot = -17.455206729313 +392000 ekin = 2.25449982760669 | erot = 2.37888824458213 | epot = -22.360585059292 | etot = -17.7271969871032 +393000 ekin = 2.40321868579769 | erot = 2.29619394920022 | epot = -22.4007355614942 | etot = -17.7013229264963 +394000 ekin = 2.3847224913627 | erot = 2.02605124890776 | epot = -22.4166559581037 | etot = -18.0058822178332 +395000 ekin = 2.35870737602685 | erot = 2.13809618093399 | epot = -22.4618388912501 | etot = -17.9650353342892 +396000 ekin = 2.36594751638181 | erot = 2.35329585924258 | epot = -22.4900242189753 | etot = -17.7707808433509 +397000 ekin = 2.32162964157157 | erot = 2.38815965169885 | epot = -22.5051745520066 | etot = -17.7953852587362 +398000 ekin = 2.28093171176819 | erot = 2.45784979337996 | epot = -22.4904502460559 | etot = -17.7516687409078 +399000 ekin = 2.24440009076081 | erot = 2.20375095522984 | epot = -22.4593286712299 | etot = -18.0111776252392 +400000 ekin = 2.21650351836316 | erot = 2.11035067120502 | epot = -22.4071568047283 | etot = -18.0803026151601 +401000 ekin = 2.18808947871548 | erot = 2.05046808146155 | epot = -22.3505439740507 | etot = -18.1119864138737 +402000 ekin = 2.16649391253914 | erot = 2.14799860386826 | epot = -22.2682562516522 | etot = -17.9537637352448 +403000 ekin = 2.28466204544584 | erot = 2.18910683075392 | epot = -22.2050986712121 | etot = -17.7313297950124 +404000 ekin = 2.34692059996736 | erot = 2.09828665659993 | epot = -22.153802700954 | etot = -17.7085954443867 +405000 ekin = 2.44056792098291 | erot = 1.95202235520071 | epot = -22.1290600615598 | etot = -17.7364697853762 +406000 ekin = 2.51200179837251 | erot = 1.84480550716535 | epot = -22.1228718442876 | etot = -17.7660645387497 +407000 ekin = 2.46779728542662 | erot = 1.9571557089084 | epot = -22.1207033013074 | etot = -17.6957503069724 +408000 ekin = 2.67524377663768 | erot = 2.25989223488923 | epot = -22.1391777417952 | etot = -17.2040417302683 +409000 ekin = 2.66315255700302 | erot = 2.37555491225742 | epot = -22.130319418611 | etot = -17.0916119493505 +410000 ekin = 2.65203478218391 | erot = 2.35306567100151 | epot = -22.1147712842537 | etot = -17.1096708310682 +411000 ekin = 2.66659217273954 | erot = 2.24630383870675 | epot = -22.1012745566864 | etot = -17.1883785452401 +412000 ekin = 2.71788228424459 | erot = 2.05994526098404 | epot = -22.0854752996799 | etot = -17.3076477544513 +413000 ekin = 2.91802848135381 | erot = 2.11234467836731 | epot = -22.071162406671 | etot = -17.0407892469499 +414000 ekin = 2.96559563750792 | erot = 2.00652755440291 | epot = -22.0704517319951 | etot = -17.0983285400842 +415000 ekin = 2.94033398741362 | erot = 2.15066367214138 | epot = -22.0908184253286 | etot = -16.9998207657736 +416000 ekin = 3.0130861756449 | erot = 2.30018045105556 | epot = -22.146756551793 | etot = -16.8334899250925 +417000 ekin = 2.99189829031791 | erot = 2.38541146259433 | epot = -22.2119953988621 | etot = -16.8346856459498 +418000 ekin = 2.92450258607182 | erot = 2.60659083472711 | epot = -22.2670317375585 | etot = -16.7359383167596 +419000 ekin = 3.02248435904793 | erot = 2.56863874909474 | epot = -22.3092445703346 | etot = -16.7181214621919 +420000 ekin = 3.11629989898243 | erot = 2.19357614992626 | epot = -22.352137101017 | etot = -17.0422610521083 +421000 ekin = 3.09888957739387 | erot = 2.50768144705336 | epot = -22.4424742155049 | etot = -16.8359031910576 +422000 ekin = 3.22879455450158 | erot = 2.72814664323869 | epot = -22.5663066955683 | etot = -16.609365497828 +423000 ekin = 3.30665671531863 | erot = 2.5159167760946 | epot = -22.6645305507577 | etot = -16.8419570593445 +424000 ekin = 3.37246731972729 | erot = 2.34745055602903 | epot = -22.7276426183929 | etot = -17.0077247426366 +425000 ekin = 3.43841525686886 | erot = 2.13655704811657 | epot = -22.7531787907647 | etot = -17.1782064857792 +426000 ekin = 3.39533061745577 | erot = 2.09679686908517 | epot = -22.7598072190451 | etot = -17.2676797325042 +427000 ekin = 3.39111059944182 | erot = 2.09557295936995 | epot = -22.7548111473876 | etot = -17.2681275885758 +428000 ekin = 3.31614466866163 | erot = 2.03921223078319 | epot = -22.7608817388065 | etot = -17.4055248393617 +429000 ekin = 3.32919751126102 | erot = 2.28907058183502 | epot = -22.7667239471957 | etot = -17.1484558540996 +430000 ekin = 3.209169039297 | erot = 2.24711750120356 | epot = -22.7569862329287 | etot = -17.3006996924281 +431000 ekin = 3.21784537917496 | erot = 2.11449131463102 | epot = -22.7330752234491 | etot = -17.4007385296431 +432000 ekin = 3.05825965277367 | erot = 2.12802457775881 | epot = -22.7058311036754 | etot = -17.5195468731429 +433000 ekin = 3.04999159233167 | erot = 2.12377304692499 | epot = -22.6927692042269 | etot = -17.5190045649702 +434000 ekin = 2.97281689578996 | erot = 2.06268809983415 | epot = -22.6735691335099 | etot = -17.6380641378858 +435000 ekin = 2.9408188199265 | erot = 2.27500624558159 | epot = -22.6471201429011 | etot = -17.431295077393 +436000 ekin = 2.76300260327171 | erot = 2.14872430130925 | epot = -22.6178894405037 | etot = -17.7061625359227 +437000 ekin = 2.5942981287548 | erot = 1.81211382552893 | epot = -22.5954850842172 | etot = -18.1890731299334 +438000 ekin = 2.55606503620589 | erot = 2.01798684807052 | epot = -22.5948271221483 | etot = -18.0207752378719 +439000 ekin = 2.53154376315503 | erot = 2.19299208744604 | epot = -22.6163361970743 | etot = -17.8918003464733 +440000 ekin = 2.40438990342989 | erot = 2.39730485059917 | epot = -22.6417525467575 | etot = -17.8400577927285 +441000 ekin = 2.39311316134448 | erot = 2.20887829122772 | epot = -22.6584374753818 | etot = -18.0564460228095 +442000 ekin = 2.33774628968783 | erot = 2.2792443860291 | epot = -22.6901952471933 | etot = -18.0732045714763 +443000 ekin = 2.29577071148449 | erot = 2.1368193262954 | epot = -22.7383184381275 | etot = -18.3057284003476 +444000 ekin = 2.23794629484166 | erot = 2.26441379885353 | epot = -22.7861053898433 | etot = -18.2837452961481 +445000 ekin = 2.295455262988 | erot = 2.2148355293276 | epot = -22.8258649969131 | etot = -18.3155742045975 +446000 ekin = 2.30609557124273 | erot = 2.31380080271862 | epot = -22.8648768729172 | etot = -18.2449804989559 +447000 ekin = 2.34004311197639 | erot = 2.11921527275248 | epot = -22.8964565927019 | etot = -18.437198207973 +448000 ekin = 2.31891408584105 | erot = 1.89336279102551 | epot = -22.9133862874844 | etot = -18.7011094106179 +449000 ekin = 2.50108402662094 | erot = 2.14275389718694 | epot = -22.9306330051682 | etot = -18.2867950813603 +450000 ekin = 2.56801154893259 | erot = 2.17030720110482 | epot = -22.9343126165987 | etot = -18.1959938665613 +451000 ekin = 2.56623797742055 | erot = 2.48936702406201 | epot = -22.9565813788789 | etot = -17.9009763773963 +452000 ekin = 2.58271965200722 | erot = 2.71036974079274 | epot = -22.9698927610142 | etot = -17.6768033682143 +453000 ekin = 2.57528128095344 | erot = 2.42064719168865 | epot = -22.9718770494988 | etot = -17.9759485768568 +454000 ekin = 2.67501362163764 | erot = 2.16830940597275 | epot = -22.9542828268572 | etot = -18.1109597992468 +455000 ekin = 2.56489981687939 | erot = 2.42902486734881 | epot = -22.9396963254754 | etot = -17.9457716412472 +456000 ekin = 2.70565104056165 | erot = 2.41758826939483 | epot = -22.9394278452201 | etot = -17.8161885352636 +457000 ekin = 2.67202110043049 | erot = 2.33461800850218 | epot = -22.9661541099741 | etot = -17.9595150010414 +458000 ekin = 2.80341163315565 | erot = 2.09116834812251 | epot = -22.9873787877665 | etot = -18.0927988064884 +459000 ekin = 2.88302679195822 | erot = 2.11686421326548 | epot = -22.9983193137535 | etot = -17.9984283085298 +460000 ekin = 2.80959444443693 | erot = 1.91875534890949 | epot = -22.9899489536659 | etot = -18.2615991603195 +461000 ekin = 2.74655544888572 | erot = 2.00712299964637 | epot = -22.9641927476616 | etot = -18.2105142991295 +462000 ekin = 2.69410871293393 | erot = 1.85692462055067 | epot = -22.9396822663686 | etot = -18.388648932884 +463000 ekin = 2.68405751272903 | erot = 1.72122902844388 | epot = -22.9206254454229 | etot = -18.51533890425 +464000 ekin = 2.68220436609111 | erot = 1.82183499702516 | epot = -22.9021000717157 | etot = -18.3980607085995 +465000 ekin = 2.72690747044721 | erot = 1.76672692428731 | epot = -22.883580832568 | etot = -18.3899464378335 +466000 ekin = 2.76097376291805 | erot = 1.45315546635121 | epot = -22.853232489585 | etot = -18.6391032603157 +467000 ekin = 2.70206815185864 | erot = 1.48571966445418 | epot = -22.8038556347772 | etot = -18.6160678184644 +468000 ekin = 2.54683782854452 | erot = 1.46932624584363 | epot = -22.7393489246082 | etot = -18.7231848502201 +469000 ekin = 2.57325964052953 | erot = 1.72667647792941 | epot = -22.688489550097 | etot = -18.3885534316381 +470000 ekin = 2.54097506641268 | erot = 1.3901983169653 | epot = -22.635429423222 | etot = -18.7042560398441 +471000 ekin = 2.53075144531174 | erot = 1.56973268857353 | epot = -22.5872254672433 | etot = -18.4867413333581 +472000 ekin = 2.48686143209682 | erot = 1.636086464973 | epot = -22.5386230972982 | etot = -18.4156752002283 +473000 ekin = 2.42292267545308 | erot = 1.87228271405928 | epot = -22.5112867940742 | etot = -18.2160814045618 +474000 ekin = 2.50613933288655 | erot = 2.09524169116573 | epot = -22.5009126606671 | etot = -17.8995316366149 +475000 ekin = 2.45603005290403 | erot = 1.85917779264055 | epot = -22.5137202723091 | etot = -18.1985124267645 +476000 ekin = 2.33468534022204 | erot = 2.02645602102819 | epot = -22.5553111044056 | etot = -18.1941697431554 +477000 ekin = 2.45891726578715 | erot = 2.02023615759312 | epot = -22.6158128757703 | etot = -18.13665945239 +478000 ekin = 2.41477886253639 | erot = 2.43026093865235 | epot = -22.6679361141585 | etot = -17.8228963129698 +479000 ekin = 2.32198252632123 | erot = 2.32644468281388 | epot = -22.7087553607367 | etot = -18.0603281516016 +480000 ekin = 2.3558894173607 | erot = 2.35954657100134 | epot = -22.7435251879183 | etot = -18.0280891995563 +481000 ekin = 2.28452089277901 | erot = 2.2043085242519 | epot = -22.7608284363971 | etot = -18.2719990193662 +482000 ekin = 2.32256646764215 | erot = 2.41557913055296 | epot = -22.7741831402842 | etot = -18.0360375420891 +483000 ekin = 2.27205927409901 | erot = 2.56178717087221 | epot = -22.772822499483 | etot = -17.9389760545117 +484000 ekin = 2.37993337782982 | erot = 2.66126649810807 | epot = -22.741647800889 | etot = -17.7004479249511 +485000 ekin = 2.38190748927821 | erot = 2.61854512767469 | epot = -22.711933457928 | etot = -17.7114808409751 +486000 ekin = 2.33418466506882 | erot = 2.46925253909108 | epot = -22.6824493106804 | etot = -17.8790121065205 +487000 ekin = 2.1809413341112 | erot = 2.69390883740086 | epot = -22.6720546869385 | etot = -17.7972045154264 +488000 ekin = 2.11650686044411 | erot = 2.55325406947429 | epot = -22.6638056402425 | etot = -17.9940447103241 +489000 ekin = 2.21431283780037 | erot = 2.6147077209327 | epot = -22.6573831222825 | etot = -17.8283625635494 +490000 ekin = 2.2177697789255 | erot = 2.2350033945615 | epot = -22.5741440270906 | etot = -18.1213708536035 +491000 ekin = 2.27432682857327 | erot = 1.88817054321459 | epot = -22.4373592688798 | etot = -18.2748618970919 +492000 ekin = 2.53138272091265 | erot = 1.96744277498782 | epot = -22.4175140127836 | etot = -17.9186885168831 +493000 ekin = 2.71682060136876 | erot = 2.08719543513572 | epot = -22.5173229601058 | etot = -17.7133069236013 +494000 ekin = 2.79234310962876 | erot = 1.83822122501528 | epot = -22.5447051999101 | etot = -17.9141408652661 +495000 ekin = 2.76785459319889 | erot = 1.73774545925603 | epot = -22.5287157975834 | etot = -18.0231157451285 +496000 ekin = 2.84739375420042 | erot = 1.56846128670017 | epot = -22.5241542479137 | etot = -18.1082992070132 +497000 ekin = 2.69680214844414 | erot = 1.74348040544617 | epot = -22.5144404613581 | etot = -18.0741579074678 +498000 ekin = 2.62941704239954 | erot = 1.98455622913416 | epot = -22.5178632839582 | etot = -17.9038900124245 +499000 ekin = 2.64804818916994 | erot = 2.28765209546422 | epot = -22.5255155919976 | etot = -17.5898153073635 +500000 ekin = 2.62333387127764 | erot = 2.24107414888827 | epot = -22.5402092035982 | etot = -17.6758011834323 +501000 ekin = 2.58728609470087 | erot = 2.55153168646072 | epot = -22.5581971333473 | etot = -17.4193793521857 +502000 ekin = 2.5743852966721 | erot = 2.59775936587112 | epot = -22.5744776891821 | etot = -17.4023330266389 +503000 ekin = 2.68620055951998 | erot = 2.57830069566431 | epot = -22.5848671752325 | etot = -17.3203659200482 +504000 ekin = 2.70861631349698 | erot = 2.63136597642943 | epot = -22.5422463026807 | etot = -17.2022640127542 +505000 ekin = 2.81322601719043 | erot = 2.35620405508435 | epot = -22.4713277487551 | etot = -17.3018976764803 +506000 ekin = 2.75875978790565 | erot = 2.28114200273201 | epot = -22.4152453500929 | etot = -17.3753435594552 +507000 ekin = 2.76795437715418 | erot = 2.08516805530088 | epot = -22.3599249092895 | etot = -17.5068024768344 +508000 ekin = 2.73683686247786 | erot = 2.23436615836139 | epot = -22.3104902501593 | etot = -17.33928722932 +509000 ekin = 2.78730220151829 | erot = 2.42925226467484 | epot = -22.2669837867326 | etot = -17.0504293205394 +510000 ekin = 2.70408252089224 | erot = 2.30581628327708 | epot = -22.2411716050791 | etot = -17.2312728009098 +511000 ekin = 2.61818706333857 | erot = 2.32198772005121 | epot = -22.2054755882156 | etot = -17.2653008048258 +512000 ekin = 2.62666567898698 | erot = 2.16861742931861 | epot = -22.1496493249523 | etot = -17.3543662166467 +513000 ekin = 2.62864579756442 | erot = 2.28017839888756 | epot = -22.0962074035279 | etot = -17.1873832070759 +514000 ekin = 2.62144790591354 | erot = 2.41032584829371 | epot = -22.0606978370585 | etot = -17.0289240828512 +515000 ekin = 2.41822665966335 | erot = 2.52539385006896 | epot = -22.0307261613949 | etot = -17.0871056516626 +516000 ekin = 2.50897552241959 | erot = 2.78752662759865 | epot = -21.9672371157166 | etot = -16.6707349656983 +517000 ekin = 2.49803351393466 | erot = 2.61327470143909 | epot = -21.8908910019266 | etot = -16.7795827865529 +518000 ekin = 2.40588427132944 | erot = 2.60496520247845 | epot = -21.8271402944048 | etot = -16.8162908205969 +519000 ekin = 2.30783192859357 | erot = 2.28376487382975 | epot = -21.7720265250264 | etot = -17.1804297226031 +520000 ekin = 2.27616423058181 | erot = 2.29434994860391 | epot = -21.7128184146398 | etot = -17.1423042354541 +521000 ekin = 2.24914668110671 | erot = 2.36897117879078 | epot = -21.6721321359535 | etot = -17.054014276056 +522000 ekin = 2.35364771784224 | erot = 2.36695097688788 | epot = -21.6628523798143 | etot = -16.9422536850842 +523000 ekin = 2.37618272265835 | erot = 2.13303138965068 | epot = -21.7051372318525 | etot = -17.1959231195435 +524000 ekin = 2.49723384027372 | erot = 2.24023872654157 | epot = -21.782377913726 | etot = -17.0449053469107 +525000 ekin = 2.4637574766049 | erot = 2.51521139084652 | epot = -21.8666578962014 | etot = -16.88768902875 +526000 ekin = 2.48852380798105 | erot = 2.58777847976823 | epot = -21.9290082944792 | etot = -16.85270600673 +527000 ekin = 2.56408998824219 | erot = 2.71602192536814 | epot = -21.9877682670141 | etot = -16.7076563534038 +528000 ekin = 2.56498509318797 | erot = 2.76910231594647 | epot = -22.0494190498079 | etot = -16.7153316406735 +529000 ekin = 2.49392950866822 | erot = 2.90081498188849 | epot = -22.095325939266 | etot = -16.7005814487092 +530000 ekin = 2.55943772908038 | erot = 3.45143762749468 | epot = -22.1238951653052 | etot = -16.1130198087301 +531000 ekin = 2.62008230330608 | erot = 3.41029569339047 | epot = -22.1596065217836 | etot = -16.1292285250871 +532000 ekin = 2.64345831357267 | erot = 3.25189148347886 | epot = -22.2210179597455 | etot = -16.325668162694 +533000 ekin = 2.66248857759375 | erot = 3.12130181040693 | epot = -22.2938545042492 | etot = -16.5100641162486 +534000 ekin = 2.57837832781882 | erot = 3.40672270429772 | epot = -22.3945209938967 | etot = -16.4094199617802 +535000 ekin = 2.54988429096274 | erot = 3.48601096999938 | epot = -22.4965663420718 | etot = -16.4606710811097 +536000 ekin = 2.54332535815071 | erot = 3.38741257391198 | epot = -22.5966447962839 | etot = -16.6659068642212 +537000 ekin = 2.51621672082876 | erot = 3.4954128648589 | epot = -22.722166058481 | etot = -16.7105364727933 +538000 ekin = 2.55164682489471 | erot = 3.74760630845821 | epot = -22.8591125937163 | etot = -16.5598594603634 +539000 ekin = 2.58092295425579 | erot = 3.80698168734289 | epot = -22.9765606947831 | etot = -16.5886560531845 +540000 ekin = 2.51008871731604 | erot = 3.80582456583089 | epot = -22.9798947810023 | etot = -16.6639814978554 +541000 ekin = 2.46719015763968 | erot = 3.50395862401684 | epot = -22.8431087269563 | etot = -16.8719599452998 +542000 ekin = 2.59107475639089 | erot = 3.1706666262415 | epot = -22.8744258545954 | etot = -17.112684471963 +543000 ekin = 2.6362020136149 | erot = 3.06589292292655 | epot = -23.0791931656973 | etot = -17.3770982291558 +544000 ekin = 2.76243033839971 | erot = 2.75752131636956 | epot = -23.190283999358 | etot = -17.6703323445887 +545000 ekin = 2.77751893807151 | erot = 2.90000680655544 | epot = -23.2046062023304 | etot = -17.5270804577034 +546000 ekin = 2.78059502363043 | erot = 2.54289051406663 | epot = -23.2005103103105 | etot = -17.8770247726134 +547000 ekin = 2.81545617905213 | erot = 2.47192481242818 | epot = -23.17185559686 | etot = -17.8844746053797 +548000 ekin = 2.79144209452777 | erot = 2.80250244565799 | epot = -23.1234791781376 | etot = -17.5295346379519 +549000 ekin = 2.75373348946697 | erot = 2.71813060504091 | epot = -23.0602788235302 | etot = -17.5884147290223 +550000 ekin = 2.68546541277406 | erot = 2.77855841780881 | epot = -22.9807527132682 | etot = -17.5167288826854 +551000 ekin = 2.63458963816006 | erot = 2.84363646369278 | epot = -22.8852605151349 | etot = -17.4070344132821 +552000 ekin = 2.65549146174165 | erot = 2.88006578689775 | epot = -22.7742141173518 | etot = -17.2386568687124 +553000 ekin = 2.61257263960416 | erot = 2.50580069544593 | epot = -22.6366728838901 | etot = -17.51829954884 +554000 ekin = 2.55042887500008 | erot = 2.45156308445395 | epot = -22.5169799021635 | etot = -17.5149879427094 +555000 ekin = 2.48771740920183 | erot = 2.41959978358368 | epot = -22.4015661830959 | etot = -17.4942489903104 +556000 ekin = 2.43741510652896 | erot = 2.45751361710346 | epot = -22.2928810834869 | etot = -17.3979523598545 +557000 ekin = 2.35602361024325 | erot = 2.35108817931548 | epot = -22.2068336513711 | etot = -17.4997218618124 +558000 ekin = 2.29845334881475 | erot = 2.47944197593299 | epot = -22.1269301143065 | etot = -17.3490347895588 +559000 ekin = 2.30547484128377 | erot = 2.43861674436455 | epot = -22.0431486095149 | etot = -17.2990570238666 +560000 ekin = 2.2773591477684 | erot = 2.22067768733761 | epot = -21.9730451699076 | etot = -17.4750083348016 +561000 ekin = 2.29286875562459 | erot = 2.1199168453984 | epot = -21.9034779049411 | etot = -17.4906923039181 +562000 ekin = 2.19274483675777 | erot = 2.46930771586789 | epot = -21.889396099988 | etot = -17.2273435473624 +563000 ekin = 2.2550795500483 | erot = 2.41065657987129 | epot = -21.9034392529017 | etot = -17.2377031229821 +564000 ekin = 2.40459323350315 | erot = 2.24328259671741 | epot = -21.940420807587 | etot = -17.2925449773665 +565000 ekin = 2.45683133378084 | erot = 2.27185510495033 | epot = -22.0074255927214 | etot = -17.2787391539902 +566000 ekin = 2.40141767311485 | erot = 2.21041354599854 | epot = -22.0735209036132 | etot = -17.4616896844998 +567000 ekin = 2.4457477053 | erot = 2.11328940794156 | epot = -22.1387930635642 | etot = -17.5797559503226 +568000 ekin = 2.4257005007209 | erot = 2.18749548652436 | epot = -22.1800917698727 | etot = -17.5668957826274 +569000 ekin = 2.41454722540358 | erot = 2.10107949642207 | epot = -22.2121048457969 | etot = -17.6964781239712 +570000 ekin = 2.2989763814646 | erot = 2.04752727974979 | epot = -22.2369346580048 | etot = -17.8904309967904 +571000 ekin = 2.37657622585406 | erot = 2.05748511989243 | epot = -22.2528258700713 | etot = -17.8187645243249 +572000 ekin = 2.31682251679288 | erot = 2.58991099215535 | epot = -22.2496997094434 | etot = -17.3429662004952 +573000 ekin = 2.30400671606327 | erot = 2.31011895599926 | epot = -22.2262777020444 | etot = -17.6121520299819 +574000 ekin = 2.22032912036986 | erot = 2.34605820626857 | epot = -22.1986731397126 | etot = -17.6322858130742 +575000 ekin = 2.32899896279976 | erot = 2.14115178550432 | epot = -22.1599463152595 | etot = -17.6897955669554 +576000 ekin = 2.39677965647583 | erot = 2.16319777458978 | epot = -22.1106499071578 | etot = -17.5506724760922 +577000 ekin = 2.3416506735784 | erot = 1.93700136472036 | epot = -22.0653568060899 | etot = -17.7867047677912 +578000 ekin = 2.16459341404815 | erot = 1.94455021171708 | epot = -22.0220297065976 | etot = -17.9128860808323 +579000 ekin = 2.10243284337438 | erot = 1.93292394186433 | epot = -21.9718679160589 | etot = -17.9365111308202 +580000 ekin = 1.99604497344192 | erot = 1.95521625056195 | epot = -21.9148231396272 | etot = -17.9635619156234 +581000 ekin = 1.96384176915027 | erot = 1.99100077453193 | epot = -21.8663464602613 | etot = -17.9115039165791 +582000 ekin = 1.86034078875963 | erot = 1.90507522813592 | epot = -21.8442116641844 | etot = -18.0787956472888 +583000 ekin = 1.71909602928123 | erot = 1.97209600265412 | epot = -21.8622366159148 | etot = -18.1710445839794 +584000 ekin = 1.70364742117104 | erot = 1.8409043836361 | epot = -21.9097350864251 | etot = -18.365183281618 +585000 ekin = 1.74431579790209 | erot = 2.03905704940611 | epot = -21.9890373916311 | etot = -18.2056645443229 +586000 ekin = 1.73466674324847 | erot = 1.83902306942852 | epot = -22.0843760980402 | etot = -18.5106862853632 +587000 ekin = 1.69495214035966 | erot = 2.05654584168955 | epot = -22.1748305300913 | etot = -18.4233325480421 +588000 ekin = 1.81991084277843 | erot = 2.03271452479358 | epot = -22.2619123801789 | etot = -18.4092870126069 +589000 ekin = 1.75774114592667 | erot = 2.09107160464917 | epot = -22.3245174454579 | etot = -18.475704694882 +590000 ekin = 1.72192880825666 | erot = 2.02708321623591 | epot = -22.3712739626592 | etot = -18.6222619381666 +591000 ekin = 1.76801497004168 | erot = 2.19934356351447 | epot = -22.4026553786929 | etot = -18.4352968451368 +592000 ekin = 1.73818904167478 | erot = 2.31753844822586 | epot = -22.4297727542858 | etot = -18.3740452643852 +593000 ekin = 1.74423680346885 | erot = 2.35378967969654 | epot = -22.43093631708 | etot = -18.3329098339146 +594000 ekin = 1.74360225576643 | erot = 1.98671317855341 | epot = -22.3849580162794 | etot = -18.6546425819596 +595000 ekin = 1.82597622479122 | erot = 2.13309374747926 | epot = -22.390309310767 | etot = -18.4312393384965 +596000 ekin = 1.88347190280875 | erot = 2.21700247043638 | epot = -22.4390117320808 | etot = -18.3385373588356 +597000 ekin = 1.85682865820151 | erot = 2.22335853873382 | epot = -22.4665965332847 | etot = -18.3864093363494 +598000 ekin = 1.90006820905243 | erot = 2.42053542571024 | epot = -22.4694279641808 | etot = -18.1488243294181 +599000 ekin = 1.90071729874354 | erot = 2.59878396537104 | epot = -22.4910623963926 | etot = -17.991561132278 +600000 ekin = 1.9775296369167 | erot = 2.72441502124518 | epot = -22.5477576362776 | etot = -17.8458129781158 +601000 ekin = 1.85698550625183 | erot = 2.88505630055951 | epot = -22.601413276632 | etot = -17.8593714698207 +602000 ekin = 1.85670612852394 | erot = 2.99246755772118 | epot = -22.6585474549208 | etot = -17.8093737686757 +603000 ekin = 1.86635938777731 | erot = 2.79466925677628 | epot = -22.7047123446179 | etot = -18.0436837000643 +604000 ekin = 1.85627372221488 | erot = 2.9645426732677 | epot = -22.7247435540802 | etot = -17.9039271585976 +605000 ekin = 1.90713526215439 | erot = 2.83334095597271 | epot = -22.7033988480802 | etot = -17.9629226299531 +606000 ekin = 1.97855456734149 | erot = 2.44168814330719 | epot = -22.6272048618403 | etot = -18.2069621511916 +607000 ekin = 2.01266482611072 | erot = 2.45716329068721 | epot = -22.5070850149334 | etot = -18.0372568981355 +608000 ekin = 2.12878560429552 | erot = 2.31425337484015 | epot = -22.3497088958722 | etot = -17.9066699167365 +609000 ekin = 2.06312041868314 | erot = 2.11817811077725 | epot = -22.1990535325683 | etot = -18.0177550031079 +610000 ekin = 2.16915995218538 | erot = 2.15710310478954 | epot = -22.0738713202685 | etot = -17.7476082632936 +611000 ekin = 2.2479062777386 | erot = 2.44524506443959 | epot = -21.9773927987228 | etot = -17.2842414565446 +612000 ekin = 2.33407663304696 | erot = 2.43880885419916 | epot = -21.9158194120391 | etot = -17.142933924793 +613000 ekin = 2.48627136554596 | erot = 2.04564905753185 | epot = -21.9014181358314 | etot = -17.3694977127536 +614000 ekin = 2.63092379207175 | erot = 1.78137353630872 | epot = -21.9268892251558 | etot = -17.5145918967753 +615000 ekin = 2.76847753887659 | erot = 1.747045066359 | epot = -22.0144396036922 | etot = -17.4989169984566 +616000 ekin = 2.91908707455727 | erot = 1.78290613271662 | epot = -22.118601225114 | etot = -17.4166080178401 +617000 ekin = 3.15203249393301 | erot = 1.78303328673775 | epot = -22.2256012419585 | etot = -17.2905354612877 +618000 ekin = 3.31119378517932 | erot = 1.96412968205628 | epot = -22.3133840086656 | etot = -17.03806054143 +619000 ekin = 3.47590250528844 | erot = 1.76611683746786 | epot = -22.3772219575797 | etot = -17.1352026148234 +620000 ekin = 3.48874988045416 | erot = 1.89528011242379 | epot = -22.4384551139399 | etot = -17.0544251210619 +621000 ekin = 3.61622461981386 | erot = 1.99344049296392 | epot = -22.4893103152157 | etot = -16.8796452024379 +622000 ekin = 3.58399773461898 | erot = 1.74513664213442 | epot = -22.4803416552216 | etot = -17.1512072784682 +623000 ekin = 3.63032006314562 | erot = 1.71430163919961 | epot = -22.4430926293461 | etot = -17.0984709270009 +624000 ekin = 3.65855713197035 | erot = 1.69922484729333 | epot = -22.3868122910147 | etot = -17.029030311751 +625000 ekin = 3.60887827930819 | erot = 1.53990637330185 | epot = -22.3164178534658 | etot = -17.1676332008557 +626000 ekin = 3.52660460237184 | erot = 1.50586548866506 | epot = -22.2442897351173 | etot = -17.2118196440804 +627000 ekin = 3.5034371177018 | erot = 1.65554299653922 | epot = -22.1699228898754 | etot = -17.0109427756344 +628000 ekin = 3.39027059126343 | erot = 1.75167273235764 | epot = -22.088238530203 | etot = -16.9462952065819 +629000 ekin = 3.2398815091692 | erot = 1.71907571962451 | epot = -21.9985657464089 | etot = -17.0396085176152 +630000 ekin = 3.19313977959947 | erot = 1.92181644528361 | epot = -21.9264321634454 | etot = -16.8114759385624 +631000 ekin = 3.16387923134673 | erot = 1.95916493180212 | epot = -21.8395694883599 | etot = -16.7165253252111 +632000 ekin = 3.1485947140351 | erot = 1.97621264135334 | epot = -21.7846629506647 | etot = -16.6598555952762 +633000 ekin = 3.21562845702805 | erot = 2.00714201834292 | epot = -21.7459219259819 | etot = -16.523151450611 +634000 ekin = 3.18996985450964 | erot = 2.012013115691 | epot = -21.7056771658785 | etot = -16.5036941956778 +635000 ekin = 3.09651235720973 | erot = 1.73602275759664 | epot = -21.6544424588023 | etot = -16.821907343996 +636000 ekin = 2.92860815614997 | erot = 1.85589302961915 | epot = -21.6235143680234 | etot = -16.8390131822543 +637000 ekin = 2.91450492940613 | erot = 1.98660531398783 | epot = -21.6191336665839 | etot = -16.71802342319 +638000 ekin = 2.98864643224901 | erot = 2.52300956640108 | epot = -21.6153555894524 | etot = -16.1036995908023 +639000 ekin = 2.82285402890248 | erot = 2.58031703406066 | epot = -21.5893617816822 | etot = -16.1861907187191 +640000 ekin = 2.87726879521912 | erot = 2.7163927085115 | epot = -21.5512867369313 | etot = -15.9576252332007 +641000 ekin = 2.95903007169266 | erot = 2.43559640758648 | epot = -21.5137572402012 | etot = -16.119130760922 +642000 ekin = 2.96204133827632 | erot = 2.5007390891145 | epot = -21.4303396745979 | etot = -15.9675592472071 +643000 ekin = 2.95135321760987 | erot = 2.18430881955823 | epot = -21.3830067810411 | etot = -16.247344743873 +644000 ekin = 2.89461472263122 | erot = 2.24797742659958 | epot = -21.3844502347312 | etot = -16.2418580855004 +645000 ekin = 2.95435208333517 | erot = 2.48214942109185 | epot = -21.3637410798344 | etot = -15.9272395754073 +646000 ekin = 2.90556723575754 | erot = 2.30743635404398 | epot = -21.3137753959635 | etot = -16.100771806162 +647000 ekin = 2.90760512758873 | erot = 2.34216740244848 | epot = -21.2632699171358 | etot = -16.0134973870986 +648000 ekin = 2.85798779133743 | erot = 2.18813680751415 | epot = -21.2316650481513 | etot = -16.1855404492997 +649000 ekin = 2.80110553006876 | erot = 1.9978930926835 | epot = -21.2271459685493 | etot = -16.4281473457971 +650000 ekin = 2.78705126936001 | erot = 2.05433186051914 | epot = -21.2258730978758 | etot = -16.3844899679966 +651000 ekin = 2.82981122207192 | erot = 2.24476751487047 | epot = -21.2549338926241 | etot = -16.1803551556817 +652000 ekin = 2.81187017826329 | erot = 2.46541600128351 | epot = -21.3104029656995 | etot = -16.0331167861527 +653000 ekin = 2.97461611593798 | erot = 2.32074630167006 | epot = -21.3681399998169 | etot = -16.0727775822089 +654000 ekin = 2.88164611559735 | erot = 2.38213902831396 | epot = -21.398131859391 | etot = -16.1343467154797 +655000 ekin = 2.94913378760835 | erot = 2.34812868784279 | epot = -21.4113698116753 | etot = -16.1141073362242 +656000 ekin = 2.89233729062061 | erot = 2.39374651226465 | epot = -21.4288546902071 | etot = -16.1427708873218 +657000 ekin = 2.77598738951928 | erot = 2.49755521549778 | epot = -21.4449504691839 | etot = -16.1714078641668 +658000 ekin = 2.77740080353724 | erot = 2.62230590128047 | epot = -21.4463092301612 | etot = -16.0466025253435 +659000 ekin = 2.65259875229227 | erot = 2.75527600584006 | epot = -21.4247610675881 | etot = -16.0168863094557 +660000 ekin = 2.56686955703644 | erot = 2.6203757628529 | epot = -21.398256132964 | etot = -16.2110108130746 +661000 ekin = 2.65054440121176 | erot = 2.62707264418951 | epot = -21.3903690458669 | etot = -16.1127520004656 +662000 ekin = 2.57957249167055 | erot = 2.57121547805659 | epot = -21.3759360832757 | etot = -16.2251481135485 +663000 ekin = 2.48664501783153 | erot = 2.38657187242632 | epot = -21.393438567821 | etot = -16.5202216775632 +664000 ekin = 2.5164577766111 | erot = 2.20401035947354 | epot = -21.4329380039057 | etot = -16.7124698678211 +665000 ekin = 2.44076978766911 | erot = 2.41816703577515 | epot = -21.4520134506819 | etot = -16.5930766272377 +666000 ekin = 2.35012835368459 | erot = 2.6049661600097 | epot = -21.4686085435909 | etot = -16.5135140298966 +667000 ekin = 2.32189657004522 | erot = 2.57250144791985 | epot = -21.4939818560077 | etot = -16.5995838380426 +668000 ekin = 2.36116261151341 | erot = 2.4186050787805 | epot = -21.5056838331986 | etot = -16.7259161429046 +669000 ekin = 2.31387988694876 | erot = 2.33668050703784 | epot = -21.5343548142369 | etot = -16.8837944202503 +670000 ekin = 2.39198713502033 | erot = 2.44748109573426 | epot = -21.5481637926254 | etot = -16.7086955618709 +671000 ekin = 2.4156803978936 | erot = 2.60129732112631 | epot = -21.6059621481886 | etot = -16.5889844291687 +672000 ekin = 2.5596138312128 | erot = 2.5516494198216 | epot = -21.7089264495899 | etot = -16.5976631985555 +673000 ekin = 2.60207943153894 | erot = 2.89040304008822 | epot = -21.8182919408405 | etot = -16.3258094692134 +674000 ekin = 2.7364856973748 | erot = 2.8185501663043 | epot = -21.9222017117615 | etot = -16.3671658480824 +675000 ekin = 2.91114076539504 | erot = 2.36500632401751 | epot = -22.0018822691681 | etot = -16.7257351797556 +676000 ekin = 2.93341061527256 | erot = 2.28532481615684 | epot = -22.0731286226862 | etot = -16.8543931912568 +677000 ekin = 3.01470682908092 | erot = 2.22858273949068 | epot = -22.1284745680575 | etot = -16.8851849994859 +678000 ekin = 3.14497803943646 | erot = 1.93068246054169 | epot = -22.1456906590923 | etot = -17.0700301591141 +679000 ekin = 3.29461438438603 | erot = 2.10760912118867 | epot = -22.136180621795 | etot = -16.7339571162203 +680000 ekin = 3.37176530279823 | erot = 2.01104009704006 | epot = -22.1041151314318 | etot = -16.7213097315935 +681000 ekin = 3.45483484720644 | erot = 1.90067457792177 | epot = -22.0463762684202 | etot = -16.690866843292 +682000 ekin = 3.37894348708854 | erot = 1.72137005878507 | epot = -21.9505620370442 | etot = -16.8502484911706 +683000 ekin = 3.42286368355835 | erot = 1.85126780834271 | epot = -21.8191972813592 | etot = -16.5450657894581 +684000 ekin = 3.36291962928525 | erot = 1.78272354471438 | epot = -21.6428884495561 | etot = -16.4972452755565 +685000 ekin = 3.36082871274671 | erot = 1.56476357384112 | epot = -21.4554201037061 | etot = -16.5298278171182 +686000 ekin = 3.29456600954367 | erot = 1.4526614688562 | epot = -21.2708420183486 | etot = -16.5236145399487 +687000 ekin = 3.28683183665721 | erot = 1.05147246964411 | epot = -21.0945257475368 | etot = -16.7562214412355 +688000 ekin = 3.12005734691895 | erot = 1.15864732674183 | epot = -20.9292915494191 | etot = -16.6505868757583 +689000 ekin = 2.98255457232255 | erot = 1.23350933506074 | epot = -20.7891561678794 | etot = -16.5730922604961 +690000 ekin = 2.88677394533053 | erot = 1.14959548133381 | epot = -20.6827307127442 | etot = -16.6463612860799 +691000 ekin = 2.85231691921442 | erot = 1.34938947635194 | epot = -20.6187495888218 | etot = -16.4170431932554 +692000 ekin = 2.8239953629433 | erot = 1.61591108279267 | epot = -20.5825839292405 | etot = -16.1426774835045 +693000 ekin = 2.78364237672009 | erot = 1.75822822075907 | epot = -20.5907390731059 | etot = -16.0488684756267 +694000 ekin = 2.73371563485523 | erot = 2.08537526939357 | epot = -20.6328696988297 | etot = -15.8137787945809 +695000 ekin = 2.57124739242717 | erot = 2.14630522202631 | epot = -20.6823542908161 | etot = -15.9648016763626 +696000 ekin = 2.51399296937018 | erot = 2.55867118356007 | epot = -20.7367847556426 | etot = -15.6641206027124 +697000 ekin = 2.50454809499975 | erot = 2.50215716077685 | epot = -20.7898428219569 | etot = -15.7831375661803 +698000 ekin = 2.36358142640515 | erot = 2.63892421049651 | epot = -20.814814737848 | etot = -15.8123091009464 +699000 ekin = 2.3119934072466 | erot = 2.68625065707116 | epot = -20.7956836949871 | etot = -15.7974396306693 +700000 ekin = 2.14616834772929 | erot = 2.12698342038349 | epot = -20.7725738213787 | etot = -16.4994220532659 +701000 ekin = 2.15539690119101 | erot = 2.17922309078409 | epot = -20.7552775762039 | etot = -16.4206575842288 +702000 ekin = 2.10080573596304 | erot = 2.11876313824385 | epot = -20.737552181646 | etot = -16.5179833074391 +703000 ekin = 2.11218006165615 | erot = 2.10588532277649 | epot = -20.7475858269112 | etot = -16.5295204424786 +704000 ekin = 2.12315820389575 | erot = 2.10220748203614 | epot = -20.757299853276 | etot = -16.5319341673441 +705000 ekin = 2.15166233402754 | erot = 2.14022995734117 | epot = -20.7941736502218 | etot = -16.5022813588531 +706000 ekin = 2.15163098226746 | erot = 2.26908854153834 | epot = -20.8512276988327 | etot = -16.430508175027 +707000 ekin = 2.15471286696278 | erot = 2.52657902495319 | epot = -20.9520579644167 | etot = -16.2707660725007 +708000 ekin = 2.17467467531748 | erot = 2.49469457222098 | epot = -21.0502066736915 | etot = -16.3808374261531 +709000 ekin = 2.25270875429065 | erot = 2.67362934165225 | epot = -21.1795445148272 | etot = -16.2532064188843 +710000 ekin = 2.19946540304423 | erot = 2.99965152220139 | epot = -21.3025369771195 | etot = -16.1034200518739 +711000 ekin = 2.25060849346072 | erot = 2.6945596185851 | epot = -21.3800741765592 | etot = -16.4349060645134 +712000 ekin = 2.31009709048309 | erot = 2.56904053029372 | epot = -21.4438411099721 | etot = -16.5647034891953 +713000 ekin = 2.34856712569142 | erot = 2.67010815786076 | epot = -21.4921710147997 | etot = -16.4734957312475 +714000 ekin = 2.46551783464037 | erot = 2.47127151678304 | epot = -21.4976914761194 | etot = -16.5609021246959 +715000 ekin = 2.51889281585643 | erot = 2.3942213472493 | epot = -21.4732726012164 | etot = -16.5601584381107 +716000 ekin = 2.57715724769554 | erot = 2.54742070298212 | epot = -21.4493966986361 | etot = -16.3248187479584 +717000 ekin = 2.65149378986134 | erot = 2.37788349879553 | epot = -21.4573082004001 | etot = -16.4279309117432 +718000 ekin = 2.69352880755697 | erot = 2.62278633313092 | epot = -21.4974593554869 | etot = -16.181144214799 +719000 ekin = 2.80177184525137 | erot = 2.54312012627449 | epot = -21.5233281256748 | etot = -16.178436154149 +720000 ekin = 2.69854861926931 | erot = 2.43897381701018 | epot = -21.5590218912255 | etot = -16.421499454946 +721000 ekin = 2.67018557216469 | erot = 2.50608214081759 | epot = -21.6315812717051 | etot = -16.4553135587228 +722000 ekin = 2.65282106714843 | erot = 2.66679722018778 | epot = -21.7056377642899 | etot = -16.3860194769537 +723000 ekin = 2.65361827521915 | erot = 2.97622205975865 | epot = -21.7797776559554 | etot = -16.1499373209776 +724000 ekin = 2.60569769803766 | erot = 2.76020150079788 | epot = -21.8376307834359 | etot = -16.4717315846004 +725000 ekin = 2.63127869433962 | erot = 2.69399118898667 | epot = -21.8984299962585 | etot = -16.5731601129322 +726000 ekin = 2.72545330440262 | erot = 2.64253926181369 | epot = -21.9407919115086 | etot = -16.5727993452923 +727000 ekin = 2.65040284294011 | erot = 2.78538015556012 | epot = -21.9637938172391 | etot = -16.5280108187389 +728000 ekin = 2.48179003902746 | erot = 2.97450520962362 | epot = -21.9479581531599 | etot = -16.4916629045088 +729000 ekin = 2.52972405397302 | erot = 2.9021249673657 | epot = -21.9040262067784 | etot = -16.4721771854397 +730000 ekin = 2.53115260905489 | erot = 2.84472555705245 | epot = -21.8740439587388 | etot = -16.4981657926314 +731000 ekin = 2.54145691681998 | erot = 2.59870522769011 | epot = -21.8660177522137 | etot = -16.7258556077036 +732000 ekin = 2.53248561362187 | erot = 2.72510944305618 | epot = -21.8573992551135 | etot = -16.5998041984355 +733000 ekin = 2.62625070581089 | erot = 2.51680047965277 | epot = -21.8396073656003 | etot = -16.6965561801366 +734000 ekin = 2.64998616374819 | erot = 2.7284569210359 | epot = -21.8405294812888 | etot = -16.4620863965047 +735000 ekin = 2.69306207166523 | erot = 3.07169199347549 | epot = -21.8204798153913 | etot = -16.0557257502506 +736000 ekin = 2.72260351822599 | erot = 2.73658566507879 | epot = -21.8062871121359 | etot = -16.3470979288311 +737000 ekin = 2.7587059894237 | erot = 2.61625561790474 | epot = -21.7997278882048 | etot = -16.4247662808763 +738000 ekin = 2.9718371126315 | erot = 2.24889762319009 | epot = -21.815880148502 | etot = -16.5951454126805 +739000 ekin = 3.05953080590062 | erot = 2.0925516015282 | epot = -21.860369608401 | etot = -16.7082872009721 +740000 ekin = 3.27063059251506 | erot = 2.33629691806438 | epot = -21.928358182454 | etot = -16.3214306718745 +741000 ekin = 3.35389594882473 | erot = 2.3177523792099 | epot = -21.990534815749 | etot = -16.3188864877144 +742000 ekin = 3.37765257218279 | erot = 2.24621136389772 | epot = -22.0551085268026 | etot = -16.4312445907221 +743000 ekin = 3.34761803886807 | erot = 2.11604292737055 | epot = -22.1501165805121 | etot = -16.6864556142735 +744000 ekin = 3.45014316044981 | erot = 2.26283739801091 | epot = -22.2301851995846 | etot = -16.5172046411239 +745000 ekin = 3.50577437774322 | erot = 2.18082158773838 | epot = -22.2958892423641 | etot = -16.6092932768825 +746000 ekin = 3.62379564063212 | erot = 2.29172371220084 | epot = -22.3504185189715 | etot = -16.4348991661385 +747000 ekin = 3.66042054955228 | erot = 2.20475025047744 | epot = -22.3851646701862 | etot = -16.5199938701565 +748000 ekin = 3.5097454014349 | erot = 2.406502625722 | epot = -22.4178592321322 | etot = -16.5016112049753 +749000 ekin = 3.56386965172274 | erot = 2.05758013521606 | epot = -22.4625938818873 | etot = -16.8411440949485 +750000 ekin = 3.49499037119352 | erot = 2.1170532032316 | epot = -22.5182146312758 | etot = -16.9061710568507 +751000 ekin = 3.52059041081486 | erot = 2.1645623466796 | epot = -22.570867136707 | etot = -16.8857143792125 +752000 ekin = 3.52922989091539 | erot = 2.13328496260282 | epot = -22.6142453819195 | etot = -16.9517305284013 +753000 ekin = 3.54450333705355 | erot = 1.90175527543433 | epot = -22.6772611743025 | etot = -17.2310025618146 +754000 ekin = 3.45153480837739 | erot = 1.87218797413988 | epot = -22.7422768873044 | etot = -17.4185541047872 +755000 ekin = 3.40998140310187 | erot = 1.79765011978447 | epot = -22.7840720762432 | etot = -17.5764405533568 +756000 ekin = 3.34055243015618 | erot = 1.98893101943512 | epot = -22.8015249198687 | etot = -17.4720414702774 +757000 ekin = 3.25995163881785 | erot = 2.23144065289712 | epot = -22.817973605037 | etot = -17.326581313322 +758000 ekin = 3.16254182007881 | erot = 2.33708167519886 | epot = -22.7968151839726 | etot = -17.2971916886949 +759000 ekin = 3.08959154816294 | erot = 2.90979409874057 | epot = -22.711924149132 | etot = -16.7125385022285 +760000 ekin = 3.12610940125223 | erot = 2.7438695705545 | epot = -22.5354298293442 | etot = -16.6654508575375 +761000 ekin = 3.01773123261609 | erot = 2.54441842482903 | epot = -22.287824947537 | etot = -16.7256752900918 +762000 ekin = 2.78676830407932 | erot = 2.45851569402079 | epot = -22.0050811851124 | etot = -16.7597971870123 +763000 ekin = 2.66585974802302 | erot = 2.362311357248 | epot = -21.722043030106 | etot = -16.693871924835 +764000 ekin = 2.45269004589485 | erot = 2.21799353566102 | epot = -21.4437328772763 | etot = -16.7730492957204 +765000 ekin = 2.33602063980822 | erot = 2.18630884760143 | epot = -21.2172136821333 | etot = -16.6948841947237 +766000 ekin = 2.29166126734383 | erot = 2.30483974019187 | epot = -21.0282994393447 | etot = -16.431798431809 +767000 ekin = 2.19131441806702 | erot = 2.03557115351125 | epot = -20.8759897944564 | etot = -16.6491042228781 +768000 ekin = 2.07724554805813 | erot = 2.24966311077066 | epot = -20.7557602191218 | etot = -16.4288515602931 +769000 ekin = 2.05775411195588 | erot = 2.4254243464562 | epot = -20.6955218025018 | etot = -16.2123433440898 +770000 ekin = 2.00758682747633 | erot = 2.45906745907278 | epot = -20.6929044608197 | etot = -16.2262501742706 +771000 ekin = 1.98409315586994 | erot = 2.48472564199802 | epot = -20.7734270007259 | etot = -16.3046082028579 +772000 ekin = 1.96669673892109 | erot = 2.78510583323484 | epot = -20.9254659410943 | etot = -16.1736633689383 +773000 ekin = 2.02461047276462 | erot = 2.78254769070796 | epot = -21.1083738193744 | etot = -16.3012156559018 +774000 ekin = 2.11360336305223 | erot = 2.98822109565685 | epot = -21.3029651154827 | etot = -16.2011406567736 +775000 ekin = 2.14002916093923 | erot = 3.19368392739119 | epot = -21.5172002816088 | etot = -16.1834871932784 +776000 ekin = 2.24832330955158 | erot = 3.06531971326436 | epot = -21.7038275157919 | etot = -16.390184492976 +777000 ekin = 2.26862051853018 | erot = 3.052041975564 | epot = -21.8350670013856 | etot = -16.5144045072914 +778000 ekin = 2.28742554048397 | erot = 3.14948640814728 | epot = -21.9086978776173 | etot = -16.4717859289861 +779000 ekin = 2.37679849205823 | erot = 3.25877776275542 | epot = -21.9331744453774 | etot = -16.2975981905637 +780000 ekin = 2.41113222109188 | erot = 3.41326897159812 | epot = -21.8804415437782 | etot = -16.0560403510882 +781000 ekin = 2.35841060920419 | erot = 3.41692834903725 | epot = -21.7562873535247 | etot = -15.9809483952833 +782000 ekin = 2.33104722618925 | erot = 3.31967786761421 | epot = -21.5791021588893 | etot = -15.9283770650858 +783000 ekin = 2.44468610858592 | erot = 3.39120123576657 | epot = -21.3872233744809 | etot = -15.5513360301284 +784000 ekin = 2.47031155030493 | erot = 3.16062374062837 | epot = -21.2067959255538 | etot = -15.5758606346205 +785000 ekin = 2.44425304006453 | erot = 2.93358092964967 | epot = -21.066643439753 | etot = -15.6888094700389 +786000 ekin = 2.38361530280111 | erot = 2.47008597237393 | epot = -20.9753503604675 | etot = -16.1216490852925 +787000 ekin = 2.48426374783216 | erot = 2.47298901652775 | epot = -20.8359485090504 | etot = -15.8786957446905 +788000 ekin = 2.62422129022946 | erot = 2.14521403572779 | epot = -20.7277036502885 | etot = -15.9582683243313 +789000 ekin = 2.71455119012379 | erot = 2.24597257975577 | epot = -20.9557602381699 | etot = -15.9952364682903 +790000 ekin = 2.89566287380398 | erot = 2.37559330223226 | epot = -21.3404176331993 | etot = -16.069161457163 +791000 ekin = 2.93118110717492 | erot = 2.41626490731772 | epot = -21.5892702620191 | etot = -16.2418242475265 +792000 ekin = 2.94573011047197 | erot = 2.50772398358449 | epot = -21.779447974455 | etot = -16.3259938803986 +793000 ekin = 2.88905153418616 | erot = 2.38272361409117 | epot = -21.9056315911052 | etot = -16.6338564428279 +794000 ekin = 2.80588096705402 | erot = 2.32779825823209 | epot = -21.9743818696615 | etot = -16.8407026443754 +795000 ekin = 2.70597772737626 | erot = 2.07317402356788 | epot = -22.0026881808375 | etot = -17.2235364298933 +796000 ekin = 2.61721688822854 | erot = 2.08773529507834 | epot = -21.9918041689519 | etot = -17.286851985645 +797000 ekin = 2.43136202877212 | erot = 1.9804893387745 | epot = -21.9515392836584 | etot = -17.5396879161117 +798000 ekin = 2.36116858693514 | erot = 1.82755970456288 | epot = -21.900064527295 | etot = -17.7113362357969 +799000 ekin = 2.29297525756191 | erot = 1.54383623564202 | epot = -21.829172635306 | etot = -17.9923611421021 +800000 ekin = 2.24935465151725 | erot = 1.54461847951829 | epot = -21.725975188811 | etot = -17.9320020577754 +801000 ekin = 2.14652429984749 | erot = 1.41717049108724 | epot = -21.638461811624 | etot = -18.0747670206892 +802000 ekin = 2.30260756676161 | erot = 1.51416478035546 | epot = -21.5464279977214 | etot = -17.7296556506043 +803000 ekin = 2.3453462856965 | erot = 1.4094988657911 | epot = -21.5017245308287 | etot = -17.7468793793411 +804000 ekin = 2.3175234695651 | erot = 1.5752835135108 | epot = -21.5228204134075 | etot = -17.6300134303316 +805000 ekin = 2.5190836302223 | erot = 2.02682036822104 | epot = -21.6250345942614 | etot = -17.079130595818 +806000 ekin = 2.69359804195369 | erot = 2.31785574785072 | epot = -21.7872941337149 | etot = -16.7758403439105 +807000 ekin = 2.78033847998957 | erot = 2.41121019329391 | epot = -21.9922590001467 | etot = -16.8007103268633 +808000 ekin = 2.80619611495448 | erot = 2.63792095913468 | epot = -22.2205031545377 | etot = -16.7763860804485 +809000 ekin = 2.88326450587592 | erot = 2.67886677112956 | epot = -22.4540143776033 | etot = -16.8918831005978 +810000 ekin = 2.91302007052298 | erot = 2.96339278377582 | epot = -22.6564267335957 | etot = -16.7800138792969 +811000 ekin = 3.09829332412733 | erot = 2.61119529725635 | epot = -22.8014808233362 | etot = -17.0919922019525 +812000 ekin = 3.08224679909935 | erot = 2.59515009531311 | epot = -22.8823180456431 | etot = -17.2049211512307 +813000 ekin = 3.0091695521178 | erot = 2.75135704659747 | epot = -22.9208796974764 | etot = -17.1603530987612 +814000 ekin = 2.97174307315438 | erot = 2.9052545136944 | epot = -22.9341256772718 | etot = -17.057128090423 +815000 ekin = 2.96997620608158 | erot = 3.14378750342447 | epot = -22.9208614386061 | etot = -16.8070977291 +816000 ekin = 2.92448217396056 | erot = 2.88577656649698 | epot = -22.878209439187 | etot = -17.0679506987294 +817000 ekin = 2.88310554429891 | erot = 2.61870439923339 | epot = -22.8398760621413 | etot = -17.338066118609 +818000 ekin = 2.81866856581223 | erot = 2.51624869438272 | epot = -22.7906528740449 | etot = -17.4557356138499 +819000 ekin = 2.6919079109904 | erot = 1.98944862516352 | epot = -22.7267915943543 | etot = -18.0454350582004 +820000 ekin = 2.68723603003253 | erot = 1.98686669393802 | epot = -22.684856204087 | etot = -18.0107534801164 +821000 ekin = 2.54604202399357 | erot = 2.17140584071585 | epot = -22.6462173351121 | etot = -17.9287694704027 +822000 ekin = 2.51719569260242 | erot = 2.14190227339863 | epot = -22.6036341275859 | etot = -17.9445361615849 +823000 ekin = 2.38975947310458 | erot = 2.45514339808654 | epot = -22.5714957893448 | etot = -17.7265929181537 +824000 ekin = 2.31794554366188 | erot = 2.04410509977368 | epot = -22.5460261880512 | etot = -18.1839755446156 +825000 ekin = 2.24137456885504 | erot = 2.02652245530611 | epot = -22.5316621259004 | etot = -18.2637651017393 +826000 ekin = 2.17386448676143 | erot = 1.87577926811353 | epot = -22.5563066825768 | etot = -18.5066629277018 +827000 ekin = 2.15440642655625 | erot = 2.1008390507396 | epot = -22.5878061584627 | etot = -18.3325606811669 +828000 ekin = 1.93354077156905 | erot = 1.9731822770431 | epot = -22.6117615018442 | etot = -18.7050384532321 +829000 ekin = 1.91274491416356 | erot = 2.31769032262726 | epot = -22.6065942718254 | etot = -18.3761590350346 +830000 ekin = 1.87910339968436 | erot = 2.45880670474181 | epot = -22.6125193475723 | etot = -18.2746092431461 +831000 ekin = 1.8972578167219 | erot = 2.49473420733519 | epot = -22.6167165770098 | etot = -18.2247245529527 +832000 ekin = 1.85092425352074 | erot = 2.48066273824452 | epot = -22.6085378559508 | etot = -18.2769508641856 +833000 ekin = 1.79059573863358 | erot = 2.56006070864993 | epot = -22.6126545978111 | etot = -18.2619981505276 +834000 ekin = 1.79399510293666 | erot = 2.44673113220985 | epot = -22.6154861129955 | etot = -18.374759877849 +835000 ekin = 1.80394510948937 | erot = 2.35964658964095 | epot = -22.6388182435247 | etot = -18.4752265443944 +836000 ekin = 1.69826382101385 | erot = 2.57406388654467 | epot = -22.6545723055291 | etot = -18.3822445979706 +837000 ekin = 1.57085807181329 | erot = 2.43187270748743 | epot = -22.6792499151532 | etot = -18.6765191358525 +838000 ekin = 1.48932995393538 | erot = 2.24165123204813 | epot = -22.6860468687766 | etot = -18.955065682793 +839000 ekin = 1.38743724869546 | erot = 1.79947957819574 | epot = -22.6563653509736 | etot = -19.4694485240824 +840000 ekin = 1.45337763400283 | erot = 1.96043695396497 | epot = -22.6075458233692 | etot = -19.1937312354014 +841000 ekin = 1.52590522598348 | erot = 2.22694909527648 | epot = -22.5519353417586 | etot = -18.7990810204987 +842000 ekin = 1.46532363485155 | erot = 2.10614026643253 | epot = -22.4887366967057 | etot = -18.9172727954216 +843000 ekin = 1.45281094628262 | erot = 2.17368676107335 | epot = -22.4106869099592 | etot = -18.7841892026032 +844000 ekin = 1.49761542714544 | erot = 2.37443717915479 | epot = -22.3449586551379 | etot = -18.4729060488377 +845000 ekin = 1.55104391739276 | erot = 2.37673299844034 | epot = -22.2778376071646 | etot = -18.3500606913315 +846000 ekin = 1.58963047079771 | erot = 2.33696583404067 | epot = -22.1844847216024 | etot = -18.257888416764 +847000 ekin = 1.54789432070443 | erot = 2.2193526636214 | epot = -22.0782777408753 | etot = -18.3110307565495 +848000 ekin = 1.64518981802307 | erot = 2.2554443671811 | epot = -21.9989181480495 | etot = -18.0982839628453 +849000 ekin = 1.65560014958063 | erot = 2.25710120668815 | epot = -21.9671927272682 | etot = -18.0544913709994 +850000 ekin = 1.64990114979127 | erot = 2.10882779392655 | epot = -21.9923852605675 | etot = -18.2336563168497 +851000 ekin = 1.76413935252605 | erot = 2.19132684842445 | epot = -22.0608745954441 | etot = -18.1054083944936 +852000 ekin = 1.77078332134281 | erot = 2.28186973474134 | epot = -22.1743987365006 | etot = -18.1217456804165 +853000 ekin = 1.8869100613698 | erot = 2.41685663704521 | epot = -22.315529258634 | etot = -18.011762560219 +854000 ekin = 1.9192805380625 | erot = 2.87742240655933 | epot = -22.4875387473848 | etot = -17.690835802763 +855000 ekin = 1.91817487389649 | erot = 2.76992189261558 | epot = -22.6436233810602 | etot = -17.9555266145481 +856000 ekin = 1.88635564274586 | erot = 2.93908057670003 | epot = -22.7647148292097 | etot = -17.9392786097638 +857000 ekin = 1.87890917293874 | erot = 2.80324259714543 | epot = -22.8439440601362 | etot = -18.161792290052 +858000 ekin = 1.76204051430329 | erot = 3.04908239798861 | epot = -22.8707912309192 | etot = -18.0596683186273 +859000 ekin = 1.79890243291169 | erot = 3.0063239833868 | epot = -22.8581636219632 | etot = -18.0529372056647 +860000 ekin = 1.84913198872829 | erot = 2.53687454533322 | epot = -22.8254155766946 | etot = -18.4394090426331 +861000 ekin = 1.91842166492715 | erot = 2.44106443467608 | epot = -22.7812919779287 | etot = -18.4218058783254 +862000 ekin = 2.03399415900866 | erot = 2.51630721219484 | epot = -22.7187848283725 | etot = -18.168483457169 +863000 ekin = 2.06594803165525 | erot = 2.19676104809343 | epot = -22.6494648939944 | etot = -18.3867558142457 +864000 ekin = 2.14467142649392 | erot = 2.30238631972367 | epot = -22.5816995592187 | etot = -18.1346418130012 +865000 ekin = 2.16190583025863 | erot = 2.29241108749928 | epot = -22.5280905818478 | etot = -18.0737736640899 +866000 ekin = 2.08928464919363 | erot = 2.34809191732022 | epot = -22.4600229326601 | etot = -18.0226463661463 +867000 ekin = 2.13586636899989 | erot = 2.4266752182288 | epot = -22.3898488501323 | etot = -17.8273072629036 +868000 ekin = 2.19543171663428 | erot = 2.34267445579126 | epot = -22.3416768736343 | etot = -17.8035707012087 +869000 ekin = 2.29038273021928 | erot = 1.9793531467175 | epot = -22.3115310066376 | etot = -18.0417951297008 +870000 ekin = 2.32898457121495 | erot = 2.18228869748504 | epot = -22.3276861507278 | etot = -17.8164128820278 +871000 ekin = 2.23179297801985 | erot = 2.24593328260165 | epot = -22.3623188812128 | etot = -17.8845926205913 +872000 ekin = 2.29217187589436 | erot = 1.92704010734646 | epot = -22.3920054616879 | etot = -18.172793478447 +873000 ekin = 2.32174880232948 | erot = 2.05958528502851 | epot = -22.426393234345 | etot = -18.045059146987 +874000 ekin = 2.31327351953412 | erot = 2.03208404812012 | epot = -22.4554437891481 | etot = -18.1100862214939 +875000 ekin = 2.36060633411453 | erot = 1.96315060902063 | epot = -22.4715825698369 | etot = -18.1478256267017 +876000 ekin = 2.37581414827236 | erot = 1.68685668202761 | epot = -22.5004013214878 | etot = -18.4377304911878 +877000 ekin = 2.2774275572836 | erot = 1.83322419137989 | epot = -22.5321167358422 | etot = -18.4214649871787 +878000 ekin = 2.26319377123925 | erot = 1.87116890647728 | epot = -22.5413279545501 | etot = -18.4069652768335 +879000 ekin = 2.23196066439052 | erot = 2.13914596070926 | epot = -22.5501734040973 | etot = -18.1790667789975 +880000 ekin = 2.13938297973397 | erot = 2.29330131769693 | epot = -22.5711782332529 | etot = -18.138493935822 +881000 ekin = 2.13186803837593 | erot = 2.14219424217102 | epot = -22.5804302674661 | etot = -18.3063679869192 +882000 ekin = 2.07769353958435 | erot = 2.09780809423991 | epot = -22.5758307354851 | etot = -18.4003291016608 +883000 ekin = 2.14813365127748 | erot = 2.30712986664785 | epot = -22.5610981496801 | etot = -18.1058346317548 +884000 ekin = 2.07540055241901 | erot = 2.6097121651115 | epot = -22.5339770599275 | etot = -17.8488643423969 +885000 ekin = 2.02469768265832 | erot = 2.37910004807544 | epot = -22.5100762497879 | etot = -18.1062785190541 +886000 ekin = 2.04877327926393 | erot = 2.49200684196671 | epot = -22.4892651846715 | etot = -17.9484850634409 +887000 ekin = 2.04537209931188 | erot = 2.62826263805271 | epot = -22.4798822756864 | etot = -17.8062475383219 +888000 ekin = 1.99171888431566 | erot = 2.59410846730975 | epot = -22.5006414627735 | etot = -17.9148141111481 +889000 ekin = 1.98870471402318 | erot = 2.78841340112904 | epot = -22.546872056789 | etot = -17.7697539416368 +890000 ekin = 1.96284801049735 | erot = 2.75880808828204 | epot = -22.6085064197192 | etot = -17.8868503209398 +891000 ekin = 1.98112231165085 | erot = 3.13734593344338 | epot = -22.6928710534586 | etot = -17.5744028083644 +892000 ekin = 1.98665494216688 | erot = 3.33630831317305 | epot = -22.7519184177193 | etot = -17.4289551623794 +893000 ekin = 2.01620612275753 | erot = 3.24720583677029 | epot = -22.8064098471907 | etot = -17.5429978876629 +894000 ekin = 2.02749033009506 | erot = 3.22400069534638 | epot = -22.852106892038 | etot = -17.6006158665965 +895000 ekin = 2.00160082448679 | erot = 3.17371669918424 | epot = -22.861417685562 | etot = -17.6861001618909 +896000 ekin = 1.81339236987826 | erot = 2.84276750236102 | epot = -22.8462163214755 | etot = -18.1900564492362 +897000 ekin = 1.78689182954807 | erot = 2.92738822261737 | epot = -22.8071071587288 | etot = -18.0928271065633 +898000 ekin = 1.79533619439939 | erot = 3.24658999514194 | epot = -22.7264192132142 | etot = -17.6844930236728 +899000 ekin = 1.86159788109517 | erot = 3.45052252235128 | epot = -22.6568068772929 | etot = -17.3446864738464 +900000 ekin = 1.87156534773537 | erot = 3.32747935578065 | epot = -22.6039784131469 | etot = -17.4049337096309 +901000 ekin = 1.9203223096468 | erot = 2.99424285088196 | epot = -22.5603724778789 | etot = -17.6458073173501 +902000 ekin = 1.90371430437791 | erot = 3.42499917648123 | epot = -22.5288190745227 | etot = -17.2001055936635 +903000 ekin = 1.90475417412636 | erot = 2.92419346565695 | epot = -22.4819033922515 | etot = -17.6529557524682 +904000 ekin = 1.90422508856298 | erot = 2.83212155923839 | epot = -22.4265338107446 | etot = -17.6901871629432 +905000 ekin = 2.00220741570039 | erot = 2.40991127904432 | epot = -22.3822853443984 | etot = -17.9701666496537 +906000 ekin = 2.01583988806336 | erot = 2.50889047935596 | epot = -22.3419713063767 | etot = -17.8172409389574 +907000 ekin = 2.13017652685894 | erot = 2.70022028195477 | epot = -22.294800159206 | etot = -17.4644033503923 +908000 ekin = 2.21155735897725 | erot = 2.35139718849955 | epot = -22.2413626180752 | etot = -17.6784080705984 +909000 ekin = 2.1338678778415 | erot = 2.19569541163544 | epot = -22.1827827026493 | etot = -17.8532194131724 +910000 ekin = 2.16567596172158 | erot = 2.22520003505072 | epot = -22.1149129856198 | etot = -17.7240369888475 +911000 ekin = 2.15809222107967 | erot = 2.29037173955218 | epot = -22.0462122442139 | etot = -17.597748283582 +912000 ekin = 2.22087547394991 | erot = 2.4365535062685 | epot = -21.9749682300963 | etot = -17.3175392498778 +913000 ekin = 2.19758537996087 | erot = 2.46754067556572 | epot = -21.8990451147438 | etot = -17.2339190592172 +914000 ekin = 2.14504994740392 | erot = 2.32786068060047 | epot = -21.8498156381482 | etot = -17.3769050101439 +915000 ekin = 2.15677546734588 | erot = 2.12497444036455 | epot = -21.8141432513065 | etot = -17.532393343596 +916000 ekin = 2.21600145725684 | erot = 2.25340153292624 | epot = -21.7876876242363 | etot = -17.3182846340532 +917000 ekin = 2.23364693785463 | erot = 2.35177352781202 | epot = -21.7779589013939 | etot = -17.1925384357273 +918000 ekin = 2.08464913851982 | erot = 2.61658836146586 | epot = -21.7825075848227 | etot = -17.081270084837 +919000 ekin = 2.05155719758458 | erot = 2.37138616162172 | epot = -21.8289412030739 | etot = -17.4059978438676 +920000 ekin = 1.99021755546976 | erot = 2.17794976390715 | epot = -21.8761397201459 | etot = -17.707972400769 +921000 ekin = 2.01039430381078 | erot = 2.29773189624639 | epot = -21.910848328397 | etot = -17.6027221283399 +922000 ekin = 1.92539579138483 | erot = 2.21469038539289 | epot = -21.926552818398 | etot = -17.7864666416203 +923000 ekin = 1.89135276318228 | erot = 2.48033290205709 | epot = -21.9147153156547 | etot = -17.5430296504154 +924000 ekin = 1.83373481371755 | erot = 2.30418865947073 | epot = -21.8715535507901 | etot = -17.7336300776018 +925000 ekin = 1.8038478551145 | erot = 2.4978787938512 | epot = -21.8417123497566 | etot = -17.5399857007909 +926000 ekin = 1.90546414331471 | erot = 2.28964220950093 | epot = -21.8161106439932 | etot = -17.6210042911776 +927000 ekin = 1.75800031856201 | erot = 2.26185811978912 | epot = -21.8155973506592 | etot = -17.795738912308 +928000 ekin = 1.73012385728572 | erot = 2.25745755725607 | epot = -21.8415061020344 | etot = -17.8539246874926 +929000 ekin = 1.7018110667566 | erot = 2.2450849522952 | epot = -21.9018319158868 | etot = -17.954935896835 +930000 ekin = 1.78315203550102 | erot = 2.33522003414088 | epot = -22.0077604163355 | etot = -17.8893883466936 +931000 ekin = 1.77363895925613 | erot = 2.46038215962602 | epot = -22.1457204230456 | etot = -17.9116993041634 +932000 ekin = 1.76667271586578 | erot = 2.59245568108961 | epot = -22.3144614382824 | etot = -17.955333041327 +933000 ekin = 1.78209785939051 | erot = 2.56752596800037 | epot = -22.4867886743826 | etot = -18.1371648469917 +934000 ekin = 1.8717364767945 | erot = 2.44750687382831 | epot = -22.6262337406971 | etot = -18.3069903900743 +935000 ekin = 1.89665977697882 | erot = 2.59891583987105 | epot = -22.7433040011 | etot = -18.2477283842501 +936000 ekin = 1.8992025911959 | erot = 2.87375257167802 | epot = -22.8003443005922 | etot = -18.0273891377183 +937000 ekin = 1.86426948560471 | erot = 2.64779084733975 | epot = -22.7873604341047 | etot = -18.2753001011602 +938000 ekin = 1.86665683366531 | erot = 2.42302063492635 | epot = -22.7023246368744 | etot = -18.4126471682827 +939000 ekin = 1.76698390194225 | erot = 2.40739406174085 | epot = -22.5642561328095 | etot = -18.3898781691264 +940000 ekin = 1.75137690733442 | erot = 2.24076427939137 | epot = -22.3713737329339 | etot = -18.3792325462081 +941000 ekin = 1.58963621298635 | erot = 2.27191088485085 | epot = -22.1644304701041 | etot = -18.3028833722669 +942000 ekin = 1.4623260249004 | erot = 2.08408025750063 | epot = -21.9623923454052 | etot = -18.4159860630042 +943000 ekin = 1.49840034172858 | erot = 2.09453482021837 | epot = -21.8214517267649 | etot = -18.2285165648179 +944000 ekin = 1.50566445428587 | erot = 2.08049635757391 | epot = -21.7243523603986 | etot = -18.1381915485388 +945000 ekin = 1.52481544863404 | erot = 2.24222261671401 | epot = -21.6950663303344 | etot = -17.9280282649863 +946000 ekin = 1.67052698469246 | erot = 2.20043430064328 | epot = -21.7083474408047 | etot = -17.837386155469 +947000 ekin = 1.75831919417177 | erot = 2.42832255803308 | epot = -21.7266669161356 | etot = -17.5400251639308 +948000 ekin = 1.7705217860228 | erot = 2.24375036337257 | epot = -21.7571925539254 | etot = -17.74292040453 +949000 ekin = 1.90525688107052 | erot = 2.15107670024962 | epot = -21.7910913830608 | etot = -17.7347578017406 +950000 ekin = 1.99637307838834 | erot = 2.29947036820516 | epot = -21.8702527820791 | etot = -17.5744093354856 +951000 ekin = 2.10483728892526 | erot = 2.3094085040773 | epot = -21.9629695449464 | etot = -17.5487237519438 +952000 ekin = 2.18030789934554 | erot = 2.68842229181076 | epot = -22.0513964726254 | etot = -17.1826662814691 +953000 ekin = 2.29894777100326 | erot = 2.6960381129226 | epot = -22.1773476270724 | etot = -17.1823617431465 +954000 ekin = 2.50427642784653 | erot = 2.51587062326938 | epot = -22.2938756186984 | etot = -17.2737285675825 +955000 ekin = 2.68601007094799 | erot = 2.85595708623611 | epot = -22.4136942236112 | etot = -16.8717270664271 +956000 ekin = 2.86208234199617 | erot = 2.86492575592096 | epot = -22.5276582827249 | etot = -16.8006501848078 +957000 ekin = 2.94712002857799 | erot = 3.23864127130578 | epot = -22.6062380946206 | etot = -16.4204767947369 +958000 ekin = 3.09033820658024 | erot = 3.08801001679483 | epot = -22.6118588804731 | etot = -16.433510657098 +959000 ekin = 3.12093785566042 | erot = 3.07623469356985 | epot = -22.5436503994878 | etot = -16.3464778502576 +960000 ekin = 2.90690163741526 | erot = 3.01090766604296 | epot = -22.3906223678561 | etot = -16.4728130643979 +961000 ekin = 2.88926986935791 | erot = 2.81186239490846 | epot = -22.1509889576315 | etot = -16.4498566933652 +962000 ekin = 2.71651285756912 | erot = 2.6935364005441 | epot = -21.8539054312209 | etot = -16.4438561731076 +963000 ekin = 2.60409923966682 | erot = 2.39582384415104 | epot = -21.541690670359 | etot = -16.5417675865411 +964000 ekin = 2.40781072012975 | erot = 2.16537437005373 | epot = -21.2330620721351 | etot = -16.6598769819517 +965000 ekin = 2.33775275825805 | erot = 2.03652274723791 | epot = -20.9588727103872 | etot = -16.5845972048912 +966000 ekin = 2.17944465260482 | erot = 2.02332848530763 | epot = -20.7642311299473 | etot = -16.5614579920348 +967000 ekin = 2.07498857026546 | erot = 2.11733282843236 | epot = -20.6152408895122 | etot = -16.4229194908144 +968000 ekin = 1.97751523071242 | erot = 2.25496129774339 | epot = -20.5096192481152 | etot = -16.2771427196593 +969000 ekin = 1.9943112249466 | erot = 2.15454095745161 | epot = -20.4866822650025 | etot = -16.3378300826043 +970000 ekin = 2.00624797975507 | erot = 2.31644539427633 | epot = -20.4984368720272 | etot = -16.1757434979958 +971000 ekin = 2.03726182368046 | erot = 2.5740691190952 | epot = -20.5474355193067 | etot = -15.936104576531 +972000 ekin = 2.11053299316089 | erot = 2.66924970104341 | epot = -20.5957948560722 | etot = -15.8160121618679 +973000 ekin = 2.13909953768438 | erot = 2.79309645313365 | epot = -20.6193111119716 | etot = -15.6871151211536 +974000 ekin = 2.0364255989653 | erot = 2.93377318653168 | epot = -20.614312681757 | etot = -15.6441138962601 +975000 ekin = 1.91630022907475 | erot = 2.56349308712585 | epot = -20.5694430140214 | etot = -16.0896496978208 +976000 ekin = 1.83216235810447 | erot = 2.64204586914642 | epot = -20.5231354926871 | etot = -16.0489272654362 +977000 ekin = 1.76505303121177 | erot = 2.68514846627367 | epot = -20.4500578076262 | etot = -15.9998563101408 +978000 ekin = 1.73639184783115 | erot = 2.27119801193601 | epot = -20.3949825706908 | etot = -16.3873927109236 +979000 ekin = 1.81309943455151 | erot = 2.038221796097 | epot = -20.3578721503546 | etot = -16.5065509197061 +980000 ekin = 1.79425326253118 | erot = 1.72046042714387 | epot = -20.3201056722024 | etot = -16.8053919825273 +981000 ekin = 1.84538588980103 | erot = 1.59977232807697 | epot = -20.3368599575045 | etot = -16.8917017396265 +982000 ekin = 1.93610246096158 | erot = 1.75747204616996 | epot = -20.4060032926321 | etot = -16.7124287855005 +983000 ekin = 1.99928359157526 | erot = 1.98902145591244 | epot = -20.4909781895406 | etot = -16.5026731420529 +984000 ekin = 2.19592051978294 | erot = 2.09613897173606 | epot = -20.6254618277917 | etot = -16.3334023362727 +985000 ekin = 2.31254022438582 | erot = 2.24661234767447 | epot = -20.7844444229592 | etot = -16.2252918508989 +986000 ekin = 2.45455647294213 | erot = 2.08651767106828 | epot = -20.9596902957344 | etot = -16.418616151724 +987000 ekin = 2.56068322151335 | erot = 2.27175324341651 | epot = -21.1348257089449 | etot = -16.3023892440151 +988000 ekin = 2.67201091365369 | erot = 2.31132475519915 | epot = -21.3185263075051 | etot = -16.3351906386523 +989000 ekin = 2.79950226646056 | erot = 2.4956624706702 | epot = -21.4876529502225 | etot = -16.1924882130918 +990000 ekin = 2.90927705603678 | erot = 2.70153575217296 | epot = -21.6276754302441 | etot = -16.0168626220344 +991000 ekin = 3.07684775125908 | erot = 3.08981572487662 | epot = -21.7184165043282 | etot = -15.5517530281925 +992000 ekin = 3.12051956981941 | erot = 3.14725854673635 | epot = -21.7580543270384 | etot = -15.4902762104827 +993000 ekin = 3.12062810763639 | erot = 3.10806695223028 | epot = -21.7488136709537 | etot = -15.520118611087 +994000 ekin = 3.10341951101668 | erot = 3.39574822230777 | epot = -21.7355411993575 | etot = -15.2363734660331 +995000 ekin = 3.07116945452615 | erot = 3.6179815597936 | epot = -21.7172569404679 | etot = -15.0281059261481 +996000 ekin = 3.08751007567553 | erot = 3.22587194373128 | epot = -21.7092684412537 | etot = -15.3958864218469 +997000 ekin = 3.02133326540323 | erot = 3.22966909291854 | epot = -21.7044711321526 | etot = -15.4534687738308 +998000 ekin = 3.04814833733245 | erot = 3.33574456092131 | epot = -21.671429150029 | etot = -15.2875362517752 +999000 ekin = 3.13698021613418 | erot = 3.24185323699413 | epot = -21.6125731456073 | etot = -15.233739692479 +1000000 ekin = 3.12438752705953 | erot = 2.79887049874939 | epot = -21.5300188398266 | etot = -15.6067608140177 + 1000000 0.13886167 -1.3621774 0.016551227 -1.150352 9.5441241e-05 64000 +Loop time of 32.858 on 1 procs for 1000000 steps with 16 atoms + +Performance: 26294.981 tau/day, 30434.005 timesteps/s +99.2% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 26.906 | 26.906 | 26.906 | 0.0 | 81.89 +Bond | 0.93252 | 0.93252 | 0.93252 | 0.0 | 2.84 +Neigh | 0.029033 | 0.029033 | 0.029033 | 0.0 | 0.09 +Comm | 0.21863 | 0.21863 | 0.21863 | 0.0 | 0.67 +Output | 0.16316 | 0.16316 | 0.16316 | 0.0 | 0.50 +Modify | 4.2825 | 4.2825 | 4.2825 | 0.0 | 13.03 +Other | | 0.3263 | | | 0.99 + +Nlocal: 16.0000 ave 16 max 16 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 105.000 ave 105 max 105 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 105 +Ave neighs/atom = 6.5625000 +Ave special neighs/atom = 3.7500000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.2.* nocoeff +System init for write_data ... +Total wall time: 0:00:32 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 new file mode 100644 index 0000000000..7ded7eec79 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 @@ -0,0 +1,1173 @@ +LAMMPS (27 May 2021) +variable number equal 2 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex2 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 16 atoms + reading velocities ... + 16 velocities + scanning bonds ... + 2 = max bonds/atom + 16 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 13 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +set atom * mass 3.1575 +Setting atom values ... + 16 settings made for mass + +group all type 1 4 +16 atoms in group all + +# oxDNA bond interactions - FENE backbone +bond_style oxdna/fene +bond_coeff * 2.0 0.25 0.7525 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk +pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 + +# NVE ensemble +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.2.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 2.9560004 + ghost atom cutoff = 3.8 + binsize = 1.4780002, bins = 28 28 28 + 4 neighbor lists, perpetual/occasional/extra = 4 0 0 + (1) pair oxdna/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +0 ekin = 2.70475393009871 | erot = 2.80172072918779 | epot = -21.9967648054699 | etot = -16.4902901461834 +Per MPI rank memory allocation (min/avg/max) = 9.234 | 9.266 | 9.346 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.12021129 -1.3914531 0.016655298 -1.2057507 5.174549e-05 64000 +1000 ekin = 2.69992875879531 | erot = 3.03905971783101 | epot = -21.7993424099171 | etot = -16.0603539332907 +2000 ekin = 2.74236013741186 | erot = 2.48566425489664 | epot = -21.5864392778805 | etot = -16.358414885572 +3000 ekin = 2.71406239909253 | erot = 2.2379964617931 | epot = -21.4096440189505 | etot = -16.4575851580649 +4000 ekin = 2.62654210651837 | erot = 2.20187014105975 | epot = -21.2649637920051 | etot = -16.436551544427 +5000 ekin = 2.54619704507767 | erot = 2.19543579497861 | epot = -21.1625272503904 | etot = -16.4208944103341 +6000 ekin = 2.54036074498671 | erot = 2.24575383349946 | epot = -21.1026949544699 | etot = -16.3165803759837 +7000 ekin = 2.54636725719323 | erot = 2.17480262107778 | epot = -21.0944608538479 | etot = -16.3732909755769 +8000 ekin = 2.44266194745413 | erot = 1.89959276882142 | epot = -21.1290547630673 | etot = -16.7868000467917 +9000 ekin = 2.49849768578547 | erot = 1.91590827145359 | epot = -21.2010010008038 | etot = -16.7865950435648 +10000 ekin = 2.60405521154315 | erot = 2.31942457678919 | epot = -21.2714985323704 | etot = -16.3480187440381 +11000 ekin = 2.5172962682744 | erot = 2.60159361363173 | epot = -21.3305509557369 | etot = -16.2116610738307 +12000 ekin = 2.52572671978709 | erot = 2.38660744367414 | epot = -21.4045010372609 | etot = -16.4921668737997 +13000 ekin = 2.6003507735884 | erot = 2.37491144376807 | epot = -21.501501753381 | etot = -16.5262395360245 +14000 ekin = 2.66935763609377 | erot = 2.2290243859921 | epot = -21.5988036534075 | etot = -16.7004216313217 +15000 ekin = 2.71551281751846 | erot = 2.21389248221188 | epot = -21.6990132370777 | etot = -16.7696079373473 +16000 ekin = 2.84978299090937 | erot = 2.43940966993627 | epot = -21.7959192679746 | etot = -16.506726607129 +17000 ekin = 2.95072779743506 | erot = 2.38947543725573 | epot = -21.8722593940791 | etot = -16.5320561593883 +18000 ekin = 2.85884496438632 | erot = 2.37101194861282 | epot = -21.9018380946368 | etot = -16.6719811816377 +19000 ekin = 2.77343461594057 | erot = 2.33973079907437 | epot = -21.8809702826778 | etot = -16.7678048676628 +20000 ekin = 2.58401274142392 | erot = 2.55272418280185 | epot = -21.8165314333067 | etot = -16.6797945090809 +21000 ekin = 2.51192366343057 | erot = 2.51457779660485 | epot = -21.7320362651687 | etot = -16.7055348051333 +22000 ekin = 2.49083859662961 | erot = 2.52955288592737 | epot = -21.6292667596242 | etot = -16.6088752770672 +23000 ekin = 2.39128650481513 | erot = 2.2075391744556 | epot = -21.5149142799636 | etot = -16.9160886006929 +24000 ekin = 2.35988329046224 | erot = 1.90440982269664 | epot = -21.4005066979857 | etot = -17.1362135848268 +25000 ekin = 2.28215741570372 | erot = 1.96977905366573 | epot = -21.3141881001702 | etot = -17.0622516308008 +26000 ekin = 2.19749762241961 | erot = 2.27833647039548 | epot = -21.2634725733341 | etot = -16.787638480519 +27000 ekin = 2.0082587505888 | erot = 2.19976409135109 | epot = -21.2659284236731 | etot = -17.0579055817332 +28000 ekin = 1.84164368193045 | erot = 2.29604978886231 | epot = -21.2913487545158 | etot = -17.1536552837231 +29000 ekin = 1.85165645974806 | erot = 2.13163577617279 | epot = -21.3636874932622 | etot = -17.3803952573414 +30000 ekin = 1.81585331071777 | erot = 2.36969485723283 | epot = -21.467249508595 | etot = -17.2817013406444 +31000 ekin = 1.87586085382615 | erot = 2.30099083087637 | epot = -21.6118799895371 | etot = -17.4350283048345 +32000 ekin = 2.0126641738456 | erot = 2.39241064946061 | epot = -21.7843461993917 | etot = -17.3792713760855 +33000 ekin = 2.10031097060265 | erot = 2.65484725731943 | epot = -21.9744733587442 | etot = -17.2193151308221 +34000 ekin = 2.024661815622 | erot = 2.84373149584293 | epot = -22.1941262603322 | etot = -17.3257329488672 +35000 ekin = 1.97481459340815 | erot = 3.01731663707887 | epot = -22.4189097716657 | etot = -17.4267785411787 +36000 ekin = 2.01233253730946 | erot = 2.91764073203603 | epot = -22.6202547427807 | etot = -17.6902814734353 +37000 ekin = 2.0722585098004 | erot = 3.06834431569986 | epot = -22.8024087727697 | etot = -17.6618059472694 +38000 ekin = 2.05378795549781 | erot = 3.03638675352696 | epot = -22.9460226281608 | etot = -17.855847919136 +39000 ekin = 2.06863065757199 | erot = 3.09515376672991 | epot = -23.0335342083505 | etot = -17.8697497840486 +40000 ekin = 2.0001441529857 | erot = 3.04584432430145 | epot = -23.0612280460054 | etot = -18.0152395687182 +41000 ekin = 2.05172104966416 | erot = 2.77830340889752 | epot = -23.0196796418278 | etot = -18.1896551832662 +42000 ekin = 2.05229847533165 | erot = 2.8527334853463 | epot = -22.9340198298526 | etot = -18.0289878691746 +43000 ekin = 1.93755805481289 | erot = 3.04650513325785 | epot = -22.8209174452141 | etot = -17.8368542571433 +44000 ekin = 1.84663697745676 | erot = 2.93951969808346 | epot = -22.7031673178542 | etot = -17.917010642314 +45000 ekin = 1.72975781399546 | erot = 2.60801842461352 | epot = -22.6010710155898 | etot = -18.2632947769808 +46000 ekin = 1.59186632906643 | erot = 2.62841769679505 | epot = -22.5067814781869 | etot = -18.2864974523254 +47000 ekin = 1.5410922886755 | erot = 2.65380906308325 | epot = -22.41397412102 | etot = -18.2190727692612 +48000 ekin = 1.52801508900137 | erot = 2.56168528383553 | epot = -22.3146405234589 | etot = -18.224940150622 +49000 ekin = 1.4523614750721 | erot = 2.19683353122206 | epot = -22.2336496311394 | etot = -18.5844546248453 +50000 ekin = 1.37133529115918 | erot = 2.38139075376808 | epot = -22.1777849612816 | etot = -18.4250589163544 +51000 ekin = 1.37894610429121 | erot = 2.5564395559548 | epot = -22.1214711763547 | etot = -18.1860855161087 +52000 ekin = 1.37307011220265 | erot = 2.64858735385409 | epot = -22.0854715362776 | etot = -18.0638140702208 +53000 ekin = 1.45140505120431 | erot = 2.86325966198758 | epot = -22.0769774994392 | etot = -17.7623127862474 +54000 ekin = 1.49400380215143 | erot = 3.02929024277169 | epot = -22.0888809603766 | etot = -17.5655869154535 +55000 ekin = 1.5504040486075 | erot = 2.51182875106827 | epot = -22.110508190484 | etot = -18.0482753908083 +56000 ekin = 1.49109168917169 | erot = 2.54803153869041 | epot = -22.1366154026192 | etot = -18.0974921747571 +57000 ekin = 1.5005013791342 | erot = 2.41737584414207 | epot = -22.1821202184232 | etot = -18.2642429951469 +58000 ekin = 1.60635589846632 | erot = 2.23996961758236 | epot = -22.2360694135127 | etot = -18.3897438974641 +59000 ekin = 1.72952597734783 | erot = 2.32633058396655 | epot = -22.2901578024363 | etot = -18.2343012411219 +60000 ekin = 1.69244797185252 | erot = 2.4002780727951 | epot = -22.3434040927657 | etot = -18.2506780481181 +61000 ekin = 1.7262070303266 | erot = 2.11017860160475 | epot = -22.3831797154274 | etot = -18.5467940834961 +62000 ekin = 1.79594241743972 | erot = 2.2156083769556 | epot = -22.4218397438853 | etot = -18.4102889494899 +63000 ekin = 1.77262742266278 | erot = 2.30422369990038 | epot = -22.4467748467828 | etot = -18.3699237242196 +64000 ekin = 1.8552728361909 | erot = 2.31267811362978 | epot = -22.4674777591492 | etot = -18.2995268093286 +65000 ekin = 1.78989203446876 | erot = 1.94802383598257 | epot = -22.4675168623456 | etot = -18.7296009918943 +66000 ekin = 1.77252597290744 | erot = 1.82642026775557 | epot = -22.4502267764221 | etot = -18.8512805357591 +67000 ekin = 1.80939758337873 | erot = 1.93052561353104 | epot = -22.4407582644841 | etot = -18.7008350675743 +68000 ekin = 1.8990812176376 | erot = 2.02160808150966 | epot = -22.4404733275274 | etot = -18.5197840283801 +69000 ekin = 1.91605115497139 | erot = 1.99686686402569 | epot = -22.4556690038854 | etot = -18.5427509848883 +70000 ekin = 1.97266986208223 | erot = 1.99525089575643 | epot = -22.4717127742739 | etot = -18.5037920164352 +71000 ekin = 2.00234841846529 | erot = 2.03963009556284 | epot = -22.4872545087286 | etot = -18.4452759947004 +72000 ekin = 2.04989413571926 | erot = 2.25125712690087 | epot = -22.5010508598362 | etot = -18.1998995972161 +73000 ekin = 1.96796663525087 | erot = 2.56091060599057 | epot = -22.5094020746157 | etot = -17.9805248333743 +74000 ekin = 1.94071763184335 | erot = 2.25118509796053 | epot = -22.4905641504115 | etot = -18.2986614206077 +75000 ekin = 1.9046477605406 | erot = 2.1101828610624 | epot = -22.4609449840085 | etot = -18.4461143624055 +76000 ekin = 1.96940901357875 | erot = 2.01632288693257 | epot = -22.4274745611142 | etot = -18.4417426606029 +77000 ekin = 1.94486767834818 | erot = 1.90684819966053 | epot = -22.3863373806157 | etot = -18.534621502607 +78000 ekin = 1.96983919523053 | erot = 1.93099842937087 | epot = -22.3443846506838 | etot = -18.4435470260824 +79000 ekin = 1.95938649015133 | erot = 1.8681062699457 | epot = -22.2942796582417 | etot = -18.4667868981447 +80000 ekin = 2.0811750227726 | erot = 1.51004106283058 | epot = -22.2616445282531 | etot = -18.6704284426499 +81000 ekin = 2.12565876638706 | erot = 1.68774361309031 | epot = -22.2503002969457 | etot = -18.4368979174683 +82000 ekin = 2.1024876598191 | erot = 1.68162562422027 | epot = -22.2731769674722 | etot = -18.4890636834328 +83000 ekin = 2.1444849861566 | erot = 1.81975712217529 | epot = -22.3046718958779 | etot = -18.340429787546 +84000 ekin = 2.13258101148062 | erot = 2.02922410781373 | epot = -22.3428808393217 | etot = -18.1810757200273 +85000 ekin = 2.08512493333097 | erot = 2.32083438054857 | epot = -22.3826539010023 | etot = -17.9766945871228 +86000 ekin = 2.17050776391446 | erot = 1.96275338625836 | epot = -22.422434182694 | etot = -18.2891730325212 +87000 ekin = 2.23989852600904 | erot = 2.23705181642096 | epot = -22.4705294491957 | etot = -17.9935791067657 +88000 ekin = 2.27467140557798 | erot = 2.15326395377648 | epot = -22.5135609707118 | etot = -18.0856256113573 +89000 ekin = 2.2884388908289 | erot = 2.12736799131715 | epot = -22.5645528135013 | etot = -18.1487459313552 +90000 ekin = 2.3033272403237 | erot = 2.29619358357564 | epot = -22.621069415243 | etot = -18.0215485913436 +91000 ekin = 2.3138100848518 | erot = 2.07740016205563 | epot = -22.6563472804759 | etot = -18.2651370335684 +92000 ekin = 2.37378013130099 | erot = 2.23716627480822 | epot = -22.6690655261851 | etot = -18.0581191200759 +93000 ekin = 2.26456629794217 | erot = 2.65755706511364 | epot = -22.6595495475479 | etot = -17.7374261844921 +94000 ekin = 2.27111991294101 | erot = 2.70843483649348 | epot = -22.6144390606054 | etot = -17.6348843111709 +95000 ekin = 2.16051509784257 | erot = 2.76861411098527 | epot = -22.5458959635298 | etot = -17.616766754702 +96000 ekin = 2.1362268433284 | erot = 3.00618377960114 | epot = -22.4457322783083 | etot = -17.3033216553787 +97000 ekin = 2.07419989457636 | erot = 2.65264916199277 | epot = -22.3153975468029 | etot = -17.5885484902338 +98000 ekin = 2.11485220649783 | erot = 2.62887211771617 | epot = -22.2055031918166 | etot = -17.4617788676026 +99000 ekin = 2.14284693208913 | erot = 2.66222856414638 | epot = -22.1106632337977 | etot = -17.3055877375622 +100000 ekin = 2.17308341836636 | erot = 2.09482283074188 | epot = -22.0437085040349 | etot = -17.7758022549266 +101000 ekin = 2.14866231805612 | erot = 2.3881976475087 | epot = -22.0122713210887 | etot = -17.4754113555239 +102000 ekin = 2.1649362923898 | erot = 2.64896606924408 | epot = -22.0210513992314 | etot = -17.2071490375976 +103000 ekin = 2.15114511690188 | erot = 2.56525012972741 | epot = -22.0652696455725 | etot = -17.3488743989432 +104000 ekin = 2.15671515638217 | erot = 2.62706983245371 | epot = -22.142181166657 | etot = -17.3583961778211 +105000 ekin = 2.12719541152379 | erot = 2.65706885533819 | epot = -22.2143972740325 | etot = -17.4301330071705 +106000 ekin = 2.13774707721056 | erot = 2.76654607800848 | epot = -22.2775634673613 | etot = -17.3732703121422 +107000 ekin = 2.20102004108532 | erot = 2.66823836970966 | epot = -22.3043515122749 | etot = -17.4350931014799 +108000 ekin = 2.17638500145526 | erot = 2.80828381708582 | epot = -22.3097186034589 | etot = -17.3250497849178 +109000 ekin = 2.19829684637003 | erot = 2.90666104596412 | epot = -22.282790113145 | etot = -17.1778322208108 +110000 ekin = 2.17152588755631 | erot = 2.81646086297862 | epot = -22.2246380567944 | etot = -17.2366513062595 +111000 ekin = 2.15373436462637 | erot = 2.45540077609876 | epot = -22.1236900284647 | etot = -17.5145548877395 +112000 ekin = 2.13686027678985 | erot = 2.53611388444162 | epot = -21.9714471685636 | etot = -17.2984730073321 +113000 ekin = 2.14753928432329 | erot = 2.38847611973764 | epot = -21.7866419003017 | etot = -17.2506264962408 +114000 ekin = 2.12631244931889 | erot = 2.25317215555341 | epot = -21.597846256073 | etot = -17.2183616512007 +115000 ekin = 2.10651342910361 | erot = 2.32111327425019 | epot = -21.410641403265 | etot = -16.9830146999112 +116000 ekin = 2.05857214689192 | erot = 2.34273379327714 | epot = -21.2543641951759 | etot = -16.8530582550068 +117000 ekin = 2.06082171760153 | erot = 2.29311267774743 | epot = -21.1252553707804 | etot = -16.7713209754314 +118000 ekin = 2.07134223704072 | erot = 2.26440570108468 | epot = -21.0201100762215 | etot = -16.6843621380961 +119000 ekin = 2.06457225589944 | erot = 1.93952258456726 | epot = -20.9769994108551 | etot = -16.9729045703884 +120000 ekin = 2.11859853404644 | erot = 1.85164657615887 | epot = -20.9836901114861 | etot = -17.0134450012808 +121000 ekin = 2.16647853751432 | erot = 2.33645973353314 | epot = -21.0297394121119 | etot = -16.5268011410645 +122000 ekin = 2.26904266267134 | erot = 2.41049986821532 | epot = -21.1056070652399 | etot = -16.4260645343533 +123000 ekin = 2.21420535468727 | erot = 2.31638894325139 | epot = -21.1806353306487 | etot = -16.65004103271 +124000 ekin = 2.25664202990655 | erot = 2.58640626588698 | epot = -21.2735600007685 | etot = -16.430511704975 +125000 ekin = 2.28621615469871 | erot = 2.48741243437901 | epot = -21.3367034039803 | etot = -16.5630748149025 +126000 ekin = 2.35529670025454 | erot = 2.6837186250083 | epot = -21.3743088823659 | etot = -16.3352935571031 +127000 ekin = 2.31727265883063 | erot = 2.65927495810814 | epot = -21.3864411166439 | etot = -16.4098934997051 +128000 ekin = 2.43349491835552 | erot = 2.48790131465765 | epot = -21.3667639128876 | etot = -16.4453676798745 +129000 ekin = 2.39675815548546 | erot = 2.10710860946288 | epot = -21.3539228728259 | etot = -16.8500561078776 +130000 ekin = 2.41755439047179 | erot = 1.81077952884569 | epot = -21.3548853564729 | etot = -17.1265514371554 +131000 ekin = 2.40648552369042 | erot = 1.77591735253046 | epot = -21.357420397669 | etot = -17.1750175214481 +132000 ekin = 2.40897764408259 | erot = 1.73059846772819 | epot = -21.3537520189403 | etot = -17.2141759071295 +133000 ekin = 2.37448540151599 | erot = 1.85880466212908 | epot = -21.3533218886589 | etot = -17.1200318250139 +134000 ekin = 2.3579677683218 | erot = 2.06779644045359 | epot = -21.3551168402505 | etot = -16.9293526314751 +135000 ekin = 2.32265431042311 | erot = 2.18050776639558 | epot = -21.3445924581616 | etot = -16.8414303813429 +136000 ekin = 2.26143919660737 | erot = 2.06564627363215 | epot = -21.3331599119329 | etot = -17.0060744416934 +137000 ekin = 2.23396906090401 | erot = 2.26473864092839 | epot = -21.3170510126768 | etot = -16.8183433108444 +138000 ekin = 2.25323790872614 | erot = 2.21298196842978 | epot = -21.3256388087683 | etot = -16.8594189316124 +139000 ekin = 2.35354475362117 | erot = 2.11114514997112 | epot = -21.4066516687638 | etot = -16.9419617651715 +140000 ekin = 2.31521381923616 | erot = 2.26671366611819 | epot = -21.499592330951 | etot = -16.9176648455967 +141000 ekin = 2.3344689024326 | erot = 2.24585605770329 | epot = -21.5117862025252 | etot = -16.9314612423893 +142000 ekin = 2.33661695709296 | erot = 1.9937796333313 | epot = -21.5249788887692 | etot = -17.194582298345 +143000 ekin = 2.35917698394981 | erot = 1.78177229585739 | epot = -21.5633348907868 | etot = -17.4223856109796 +144000 ekin = 2.41193656560918 | erot = 1.85068539007334 | epot = -21.619056918118 | etot = -17.3564349624355 +145000 ekin = 2.50328391189512 | erot = 1.97991868781718 | epot = -21.662761532947 | etot = -17.1795589332347 +146000 ekin = 2.5250108653161 | erot = 1.94890179310183 | epot = -21.7158596570763 | etot = -17.2419469986583 +147000 ekin = 2.55047937715164 | erot = 1.85137728928148 | epot = -21.7917365034045 | etot = -17.3898798369714 +148000 ekin = 2.52990172449131 | erot = 2.00218673263755 | epot = -21.8973033212464 | etot = -17.3652148641175 +149000 ekin = 2.47322709286655 | erot = 2.00142069560524 | epot = -22.0256184185784 | etot = -17.5509706301066 +150000 ekin = 2.55997956203431 | erot = 2.04181533809328 | epot = -22.1371239984733 | etot = -17.5353290983457 +151000 ekin = 2.44470695881366 | erot = 2.34031071867532 | epot = -22.2527174105275 | etot = -17.4676997330385 +152000 ekin = 2.44475737305755 | erot = 2.26076754628983 | epot = -22.3351232248324 | etot = -17.6295983054851 +153000 ekin = 2.46166206744186 | erot = 2.1789456139199 | epot = -22.3636879590955 | etot = -17.7230802777338 +154000 ekin = 2.49242904735514 | erot = 2.18959276990457 | epot = -22.3683882355897 | etot = -17.68636641833 +155000 ekin = 2.44328722883251 | erot = 2.13628761933908 | epot = -22.3356925905993 | etot = -17.7561177424278 +156000 ekin = 2.45031007040228 | erot = 2.26271751825021 | epot = -22.2682169791441 | etot = -17.5551893904916 +157000 ekin = 2.46907480878159 | erot = 1.93271915185538 | epot = -22.2160752580763 | etot = -17.8142812974393 +158000 ekin = 2.47549100134271 | erot = 1.8913430375128 | epot = -22.1750861634873 | etot = -17.8082521246318 +159000 ekin = 2.44378132199958 | erot = 1.82517595680759 | epot = -22.1335445885752 | etot = -17.8645873097681 +160000 ekin = 2.35644874685036 | erot = 1.85678861125786 | epot = -22.1078628335995 | etot = -17.8946254754913 +161000 ekin = 2.4417535709772 | erot = 2.14888928050335 | epot = -22.103198749515 | etot = -17.5125558980345 +162000 ekin = 2.46554036240857 | erot = 2.05333880369388 | epot = -22.1046164027322 | etot = -17.5857372366298 +163000 ekin = 2.36847802529576 | erot = 2.16987713772667 | epot = -22.1331210722205 | etot = -17.5947659091981 +164000 ekin = 2.31295455944026 | erot = 2.18879772052573 | epot = -22.1887776544463 | etot = -17.6870253744803 +165000 ekin = 2.37278415235397 | erot = 2.59415671104248 | epot = -22.2691581335389 | etot = -17.3022172701424 +166000 ekin = 2.45715177025092 | erot = 2.91759661846337 | epot = -22.3489659308412 | etot = -16.9742175421269 +167000 ekin = 2.52772481698543 | erot = 2.9570776047498 | epot = -22.4233688575489 | etot = -16.9385664358137 +168000 ekin = 2.38117634975369 | erot = 2.66863240829495 | epot = -22.4863077773177 | etot = -17.4364990192691 +169000 ekin = 2.37442003008251 | erot = 3.02523535510253 | epot = -22.552454463073 | etot = -17.152799077888 +170000 ekin = 2.35912346263696 | erot = 3.26723708493098 | epot = -22.593146241002 | etot = -16.9667856934341 +171000 ekin = 2.30318527402304 | erot = 3.1461628260988 | epot = -22.6090060092427 | etot = -17.1596579091209 +172000 ekin = 2.27403162918126 | erot = 3.03566839385154 | epot = -22.5926818968564 | etot = -17.2829818738236 +173000 ekin = 2.2834164296892 | erot = 3.07205239473261 | epot = -22.5825638558609 | etot = -17.2270950314391 +174000 ekin = 2.32458116486048 | erot = 3.00979281518584 | epot = -22.5948442115046 | etot = -17.2604702314582 +175000 ekin = 2.28314539624396 | erot = 2.68632336807992 | epot = -22.6176552757189 | etot = -17.6481865113951 +176000 ekin = 2.39450710620724 | erot = 2.64107287395718 | epot = -22.666704154903 | etot = -17.6311241747386 +177000 ekin = 2.34061737024885 | erot = 2.84587683178904 | epot = -22.7367147797006 | etot = -17.5502205776627 +178000 ekin = 2.37612348031832 | erot = 3.01155432501134 | epot = -22.8363255725677 | etot = -17.4486477672381 +179000 ekin = 2.44543239233026 | erot = 2.86468226567411 | epot = -22.9489860454759 | etot = -17.6388713874715 +180000 ekin = 2.43660202081819 | erot = 2.76977637853851 | epot = -23.0553980647268 | etot = -17.8490196653701 +181000 ekin = 2.48112579799584 | erot = 2.6278391417024 | epot = -23.1486576952531 | etot = -18.0396927555549 +182000 ekin = 2.49495772650969 | erot = 2.42192837677025 | epot = -23.2214385077914 | etot = -18.3045524045115 +183000 ekin = 2.64232135835023 | erot = 2.1668960319534 | epot = -23.2638526717323 | etot = -18.4546352814286 +184000 ekin = 2.60197203740134 | erot = 2.23382360906442 | epot = -23.2818965049629 | etot = -18.4461008584971 +185000 ekin = 2.57711189972532 | erot = 2.46016697006766 | epot = -23.3003293492567 | etot = -18.2630504794637 +186000 ekin = 2.52186177988769 | erot = 2.57013836767131 | epot = -23.3067390551247 | etot = -18.2147389075657 +187000 ekin = 2.50245214010174 | erot = 2.79417927414277 | epot = -23.296163562981 | etot = -17.9995321487365 +188000 ekin = 2.46480838237784 | erot = 3.04604077517096 | epot = -23.2499789204155 | etot = -17.7391297628667 +189000 ekin = 2.30511335916365 | erot = 2.75740516208191 | epot = -23.1747970843816 | etot = -18.112278563136 +190000 ekin = 2.21392698297074 | erot = 2.71955696974834 | epot = -23.0904117080344 | etot = -18.1569277553154 +191000 ekin = 2.16967810266251 | erot = 2.75919231540811 | epot = -23.0140192997739 | etot = -18.0851488817033 +192000 ekin = 1.98382084286039 | erot = 3.03429574416023 | epot = -22.9329314753771 | etot = -17.9148148883565 +193000 ekin = 1.85970667375617 | erot = 2.92182615510931 | epot = -22.8656246963103 | etot = -18.0840918674448 +194000 ekin = 1.7929696680452 | erot = 2.88349607002168 | epot = -22.8222401649263 | etot = -18.1457744268594 +195000 ekin = 1.64582813172132 | erot = 2.50667314432813 | epot = -22.7522033865826 | etot = -18.5997021105331 +196000 ekin = 1.60167277963843 | erot = 2.38989177939812 | epot = -22.6637097277974 | etot = -18.6721451687609 +197000 ekin = 1.71167813407961 | erot = 2.09589007853646 | epot = -22.5747312796685 | etot = -18.7671630670524 +198000 ekin = 1.64776254765037 | erot = 1.92608890072777 | epot = -22.4842649258583 | etot = -18.9104134774802 +199000 ekin = 1.65621021226673 | erot = 2.21876596478776 | epot = -22.4280470542139 | etot = -18.5530708771594 +200000 ekin = 1.68396557470048 | erot = 2.18851360029564 | epot = -22.379280294039 | etot = -18.5068011190429 +201000 ekin = 1.58452256050709 | erot = 2.76907779285238 | epot = -22.3014443905324 | etot = -17.947844037173 +202000 ekin = 1.54321939213116 | erot = 2.44655962102429 | epot = -22.2136540120258 | etot = -18.2238749988704 +203000 ekin = 1.49527423056762 | erot = 2.44440846517496 | epot = -22.1231335789825 | etot = -18.1834508832399 +204000 ekin = 1.42525079936429 | erot = 2.83745592867446 | epot = -22.0409614513841 | etot = -17.7782547233454 +205000 ekin = 1.42978422295414 | erot = 2.95341773064219 | epot = -21.9571851603537 | etot = -17.5739832067574 +206000 ekin = 1.36049778309753 | erot = 2.83549996707323 | epot = -21.8974335725846 | etot = -17.7014358224139 +207000 ekin = 1.29887157812385 | erot = 3.03783363013878 | epot = -21.8430515160584 | etot = -17.5063463077957 +208000 ekin = 1.34341544648364 | erot = 3.11373358018431 | epot = -21.785603235413 | etot = -17.3284542087451 +209000 ekin = 1.37014771279219 | erot = 2.91335961336075 | epot = -21.7135808557959 | etot = -17.430073529643 +210000 ekin = 1.42476756889871 | erot = 2.89331189478046 | epot = -21.5850142544311 | etot = -17.266934790752 +211000 ekin = 1.34927361868026 | erot = 2.68288143618382 | epot = -21.4400426672499 | etot = -17.4078876123858 +212000 ekin = 1.49128069580886 | erot = 2.70604382180407 | epot = -21.2914762616263 | etot = -17.0941517440134 +213000 ekin = 1.59986466327346 | erot = 2.65822930237652 | epot = -21.1410448576725 | etot = -16.8829508920225 +214000 ekin = 1.57570953317267 | erot = 2.79629927670805 | epot = -20.9904223688205 | etot = -16.6184135589398 +215000 ekin = 1.63256105235979 | erot = 2.69597024855494 | epot = -20.8601256454146 | etot = -16.5315943444999 +216000 ekin = 1.67064385264714 | erot = 2.44739930798252 | epot = -20.7555716480124 | etot = -16.6375284873828 +217000 ekin = 1.6218880063798 | erot = 2.4330555728333 | epot = -20.722413328212 | etot = -16.6674697489989 +218000 ekin = 1.64606636901744 | erot = 2.6486981466189 | epot = -20.7502510322013 | etot = -16.4554865165649 +219000 ekin = 1.70353414409848 | erot = 2.7997221130251 | epot = -20.7845992910567 | etot = -16.2813430339331 +220000 ekin = 1.74880022179254 | erot = 2.64905074347643 | epot = -20.8396457684431 | etot = -16.4417948031742 +221000 ekin = 1.81236487768043 | erot = 2.93669133915737 | epot = -20.9499015869694 | etot = -16.2008453701316 +222000 ekin = 1.84649161859346 | erot = 2.85287175773866 | epot = -21.0927343336169 | etot = -16.3933709572848 +223000 ekin = 1.87441660338485 | erot = 2.96311764811085 | epot = -21.2564885593178 | etot = -16.4189543078221 +224000 ekin = 2.09907785839491 | erot = 2.75433402152825 | epot = -21.424818361708 | etot = -16.5714064817849 +225000 ekin = 2.30010533938626 | erot = 2.67454361218699 | epot = -21.6008171170612 | etot = -16.626168165488 +226000 ekin = 2.42689725101242 | erot = 2.70736025408607 | epot = -21.7515066872426 | etot = -16.6172491821441 +227000 ekin = 2.54895929165975 | erot = 2.79460739709118 | epot = -21.8741313055212 | etot = -16.5305646167702 +228000 ekin = 2.61677978890097 | erot = 2.79388359916086 | epot = -21.973054308316 | etot = -16.5623909202542 +229000 ekin = 2.63216772040856 | erot = 2.92346177925235 | epot = -22.0307357525402 | etot = -16.4751062528793 +230000 ekin = 2.5839048934589 | erot = 2.87686964533646 | epot = -22.0461245567339 | etot = -16.5853500179385 +231000 ekin = 2.66188078761018 | erot = 2.60162661808963 | epot = -22.018684895378 | etot = -16.7551774896782 +232000 ekin = 2.65841421937248 | erot = 2.58950084967971 | epot = -21.952644801982 | etot = -16.7047297329298 +233000 ekin = 2.67013502535659 | erot = 2.39334157985991 | epot = -21.8593772977147 | etot = -16.7959006924982 +234000 ekin = 2.55687226826836 | erot = 2.28743657262082 | epot = -21.7196048549653 | etot = -16.8752960140761 +235000 ekin = 2.40908240211927 | erot = 2.18856718834604 | epot = -21.5568246763415 | etot = -16.9591750858762 +236000 ekin = 2.45296495728484 | erot = 1.73228998399397 | epot = -21.3990016680231 | etot = -17.2137467267443 +237000 ekin = 2.45647675573889 | erot = 1.55838299475438 | epot = -21.2711453873861 | etot = -17.2562856368928 +238000 ekin = 2.45085948587454 | erot = 1.73357194764423 | epot = -21.1889221126865 | etot = -17.0044906791677 +239000 ekin = 2.46602609451848 | erot = 1.90065188676585 | epot = -21.1667563196057 | etot = -16.8000783383214 +240000 ekin = 2.33796945986663 | erot = 2.10011736609371 | epot = -21.1933792884248 | etot = -16.7552924624644 +241000 ekin = 2.44155086640152 | erot = 2.5294221893795 | epot = -21.2654521458311 | etot = -16.29447909005 +242000 ekin = 2.43726026146458 | erot = 2.56189785799922 | epot = -21.3596468217686 | etot = -16.3604887023048 +243000 ekin = 2.38527720170858 | erot = 2.92483517968789 | epot = -21.4476955876487 | etot = -16.1375832062522 +244000 ekin = 2.43305152134978 | erot = 3.13030199682037 | epot = -21.5253542662412 | etot = -15.9620007480711 +245000 ekin = 2.34248058405609 | erot = 3.39654754017994 | epot = -21.5746719384285 | etot = -15.8356438141925 +246000 ekin = 2.22203010313987 | erot = 3.24539512103698 | epot = -21.6102612139387 | etot = -16.1428359897618 +247000 ekin = 2.18161414825905 | erot = 3.17708625003437 | epot = -21.6121017617732 | etot = -16.2534013634798 +248000 ekin = 2.14786027857325 | erot = 2.93493583442535 | epot = -21.5821175301772 | etot = -16.4993214171786 +249000 ekin = 2.1154622560351 | erot = 2.65676577989616 | epot = -21.5328260462557 | etot = -16.7605980103245 +250000 ekin = 2.08258254452502 | erot = 2.51278109177547 | epot = -21.4612192152785 | etot = -16.865855578978 +251000 ekin = 1.9742489487821 | erot = 2.34806738759138 | epot = -21.3923428532783 | etot = -17.0700265169048 +252000 ekin = 1.97048808369653 | erot = 1.99115759882276 | epot = -21.3271316585964 | etot = -17.3654859760771 +253000 ekin = 2.01408243379402 | erot = 2.32755027924622 | epot = -21.2782132891156 | etot = -16.9365805760754 +254000 ekin = 2.08055003788165 | erot = 1.89671800228147 | epot = -21.2526263857113 | etot = -17.2753583455482 +255000 ekin = 2.03693196256138 | erot = 2.07777286412284 | epot = -21.2590218685809 | etot = -17.1443170418967 +256000 ekin = 2.09443852502217 | erot = 1.93072997337288 | epot = -21.2924018193625 | etot = -17.2672333209674 +257000 ekin = 2.15892268396657 | erot = 1.80542946186159 | epot = -21.3549991612159 | etot = -17.3906470153878 +258000 ekin = 2.1798553186145 | erot = 1.78899461221362 | epot = -21.4290810676498 | etot = -17.4602311368217 +259000 ekin = 2.21879481100383 | erot = 2.00042152481931 | epot = -21.5156859416456 | etot = -17.2964696058224 +260000 ekin = 2.23230781087046 | erot = 1.92469119981206 | epot = -21.5739218213471 | etot = -17.4169228106646 +261000 ekin = 2.20725422443418 | erot = 1.95063112971748 | epot = -21.6226626065193 | etot = -17.4647772523677 +262000 ekin = 2.25364220587794 | erot = 1.86806956106358 | epot = -21.6606203978347 | etot = -17.5389086308931 +263000 ekin = 2.2745191124411 | erot = 1.88576182425897 | epot = -21.6707355563004 | etot = -17.5104546196004 +264000 ekin = 2.31743274100675 | erot = 1.89043794607679 | epot = -21.6658367619932 | etot = -17.4579660749097 +265000 ekin = 2.34289229985179 | erot = 2.08595197099475 | epot = -21.6767978216757 | etot = -17.2479535508292 +266000 ekin = 2.3899300653484 | erot = 2.06541078395747 | epot = -21.7067349964001 | etot = -17.2513941470942 +267000 ekin = 2.42913514053661 | erot = 1.90515845127833 | epot = -21.753771867194 | etot = -17.419478275379 +268000 ekin = 2.56337406000812 | erot = 1.92623756183675 | epot = -21.8331768183362 | etot = -17.3435651964914 +269000 ekin = 2.61168966394753 | erot = 1.99189529087478 | epot = -21.8974804447422 | etot = -17.2938954899199 +270000 ekin = 2.53639435963122 | erot = 2.18070434963339 | epot = -21.9584187694417 | etot = -17.2413200601771 +271000 ekin = 2.4730499948757 | erot = 2.35836713203746 | epot = -21.9991923760468 | etot = -17.1677752491337 +272000 ekin = 2.47073160362048 | erot = 2.18239415020589 | epot = -22.0193810519899 | etot = -17.3662552981635 +273000 ekin = 2.4161128868233 | erot = 2.11264062363061 | epot = -22.0447361710736 | etot = -17.5159826606197 +274000 ekin = 2.33309205622036 | erot = 2.12677358473247 | epot = -22.0456863660978 | etot = -17.585820725145 +275000 ekin = 2.25325149778063 | erot = 2.19345346449468 | epot = -21.9873759762878 | etot = -17.5406710140125 +276000 ekin = 2.11579900114214 | erot = 2.01180248953933 | epot = -21.8981479929511 | etot = -17.7705465022696 +277000 ekin = 2.01204365222986 | erot = 1.98722100035167 | epot = -21.7960888645598 | etot = -17.7968242119783 +278000 ekin = 1.94141858256029 | erot = 2.28521819509401 | epot = -21.7113859217473 | etot = -17.484749144093 +279000 ekin = 1.83792081872222 | erot = 2.29363129336714 | epot = -21.6511613802402 | etot = -17.5196092681508 +280000 ekin = 1.73807918416876 | erot = 2.50531944195154 | epot = -21.648860900744 | etot = -17.4054622746237 +281000 ekin = 1.73432743109903 | erot = 2.683788200705 | epot = -21.6510875258494 | etot = -17.2329718940453 +282000 ekin = 1.707454359447 | erot = 2.4631171643996 | epot = -21.702633188471 | etot = -17.5320616646244 +283000 ekin = 1.60185741540726 | erot = 2.73972949535758 | epot = -21.788969309387 | etot = -17.4473823986222 +284000 ekin = 1.45656966763948 | erot = 3.08718988751344 | epot = -21.9109766986028 | etot = -17.3672171434499 +285000 ekin = 1.52336397324818 | erot = 3.2348904453559 | epot = -22.0771348239222 | etot = -17.3188804053181 +286000 ekin = 1.52886747117867 | erot = 3.26500488671026 | epot = -22.2419806366669 | etot = -17.4481082787779 +287000 ekin = 1.5582725813792 | erot = 3.2185398289023 | epot = -22.374580622938 | etot = -17.5977682126565 +288000 ekin = 1.62221220393018 | erot = 3.11944065317502 | epot = -22.4753647550739 | etot = -17.7337118979687 +289000 ekin = 1.67251771955046 | erot = 2.53263586427446 | epot = -22.5286401037665 | etot = -18.3234865199416 +290000 ekin = 1.79922183320689 | erot = 2.60060797838013 | epot = -22.5663935494002 | etot = -18.1665637378131 +291000 ekin = 1.83910683599856 | erot = 2.21931974991974 | epot = -22.5984502564983 | etot = -18.54002367058 +292000 ekin = 1.94895219984002 | erot = 2.13471584079355 | epot = -22.6223121384565 | etot = -18.538644097823 +293000 ekin = 2.00848212838241 | erot = 2.19116654326673 | epot = -22.6334508938888 | etot = -18.4338022222397 +294000 ekin = 2.10559198417458 | erot = 1.93202707864297 | epot = -22.6586912703106 | etot = -18.621072207493 +295000 ekin = 2.21769154753229 | erot = 1.88155097269452 | epot = -22.7095788430016 | etot = -18.6103363227748 +296000 ekin = 2.33458415024603 | erot = 2.23498610265731 | epot = -22.7640278342614 | etot = -18.194457581358 +297000 ekin = 2.42885632292099 | erot = 1.96776290060609 | epot = -22.8238447137232 | etot = -18.4272254901961 +298000 ekin = 2.55470243764224 | erot = 2.23334330823264 | epot = -22.9186285858852 | etot = -18.1305828400103 +299000 ekin = 2.66453185837133 | erot = 2.34987058034008 | epot = -23.0168248151099 | etot = -18.0024223763984 +300000 ekin = 2.72119699302726 | erot = 2.29170874462634 | epot = -23.0901056634069 | etot = -18.0771999257533 +301000 ekin = 2.81586193114734 | erot = 2.13213339022162 | epot = -23.149588375443 | etot = -18.201593054074 +302000 ekin = 2.91520994762752 | erot = 1.88276051696952 | epot = -23.1915517299788 | etot = -18.3935812653817 +303000 ekin = 3.00910392441911 | erot = 1.95969044044558 | epot = -23.2200453504935 | etot = -18.2512509856288 +304000 ekin = 3.09252107593619 | erot = 1.62524026936747 | epot = -23.2362247506591 | etot = -18.5184634053554 +305000 ekin = 3.1833332778338 | erot = 1.64710767299387 | epot = -23.239688077863 | etot = -18.4092471270354 +306000 ekin = 3.2303852450878 | erot = 1.86572791579381 | epot = -23.2226722815321 | etot = -18.1265591206505 +307000 ekin = 3.17553918919359 | erot = 2.33048974790649 | epot = -23.1930577755999 | etot = -17.6870288384998 +308000 ekin = 3.05565196722448 | erot = 2.12851261980202 | epot = -23.1373688624437 | etot = -17.9532042754172 +309000 ekin = 3.06886265684594 | erot = 2.25716457141468 | epot = -23.0626811521325 | etot = -17.7366539238719 +310000 ekin = 2.9103478785017 | erot = 2.45832048654341 | epot = -23.0039736316974 | etot = -17.6353052666523 +311000 ekin = 2.80209798482117 | erot = 2.69963602433988 | epot = -22.9644587572484 | etot = -17.4627247480874 +312000 ekin = 2.89133577486401 | erot = 2.91057311416267 | epot = -22.9280382115917 | etot = -17.126129322565 +313000 ekin = 2.85188593774383 | erot = 2.64756099113599 | epot = -22.9072517674229 | etot = -17.407804838543 +314000 ekin = 2.78595369543557 | erot = 2.70015943474038 | epot = -22.9231273154874 | etot = -17.4370141853114 +315000 ekin = 2.80274029888226 | erot = 2.58977766570975 | epot = -22.9544686180923 | etot = -17.5619506535003 +316000 ekin = 2.813169306106 | erot = 2.690980071203 | epot = -22.9778084391862 | etot = -17.4736590618772 +317000 ekin = 2.92747042873583 | erot = 2.60588706069162 | epot = -22.9662401312089 | etot = -17.4328826417815 +318000 ekin = 2.92235999955154 | erot = 2.47590791759842 | epot = -22.9395079234944 | etot = -17.5412400063444 +319000 ekin = 2.95294558428538 | erot = 2.3284695967344 | epot = -22.8862142058975 | etot = -17.6047990248777 +320000 ekin = 2.96034320260985 | erot = 1.96132462322065 | epot = -22.8325608441835 | etot = -17.910893018353 +321000 ekin = 3.0506123149284 | erot = 1.60256900115906 | epot = -22.772967562217 | etot = -18.1197862461295 +322000 ekin = 3.06917008169216 | erot = 1.78242384845949 | epot = -22.7183310735853 | etot = -17.8667371434336 +323000 ekin = 3.01773744699203 | erot = 1.54792296048673 | epot = -22.6793347879489 | etot = -18.1136743804701 +324000 ekin = 3.00480822228189 | erot = 1.41906862436133 | epot = -22.6494390826941 | etot = -18.2255622360509 +325000 ekin = 2.89783034430742 | erot = 1.53330273244741 | epot = -22.6175860707657 | etot = -18.1864529940109 +326000 ekin = 2.86411015648574 | erot = 1.46437933803489 | epot = -22.5787186521105 | etot = -18.2502291575898 +327000 ekin = 2.85311531697693 | erot = 1.58696821581913 | epot = -22.5591982819074 | etot = -18.1191147491114 +328000 ekin = 2.86747144026835 | erot = 1.74413948970463 | epot = -22.5408974569852 | etot = -17.9292865270122 +329000 ekin = 2.78611224528675 | erot = 1.59178805962542 | epot = -22.4940152398142 | etot = -18.116114934902 +330000 ekin = 2.69317692812656 | erot = 1.77728472427356 | epot = -22.4199575472595 | etot = -17.9494958948593 +331000 ekin = 2.66550770553878 | erot = 1.86897796248965 | epot = -22.3262951615913 | etot = -17.7918094935629 +332000 ekin = 2.46548011243441 | erot = 1.78639997747238 | epot = -22.2432651292252 | etot = -17.9913850393184 +333000 ekin = 2.38707429510573 | erot = 1.88540525492875 | epot = -22.1912828165259 | etot = -17.9188032664914 +334000 ekin = 2.29842323367102 | erot = 1.91569547244919 | epot = -22.1605657807781 | etot = -17.9464470746579 +335000 ekin = 2.14328705611339 | erot = 1.93351743363534 | epot = -22.1267428568705 | etot = -18.0499383671218 +336000 ekin = 2.17230386456881 | erot = 1.84213347788928 | epot = -22.0906093676853 | etot = -18.0761720252272 +337000 ekin = 2.12998408141727 | erot = 1.61504892612904 | epot = -22.0362365245474 | etot = -18.2912035170011 +338000 ekin = 2.22344100551942 | erot = 1.68131888644304 | epot = -21.9914967299633 | etot = -18.0867368380009 +339000 ekin = 2.17397763598077 | erot = 2.04937445475364 | epot = -21.9399664944352 | etot = -17.7166144037008 +340000 ekin = 2.20074652018761 | erot = 2.20161688813948 | epot = -21.9270463566988 | etot = -17.5246829483717 +341000 ekin = 2.27511078184159 | erot = 2.29314361762764 | epot = -21.9408735448824 | etot = -17.3726191454131 +342000 ekin = 2.23496832750093 | erot = 2.5650510125349 | epot = -21.9730675845141 | etot = -17.1730482444783 +343000 ekin = 2.14180809724111 | erot = 2.97675645193248 | epot = -21.9956779914414 | etot = -16.8771134422678 +344000 ekin = 2.2126707016694 | erot = 2.22143192231864 | epot = -22.0021896006045 | etot = -17.5680869766165 +345000 ekin = 2.33078283444873 | erot = 2.24242604297012 | epot = -22.0150204126161 | etot = -17.4418115351973 +346000 ekin = 2.34407159811759 | erot = 1.99201495775972 | epot = -22.0385016930848 | etot = -17.7024151372075 +347000 ekin = 2.44088137371613 | erot = 2.12531879806797 | epot = -22.0618508546084 | etot = -17.4956506828243 +348000 ekin = 2.64914602526481 | erot = 2.46233252053011 | epot = -22.0937551106248 | etot = -16.9822765648299 +349000 ekin = 2.74052569579419 | erot = 2.4858891328714 | epot = -22.1113349203141 | etot = -16.8849200916485 +350000 ekin = 2.63009093889651 | erot = 2.96194682397752 | epot = -22.1188176550615 | etot = -16.5267798921874 +351000 ekin = 2.58934992266496 | erot = 2.87704347850333 | epot = -22.1025806281002 | etot = -16.6361872269319 +352000 ekin = 2.54228487046017 | erot = 2.63361513807469 | epot = -22.065268676535 | etot = -16.8893686680001 +353000 ekin = 2.53249364323764 | erot = 2.47221948070281 | epot = -22.0318641173349 | etot = -17.0271509933945 +354000 ekin = 2.56206560144996 | erot = 2.34662515218724 | epot = -22.0126143901227 | etot = -17.1039236364855 +355000 ekin = 2.53151865050983 | erot = 2.41130529481779 | epot = -21.9989758809428 | etot = -17.0561519356152 +356000 ekin = 2.38856942051675 | erot = 2.45957154153164 | epot = -21.9929238390888 | etot = -17.1447828770405 +357000 ekin = 2.38503185044981 | erot = 2.38151023524621 | epot = -22.0040942348338 | etot = -17.2375521491378 +358000 ekin = 2.44758512950039 | erot = 2.71803579945338 | epot = -22.0072561961475 | etot = -16.8416352671937 +359000 ekin = 2.3851668843951 | erot = 2.57286490732325 | epot = -21.9670271651235 | etot = -17.0089953734051 +360000 ekin = 2.33663079544644 | erot = 2.56848564652217 | epot = -21.9181648411088 | etot = -17.0130483991401 +361000 ekin = 2.42677922379477 | erot = 2.37500774993747 | epot = -21.8672713761356 | etot = -17.0654844024033 +362000 ekin = 2.4605364062406 | erot = 2.49590481611229 | epot = -21.7779995387158 | etot = -16.8215583163629 +363000 ekin = 2.55310738370223 | erot = 2.17768318633137 | epot = -21.677682077902 | etot = -16.9468915078684 +364000 ekin = 2.5678010972577 | erot = 2.16474191665875 | epot = -21.5533633280085 | etot = -16.820820314092 +365000 ekin = 2.59901975131882 | erot = 1.7140989302114 | epot = -21.4252112523553 | etot = -17.1120925708251 +366000 ekin = 2.80245009247369 | erot = 1.4404838150693 | epot = -21.311596587106 | etot = -17.068662679563 +367000 ekin = 2.85134090040924 | erot = 1.61253537083183 | epot = -21.2054965437889 | etot = -16.7416202725478 +368000 ekin = 3.00720175661758 | erot = 1.37649145802376 | epot = -21.1143147590192 | etot = -16.7306215443779 +369000 ekin = 3.02782850583644 | erot = 1.29964512201192 | epot = -21.0456750388441 | etot = -16.7182014109957 +370000 ekin = 2.96718136039109 | erot = 1.45830059090196 | epot = -20.9956751371928 | etot = -16.5701931858997 +371000 ekin = 2.97398053523892 | erot = 1.26453322843172 | epot = -20.9819115867117 | etot = -16.743397823041 +372000 ekin = 2.93284410498 | erot = 1.41224205422984 | epot = -20.9908796563722 | etot = -16.6457934971623 +373000 ekin = 2.8879003401046 | erot = 1.42564554966125 | epot = -21.0338923993971 | etot = -16.7203465096313 +374000 ekin = 2.82344708085634 | erot = 1.62526123419932 | epot = -21.0946345683056 | etot = -16.64592625325 +375000 ekin = 2.90481916892106 | erot = 1.7464206770586 | epot = -21.2008783966461 | etot = -16.5496385506664 +376000 ekin = 2.84134799892063 | erot = 1.87675422092541 | epot = -21.3649261105941 | etot = -16.6468238907481 +377000 ekin = 2.86364799078503 | erot = 1.93393380949078 | epot = -21.5406268140671 | etot = -16.7430450137913 +378000 ekin = 2.90483004895234 | erot = 2.17252781549633 | epot = -21.7155346442898 | etot = -16.6381767798411 +379000 ekin = 2.88650755861751 | erot = 1.96118442992086 | epot = -21.8538626049789 | etot = -17.0061706164405 +380000 ekin = 2.88651329834471 | erot = 2.08410077478119 | epot = -21.9401095058162 | etot = -16.9694954326903 +381000 ekin = 2.84108364234484 | erot = 2.3660240689464 | epot = -21.98104394619 | etot = -16.7739362348987 +382000 ekin = 2.65581712933813 | erot = 2.32549072457596 | epot = -21.9604472596473 | etot = -16.9791394057332 +383000 ekin = 2.66697103963098 | erot = 2.19715446258958 | epot = -21.8997743494525 | etot = -17.035648847232 +384000 ekin = 2.71347175798896 | erot = 2.0860453579752 | epot = -21.8256490214726 | etot = -17.0261319055084 +385000 ekin = 2.58866272891295 | erot = 2.07169637253233 | epot = -21.758827765026 | etot = -17.0984686635807 +386000 ekin = 2.61416908347388 | erot = 2.1240237822152 | epot = -21.727589058865 | etot = -16.9893961931759 +387000 ekin = 2.703733725349 | erot = 2.21149248908629 | epot = -21.7114203261748 | etot = -16.7961941117395 +388000 ekin = 2.7497838323679 | erot = 2.03622128721578 | epot = -21.7171286702608 | etot = -16.9311235506772 +389000 ekin = 2.75876151313239 | erot = 2.35914494269186 | epot = -21.7195350651328 | etot = -16.6016286093086 +390000 ekin = 2.87281151326072 | erot = 2.14919283772489 | epot = -21.7092098874033 | etot = -16.6872055364177 +391000 ekin = 2.88070946214033 | erot = 2.15553640701987 | epot = -21.7308938242006 | etot = -16.6946479550404 +392000 ekin = 2.85350413424024 | erot = 1.95551148082617 | epot = -21.7800211133378 | etot = -16.9710054982714 +393000 ekin = 2.90295298668554 | erot = 2.00031478831757 | epot = -21.8483879920452 | etot = -16.9451202170421 +394000 ekin = 2.87980364418038 | erot = 2.13854428764088 | epot = -21.9278910355293 | etot = -16.9095431037081 +395000 ekin = 2.89980834808641 | erot = 2.27975081097518 | epot = -22.0016489908306 | etot = -16.822089831769 +396000 ekin = 2.9360557483404 | erot = 2.2875622150139 | epot = -22.0837193562733 | etot = -16.860101392919 +397000 ekin = 2.80779171295693 | erot = 2.19257867663261 | epot = -22.1878285992745 | etot = -17.187458209685 +398000 ekin = 2.65560496560025 | erot = 2.63286768292198 | epot = -22.2927014267369 | etot = -17.0042287782147 +399000 ekin = 2.7083129997789 | erot = 2.28957359120755 | epot = -22.4133968187077 | etot = -17.4155102277212 +400000 ekin = 2.62631472682178 | erot = 2.32258453004909 | epot = -22.5144474162181 | etot = -17.5655481593472 +401000 ekin = 2.61084599477582 | erot = 2.5915842232174 | epot = -22.6219132294947 | etot = -17.4194830115015 +402000 ekin = 2.63588590320108 | erot = 2.77714471535845 | epot = -22.726497935138 | etot = -17.3134673165785 +403000 ekin = 2.57124299169012 | erot = 2.91857224360648 | epot = -22.7998184812978 | etot = -17.3100032460012 +404000 ekin = 2.64669440558072 | erot = 2.93356467106652 | epot = -22.8394282855354 | etot = -17.2591692088882 +405000 ekin = 2.63136962603962 | erot = 3.04830494377458 | epot = -22.8811547071106 | etot = -17.2014801372964 +406000 ekin = 2.57687330940515 | erot = 2.89269043406019 | epot = -22.8904487120534 | etot = -17.420884968588 +407000 ekin = 2.56184489605048 | erot = 3.0869265673611 | epot = -22.8853592595439 | etot = -17.2365877961323 +408000 ekin = 2.54127249851751 | erot = 3.17601770471237 | epot = -22.9006717760475 | etot = -17.1833815728176 +409000 ekin = 2.53459046783756 | erot = 3.13623300199206 | epot = -22.8968640693002 | etot = -17.2260405994706 +410000 ekin = 2.51587421571662 | erot = 3.14201699757386 | epot = -22.9150990085739 | etot = -17.2572077952835 +411000 ekin = 2.42964978573949 | erot = 3.32305144355808 | epot = -22.950164108708 | etot = -17.1974628794104 +412000 ekin = 2.36687843567492 | erot = 3.32855044296013 | epot = -22.9956786711899 | etot = -17.3002497925549 +413000 ekin = 2.32867643693121 | erot = 3.02147909460693 | epot = -23.0359443059235 | etot = -17.6857887743854 +414000 ekin = 2.25152604494466 | erot = 3.14866247342447 | epot = -23.0379850078344 | etot = -17.6377964894653 +415000 ekin = 2.14860234477144 | erot = 3.14281806599387 | epot = -23.0168097112442 | etot = -17.7253893004789 +416000 ekin = 2.13327753923941 | erot = 2.78190144921923 | epot = -22.9549412646377 | etot = -18.0397622761791 +417000 ekin = 2.07867029653697 | erot = 2.63891364632696 | epot = -22.8771697337527 | etot = -18.1595857908887 +418000 ekin = 2.0150349708746 | erot = 2.48786384280144 | epot = -22.7881812529125 | etot = -18.2852824392364 +419000 ekin = 1.93436445840322 | erot = 2.56473142390303 | epot = -22.7122209786172 | etot = -18.213125096311 +420000 ekin = 1.86691051963017 | erot = 2.37316247804236 | epot = -22.6636441048361 | etot = -18.4235711071636 +421000 ekin = 1.8667725624874 | erot = 2.32313827929402 | epot = -22.6187875829574 | etot = -18.428876741176 +422000 ekin = 1.8200582415809 | erot = 2.55465763559262 | epot = -22.5903542114936 | etot = -18.2156383343201 +423000 ekin = 1.85196925130418 | erot = 2.59745988234307 | epot = -22.5868190893395 | etot = -18.1373899556923 +424000 ekin = 1.87511106269032 | erot = 2.36649086179865 | epot = -22.5883508404773 | etot = -18.3467489159883 +425000 ekin = 1.85448962199789 | erot = 2.3591233455441 | epot = -22.5825697876888 | etot = -18.3689568201468 +426000 ekin = 1.93877126287082 | erot = 2.34047239554888 | epot = -22.5855644966028 | etot = -18.3063208381831 +427000 ekin = 1.98667133587004 | erot = 2.21434059237444 | epot = -22.6165038624104 | etot = -18.4154919341659 +428000 ekin = 2.06633462219177 | erot = 2.46308595042552 | epot = -22.6536305130781 | etot = -18.1242099404608 +429000 ekin = 2.06647569478212 | erot = 2.85029146170665 | epot = -22.6734202786044 | etot = -17.7566531221156 +430000 ekin = 2.02119030876797 | erot = 3.03581181603967 | epot = -22.6592821074028 | etot = -17.6022799825951 +431000 ekin = 1.92940982496923 | erot = 3.125674796042 | epot = -22.6051004098154 | etot = -17.5500157888042 +432000 ekin = 1.98926835887576 | erot = 2.96897634192392 | epot = -22.5090519549375 | etot = -17.5508072541379 +433000 ekin = 2.04143073246114 | erot = 2.85215225860714 | epot = -22.3406443583776 | etot = -17.4470613673093 +434000 ekin = 2.05565692829913 | erot = 2.95627927317631 | epot = -22.1000056035569 | etot = -17.0880694020814 +435000 ekin = 2.08432405496736 | erot = 2.68419048003187 | epot = -21.8308353279849 | etot = -17.0623207929857 +436000 ekin = 2.12772749840182 | erot = 2.84173548840778 | epot = -21.5604223141965 | etot = -16.5909593273869 +437000 ekin = 2.04468233985804 | erot = 2.51892636169328 | epot = -21.3171953647822 | etot = -16.7535866632309 +438000 ekin = 2.04330796733059 | erot = 2.25039837644734 | epot = -21.1104661155377 | etot = -16.8167597717598 +439000 ekin = 2.1303450962371 | erot = 2.34282002521722 | epot = -20.9455910272725 | etot = -16.4724259058182 +440000 ekin = 2.19070367254264 | erot = 2.15029144838855 | epot = -20.8316849257311 | etot = -16.4906898047999 +441000 ekin = 2.18523324344632 | erot = 2.14329639955493 | epot = -20.7742603417167 | etot = -16.4457306987154 +442000 ekin = 2.35525341099367 | erot = 2.33073585925573 | epot = -20.792107801297 | etot = -16.1061185310476 +443000 ekin = 2.42381848947187 | erot = 2.29410897800853 | epot = -20.8510039080529 | etot = -16.1330764405725 +444000 ekin = 2.58327001521848 | erot = 2.2555040393805 | epot = -20.9496740359511 | etot = -16.1108999813521 +445000 ekin = 2.74914318766607 | erot = 2.36474125562136 | epot = -21.0902773104291 | etot = -15.9763928671417 +446000 ekin = 2.75866465553895 | erot = 2.51903536478372 | epot = -21.2771375903941 | etot = -15.9994375700714 +447000 ekin = 2.81341929589966 | erot = 2.61543912233437 | epot = -21.4943223583148 | etot = -16.0654639400807 +448000 ekin = 2.98791449212409 | erot = 2.68601572134495 | epot = -21.6882416455897 | etot = -16.0143114321207 +449000 ekin = 3.02989562281076 | erot = 2.59921391657428 | epot = -21.8625805167009 | etot = -16.2334709773159 +450000 ekin = 3.0758419338981 | erot = 2.74644112742609 | epot = -21.997728414517 | etot = -16.1754453531928 +451000 ekin = 3.1732510322311 | erot = 2.71318685835058 | epot = -22.0826869675359 | etot = -16.1962490769543 +452000 ekin = 3.26804429580701 | erot = 2.87778182303269 | epot = -22.0906838053159 | etot = -15.9448576864762 +453000 ekin = 3.27357354113463 | erot = 2.70771602218257 | epot = -22.009345068552 | etot = -16.0280555052348 +454000 ekin = 3.19461395199184 | erot = 2.6448969266276 | epot = -21.8896212815603 | etot = -16.0501104029409 +455000 ekin = 3.06934448991755 | erot = 2.52112023723157 | epot = -21.7581228733757 | etot = -16.1676581462265 +456000 ekin = 3.00870709873354 | erot = 2.69030125753166 | epot = -21.6192081822489 | etot = -15.9201998259837 +457000 ekin = 2.77721648981712 | erot = 2.81809494378998 | epot = -21.5044838205097 | etot = -15.9091723869026 +458000 ekin = 2.72192779143867 | erot = 2.81327589912996 | epot = -21.3991411950549 | etot = -15.8639375044863 +459000 ekin = 2.66716160346742 | erot = 2.91218722489636 | epot = -21.3056824262503 | etot = -15.7263335978865 +460000 ekin = 2.61631308900579 | erot = 2.72088150404094 | epot = -21.2125642789402 | etot = -15.8753696858935 +461000 ekin = 2.52111486337738 | erot = 2.61083643510198 | epot = -21.1320849455672 | etot = -16.0001336470878 +462000 ekin = 2.35496729961946 | erot = 2.53585610998176 | epot = -21.0535223021749 | etot = -16.1626988925736 +463000 ekin = 2.2439343318321 | erot = 2.51761943073272 | epot = -21.0230425923881 | etot = -16.2614888298233 +464000 ekin = 2.1626457562572 | erot = 2.67496242735603 | epot = -21.0323536551491 | etot = -16.1947454715359 +465000 ekin = 2.12337820037341 | erot = 2.82456556368787 | epot = -21.0880254572834 | etot = -16.1400816932221 +466000 ekin = 2.04496236125005 | erot = 2.74204868129271 | epot = -21.1490905898125 | etot = -16.3620795472697 +467000 ekin = 2.0707620645862 | erot = 2.74539024720618 | epot = -21.2150241645281 | etot = -16.3988718527357 +468000 ekin = 2.08250457485156 | erot = 2.4940100588542 | epot = -21.2895135595468 | etot = -16.712998925841 +469000 ekin = 2.11940107816891 | erot = 2.73165603901951 | epot = -21.3555553713497 | etot = -16.5044982541612 +470000 ekin = 2.27554500930735 | erot = 2.57556168280453 | epot = -21.4121284090537 | etot = -16.5610217169418 +471000 ekin = 2.21149846213409 | erot = 2.49207243095059 | epot = -21.4357320520247 | etot = -16.73216115894 +472000 ekin = 2.13757463851149 | erot = 2.31011730813796 | epot = -21.4380116997287 | etot = -16.9903197530793 +473000 ekin = 2.06821493877588 | erot = 2.26850039282583 | epot = -21.4114781960853 | etot = -17.0747628644836 +474000 ekin = 1.96490547218375 | erot = 2.35563819582063 | epot = -21.3522336688369 | etot = -17.0316900008326 +475000 ekin = 1.94558586419879 | erot = 2.10680745423894 | epot = -21.2548130597364 | etot = -17.2024197412987 +476000 ekin = 1.94190624501475 | erot = 2.16513825042938 | epot = -21.159554468915 | etot = -17.0525099734709 +477000 ekin = 1.99924367094377 | erot = 1.80803378013927 | epot = -21.0628461625389 | etot = -17.2555687114559 +478000 ekin = 1.89989927585438 | erot = 1.77183940189893 | epot = -20.9920693922243 | etot = -17.320330714471 +479000 ekin = 1.84520242098747 | erot = 1.66369715226449 | epot = -20.9431976611348 | etot = -17.4342980878828 +480000 ekin = 1.78395227007269 | erot = 1.62380842243988 | epot = -20.9116440658475 | etot = -17.503883373335 +481000 ekin = 1.80711393748078 | erot = 1.45108120724281 | epot = -20.8998091956538 | etot = -17.6416140509303 +482000 ekin = 1.83485472728802 | erot = 1.58991315613704 | epot = -20.9502956349549 | etot = -17.5255277515298 +483000 ekin = 1.74714650944526 | erot = 2.06533056940214 | epot = -21.0598264029401 | etot = -17.2473493240927 +484000 ekin = 1.8057186887513 | erot = 2.45785513658366 | epot = -21.2268132327393 | etot = -16.9632394074044 +485000 ekin = 1.97685842465673 | erot = 2.60360246547727 | epot = -21.4062901266652 | etot = -16.8258292365312 +486000 ekin = 2.06309847922677 | erot = 2.90380547812245 | epot = -21.5894655607393 | etot = -16.6225616033901 +487000 ekin = 2.19649216659994 | erot = 2.81883409927294 | epot = -21.7360008549519 | etot = -16.7206745890791 +488000 ekin = 2.27235435120772 | erot = 3.21078167833795 | epot = -21.8710028956712 | etot = -16.3878668661256 +489000 ekin = 2.3636591616528 | erot = 2.98148333833798 | epot = -21.9731809770875 | etot = -16.6280384770967 +490000 ekin = 2.4636557224321 | erot = 3.03413636977543 | epot = -22.0415730890951 | etot = -16.5437809968876 +491000 ekin = 2.48043066028413 | erot = 2.95353817719114 | epot = -22.0882801530733 | etot = -16.654311315598 +492000 ekin = 2.43187986853069 | erot = 2.81942197452466 | epot = -22.1316786946073 | etot = -16.880376851552 +493000 ekin = 2.43297707751461 | erot = 3.13501618675316 | epot = -22.1516877815832 | etot = -16.5836945173154 +494000 ekin = 2.4354773700696 | erot = 3.224943833042 | epot = -22.1277792873507 | etot = -16.4673580842391 +495000 ekin = 2.44131017621637 | erot = 3.14764944977806 | epot = -22.079810722608 | etot = -16.4908510966136 +496000 ekin = 2.44929786442212 | erot = 3.00103698197392 | epot = -22.0029286492464 | etot = -16.5525938028503 +497000 ekin = 2.4280734272358 | erot = 2.78818041326617 | epot = -21.8989958230258 | etot = -16.6827419825238 +498000 ekin = 2.43232675717266 | erot = 2.78563195522793 | epot = -21.7990677062028 | etot = -16.5811089938022 +499000 ekin = 2.39683774655007 | erot = 2.52204743265467 | epot = -21.6970829564495 | etot = -16.7781977772448 +500000 ekin = 2.39561357167997 | erot = 2.04914490208487 | epot = -21.6057727183573 | etot = -17.1610142445925 +501000 ekin = 2.49011062220811 | erot = 2.09141321522323 | epot = -21.5560066661711 | etot = -16.9744828287398 +502000 ekin = 2.50365744754297 | erot = 2.10420254833234 | epot = -21.5549657901239 | etot = -16.9471057942486 +503000 ekin = 2.50788240480049 | erot = 2.30709919674968 | epot = -21.6015443787762 | etot = -16.786562777226 +504000 ekin = 2.42370070726357 | erot = 1.84999363757419 | epot = -21.6380109735029 | etot = -17.3643166286652 +505000 ekin = 2.35874834855526 | erot = 2.14636862503864 | epot = -21.6689774661098 | etot = -17.1638604925159 +506000 ekin = 2.26228062582635 | erot = 2.45377485636132 | epot = -21.7153954382918 | etot = -16.9993399561042 +507000 ekin = 2.13919237077154 | erot = 2.50319755000149 | epot = -21.7581761618781 | etot = -17.1157862411051 +508000 ekin = 2.14831373874063 | erot = 3.06092132482214 | epot = -21.7763037427622 | etot = -16.5670686791994 +509000 ekin = 2.05180259764867 | erot = 3.39029610338365 | epot = -21.7760035853532 | etot = -16.3339048843209 +510000 ekin = 2.04381464635437 | erot = 3.61253858305498 | epot = -21.7386277737472 | etot = -16.0822745443378 +511000 ekin = 2.05816959569127 | erot = 3.102136513493 | epot = -21.6883623768063 | etot = -16.528056267622 +512000 ekin = 1.92422822548484 | erot = 2.7926385451771 | epot = -21.6550102347612 | etot = -16.9381434640992 +513000 ekin = 2.02050703596267 | erot = 2.71259548634819 | epot = -21.6549051178158 | etot = -16.921802595505 +514000 ekin = 2.07581905977924 | erot = 2.32467594776647 | epot = -21.6655568342184 | etot = -17.2650618266727 +515000 ekin = 2.08477825623489 | erot = 2.59404540183174 | epot = -21.7265307260937 | etot = -17.0477070680271 +516000 ekin = 2.15812359163726 | erot = 2.69267871008878 | epot = -21.8093937590779 | etot = -16.9585914573518 +517000 ekin = 2.13934962382501 | erot = 2.8436528571905 | epot = -21.9032983411413 | etot = -16.9202958601258 +518000 ekin = 2.20591925285869 | erot = 3.12936446615959 | epot = -22.0120787399692 | etot = -16.6767950209509 +519000 ekin = 2.26634159461371 | erot = 3.09465064893055 | epot = -22.1371864066217 | etot = -16.7761941630775 +520000 ekin = 2.33395232089093 | erot = 3.1670786380661 | epot = -22.2618368300502 | etot = -16.7608058710932 +521000 ekin = 2.37443913996459 | erot = 2.84321493552062 | epot = -22.3608681173471 | etot = -17.1432140418619 +522000 ekin = 2.38014534564443 | erot = 2.71344764130118 | epot = -22.4471285851328 | etot = -17.3535355981872 +523000 ekin = 2.43082426163801 | erot = 2.87118432179588 | epot = -22.5347499952688 | etot = -17.2327414118349 +524000 ekin = 2.56081842163085 | erot = 3.05550273097475 | epot = -22.6100687346066 | etot = -16.993747582001 +525000 ekin = 2.5595327185846 | erot = 2.67513220891039 | epot = -22.6739874644372 | etot = -17.4393225369422 +526000 ekin = 2.59958209030967 | erot = 2.95738463024345 | epot = -22.7033728209714 | etot = -17.1464061004182 +527000 ekin = 2.52409384361546 | erot = 2.89851026515111 | epot = -22.7152196639493 | etot = -17.2926155551827 +528000 ekin = 2.5793534980762 | erot = 2.86931301300845 | epot = -22.7061100878872 | etot = -17.2574435768025 +529000 ekin = 2.54499132301732 | erot = 3.03033580941359 | epot = -22.6577883790845 | etot = -17.0824612466536 +530000 ekin = 2.37583920711473 | erot = 3.07767101681233 | epot = -22.5498147001084 | etot = -17.0963044761814 +531000 ekin = 2.28423424660353 | erot = 2.99538223189526 | epot = -22.4172244060315 | etot = -17.1376079275327 +532000 ekin = 2.1109280228991 | erot = 2.62650535715256 | epot = -22.2554156639846 | etot = -17.517982283933 +533000 ekin = 2.07823067751594 | erot = 2.60462012944303 | epot = -22.0829115643989 | etot = -17.4000607574399 +534000 ekin = 2.08976309920187 | erot = 2.60045035336435 | epot = -21.9117889556571 | etot = -17.2215755030909 +535000 ekin = 2.03320809614292 | erot = 2.53673993181132 | epot = -21.7263132935396 | etot = -17.1563652655854 +536000 ekin = 1.97106365765638 | erot = 2.35170112588149 | epot = -21.571809644199 | etot = -17.2490448606611 +537000 ekin = 1.85757994043342 | erot = 2.10009393160123 | epot = -21.4673782965335 | etot = -17.5097044244988 +538000 ekin = 1.82596102898874 | erot = 2.13846192719764 | epot = -21.398373431854 | etot = -17.4339504756676 +539000 ekin = 1.73881232516788 | erot = 2.4948493136435 | epot = -21.3425267679342 | etot = -17.1088651291228 +540000 ekin = 1.67447223010825 | erot = 2.77285924634643 | epot = -21.271659054413 | etot = -16.8243275779583 +541000 ekin = 1.69990418580809 | erot = 2.88110182550566 | epot = -21.1962442587827 | etot = -16.615238247469 +542000 ekin = 1.7111365749696 | erot = 2.75900359073003 | epot = -21.1355976616677 | etot = -16.665457495968 +543000 ekin = 1.78866852977452 | erot = 2.71660471692181 | epot = -21.0866732693155 | etot = -16.5814000226192 +544000 ekin = 1.77181782019774 | erot = 2.32877176942813 | epot = -21.0413457588297 | etot = -16.9407561692039 +545000 ekin = 1.7866779339122 | erot = 2.11448637898461 | epot = -21.0004042884457 | etot = -17.0992399755488 +546000 ekin = 1.85376909065287 | erot = 1.89612518110716 | epot = -20.9731062289206 | etot = -17.2232119571606 +547000 ekin = 1.88607623839212 | erot = 1.6712325505803 | epot = -20.9706093546519 | etot = -17.4133005656795 +548000 ekin = 1.90991638455396 | erot = 1.78815489997996 | epot = -20.9683934987357 | etot = -17.2703222142018 +549000 ekin = 1.93154736700941 | erot = 1.83109029837903 | epot = -20.9876899630384 | etot = -17.22505229765 +550000 ekin = 1.99815580980645 | erot = 1.56054958425452 | epot = -21.0360042320961 | etot = -17.4772988380352 +551000 ekin = 2.06223281194893 | erot = 1.82140531055406 | epot = -21.10997931596 | etot = -17.226341193457 +552000 ekin = 2.19995559126134 | erot = 1.93328987912251 | epot = -21.1805106953399 | etot = -17.0472652249561 +553000 ekin = 2.16476612655663 | erot = 2.18848299832304 | epot = -21.2339007238649 | etot = -16.8806515989852 +554000 ekin = 2.19253395809327 | erot = 1.99269602147233 | epot = -21.3216202633274 | etot = -17.1363902837618 +555000 ekin = 2.30423346281242 | erot = 1.75126691279982 | epot = -21.4340368938555 | etot = -17.3785365182433 +556000 ekin = 2.45212673301272 | erot = 2.39109930640492 | epot = -21.5725172133448 | etot = -16.7292911739272 +557000 ekin = 2.55511582944017 | erot = 2.60632466872841 | epot = -21.7241981903448 | etot = -16.5627576921762 +558000 ekin = 2.67318624692484 | erot = 2.43046608161984 | epot = -21.8811108747503 | etot = -16.7774585462056 +559000 ekin = 2.79102973560968 | erot = 2.67538733153562 | epot = -22.037855387448 | etot = -16.5714383203027 +560000 ekin = 2.9183792158121 | erot = 2.68572428538362 | epot = -22.1492797858931 | etot = -16.5451762846974 +561000 ekin = 2.81692468047697 | erot = 2.70423444900948 | epot = -22.216487219322 | etot = -16.6953280898356 +562000 ekin = 2.76503975841347 | erot = 2.53761848613789 | epot = -22.2442970633447 | etot = -16.9416388187934 +563000 ekin = 2.65825040724883 | erot = 2.71023439088357 | epot = -22.243221823098 | etot = -16.8747370249656 +564000 ekin = 2.64808423454302 | erot = 2.7031533075073 | epot = -22.2101649946185 | etot = -16.8589274525682 +565000 ekin = 2.56520347515872 | erot = 2.51222337320364 | epot = -22.1609166692024 | etot = -17.08348982084 +566000 ekin = 2.49797853328213 | erot = 1.95572936802152 | epot = -22.1122925054564 | etot = -17.6585846041527 +567000 ekin = 2.54792607074833 | erot = 1.85729033385336 | epot = -22.0797419433029 | etot = -17.6745255387012 +568000 ekin = 2.60591444007081 | erot = 1.83755900710587 | epot = -22.0644073196267 | etot = -17.6209338724501 +569000 ekin = 2.62362305667703 | erot = 2.09101698674206 | epot = -22.0262950849346 | etot = -17.3116550415156 +570000 ekin = 2.59966130338224 | erot = 1.8528357789039 | epot = -21.9852976772882 | etot = -17.5328005950021 +571000 ekin = 2.57696065480236 | erot = 2.10053443453254 | epot = -21.9714910967201 | etot = -17.2939960073852 +572000 ekin = 2.6199221152626 | erot = 2.3592960436722 | epot = -21.9659339101478 | etot = -16.986715751213 +573000 ekin = 2.80765379250703 | erot = 2.64066236878634 | epot = -21.9992362601246 | etot = -16.5509200988312 +574000 ekin = 2.77886407527571 | erot = 2.38672398638113 | epot = -22.0653999532901 | etot = -16.8998118916333 +575000 ekin = 2.68662185812297 | erot = 2.33286464853949 | epot = -22.1404382955663 | etot = -17.1209517889038 +576000 ekin = 2.71580008212145 | erot = 2.47248086928771 | epot = -22.2173146829094 | etot = -17.0290337315003 +577000 ekin = 2.7302158927818 | erot = 2.52068341312541 | epot = -22.2907564203192 | etot = -17.039857114412 +578000 ekin = 2.73054357573016 | erot = 2.55784953441613 | epot = -22.3560478485211 | etot = -17.0676547383748 +579000 ekin = 2.66821624836572 | erot = 2.41812757787305 | epot = -22.3944025993856 | etot = -17.3080587731468 +580000 ekin = 2.67666651361969 | erot = 2.37337561149781 | epot = -22.397039042447 | etot = -17.3469969173295 +581000 ekin = 2.50777332809615 | erot = 2.18045458374933 | epot = -22.3739113390257 | etot = -17.6856834271802 +582000 ekin = 2.40279105318935 | erot = 1.89859122534185 | epot = -22.3216073421081 | etot = -18.0202250635769 +583000 ekin = 2.31269263220149 | erot = 1.73074513088278 | epot = -22.2573140454874 | etot = -18.2138762824031 +584000 ekin = 2.21239433549753 | erot = 1.75290221167389 | epot = -22.2111149411394 | etot = -18.245818393968 +585000 ekin = 2.15356855038317 | erot = 1.75180079977016 | epot = -22.229356241441 | etot = -18.3239868912877 +586000 ekin = 2.10262413841983 | erot = 1.85113983993476 | epot = -22.2792098403955 | etot = -18.3254458620409 +587000 ekin = 2.13288374468826 | erot = 2.20890667221802 | epot = -22.3055082909211 | etot = -17.9637178740148 +588000 ekin = 2.14862689118336 | erot = 2.25138259268979 | epot = -22.2976262267036 | etot = -17.8976167428305 +589000 ekin = 2.04435421027859 | erot = 2.19255127415926 | epot = -22.2575972691454 | etot = -18.0206917847075 +590000 ekin = 1.97499579795968 | erot = 2.18955821954235 | epot = -22.1946880982516 | etot = -18.0301340807496 +591000 ekin = 1.91372986676051 | erot = 2.00143608804042 | epot = -22.0969708781104 | etot = -18.1818049233094 +592000 ekin = 1.90759584087294 | erot = 1.75955547353146 | epot = -22.0003759984159 | etot = -18.3332246840115 +593000 ekin = 1.85491418079517 | erot = 1.82471441354122 | epot = -21.8971191196321 | etot = -18.2174905252957 +594000 ekin = 1.80279616325907 | erot = 1.89197043010803 | epot = -21.7918103226298 | etot = -18.0970437292627 +595000 ekin = 1.73140057218467 | erot = 1.88940188632509 | epot = -21.6714819005053 | etot = -18.0506794419956 +596000 ekin = 1.66362739557022 | erot = 2.08459374164569 | epot = -21.5484728514112 | etot = -17.8002517141953 +597000 ekin = 1.58837419642024 | erot = 2.25218931046815 | epot = -21.4300614484294 | etot = -17.589497941541 +598000 ekin = 1.51530311364937 | erot = 2.10564447814208 | epot = -21.3454884805721 | etot = -17.7245408887807 +599000 ekin = 1.51205618459762 | erot = 2.59561573346759 | epot = -21.3001794349542 | etot = -17.192507516889 +600000 ekin = 1.42420860787937 | erot = 2.66872977571286 | epot = -21.2831261175835 | etot = -17.1901877339913 +601000 ekin = 1.41614052584482 | erot = 2.71409841098203 | epot = -21.2819425817443 | etot = -17.1517036449175 +602000 ekin = 1.39716919100115 | erot = 2.88098133874131 | epot = -21.2738817162066 | etot = -16.9957311864642 +603000 ekin = 1.35362959397705 | erot = 2.47699104027329 | epot = -21.2686606294832 | etot = -17.4380399952329 +604000 ekin = 1.30109941785313 | erot = 2.37915588297075 | epot = -21.2782162294354 | etot = -17.5979609286115 +605000 ekin = 1.33474102107266 | erot = 2.45818083278442 | epot = -21.3160026412609 | etot = -17.5230807874038 +606000 ekin = 1.29920725195382 | erot = 2.42086336903897 | epot = -21.3751929493918 | etot = -17.655122328399 +607000 ekin = 1.23411371003043 | erot = 2.51322970316868 | epot = -21.4519931649193 | etot = -17.7046497517202 +608000 ekin = 1.22186321044676 | erot = 2.5311041555214 | epot = -21.5178918639285 | etot = -17.7649244979604 +609000 ekin = 1.29545020421435 | erot = 2.63039876861612 | epot = -21.5664820555065 | etot = -17.6406330826761 +610000 ekin = 1.32833269788911 | erot = 2.69742481429433 | epot = -21.6042752567674 | etot = -17.5785177445839 +611000 ekin = 1.37555485576615 | erot = 2.44250786358881 | epot = -21.6325158720208 | etot = -17.8144531526659 +612000 ekin = 1.43492266332471 | erot = 2.48338158304032 | epot = -21.6301768868774 | etot = -17.7118726405124 +613000 ekin = 1.45874940730907 | erot = 2.24888080699412 | epot = -21.6206823260948 | etot = -17.9130521117916 +614000 ekin = 1.55936377690334 | erot = 2.20987492911103 | epot = -21.5983529263265 | etot = -17.8291142203122 +615000 ekin = 1.65618793567257 | erot = 2.06571861106629 | epot = -21.5839674847187 | etot = -17.8620609379798 +616000 ekin = 1.69323202132181 | erot = 2.4207923919525 | epot = -21.5767246732272 | etot = -17.4627002599529 +617000 ekin = 1.68010177617046 | erot = 2.37299975949563 | epot = -21.5796207721198 | etot = -17.5265192364537 +618000 ekin = 1.82463445029578 | erot = 2.21376210856707 | epot = -21.5858855133937 | etot = -17.5474889545309 +619000 ekin = 1.82457061205234 | erot = 2.1371769710369 | epot = -21.608601217417 | etot = -17.6468536343277 +620000 ekin = 1.90243298129558 | erot = 2.02639928769549 | epot = -21.6453403015349 | etot = -17.7165080325438 +621000 ekin = 2.0007105481323 | erot = 2.00740169333777 | epot = -21.6932983622015 | etot = -17.6851861207314 +622000 ekin = 2.06294983283403 | erot = 2.33338027747366 | epot = -21.747610545892 | etot = -17.3512804355843 +623000 ekin = 2.16886474013683 | erot = 2.34052136367666 | epot = -21.8030581053771 | etot = -17.2936720015636 +624000 ekin = 2.27472643943783 | erot = 2.06709867004471 | epot = -21.8339575931653 | etot = -17.4921324836828 +625000 ekin = 2.44743468020662 | erot = 1.92194449605304 | epot = -21.8528539423019 | etot = -17.4834747660422 +626000 ekin = 2.6254852196294 | erot = 1.89145499927505 | epot = -21.8798709040072 | etot = -17.3629306851027 +627000 ekin = 2.68150434400643 | erot = 2.0842888332754 | epot = -21.9107134797365 | etot = -17.1449203024547 +628000 ekin = 2.74903675678073 | erot = 1.99441751232753 | epot = -21.9473456387959 | etot = -17.2038913696877 +629000 ekin = 2.86146526790743 | erot = 1.88649666651194 | epot = -21.9845526009193 | etot = -17.2365906664999 +630000 ekin = 2.97219747359781 | erot = 1.94159826713921 | epot = -21.9956245597357 | etot = -17.0818288189987 +631000 ekin = 3.02655709138838 | erot = 1.98612431446979 | epot = -21.9867324807638 | etot = -16.9740510749056 +632000 ekin = 2.89242823961396 | erot = 2.07813215947651 | epot = -21.9871217882287 | etot = -17.0165613891382 +633000 ekin = 2.89559354591988 | erot = 2.04782477805542 | epot = -21.9766614082668 | etot = -17.0332430842915 +634000 ekin = 2.83247679377595 | erot = 2.13051755362208 | epot = -21.9597388170748 | etot = -16.9967444696767 +635000 ekin = 2.63710074800464 | erot = 2.23426349035993 | epot = -21.9715274348462 | etot = -17.1001631964816 +636000 ekin = 2.58412863450159 | erot = 2.48166310505774 | epot = -21.9758376025019 | etot = -16.9100458629426 +637000 ekin = 2.48413021154122 | erot = 3.05163678747143 | epot = -21.9559270975241 | etot = -16.4201600985115 +638000 ekin = 2.41845843253208 | erot = 3.18487359706662 | epot = -21.9218182691583 | etot = -16.3184862395596 +639000 ekin = 2.41474442997057 | erot = 3.07946799577796 | epot = -21.8601538104457 | etot = -16.3659413846972 +640000 ekin = 2.43888704755838 | erot = 3.19916726587376 | epot = -21.773260571449 | etot = -16.1352062580169 +641000 ekin = 2.33318464269148 | erot = 3.52964988306967 | epot = -21.6751385521709 | etot = -15.8123040264097 +642000 ekin = 2.29269127471833 | erot = 3.21459747812113 | epot = -21.5762475219901 | etot = -16.0689587691506 +643000 ekin = 2.2000927150324 | erot = 3.27121474420553 | epot = -21.4712567460628 | etot = -15.9999492868249 +644000 ekin = 2.12761393014637 | erot = 3.26891111731326 | epot = -21.3483627077497 | etot = -15.9518376602901 +645000 ekin = 2.14283359918393 | erot = 3.15969008283745 | epot = -21.2132518657603 | etot = -15.9107281837389 +646000 ekin = 2.06396314958936 | erot = 3.0937199947276 | epot = -21.1127434027894 | etot = -15.9550602584725 +647000 ekin = 2.09494506011006 | erot = 3.01853693183347 | epot = -21.0393545332665 | etot = -15.925872541323 +648000 ekin = 2.04196638106979 | erot = 2.9235470200276 | epot = -20.9985594175429 | etot = -16.0330460164456 +649000 ekin = 2.12312778485914 | erot = 2.76395475216335 | epot = -20.9701414537495 | etot = -16.083058916727 +650000 ekin = 2.10015809243625 | erot = 2.49008137666259 | epot = -20.9856777615303 | etot = -16.3954382924315 +651000 ekin = 2.17042975668772 | erot = 2.82094735385287 | epot = -21.0172459830262 | etot = -16.0258688724856 +652000 ekin = 2.09384051310247 | erot = 2.85582968797875 | epot = -21.0193054655956 | etot = -16.0696352645143 +653000 ekin = 2.04333185286073 | erot = 2.7789078304003 | epot = -21.0137769463715 | etot = -16.1915372631105 +654000 ekin = 2.08939824491288 | erot = 2.64655974106803 | epot = -20.9895202496122 | etot = -16.2535622636313 +655000 ekin = 2.04966047424265 | erot = 2.69502096883418 | epot = -20.9377501246659 | etot = -16.1930686815891 +656000 ekin = 2.01275055755516 | erot = 2.7954688131256 | epot = -20.8915125736499 | etot = -16.0832932029691 +657000 ekin = 2.03431712568968 | erot = 2.53773887631559 | epot = -20.8578047692318 | etot = -16.2857487672265 +658000 ekin = 2.0673538576767 | erot = 2.66675755014629 | epot = -20.8663643114319 | etot = -16.1322529036089 +659000 ekin = 2.06847583306457 | erot = 2.50326478566289 | epot = -20.8825165023748 | etot = -16.3107758836473 +660000 ekin = 2.07870932959682 | erot = 2.81447557231104 | epot = -20.9216042516442 | etot = -16.0284193497364 +661000 ekin = 2.19772022528386 | erot = 2.70676732599789 | epot = -20.955272489221 | etot = -16.0507849379392 +662000 ekin = 2.25232628384276 | erot = 2.75397596508084 | epot = -20.9799482828289 | etot = -15.9736460339053 +663000 ekin = 2.34038951099369 | erot = 2.81430750752421 | epot = -21.0068651854286 | etot = -15.8521681669107 +664000 ekin = 2.44930976235134 | erot = 2.91832446463371 | epot = -21.0209243921204 | etot = -15.6532901651354 +665000 ekin = 2.62422537382033 | erot = 3.05929629192749 | epot = -21.0148549044021 | etot = -15.3313332386542 +666000 ekin = 2.67000607831501 | erot = 3.11170707620175 | epot = -20.9818079036879 | etot = -15.2000947491711 +667000 ekin = 2.646914655505 | erot = 2.74197391498658 | epot = -20.9087124741424 | etot = -15.5198239036508 +668000 ekin = 2.62658511176452 | erot = 2.52395435462692 | epot = -20.7862996323554 | etot = -15.635760165964 +669000 ekin = 2.54613084896613 | erot = 2.35938084583991 | epot = -20.6443137124924 | etot = -15.7388020176863 +670000 ekin = 2.43931260869843 | erot = 2.38690789091365 | epot = -20.4714500069456 | etot = -15.6452295073335 +671000 ekin = 2.36289981273396 | erot = 2.15959347634236 | epot = -20.2658276701866 | etot = -15.7433343811103 +672000 ekin = 2.29106022746054 | erot = 2.06640999933942 | epot = -20.0256672427845 | etot = -15.6681970159846 +673000 ekin = 2.10231422621899 | erot = 1.9981861779267 | epot = -19.7891832406051 | etot = -15.6886828364594 +674000 ekin = 1.99734939649462 | erot = 1.85664304782852 | epot = -19.5650277424018 | etot = -15.7110352980787 +675000 ekin = 1.90857669053573 | erot = 1.65889203440048 | epot = -19.3811887348954 | etot = -15.8137200099592 +676000 ekin = 1.77298099338112 | erot = 1.83094376160153 | epot = -19.2510356435192 | etot = -15.6471108885365 +677000 ekin = 1.63736904978638 | erot = 1.99281479568097 | epot = -19.1448234704469 | etot = -15.5146396249795 +678000 ekin = 1.63864208730587 | erot = 2.08161035578926 | epot = -19.1055006884084 | etot = -15.3852482453133 +679000 ekin = 1.5528275154202 | erot = 2.3521751505234 | epot = -19.1160594043142 | etot = -15.2110567383706 +680000 ekin = 1.55994958081146 | erot = 2.581332640496 | epot = -19.1875667436096 | etot = -15.0462845223021 +681000 ekin = 1.47247027591493 | erot = 2.65144156511814 | epot = -19.2708019300332 | etot = -15.1468900890001 +682000 ekin = 1.5050631291314 | erot = 2.58308917381125 | epot = -19.376855112331 | etot = -15.2887028093883 +683000 ekin = 1.58124836058866 | erot = 2.16095218888017 | epot = -19.4911476852364 | etot = -15.7489471357676 +684000 ekin = 1.60010059600002 | erot = 2.67440743177681 | epot = -19.6181338883197 | etot = -15.3436258605429 +685000 ekin = 1.74893549928195 | erot = 2.6245807347796 | epot = -19.7359660896836 | etot = -15.362449855622 +686000 ekin = 1.76162153341746 | erot = 2.25978530691208 | epot = -19.8541116154906 | etot = -15.8327047751611 +687000 ekin = 1.82619229946474 | erot = 2.29432044590946 | epot = -19.9622292318976 | etot = -15.8417164865234 +688000 ekin = 1.86359828413875 | erot = 2.16944371769556 | epot = -20.0476865748926 | etot = -16.0146445730583 +689000 ekin = 1.93393905859066 | erot = 2.35498206852848 | epot = -20.1007195797137 | etot = -15.8117984525945 +690000 ekin = 1.97584813479927 | erot = 2.24522756497964 | epot = -20.1288568750727 | etot = -15.9077811752937 +691000 ekin = 1.98048868486388 | erot = 2.14627975778132 | epot = -20.1381110985234 | etot = -16.0113426558782 +692000 ekin = 2.07313460019169 | erot = 1.9800884819351 | epot = -20.1378652364601 | etot = -16.0846421543333 +693000 ekin = 2.19190306917338 | erot = 1.58910242480116 | epot = -20.1350957523476 | etot = -16.354090258373 +694000 ekin = 2.32090880385012 | erot = 1.61295927134746 | epot = -20.1314162689194 | etot = -16.1975481937218 +695000 ekin = 2.36874640002722 | erot = 1.59056066666412 | epot = -20.1380145179387 | etot = -16.1787074512473 +696000 ekin = 2.44650937280268 | erot = 1.81535925455471 | epot = -20.1652369679569 | etot = -15.9033683405995 +697000 ekin = 2.51545709816391 | erot = 1.68826010240614 | epot = -20.2135933592978 | etot = -16.0098761587277 +698000 ekin = 2.62928708586012 | erot = 1.96628199836561 | epot = -20.2928804390014 | etot = -15.6973113547757 +699000 ekin = 2.71719696170785 | erot = 2.26885524041395 | epot = -20.3980545329773 | etot = -15.4120023308555 +700000 ekin = 2.87208259001893 | erot = 2.42835298004853 | epot = -20.5178291857199 | etot = -15.2173936156525 +701000 ekin = 2.9590025941786 | erot = 2.35931389631763 | epot = -20.6419240268714 | etot = -15.3236075363752 +702000 ekin = 3.02090269085831 | erot = 2.15074914986673 | epot = -20.7704027073323 | etot = -15.5987508666073 +703000 ekin = 2.97785017762421 | erot = 2.21426045315814 | epot = -20.8971176595447 | etot = -15.7050070287624 +704000 ekin = 2.95736377946439 | erot = 2.20998660273223 | epot = -21.0054958631765 | etot = -15.8381454809799 +705000 ekin = 2.86750561874093 | erot = 2.27820994963668 | epot = -21.0805981580102 | etot = -15.9348825896326 +706000 ekin = 2.78753231022087 | erot = 2.27865200108174 | epot = -21.1291811901197 | etot = -16.0629968788171 +707000 ekin = 2.8221544757383 | erot = 2.35221981249493 | epot = -21.1609961465456 | etot = -15.9866218583124 +708000 ekin = 2.82884823815726 | erot = 2.35861511414888 | epot = -21.1686473578681 | etot = -15.981184005562 +709000 ekin = 2.83366981825964 | erot = 2.36573692196793 | epot = -21.1360090124618 | etot = -15.9366022722343 +710000 ekin = 2.82063152616528 | erot = 2.46614987505483 | epot = -21.084135790447 | etot = -15.7973543892268 +711000 ekin = 2.86012277832215 | erot = 2.45669685378257 | epot = -21.0284124029734 | etot = -15.7115927708687 +712000 ekin = 2.8390063227991 | erot = 2.58641728570271 | epot = -20.9774953745403 | etot = -15.5520717660385 +713000 ekin = 2.81285265683925 | erot = 2.77009227835482 | epot = -20.9479708753284 | etot = -15.3650259401343 +714000 ekin = 2.79476769474643 | erot = 2.56608145301021 | epot = -20.9660227808507 | etot = -15.6051736330941 +715000 ekin = 2.88214044419472 | erot = 2.35359704421368 | epot = -21.0023890888566 | etot = -15.7666516004482 +716000 ekin = 2.80624441075242 | erot = 2.44602402366733 | epot = -21.064339930078 | etot = -15.8120714956583 +717000 ekin = 2.83593496475382 | erot = 1.92271233473076 | epot = -21.1419339045501 | etot = -16.3832866050655 +718000 ekin = 3.04347220736757 | erot = 2.09664480466669 | epot = -21.2307953497154 | etot = -16.0906783376812 +719000 ekin = 3.12566385858553 | erot = 1.94969815384692 | epot = -21.3369127599923 | etot = -16.2615507475599 +720000 ekin = 3.09860713118153 | erot = 1.90387725838985 | epot = -21.4309432046991 | etot = -16.4284588151277 +721000 ekin = 3.12993031147993 | erot = 1.75974471708504 | epot = -21.493414783552 | etot = -16.6037397549871 +722000 ekin = 3.20199415669038 | erot = 1.70619449649603 | epot = -21.5365621621193 | etot = -16.6283735089329 +723000 ekin = 3.2399616527217 | erot = 1.89914229033975 | epot = -21.5885170205206 | etot = -16.4494130774592 +724000 ekin = 3.23853046611197 | erot = 2.03882621849445 | epot = -21.6296558315722 | etot = -16.3522991469658 +725000 ekin = 3.28185949262397 | erot = 2.3703066317188 | epot = -21.6824484616651 | etot = -16.0302823373224 +726000 ekin = 3.25580607632146 | erot = 2.39086109621911 | epot = -21.717756538354 | etot = -16.0710893658134 +727000 ekin = 3.1980522899894 | erot = 2.32087178780801 | epot = -21.7371075347418 | etot = -16.2181834569444 +728000 ekin = 3.15990197080378 | erot = 2.25349819703047 | epot = -21.7242195216855 | etot = -16.3108193538513 +729000 ekin = 3.1567654024144 | erot = 2.43628064604815 | epot = -21.6874540329219 | etot = -16.0944079844593 +730000 ekin = 3.09116846008049 | erot = 2.25419507427888 | epot = -21.6463691748061 | etot = -16.3010056404467 +731000 ekin = 3.13482605258299 | erot = 2.37233499175372 | epot = -21.6178854848953 | etot = -16.1107244405586 +732000 ekin = 2.99746260909709 | erot = 2.05794797450101 | epot = -21.6100718510639 | etot = -16.5546612674658 +733000 ekin = 2.96980729498492 | erot = 2.41656769534058 | epot = -21.6212858194822 | etot = -16.2349108291567 +734000 ekin = 2.95805172881175 | erot = 2.41106090291006 | epot = -21.6442325736442 | etot = -16.2751199419224 +735000 ekin = 2.9891264560767 | erot = 2.56433748906662 | epot = -21.6552350758765 | etot = -16.1017711307332 +736000 ekin = 2.98402840956487 | erot = 2.50919943020275 | epot = -21.6382057820194 | etot = -16.1449779422518 +737000 ekin = 2.93444255324145 | erot = 2.46509691619813 | epot = -21.606907547211 | etot = -16.2073680777714 +738000 ekin = 2.92304716734017 | erot = 2.3908682646107 | epot = -21.5785523296152 | etot = -16.2646368976643 +739000 ekin = 2.87558559566485 | erot = 2.33418319756081 | epot = -21.5767003124475 | etot = -16.3669315192218 +740000 ekin = 2.83334180172253 | erot = 1.96595420169415 | epot = -21.5790601467372 | etot = -16.7797641433205 +741000 ekin = 2.90514747722405 | erot = 1.9006428025971 | epot = -21.5882717938206 | etot = -16.7824815139994 +742000 ekin = 2.94949674447573 | erot = 2.1048120766183 | epot = -21.6073581142244 | etot = -16.5530492931303 +743000 ekin = 3.04809185048074 | erot = 2.29122955891137 | epot = -21.621784420587 | etot = -16.2824630111949 +744000 ekin = 2.98636530702449 | erot = 2.18551221916311 | epot = -21.6006673772006 | etot = -16.428789851013 +745000 ekin = 2.92324621087507 | erot = 2.67370319519972 | epot = -21.5479250866168 | etot = -15.950975680542 +746000 ekin = 2.81108840832449 | erot = 2.60039332109235 | epot = -21.4880495112526 | etot = -16.0765677818358 +747000 ekin = 2.67991382739574 | erot = 2.55252994490165 | epot = -21.4304230755336 | etot = -16.1979793032362 +748000 ekin = 2.53045428101843 | erot = 2.2495073629404 | epot = -21.3737230667376 | etot = -16.5937614227788 +749000 ekin = 2.4521893183738 | erot = 2.14663919598189 | epot = -21.3068166295675 | etot = -16.7079881152118 +750000 ekin = 2.43997409031382 | erot = 2.12137765598068 | epot = -21.2605139231808 | etot = -16.6991621768863 +751000 ekin = 2.39722500832658 | erot = 1.84714049259511 | epot = -21.224520454873 | etot = -16.9801549539513 +752000 ekin = 2.37942582094574 | erot = 1.94578907645454 | epot = -21.2018614145335 | etot = -16.8766465171332 +753000 ekin = 2.28406990648596 | erot = 2.197225255846 | epot = -21.2075024607037 | etot = -16.7262072983717 +754000 ekin = 2.17408286982644 | erot = 2.09839079215051 | epot = -21.2133775747239 | etot = -16.940903912747 +755000 ekin = 2.20136426888663 | erot = 2.2406707957933 | epot = -21.2335060459118 | etot = -16.7914709812319 +756000 ekin = 2.1284426091314 | erot = 2.75005545693648 | epot = -21.2581599852216 | etot = -16.3796619191537 +757000 ekin = 2.25743819675579 | erot = 2.52018349756316 | epot = -21.2980084121414 | etot = -16.5203867178225 +758000 ekin = 2.27601870393359 | erot = 2.5755921466063 | epot = -21.3386893542482 | etot = -16.4870785037083 +759000 ekin = 2.36164379748129 | erot = 2.34149147167517 | epot = -21.3861537164023 | etot = -16.6830184472459 +760000 ekin = 2.46751181779574 | erot = 2.29440108117585 | epot = -21.4502954100428 | etot = -16.6883825110713 +761000 ekin = 2.56117979243454 | erot = 2.28528133130908 | epot = -21.5440902713619 | etot = -16.6976291476183 +762000 ekin = 2.73403817269076 | erot = 2.05037676089394 | epot = -21.6655284682356 | etot = -16.881113534651 +763000 ekin = 2.89028863280026 | erot = 1.96997057412364 | epot = -21.7985105959422 | etot = -16.9382513890183 +764000 ekin = 3.07961097461013 | erot = 1.90337686517649 | epot = -21.9231959994997 | etot = -16.9402081597131 +765000 ekin = 3.10823123780442 | erot = 1.87663540264887 | epot = -22.0019892323023 | etot = -17.017122591849 +766000 ekin = 3.06909048295622 | erot = 2.19611166095449 | epot = -22.0456827970015 | etot = -16.7804806530908 +767000 ekin = 2.95314668625032 | erot = 2.25238187251628 | epot = -22.0265415483729 | etot = -16.8210129896063 +768000 ekin = 2.82146820632435 | erot = 2.14933629194888 | epot = -21.9729916913491 | etot = -17.0021871930759 +769000 ekin = 2.77603784528996 | erot = 1.90506312419816 | epot = -21.892293283993 | etot = -17.2111923145049 +770000 ekin = 2.78938661934792 | erot = 1.68105737595288 | epot = -21.799863534568 | etot = -17.3294195392672 +771000 ekin = 2.69423677840416 | erot = 1.66016415121808 | epot = -21.7233415289995 | etot = -17.3689405993773 +772000 ekin = 2.47513570113015 | erot = 1.55323249560273 | epot = -21.6442608053663 | etot = -17.6158926086334 +773000 ekin = 2.31141180852011 | erot = 1.521177135233 | epot = -21.5669030975225 | etot = -17.7343141537694 +774000 ekin = 2.17520959919718 | erot = 1.42853024205637 | epot = -21.5199609482921 | etot = -17.9162211070385 +775000 ekin = 2.04944703670454 | erot = 1.48494648755665 | epot = -21.528093327263 | etot = -17.9936998030018 +776000 ekin = 1.92108310791733 | erot = 1.66205812928448 | epot = -21.5590874070444 | etot = -17.9759461698426 +777000 ekin = 1.71219857932787 | erot = 1.81255070842967 | epot = -21.5756405048093 | etot = -18.0508912170518 +778000 ekin = 1.64975190369133 | erot = 1.77693127539902 | epot = -21.6017623261212 | etot = -18.1750791470308 +779000 ekin = 1.48106773483733 | erot = 1.73996737730546 | epot = -21.6271500213887 | etot = -18.4061149092459 +780000 ekin = 1.421154751897 | erot = 1.92486733092772 | epot = -21.6544636605777 | etot = -18.308441577753 +781000 ekin = 1.45929388158655 | erot = 2.37782097649985 | epot = -21.6537823170126 | etot = -17.8166674589262 +782000 ekin = 1.41005089049943 | erot = 2.64330507296429 | epot = -21.6242214819651 | etot = -17.5708655185014 +783000 ekin = 1.48665806788364 | erot = 2.2551551458972 | epot = -21.6087091715117 | etot = -17.8668959577309 +784000 ekin = 1.51747380423291 | erot = 1.88850072498565 | epot = -21.5108011603796 | etot = -18.104826631161 +785000 ekin = 1.54947682048269 | erot = 1.86706119579391 | epot = -21.3875221209817 | etot = -17.9709841047051 +786000 ekin = 1.54716158992394 | erot = 1.85630977678419 | epot = -21.2539376526403 | etot = -17.8504662859322 +787000 ekin = 1.62670511458663 | erot = 1.68010954051076 | epot = -21.1236984428165 | etot = -17.8168837877191 +788000 ekin = 1.71061295763359 | erot = 1.48079461940025 | epot = -21.0260161605707 | etot = -17.8346085835368 +789000 ekin = 1.75916840317588 | erot = 1.50945935318381 | epot = -21.0009620101458 | etot = -17.7323342537861 +790000 ekin = 1.8174567271449 | erot = 1.42634706359387 | epot = -20.9943086861151 | etot = -17.7505048953764 +791000 ekin = 1.94362771134128 | erot = 1.56573593007327 | epot = -21.0261698907268 | etot = -17.5168062493123 +792000 ekin = 2.04975276454239 | erot = 1.57988802147767 | epot = -21.0770336678104 | etot = -17.4473928817903 +793000 ekin = 2.17271315800351 | erot = 1.66062406864789 | epot = -21.1162570840036 | etot = -17.2829198573522 +794000 ekin = 2.13334157803654 | erot = 1.76445873405416 | epot = -21.1513206879656 | etot = -17.2535203758749 +795000 ekin = 2.13601408983627 | erot = 1.8111607883192 | epot = -21.1807545548915 | etot = -17.233579676736 +796000 ekin = 2.17221625803756 | erot = 1.84884046113895 | epot = -21.2058704683363 | etot = -17.1848137491598 +797000 ekin = 2.14637210530451 | erot = 2.21749811105555 | epot = -21.2529195044657 | etot = -16.8890492881057 +798000 ekin = 2.1595764262584 | erot = 2.29275394485819 | epot = -21.2708923889551 | etot = -16.8185620178386 +799000 ekin = 2.08753769092936 | erot = 2.48223892350034 | epot = -21.2988770573756 | etot = -16.7291004429459 +800000 ekin = 2.10166063621261 | erot = 2.30451589147721 | epot = -21.3357063804168 | etot = -16.929529852727 +801000 ekin = 1.98982068448267 | erot = 2.31496031357917 | epot = -21.3630439256795 | etot = -17.0582629276177 +802000 ekin = 1.88852653962923 | erot = 2.53585639899759 | epot = -21.4221529007417 | etot = -16.9977699621148 +803000 ekin = 1.864948997027 | erot = 2.51258933602245 | epot = -21.5138216867267 | etot = -17.1362833536772 +804000 ekin = 1.83485043700218 | erot = 2.73777283234846 | epot = -21.6067538814712 | etot = -17.0341306121205 +805000 ekin = 1.89569263744108 | erot = 2.82042555409451 | epot = -21.7141010846681 | etot = -16.9979828931325 +806000 ekin = 2.0359895439272 | erot = 2.98358468485799 | epot = -21.8550274116345 | etot = -16.8354531828493 +807000 ekin = 2.09814069227237 | erot = 2.81323193536483 | epot = -21.982732578034 | etot = -17.0713599503968 +808000 ekin = 2.11462770272961 | erot = 2.49693470536654 | epot = -22.0688650799844 | etot = -17.4573026718882 +809000 ekin = 2.13890385092021 | erot = 2.65117639911353 | epot = -22.1082573604103 | etot = -17.3181771103766 +810000 ekin = 2.15577455258838 | erot = 2.56739189056116 | epot = -22.0870651879662 | etot = -17.3638987448167 +811000 ekin = 2.17521477004717 | erot = 2.59273676449839 | epot = -22.0068576171896 | etot = -17.2389060826441 +812000 ekin = 2.21382110826674 | erot = 2.28331903732698 | epot = -21.9221481456803 | etot = -17.4250080000866 +813000 ekin = 2.23606377538011 | erot = 2.06676286322574 | epot = -21.8452254459267 | etot = -17.5423988073208 +814000 ekin = 2.31218669650381 | erot = 2.21982956647001 | epot = -21.7734705593994 | etot = -17.2414542964256 +815000 ekin = 2.26166132057918 | erot = 2.05343829873186 | epot = -21.7104605671137 | etot = -17.3953609478027 +816000 ekin = 2.29922240841952 | erot = 1.78921729996983 | epot = -21.673177295008 | etot = -17.5847375866187 +817000 ekin = 2.2854665071831 | erot = 1.7599434175785 | epot = -21.6545632782239 | etot = -17.6091533534623 +818000 ekin = 2.21513678285481 | erot = 1.78656435337603 | epot = -21.6636032884049 | etot = -17.6619021521741 +819000 ekin = 2.27391440988989 | erot = 1.82930333148455 | epot = -21.7137466609637 | etot = -17.6105289195893 +820000 ekin = 2.24282091294454 | erot = 1.73998445300775 | epot = -21.8023021191166 | etot = -17.8194967531643 +821000 ekin = 2.19192382316403 | erot = 2.0989386313738 | epot = -21.9355239556901 | etot = -17.6446615011523 +822000 ekin = 2.231078749125 | erot = 2.41397800350102 | epot = -22.0937718271944 | etot = -17.4487150745684 +823000 ekin = 2.18728871634505 | erot = 2.89300153500215 | epot = -22.2549565567124 | etot = -17.1746663053652 +824000 ekin = 2.09269007791821 | erot = 3.32774437375283 | epot = -22.4116674984377 | etot = -16.9912330467666 +825000 ekin = 2.02686183028597 | erot = 3.16127293746735 | epot = -22.5058824787882 | etot = -17.3177477110349 +826000 ekin = 2.03054435558016 | erot = 3.10016450783391 | epot = -22.5168374475926 | etot = -17.3861285841785 +827000 ekin = 2.0145241039294 | erot = 2.84123064216301 | epot = -22.4710810828114 | etot = -17.615326336719 +828000 ekin = 1.90238312904223 | erot = 2.71042154497583 | epot = -22.3794911074955 | etot = -17.7666864334774 +829000 ekin = 1.90418220366947 | erot = 2.69477669052598 | epot = -22.2643157201658 | etot = -17.6653568259704 +830000 ekin = 1.81997341684319 | erot = 2.5447850574763 | epot = -22.1272898430371 | etot = -17.7625313687176 +831000 ekin = 1.83168283006275 | erot = 2.11677888813413 | epot = -22.0163067804204 | etot = -18.0678450622236 +832000 ekin = 1.95186197623527 | erot = 2.17410981396393 | epot = -21.9377902835798 | etot = -17.8118184933806 +833000 ekin = 2.02730820338456 | erot = 1.91567543746849 | epot = -21.8853858637296 | etot = -17.9424022228766 +834000 ekin = 2.14966587630706 | erot = 1.87948738398703 | epot = -21.8918169629541 | etot = -17.8626637026601 +835000 ekin = 2.11991706021007 | erot = 1.80545414551881 | epot = -21.9417230794068 | etot = -18.016351873678 +836000 ekin = 2.16450787990255 | erot = 1.56947066595273 | epot = -22.0176370617292 | etot = -18.2836585158739 +837000 ekin = 2.22942308740213 | erot = 1.72466381535966 | epot = -22.0834662658142 | etot = -18.1293793630524 +838000 ekin = 2.33805060269866 | erot = 2.18496998632888 | epot = -22.1577664107317 | etot = -17.6347458217042 +839000 ekin = 2.4577627051558 | erot = 2.34137207492887 | epot = -22.2345011792195 | etot = -17.4353663991348 +840000 ekin = 2.4408859701061 | erot = 2.20193516257624 | epot = -22.3102615213262 | etot = -17.6674403886438 +841000 ekin = 2.52217561151239 | erot = 2.11119786335641 | epot = -22.4106870083823 | etot = -17.7773135335135 +842000 ekin = 2.53177717032708 | erot = 2.03329546380491 | epot = -22.5051884058713 | etot = -17.9401157717393 +843000 ekin = 2.46981084627163 | erot = 2.26208096486898 | epot = -22.6073969437417 | etot = -17.8755051326011 +844000 ekin = 2.53343392638537 | erot = 2.26231111168032 | epot = -22.6930988517866 | etot = -17.8973538137209 +845000 ekin = 2.55237006837693 | erot = 2.51402635295012 | epot = -22.7449813491075 | etot = -17.6785849277805 +846000 ekin = 2.43591378572747 | erot = 2.18244993014987 | epot = -22.7598171984303 | etot = -18.1414534825529 +847000 ekin = 2.47489280739527 | erot = 2.44850012169225 | epot = -22.7352494455244 | etot = -17.8118565164369 +848000 ekin = 2.56433574545226 | erot = 2.34872816436964 | epot = -22.6736999531278 | etot = -17.7606360433059 +849000 ekin = 2.59586448024853 | erot = 2.2652949780479 | epot = -22.5710185702837 | etot = -17.7098591119873 +850000 ekin = 2.49039613324366 | erot = 2.08374957064521 | epot = -22.4628543871474 | etot = -17.8887086832586 +851000 ekin = 2.48848828005073 | erot = 2.1504397370545 | epot = -22.3616397400165 | etot = -17.7227117229112 +852000 ekin = 2.50477194373625 | erot = 2.31551148311429 | epot = -22.2794107361279 | etot = -17.4591273092774 +853000 ekin = 2.48988722576781 | erot = 2.37905944195178 | epot = -22.2174467488413 | etot = -17.3485000811217 +854000 ekin = 2.48068473577069 | erot = 2.18215338513721 | epot = -22.1954265386904 | etot = -17.5325884177825 +855000 ekin = 2.36041825080301 | erot = 2.14907471345967 | epot = -22.229814016814 | etot = -17.7203210525513 +856000 ekin = 2.41735820368112 | erot = 2.28663399372954 | epot = -22.3010603003025 | etot = -17.5970681028918 +857000 ekin = 2.30380534498035 | erot = 2.28079843394969 | epot = -22.3899957816153 | etot = -17.8053920026852 +858000 ekin = 2.32374915951128 | erot = 2.52586913415202 | epot = -22.4777730735044 | etot = -17.6281547798411 +859000 ekin = 2.36194825640362 | erot = 2.27489572175793 | epot = -22.5497050266214 | etot = -17.9128610484599 +860000 ekin = 2.29676205732791 | erot = 2.83889891466404 | epot = -22.6025698957187 | etot = -17.4669089237267 +861000 ekin = 2.2116102131386 | erot = 2.99481322410894 | epot = -22.629924563885 | etot = -17.4235011266375 +862000 ekin = 2.2183818372621 | erot = 3.2500051060616 | epot = -22.6168976032126 | etot = -17.1485106598888 +863000 ekin = 2.13571465170696 | erot = 3.00165601774444 | epot = -22.5766345837817 | etot = -17.4392639143303 +864000 ekin = 2.17821492819518 | erot = 3.24144192927487 | epot = -22.5094500698139 | etot = -17.0897932123439 +865000 ekin = 2.12870821452427 | erot = 3.22322665201242 | epot = -22.4134082795113 | etot = -17.0614734129746 +866000 ekin = 2.03423896587968 | erot = 2.41447107774416 | epot = -22.3090528921738 | etot = -17.8603428485499 +867000 ekin = 1.97183886889137 | erot = 2.48184160436842 | epot = -22.2021182647476 | etot = -17.7484377914878 +868000 ekin = 1.91308044020404 | erot = 2.24650208042639 | epot = -22.1047137256861 | etot = -17.9451312050556 +869000 ekin = 1.86185635878425 | erot = 2.19298136311335 | epot = -22.0509375705499 | etot = -17.9960998486523 +870000 ekin = 1.75992459606837 | erot = 2.27547409061146 | epot = -22.0117595888703 | etot = -17.9763609021905 +871000 ekin = 1.72178818046697 | erot = 1.96572150785531 | epot = -21.9802199744919 | etot = -18.2927102861696 +872000 ekin = 1.66903556580781 | erot = 1.93794167823874 | epot = -21.9603990023827 | etot = -18.3534217583362 +873000 ekin = 1.64894346626438 | erot = 1.88450940280994 | epot = -21.9681555430983 | etot = -18.434702674024 +874000 ekin = 1.57135406761308 | erot = 1.94741453396443 | epot = -21.9765853859781 | etot = -18.4578167844006 +875000 ekin = 1.59516741268916 | erot = 2.2315729779776 | epot = -21.9920927279222 | etot = -18.1653523372555 +876000 ekin = 1.50206798403357 | erot = 2.57780068625255 | epot = -22.0050475608075 | etot = -17.9251788905214 +877000 ekin = 1.52015373136843 | erot = 2.2843716369875 | epot = -22.0218254393279 | etot = -18.217300070972 +878000 ekin = 1.53387227783115 | erot = 2.27517376879632 | epot = -22.0464155341917 | etot = -18.2373694875642 +879000 ekin = 1.55669077534447 | erot = 2.3756587781102 | epot = -22.062973657109 | etot = -18.1306241036543 +880000 ekin = 1.60508011630073 | erot = 2.26195551636665 | epot = -22.0724613924584 | etot = -18.205425759791 +881000 ekin = 1.6255817800637 | erot = 2.31792675005685 | epot = -22.0658818657201 | etot = -18.1223733355995 +882000 ekin = 1.61449109588179 | erot = 2.44866007965501 | epot = -22.0469024278369 | etot = -17.9837512523001 +883000 ekin = 1.63091904235009 | erot = 2.18398402433298 | epot = -22.0252651066255 | etot = -18.2103620399425 +884000 ekin = 1.69681929338606 | erot = 2.21165212418229 | epot = -21.974538546393 | etot = -18.0660671288247 +885000 ekin = 1.75683241806792 | erot = 2.08331167107024 | epot = -21.8927725348209 | etot = -18.0526284456827 +886000 ekin = 1.75713708681646 | erot = 1.80115910431459 | epot = -21.826515750348 | etot = -18.268219559217 +887000 ekin = 1.84458649763984 | erot = 1.66553699702637 | epot = -21.7661815209402 | etot = -18.256058026274 +888000 ekin = 1.88680036415698 | erot = 1.72065200162268 | epot = -21.7110459690317 | etot = -18.1035936032521 +889000 ekin = 1.92232221960089 | erot = 1.56101057590113 | epot = -21.6536565424971 | etot = -18.1703237469951 +890000 ekin = 2.022841033779 | erot = 1.31029028744447 | epot = -21.5930522300752 | etot = -18.2599209088518 +891000 ekin = 2.02442701619092 | erot = 1.42067034503705 | epot = -21.5472191599557 | etot = -18.1021217987277 +892000 ekin = 2.03626775806652 | erot = 1.66316771076554 | epot = -21.5129190017506 | etot = -17.8134835329186 +893000 ekin = 2.05186124624806 | erot = 1.5752716113925 | epot = -21.4921943128918 | etot = -17.8650614552512 +894000 ekin = 2.09965074001054 | erot = 1.56560345394424 | epot = -21.4743969884815 | etot = -17.8091427945267 +895000 ekin = 2.16252772919142 | erot = 1.54647539834669 | epot = -21.4549689326413 | etot = -17.7459658051031 +896000 ekin = 2.10489706554183 | erot = 1.78263133107129 | epot = -21.4330314423343 | etot = -17.5455030457212 +897000 ekin = 2.15073147494821 | erot = 1.74536300046879 | epot = -21.4239119831847 | etot = -17.5278175077677 +898000 ekin = 2.21697995910577 | erot = 2.0697876586941 | epot = -21.4471718071731 | etot = -17.1604041893732 +899000 ekin = 2.33779396143598 | erot = 2.00733840871183 | epot = -21.4839889813096 | etot = -17.1388566111618 +900000 ekin = 2.41597591914443 | erot = 1.85133754557128 | epot = -21.5274273367608 | etot = -17.2601138720451 +901000 ekin = 2.52644082939946 | erot = 2.19280268194132 | epot = -21.5756266105074 | etot = -16.8563830991666 +902000 ekin = 2.51043073712952 | erot = 1.85686816359505 | epot = -21.6063552107204 | etot = -17.2390563099959 +903000 ekin = 2.6254801850032 | erot = 1.94554509677337 | epot = -21.6466830430368 | etot = -17.0756577612602 +904000 ekin = 2.68604865641952 | erot = 1.82230313014683 | epot = -21.7065646613497 | etot = -17.1982128747834 +905000 ekin = 2.83060251059713 | erot = 2.01697139484873 | epot = -21.7613929111655 | etot = -16.9138190057197 +906000 ekin = 2.94848642766326 | erot = 1.99957930227816 | epot = -21.7999060542926 | etot = -16.8518403243511 +907000 ekin = 2.88672419291329 | erot = 2.19624352905733 | epot = -21.8240702621865 | etot = -16.7411025402159 +908000 ekin = 2.91368680910739 | erot = 2.27525981289754 | epot = -21.8626935205284 | etot = -16.6737468985235 +909000 ekin = 3.0399311133842 | erot = 2.4181338660187 | epot = -21.8797361081397 | etot = -16.4216711287368 +910000 ekin = 3.02111394144684 | erot = 2.25653445757737 | epot = -21.8869501318906 | etot = -16.6093017328664 +911000 ekin = 2.99074440602977 | erot = 2.42571768981063 | epot = -21.8911591932149 | etot = -16.4746970973745 +912000 ekin = 2.9388350389882 | erot = 2.54048734112232 | epot = -21.8943632676177 | etot = -16.4150408875072 +913000 ekin = 2.88155815219754 | erot = 2.43333021308748 | epot = -21.8712405715108 | etot = -16.5563522062257 +914000 ekin = 2.78298688987958 | erot = 2.69976035391025 | epot = -21.8286041753386 | etot = -16.3458569315488 +915000 ekin = 2.7514400944916 | erot = 2.66679831130742 | epot = -21.7506323099744 | etot = -16.3323939041754 +916000 ekin = 2.72328856812533 | erot = 2.53216922557983 | epot = -21.6421731788437 | etot = -16.3867153851385 +917000 ekin = 2.69768821710611 | erot = 2.47439052917339 | epot = -21.5733596386745 | etot = -16.401280892395 +918000 ekin = 2.66995818672158 | erot = 2.09882686301133 | epot = -21.5521619505363 | etot = -16.7833769008034 +919000 ekin = 2.61716147205238 | erot = 2.17918504384224 | epot = -21.5346780530114 | etot = -16.7383315371168 +920000 ekin = 2.4752636050952 | erot = 2.51685127690442 | epot = -21.4991402053986 | etot = -16.507025323399 +921000 ekin = 2.47056876817998 | erot = 2.49255863309435 | epot = -21.4619591744662 | etot = -16.4988317731919 +922000 ekin = 2.58423659960655 | erot = 2.61648914398982 | epot = -21.4156116153633 | etot = -16.2148858717669 +923000 ekin = 2.49375353890865 | erot = 2.67153957254788 | epot = -21.4001146688765 | etot = -16.2348215574199 +924000 ekin = 2.44602138611864 | erot = 2.6849871570182 | epot = -21.4057397221907 | etot = -16.2747311790539 +925000 ekin = 2.40338846624006 | erot = 3.00424602709663 | epot = -21.4434811046204 | etot = -16.0358466112837 +926000 ekin = 2.47488592872435 | erot = 3.17529768125875 | epot = -21.5232565657781 | etot = -15.873072955795 +927000 ekin = 2.40301595960232 | erot = 3.17662851484981 | epot = -21.6300583966372 | etot = -16.050413922185 +928000 ekin = 2.44990005675411 | erot = 3.45632999664445 | epot = -21.7790682902906 | etot = -15.872838236892 +929000 ekin = 2.56646836803309 | erot = 3.14534753938437 | epot = -21.9043533033891 | etot = -16.1925373959717 +930000 ekin = 2.53471244466888 | erot = 3.3457187787957 | epot = -21.9769628203937 | etot = -16.0965315969291 +931000 ekin = 2.50104812028235 | erot = 3.03046410574105 | epot = -22.0056915593073 | etot = -16.4741793332839 +932000 ekin = 2.49568433462376 | erot = 2.88794958693756 | epot = -21.9962407011233 | etot = -16.612606779562 +933000 ekin = 2.38321005751951 | erot = 2.81796519585765 | epot = -21.9635224592426 | etot = -16.7623472058655 +934000 ekin = 2.46317933029144 | erot = 2.48085702084566 | epot = -21.9076116702184 | etot = -16.9635753190813 +935000 ekin = 2.494042694389 | erot = 2.26805014218364 | epot = -21.8352758876529 | etot = -17.0731830510803 +936000 ekin = 2.5430697132387 | erot = 2.27852041735828 | epot = -21.7446317199061 | etot = -16.9230415893091 +937000 ekin = 2.53788333247346 | erot = 2.23194591805574 | epot = -21.6534356613621 | etot = -16.8836064108329 +938000 ekin = 2.56958704064571 | erot = 2.22382492410293 | epot = -21.6129100017685 | etot = -16.8194980370198 +939000 ekin = 2.57422838457721 | erot = 2.07923538706594 | epot = -21.6279254714879 | etot = -16.9744616998447 +940000 ekin = 2.60491982052062 | erot = 1.98992236153729 | epot = -21.6750092612153 | etot = -17.0801670791574 +941000 ekin = 2.66373355701793 | erot = 2.32917490630082 | epot = -21.764370163331 | etot = -16.7714617000123 +942000 ekin = 2.69288932722118 | erot = 2.640619275087 | epot = -21.8851511920185 | etot = -16.5516425897103 +943000 ekin = 2.85220624426593 | erot = 2.6475855859485 | epot = -22.0439788566384 | etot = -16.544187026424 +944000 ekin = 3.0698183844293 | erot = 2.584326500339 | epot = -22.1868426785132 | etot = -16.5326977937449 +945000 ekin = 3.11977740266063 | erot = 2.7604705229242 | epot = -22.3020466458578 | etot = -16.421798720273 +946000 ekin = 3.19652619014303 | erot = 2.60532859032606 | epot = -22.3840876069666 | etot = -16.5822328264975 +947000 ekin = 3.08784085528995 | erot = 2.30512601523234 | epot = -22.4409982051653 | etot = -17.048031334643 +948000 ekin = 3.07667922739837 | erot = 2.80704322134879 | epot = -22.4646638948264 | etot = -16.5809414460792 +949000 ekin = 3.17062900635953 | erot = 2.74445638705353 | epot = -22.4206065116941 | etot = -16.505521118281 +950000 ekin = 2.99689212844042 | erot = 2.86552970257342 | epot = -22.336181645013 | etot = -16.4737598139991 +951000 ekin = 2.97085887473051 | erot = 2.98485442072158 | epot = -22.2080335641941 | etot = -16.252320268742 +952000 ekin = 2.88426317548639 | erot = 2.88099001925752 | epot = -22.0862048891001 | etot = -16.3209516943562 +953000 ekin = 2.79821947299194 | erot = 2.79125510393654 | epot = -21.9697259248555 | etot = -16.380251347927 +954000 ekin = 2.75832450886912 | erot = 2.42390666106202 | epot = -21.8712203511705 | etot = -16.6889891812394 +955000 ekin = 2.87942571582949 | erot = 2.62352115358357 | epot = -21.7827306606127 | etot = -16.2797837911997 +956000 ekin = 2.99654896256508 | erot = 2.37509995935524 | epot = -21.7003789778445 | etot = -16.3287300559242 +957000 ekin = 3.01075252014519 | erot = 2.0959903323954 | epot = -21.6228190260864 | etot = -16.5160761735458 +958000 ekin = 3.08956507051393 | erot = 2.10771389670703 | epot = -21.5884599129528 | etot = -16.3911809457318 +959000 ekin = 3.07649935611857 | erot = 2.19950747705674 | epot = -21.608299575745 | etot = -16.3322927425697 +960000 ekin = 3.10536584557336 | erot = 2.29678872673574 | epot = -21.6407886898389 | etot = -16.2386341175298 +961000 ekin = 3.15824288797258 | erot = 2.14027743718263 | epot = -21.6571494232644 | etot = -16.3586290981092 +962000 ekin = 3.14297945524716 | erot = 2.20585989326466 | epot = -21.6669948660151 | etot = -16.3181555175033 +963000 ekin = 3.09592787201201 | erot = 1.84946957131998 | epot = -21.6592309502122 | etot = -16.7138335068802 +964000 ekin = 3.09941791328147 | erot = 2.05420199745758 | epot = -21.6348571714205 | etot = -16.4812372606815 +965000 ekin = 3.0590978002562 | erot = 2.03923495471246 | epot = -21.5780802205105 | etot = -16.4797474655419 +966000 ekin = 3.14454176510568 | erot = 2.08245540621284 | epot = -21.4998250637726 | etot = -16.2728278924541 +967000 ekin = 3.03869206876045 | erot = 1.99551102271526 | epot = -21.4455121298548 | etot = -16.4113090383791 +968000 ekin = 2.91377375855351 | erot = 2.20122833628372 | epot = -21.4117922551797 | etot = -16.2967901603425 +969000 ekin = 2.99132330213163 | erot = 2.47698235897901 | epot = -21.356556122341 | etot = -15.8882504612304 +970000 ekin = 2.95925005680405 | erot = 2.48694698427801 | epot = -21.3051309670823 | etot = -15.8589339260003 +971000 ekin = 2.85605976500569 | erot = 2.1530873115416 | epot = -21.2711653081509 | etot = -16.2620182316036 +972000 ekin = 2.87454972615782 | erot = 2.2162227007048 | epot = -21.2533681597902 | etot = -16.1625957329276 +973000 ekin = 2.82721122527838 | erot = 2.35000163924771 | epot = -21.2327108232255 | etot = -16.0554979586994 +974000 ekin = 2.72683175865821 | erot = 2.83125023318122 | epot = -21.2149243536637 | etot = -15.6568423618242 +975000 ekin = 2.7058821636302 | erot = 2.49368474281296 | epot = -21.1936492280793 | etot = -15.9940823216362 +976000 ekin = 2.70041722750245 | erot = 2.45741362546316 | epot = -21.187275504801 | etot = -16.0294446518354 +977000 ekin = 2.5945783600864 | erot = 2.48585482647506 | epot = -21.1832960991299 | etot = -16.1028629125685 +978000 ekin = 2.59433384768146 | erot = 2.25685298850986 | epot = -21.1912738457586 | etot = -16.3400870095673 +979000 ekin = 2.65907339789597 | erot = 2.14939269259699 | epot = -21.2277961745875 | etot = -16.4193300840946 +980000 ekin = 2.6800258272481 | erot = 2.14623475911376 | epot = -21.2888425661003 | etot = -16.4625819797384 +981000 ekin = 2.64198792972579 | erot = 2.09278957349386 | epot = -21.3758129934798 | etot = -16.6410354902601 +982000 ekin = 2.72135605208941 | erot = 2.10484266920753 | epot = -21.469578829443 | etot = -16.6433801081461 +983000 ekin = 2.63994960139807 | erot = 2.23278066526168 | epot = -21.5361373723972 | etot = -16.6634071057375 +984000 ekin = 2.61481848524905 | erot = 2.09640066338756 | epot = -21.5563728487098 | etot = -16.8451537000732 +985000 ekin = 2.61123661404095 | erot = 2.3371171115187 | epot = -21.5280304280228 | etot = -16.5796767024632 +986000 ekin = 2.53166588529896 | erot = 2.51414944396533 | epot = -21.4598136655137 | etot = -16.4139983362494 +987000 ekin = 2.51681610277252 | erot = 2.1560100013963 | epot = -21.3682813084315 | etot = -16.6954552042626 +988000 ekin = 2.52900907479865 | erot = 1.99810184774731 | epot = -21.2423979763254 | etot = -16.7152870537794 +989000 ekin = 2.46743393431882 | erot = 2.1761264782121 | epot = -21.1081947595191 | etot = -16.4646343469882 +990000 ekin = 2.33679166273175 | erot = 2.21492463068876 | epot = -20.9584920898951 | etot = -16.4067757964745 +991000 ekin = 2.15649617938395 | erot = 2.10512589255934 | epot = -20.8223518284059 | etot = -16.5607297564626 +992000 ekin = 2.16667762000927 | erot = 2.36721990012083 | epot = -20.7043891749962 | etot = -16.1704916548661 +993000 ekin = 2.19208440550362 | erot = 2.60766896726695 | epot = -20.6167811931571 | etot = -15.8170278203865 +994000 ekin = 2.24324320799042 | erot = 2.72045204046636 | epot = -20.5394560680998 | etot = -15.5757608196431 +995000 ekin = 2.30218249346891 | erot = 2.38815652338748 | epot = -20.5055629227556 | etot = -15.8152239058992 +996000 ekin = 2.42068208522236 | erot = 2.25149887670444 | epot = -20.5308517273634 | etot = -15.8586707654366 +997000 ekin = 2.40906609277991 | erot = 2.62359663392162 | epot = -20.6100670630842 | etot = -15.5774043363827 +998000 ekin = 2.47036155438533 | erot = 2.72144206830377 | epot = -20.7420376418526 | etot = -15.5502340191635 +999000 ekin = 2.48386726649674 | erot = 3.06416174290219 | epot = -20.8948468865809 | etot = -15.346817877182 +1000000 ekin = 2.67285546610894 | erot = 3.25707361502004 | epot = -21.0717432309422 | etot = -15.1418141498132 + 1000000 0.11879358 -1.3439085 0.026924568 -1.1499305 -8.5339515e-05 64000 +Loop time of 31.185 on 4 procs for 1000000 steps with 16 atoms + +Performance: 27705.600 tau/day, 32066.666 timesteps/s +96.4% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 14.443 | 16.691 | 18.812 | 49.1 | 53.52 +Bond | 0.41614 | 0.53705 | 0.60987 | 10.2 | 1.72 +Neigh | 0.026099 | 0.026141 | 0.02616 | 0.0 | 0.08 +Comm | 3.8806 | 4.0753 | 4.3197 | 8.3 | 13.07 +Output | 0.15586 | 0.15985 | 0.16634 | 1.0 | 0.51 +Modify | 1.5962 | 1.8782 | 2.1413 | 17.6 | 6.02 +Other | | 7.818 | | | 25.07 + +Nlocal: 4.00000 ave 5 max 3 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Nghost: 12.0000 ave 13 max 11 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Neighs: 48.5000 ave 58 max 39 min +Histogram: 2 0 0 0 0 0 0 0 0 2 + +Total # of neighbors = 194 +Ave neighs/atom = 12.125000 +Ave special neighs/atom = 3.7500000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.2.* nocoeff +System init for write_data ... +Total wall time: 0:00:31 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.1 deleted file mode 100644 index f030e0f93c..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.1 +++ /dev/null @@ -1,1176 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 2 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex2 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 16 atoms - reading velocities ... - 16 velocities - 16 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 13 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.002 seconds - -set atom * mass 3.1575 - 16 settings made for mass - -group all type 1 4 -16 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna/fene -bond_coeff * 2.0 0.25 0.7525 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk -pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 - -# NVE ensemble -#fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -fix 1 all nve/asphere -fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 -fix 2 all langevin 0.1 ${T} 0.03 457145 angmom 10 -fix 2 all langevin 0.1 0.1 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 1.9560004 - ghost atom cutoff = 2.5 - binsize = 0.97800022, bins = 41 41 41 - 5 neighbor lists, perpetual/occasional/extra = 5 0 0 - (1) pair oxdna/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -0 ekin = 0 | erot = 0 | epot = -24.5312382023597 | etot = -24.5312382023597 -Per MPI rank memory allocation (min/avg/max) = 8.008 | 8.008 | 8.008 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.5402493 0.0070469125 -1.5332024 6.0760034e-06 -1000 ekin = 1.14690574396998 | erot = 2.51569518930742 | epot = -24.5229788082339 | etot = -20.8603778749565 -2000 ekin = 1.45399965653676 | erot = 2.47529346761995 | epot = -24.5053413112924 | etot = -20.5760481871357 -3000 ekin = 1.98748516841538 | erot = 2.27869060236515 | epot = -24.479432022183 | etot = -20.2132562514025 -4000 ekin = 1.64496816080429 | erot = 1.81579764130658 | epot = -24.4776224042961 | etot = -21.0168566021853 -5000 ekin = 1.84895966245555 | erot = 2.72664609970378 | epot = -24.4004650506536 | etot = -19.8248592884943 -6000 ekin = 2.81982646967251 | erot = 2.27943933047792 | epot = -24.3708804580518 | etot = -19.2716146579014 -7000 ekin = 3.4295488541453 | erot = 3.06244546790251 | epot = -24.2894811609395 | etot = -17.7974868388917 -8000 ekin = 3.46902364328651 | erot = 1.87163076744154 | epot = -24.2046945377415 | etot = -18.8640401270135 -9000 ekin = 3.42624221752733 | erot = 2.19665328890067 | epot = -24.1061295133862 | etot = -18.4832340069582 -10000 ekin = 3.47261688291849 | erot = 2.11359627880933 | epot = -23.9936001795499 | etot = -18.4073870178221 -11000 ekin = 2.94815134012461 | erot = 1.68371787420979 | epot = -23.8824451066212 | etot = -19.2505758922868 -12000 ekin = 2.91661369846828 | erot = 2.44986569301244 | epot = -23.7971038712851 | etot = -18.4306244798044 -13000 ekin = 2.90452877485052 | erot = 3.15041912070996 | epot = -23.7183348836954 | etot = -17.6633869881349 -14000 ekin = 3.03173396911322 | erot = 3.20528252680661 | epot = -23.6395534566822 | etot = -17.4025369607624 -15000 ekin = 3.10924339992056 | erot = 2.34851811722898 | epot = -23.5718810747763 | etot = -18.1141195576268 -16000 ekin = 2.21129165426584 | erot = 2.77310226941398 | epot = -23.4674880203451 | etot = -18.4830940966653 -17000 ekin = 1.64364291226705 | erot = 2.11093006069599 | epot = -23.4464921197588 | etot = -19.6919191467958 -18000 ekin = 1.71575404949661 | erot = 2.18377153128382 | epot = -23.4394231359426 | etot = -19.5398975551621 -19000 ekin = 2.74802968392513 | erot = 3.43483629560937 | epot = -23.451104173519 | etot = -17.2682381939845 -20000 ekin = 2.3643229041162 | erot = 2.97756435312011 | epot = -23.4354516313364 | etot = -18.0935643741001 -21000 ekin = 3.01197341291121 | erot = 2.06047278730446 | epot = -23.4653464733578 | etot = -18.3929002731421 -22000 ekin = 2.72181189461236 | erot = 1.68043760380063 | epot = -23.499010600721 | etot = -19.0967611023081 -23000 ekin = 2.78354866420193 | erot = 2.27555762688526 | epot = -23.4149266394174 | etot = -18.3558203483302 -24000 ekin = 2.70238951268775 | erot = 2.77699460975588 | epot = -23.3727816681014 | etot = -17.8933975456577 -25000 ekin = 2.79329314290743 | erot = 1.72270284379168 | epot = -23.4092634474478 | etot = -18.8932674607487 -26000 ekin = 2.12045088758989 | erot = 2.56536846297423 | epot = -23.4001345199736 | etot = -18.7143151694095 -27000 ekin = 2.13984384122857 | erot = 2.80867896704025 | epot = -23.372540623668 | etot = -18.4240178153992 -28000 ekin = 1.83987887691915 | erot = 1.95066344021761 | epot = -23.3274470842878 | etot = -19.536904767151 -29000 ekin = 1.89211705701482 | erot = 2.1696768345372 | epot = -23.293062192394 | etot = -19.231268300842 -30000 ekin = 2.14849041779036 | erot = 2.16067509784504 | epot = -23.2773582752331 | etot = -18.9681927595977 -31000 ekin = 2.67234738212361 | erot = 2.86863391076037 | epot = -23.2995071870109 | etot = -17.7585258941269 -32000 ekin = 2.53397631055537 | erot = 2.90803809156287 | epot = -23.2362493660415 | etot = -17.7942349639233 -33000 ekin = 3.08856443970765 | erot = 2.77830373791794 | epot = -23.1957127399696 | etot = -17.328844562344 -34000 ekin = 2.34758696559903 | erot = 2.73235573196028 | epot = -23.1859092641964 | etot = -18.1059665666371 -35000 ekin = 2.37656125971695 | erot = 2.21670282442912 | epot = -23.2990352575428 | etot = -18.7057711733968 -36000 ekin = 1.91500165278598 | erot = 2.22479415969906 | epot = -23.3423509866966 | etot = -19.2025551742115 -37000 ekin = 1.90416513806792 | erot = 2.44362474415858 | epot = -23.4523097395397 | etot = -19.1045198573132 -38000 ekin = 2.64855728429901 | erot = 2.6250961281024 | epot = -23.4330562973534 | etot = -18.159402884952 -39000 ekin = 2.47023253086004 | erot = 2.94458438664745 | epot = -23.3886129152296 | etot = -17.9737959977221 -40000 ekin = 2.36649278209599 | erot = 2.21667374563979 | epot = -23.3060594391637 | etot = -18.722892911428 -41000 ekin = 2.11640638984279 | erot = 2.75431236003956 | epot = -23.296637047546 | etot = -18.4259182976636 -42000 ekin = 2.19538989967685 | erot = 2.80995153019434 | epot = -23.3287628829795 | etot = -18.3234214531083 -43000 ekin = 2.28336241709741 | erot = 1.91100961808481 | epot = -23.398154745965 | etot = -19.2037827107827 -44000 ekin = 2.43910444561977 | erot = 2.20967357150541 | epot = -23.3408075599757 | etot = -18.6920295428505 -45000 ekin = 1.99725725495469 | erot = 2.55697923716124 | epot = -23.2988802257869 | etot = -18.744643733671 -46000 ekin = 2.80179143005448 | erot = 3.94591979804991 | epot = -23.2634234091195 | etot = -16.5157121810151 -47000 ekin = 2.00831918922489 | erot = 1.99358498528542 | epot = -23.1997437408908 | etot = -19.1978395663805 -48000 ekin = 2.65343777724262 | erot = 3.19529693167641 | epot = -23.2752277173461 | etot = -17.4264930084271 -49000 ekin = 3.08609210167617 | erot = 3.098444131902 | epot = -23.3331562765622 | etot = -17.148620042984 -50000 ekin = 2.79161045816108 | erot = 3.87280243835105 | epot = -23.283716155905 | etot = -16.6193032593929 -51000 ekin = 2.63041022395737 | erot = 1.73292678860556 | epot = -23.2028735154881 | etot = -18.8395365029252 -52000 ekin = 2.18205853362573 | erot = 2.96101862628972 | epot = -23.1079417719452 | etot = -17.9648646120298 -53000 ekin = 2.3943556604873 | erot = 3.52800628354648 | epot = -23.0586505350936 | etot = -17.1362885910599 -54000 ekin = 2.12390729593688 | erot = 2.48502694765291 | epot = -22.9790932946842 | etot = -18.3701590510944 -55000 ekin = 1.95245465404747 | erot = 2.39606028736228 | epot = -23.0362462549527 | etot = -18.687731313543 -56000 ekin = 2.078586656515 | erot = 2.51006580668827 | epot = -23.0629170158575 | etot = -18.4742645526543 -57000 ekin = 2.60842664676812 | erot = 3.02172637784133 | epot = -23.0307524021856 | etot = -17.4005993775762 -58000 ekin = 2.99447041104738 | erot = 2.32823492888449 | epot = -23.0721969273868 | etot = -17.7494915874549 -59000 ekin = 2.4566598353902 | erot = 2.43942437937462 | epot = -23.0847799943358 | etot = -18.188695779571 -60000 ekin = 2.6971497663209 | erot = 1.66133214228194 | epot = -23.0332753747144 | etot = -18.6747934661116 -61000 ekin = 2.11191914746267 | erot = 1.6204782869367 | epot = -22.9667049822233 | etot = -19.234307547824 -62000 ekin = 2.11717212979171 | erot = 2.47796844210791 | epot = -22.8144212994634 | etot = -18.2192807275637 -63000 ekin = 2.72171812217735 | erot = 2.66368566253267 | epot = -22.7776567061626 | etot = -17.3922529214526 -64000 ekin = 3.22835802379379 | erot = 2.36781220330958 | epot = -22.7933861176758 | etot = -17.1972158905724 -65000 ekin = 3.64756058058813 | erot = 3.15015944023671 | epot = -22.7765851531231 | etot = -15.9788651322982 -66000 ekin = 2.66639386198067 | erot = 2.72112154754982 | epot = -22.7755021487188 | etot = -17.3879867391884 -67000 ekin = 2.38306133316432 | erot = 2.49378542212015 | epot = -22.7973748348603 | etot = -17.9205280795759 -68000 ekin = 2.52481286112851 | erot = 3.23872813661013 | epot = -22.8468557220554 | etot = -17.0833147243168 -69000 ekin = 2.60430769391747 | erot = 3.00968890211103 | epot = -22.8318824138615 | etot = -17.217885817833 -70000 ekin = 2.72529278847958 | erot = 2.96912272855297 | epot = -22.9182544554594 | etot = -17.2238389384268 -71000 ekin = 2.30851064297996 | erot = 2.44510178131689 | epot = -23.110146286175 | etot = -18.3565338618781 -72000 ekin = 1.86333205174444 | erot = 2.21918738219008 | epot = -23.2088713208781 | etot = -19.1263518869436 -73000 ekin = 1.97363737837151 | erot = 2.92039675389546 | epot = -23.3456188157452 | etot = -18.4515846834783 -74000 ekin = 2.03973663696274 | erot = 2.44352827046787 | epot = -23.3706565736274 | etot = -18.8873916661968 -75000 ekin = 2.13029836638111 | erot = 2.25069247013825 | epot = -23.3468514357058 | etot = -18.9658605991864 -76000 ekin = 1.86911909276267 | erot = 1.88174803064112 | epot = -23.3433063511182 | etot = -19.5924392277144 -77000 ekin = 2.8311971230152 | erot = 1.4764600924275 | epot = -23.3736217515866 | etot = -19.0659645361439 -78000 ekin = 3.02331647633308 | erot = 3.49408579644919 | epot = -23.4257428368656 | etot = -16.9083405640833 -79000 ekin = 3.51133596793171 | erot = 2.66043649565033 | epot = -23.4320673594166 | etot = -17.2602948958345 -80000 ekin = 2.88371521187479 | erot = 1.92272084366328 | epot = -23.4437991576283 | etot = -18.6373631020903 -81000 ekin = 2.93345241699417 | erot = 2.30354045717278 | epot = -23.4023767063862 | etot = -18.1653838322193 -82000 ekin = 2.31364693930239 | erot = 1.52107123456185 | epot = -23.332732976686 | etot = -19.4980148028218 -83000 ekin = 2.79964810868887 | erot = 3.01031848157711 | epot = -23.1805490994262 | etot = -17.3705825091602 -84000 ekin = 3.14238697097954 | erot = 2.54443984047462 | epot = -23.0036486008467 | etot = -17.3168217893925 -85000 ekin = 3.11037170652329 | erot = 2.81688612333738 | epot = -22.9040286513178 | etot = -16.9767708214572 -86000 ekin = 3.24614571607055 | erot = 2.4691668527709 | epot = -22.9115348786951 | etot = -17.1962223098536 -87000 ekin = 3.15148333101924 | erot = 2.81476071986705 | epot = -22.88497016051 | etot = -16.9187261096237 -88000 ekin = 2.79204781171839 | erot = 2.11551211421263 | epot = -22.9365333909989 | etot = -18.0289734650679 -89000 ekin = 2.35289392365394 | erot = 3.20722667156868 | epot = -22.838834182654 | etot = -17.2787135874314 -90000 ekin = 2.37582791595297 | erot = 2.35376824711544 | epot = -22.7759716111928 | etot = -18.0463754481244 -91000 ekin = 2.11229902300038 | erot = 2.49991596560396 | epot = -22.7428668079145 | etot = -18.1306518193102 -92000 ekin = 2.18222080456226 | erot = 2.12578389554434 | epot = -22.6742877211503 | etot = -18.3662830210437 -93000 ekin = 2.21095150681925 | erot = 3.26438303982222 | epot = -22.5594438754277 | etot = -17.0841093287862 -94000 ekin = 2.12232737083461 | erot = 3.41982221867449 | epot = -22.5731643271249 | etot = -17.0310147376158 -95000 ekin = 1.85629034286763 | erot = 1.96410759501716 | epot = -22.59538207669 | etot = -18.7749841388052 -96000 ekin = 2.39869119547858 | erot = 2.71927150056489 | epot = -22.6306283736797 | etot = -17.5126656776363 -97000 ekin = 2.66273024813647 | erot = 1.89080412966723 | epot = -22.6359449758314 | etot = -18.0824105980277 -98000 ekin = 2.85072927082227 | erot = 1.60816717415087 | epot = -22.7177273012906 | etot = -18.2588308563174 -99000 ekin = 2.83238909889775 | erot = 2.47205959733049 | epot = -22.8003244534363 | etot = -17.495875757208 -100000 ekin = 2.41865993058067 | erot = 2.0598579213647 | epot = -22.9852243238147 | etot = -18.5067064718694 -101000 ekin = 2.54841697870327 | erot = 2.36461883832458 | epot = -23.0633841926615 | etot = -18.1503483756336 -102000 ekin = 2.54594946615645 | erot = 2.86139475908785 | epot = -23.1098219772669 | etot = -17.7024777520226 -103000 ekin = 2.13582591081888 | erot = 2.12361330514722 | epot = -23.1354410963672 | etot = -18.8760018804011 -104000 ekin = 2.21385815248422 | erot = 2.29274274660023 | epot = -23.0865139718305 | etot = -18.5799130727461 -105000 ekin = 2.44889646860174 | erot = 2.75107727112909 | epot = -23.0544140778533 | etot = -17.8544403381225 -106000 ekin = 1.95956756411726 | erot = 2.3209345631325 | epot = -23.0430612833128 | etot = -18.7625591560631 -107000 ekin = 2.27802020438547 | erot = 2.08909400930221 | epot = -23.0686930034876 | etot = -18.7015787897999 -108000 ekin = 1.90572708538444 | erot = 3.13702334473575 | epot = -23.0271860838353 | etot = -17.9844356537151 -109000 ekin = 2.39380259291066 | erot = 2.22054516746467 | epot = -23.0249223512454 | etot = -18.41057459087 -110000 ekin = 2.26587242950359 | erot = 2.25607481649737 | epot = -23.039981892631 | etot = -18.51803464663 -111000 ekin = 2.15727458703525 | erot = 1.98358283370136 | epot = -23.0767942184013 | etot = -18.9359367976647 -112000 ekin = 2.3828169618658 | erot = 2.69686827828485 | epot = -23.1107895116834 | etot = -18.0311042715327 -113000 ekin = 2.8101781075741 | erot = 2.59950194588724 | epot = -23.0287341179313 | etot = -17.6190540644699 -114000 ekin = 2.35455919019172 | erot = 3.20470938308889 | epot = -22.9694690534849 | etot = -17.4102004802043 -115000 ekin = 2.4406692440432 | erot = 1.89109901084122 | epot = -22.9284259454167 | etot = -18.5966576905323 -116000 ekin = 2.31064767487137 | erot = 2.83979549060621 | epot = -22.9485617435445 | etot = -17.7981185780669 -117000 ekin = 2.08937942523073 | erot = 2.22599804456159 | epot = -22.8649871463364 | etot = -18.5496096765441 -118000 ekin = 2.13839981510475 | erot = 2.6042059558218 | epot = -22.7656872587424 | etot = -18.0230814878159 -119000 ekin = 2.82390266451549 | erot = 2.20939391190357 | epot = -22.7729728906623 | etot = -17.7396763142432 -120000 ekin = 2.01401322106231 | erot = 2.48866024138323 | epot = -22.6353588152779 | etot = -18.1326853528324 -121000 ekin = 2.38145077479306 | erot = 3.12007697133009 | epot = -22.5496980171072 | etot = -17.048170270984 -122000 ekin = 3.27512287434745 | erot = 3.22243197902324 | epot = -22.5766115874577 | etot = -16.079056734087 -123000 ekin = 2.81132514620283 | erot = 2.86307874434964 | epot = -22.6263844574797 | etot = -16.9519805669272 -124000 ekin = 2.19849534367232 | erot = 2.58327740029555 | epot = -22.632926922485 | etot = -17.8511541785171 -125000 ekin = 1.9938456811927 | erot = 1.90953618390393 | epot = -22.6331404835376 | etot = -18.7297586184409 -126000 ekin = 2.42731825528385 | erot = 2.87237001426948 | epot = -22.6106846507781 | etot = -17.3109963812248 -127000 ekin = 1.95505736761304 | erot = 2.81720121527978 | epot = -22.5579301674971 | etot = -17.7856715846043 -128000 ekin = 2.10594260964226 | erot = 2.01356984269814 | epot = -22.4981321684107 | etot = -18.3786197160703 -129000 ekin = 2.55520588445759 | erot = 2.57894735511156 | epot = -22.559207781978 | etot = -17.4250545424089 -130000 ekin = 2.86259834978311 | erot = 2.18965938451607 | epot = -22.5770466332128 | etot = -17.5247888989136 -131000 ekin = 2.86321076870393 | erot = 1.66847645340269 | epot = -22.529949359668 | etot = -17.9982621375613 -132000 ekin = 2.93426604771556 | erot = 3.00425629789163 | epot = -22.5601802720307 | etot = -16.6216579264235 -133000 ekin = 3.65754901201543 | erot = 1.43666262449492 | epot = -22.6237662747263 | etot = -17.529554638216 -134000 ekin = 2.18898923715712 | erot = 2.33049897457535 | epot = -22.7470394091699 | etot = -18.2275511974375 -135000 ekin = 2.03823330514395 | erot = 2.69291476269712 | epot = -22.8900275663634 | etot = -18.1588794985223 -136000 ekin = 2.6538713732039 | erot = 2.40958876583255 | epot = -22.9857440078583 | etot = -17.9222838688218 -137000 ekin = 3.12283566057286 | erot = 3.49983145404452 | epot = -23.0096984445474 | etot = -16.3870313299301 -138000 ekin = 2.45014875520084 | erot = 2.4508647359669 | epot = -23.0794084265037 | etot = -18.178394935336 -139000 ekin = 2.03608492985731 | erot = 1.97462403722722 | epot = -23.178945590097 | etot = -19.1682366230125 -140000 ekin = 2.8375811142686 | erot = 2.49376841321459 | epot = -23.298440206365 | etot = -17.9670906788818 -141000 ekin = 2.83405987670134 | erot = 2.48065309139941 | epot = -23.4226619452758 | etot = -18.107948977175 -142000 ekin = 3.19333498685692 | erot = 3.17336002986012 | epot = -23.3250285546098 | etot = -16.9583335378927 -143000 ekin = 2.2053085459229 | erot = 2.51795869911564 | epot = -23.4007031674318 | etot = -18.6774359223932 -144000 ekin = 3.13477789699627 | erot = 2.69612114268137 | epot = -23.3846120043903 | etot = -17.5537129647126 -145000 ekin = 3.05703751181504 | erot = 2.77857540632303 | epot = -23.3935227778029 | etot = -17.5579098596648 -146000 ekin = 3.56567491078422 | erot = 1.97456126200808 | epot = -23.3912044699534 | etot = -17.8509682971611 -147000 ekin = 2.62692101320613 | erot = 2.7990853604292 | epot = -23.4731299563114 | etot = -18.0471235826761 -148000 ekin = 2.45471110479969 | erot = 1.97948594654501 | epot = -23.5390482551317 | etot = -19.104851203787 -149000 ekin = 2.91425191756495 | erot = 2.34219263228086 | epot = -23.5494392195753 | etot = -18.2929946697295 -150000 ekin = 2.11267470955651 | erot = 3.15139951917672 | epot = -23.456213233303 | etot = -18.1921390045698 -151000 ekin = 1.89283581343662 | erot = 2.39812863380885 | epot = -23.3591999925057 | etot = -19.0682355452602 -152000 ekin = 2.40790737144431 | erot = 2.01427800135936 | epot = -23.2626112351643 | etot = -18.8404258623606 -153000 ekin = 2.05155784053096 | erot = 2.23618306870396 | epot = -23.2634856578898 | etot = -18.9757447486549 -154000 ekin = 2.51778354567736 | erot = 3.20314773898096 | epot = -23.2975528150325 | etot = -17.5766215303742 -155000 ekin = 2.00284429469695 | erot = 2.89937315438495 | epot = -23.3218945133551 | etot = -18.4196770642732 -156000 ekin = 1.91144554872485 | erot = 2.99821559619451 | epot = -23.2209466091476 | etot = -18.3112854642282 -157000 ekin = 2.43182251041877 | erot = 1.62406041783895 | epot = -23.1045847485264 | etot = -19.0487018202686 -158000 ekin = 2.09298289420886 | erot = 2.6766289229666 | epot = -23.031927214759 | etot = -18.2623153975835 -159000 ekin = 2.20764198734381 | erot = 2.83616967442204 | epot = -22.9227666897823 | etot = -17.8789550280164 -160000 ekin = 2.21243983900826 | erot = 2.20003736549807 | epot = -22.9543660393476 | etot = -18.5418888348412 -161000 ekin = 2.45073410895006 | erot = 2.43388496890226 | epot = -22.9636574775946 | etot = -18.0790383997422 -162000 ekin = 2.17367299341061 | erot = 2.69488535843695 | epot = -23.0527030224094 | etot = -18.1841446705618 -163000 ekin = 1.6416624121019 | erot = 2.84097373738807 | epot = -23.1292124278341 | etot = -18.6465762783441 -164000 ekin = 1.67565049116239 | erot = 2.68380704848371 | epot = -23.1590424140942 | etot = -18.7995848744481 -165000 ekin = 2.42206226766745 | erot = 2.72988204300635 | epot = -23.1799778993767 | etot = -18.0280335887029 -166000 ekin = 3.14880802219226 | erot = 2.84384837642053 | epot = -23.2429974571314 | etot = -17.2503410585186 -167000 ekin = 2.25647190185324 | erot = 2.22025584454645 | epot = -23.3152815140534 | etot = -18.8385537676537 -168000 ekin = 2.05307577726746 | erot = 1.92982813234681 | epot = -23.3121709078534 | etot = -19.3292669982392 -169000 ekin = 2.25333032487684 | erot = 2.03837973951729 | epot = -23.3314587534472 | etot = -19.0397486890531 -170000 ekin = 3.24025514660291 | erot = 2.68054613971874 | epot = -23.2656213247604 | etot = -17.3448200384388 -171000 ekin = 3.26091283919611 | erot = 2.31337270355485 | epot = -23.30671463487 | etot = -17.732429092119 -172000 ekin = 3.71728985541098 | erot = 2.37762994657772 | epot = -23.3035184476851 | etot = -17.2085986456964 -173000 ekin = 3.15518229037533 | erot = 2.74844421936228 | epot = -23.2758116201384 | etot = -17.3721851104007 -174000 ekin = 2.99648976213193 | erot = 1.71811302453253 | epot = -23.1981882260451 | etot = -18.4835854393806 -175000 ekin = 2.57240965973333 | erot = 2.55046855203897 | epot = -23.1014541624941 | etot = -17.9785759507218 -176000 ekin = 1.93852156602125 | erot = 2.47332967602318 | epot = -23.1368569455589 | etot = -18.7250057035145 -177000 ekin = 2.80960374115401 | erot = 1.95409121605924 | epot = -23.0982934782514 | etot = -18.3345985210382 -178000 ekin = 2.33244636491393 | erot = 2.27408462832222 | epot = -23.0825224910612 | etot = -18.4759914978251 -179000 ekin = 2.13982176908862 | erot = 2.89346836042849 | epot = -23.0763356798213 | etot = -18.0430455503042 -180000 ekin = 2.207400927993 | erot = 1.5562703232207 | epot = -23.0740416866628 | etot = -19.3103704354491 -181000 ekin = 2.12924843078766 | erot = 3.48717124411563 | epot = -22.9481791847174 | etot = -17.3317595098141 -182000 ekin = 1.86429514249569 | erot = 2.12691540074977 | epot = -22.8573607952401 | etot = -18.8661502519946 -183000 ekin = 2.49432213049246 | erot = 1.94397526976538 | epot = -22.8739996678934 | etot = -18.4357022676356 -184000 ekin = 2.32559536618148 | erot = 2.16188851089671 | epot = -22.8801350202001 | etot = -18.3926511431219 -185000 ekin = 3.43221902743033 | erot = 2.76663819243887 | epot = -22.7961878859294 | etot = -16.5973306660602 -186000 ekin = 3.27655677826301 | erot = 2.10542412812558 | epot = -22.5860615279726 | etot = -17.204080621584 -187000 ekin = 3.21808565073807 | erot = 3.12646745373177 | epot = -22.4680437052799 | etot = -16.1234906008101 -188000 ekin = 3.29470028080779 | erot = 2.71885909254934 | epot = -22.4777213671005 | etot = -16.4641619937434 -189000 ekin = 2.29225438861808 | erot = 2.15238017837044 | epot = -22.4423181907693 | etot = -17.9976836237808 -190000 ekin = 2.31172879251782 | erot = 1.69869193216314 | epot = -22.4421736779848 | etot = -18.4317529533038 -191000 ekin = 2.44737449537105 | erot = 1.95471142288415 | epot = -22.4940636736618 | etot = -18.0919777554066 -192000 ekin = 2.65685760576573 | erot = 2.49493427834054 | epot = -22.551770059613 | etot = -17.3999781755067 -193000 ekin = 2.01491600271975 | erot = 2.53697801257504 | epot = -22.611413796154 | etot = -18.0595197808592 -194000 ekin = 2.13098665262876 | erot = 2.65162788921838 | epot = -22.6516249427401 | etot = -17.869010400893 -195000 ekin = 2.15880156426523 | erot = 2.30285156951273 | epot = -22.6801152411448 | etot = -18.2184621073669 -196000 ekin = 2.26045454251242 | erot = 1.7400410306741 | epot = -22.6243696974319 | etot = -18.6238741242454 -197000 ekin = 2.08353851799175 | erot = 2.84019387252897 | epot = -22.5254653541291 | etot = -17.6017329636084 -198000 ekin = 2.40254425598167 | erot = 1.59510544084176 | epot = -22.4875571568747 | etot = -18.4899074600513 -199000 ekin = 2.32315315727966 | erot = 1.64758309421108 | epot = -22.3940543169462 | etot = -18.4233180654554 -200000 ekin = 1.9344201599962 | erot = 2.09946369983286 | epot = -22.3163824882501 | etot = -18.282498628421 -201000 ekin = 2.25758946372665 | erot = 1.57318447391795 | epot = -22.2162199013465 | etot = -18.3854459637019 -202000 ekin = 2.14286142871167 | erot = 1.84411011823104 | epot = -22.0782645916587 | etot = -18.0912930447159 -203000 ekin = 1.82640790776851 | erot = 3.05975799451598 | epot = -21.9788881819889 | etot = -17.0927222797045 -204000 ekin = 1.62851140603835 | erot = 1.97764157787611 | epot = -21.9332382928783 | etot = -18.3270853089638 -205000 ekin = 1.25482843048893 | erot = 2.20166998646264 | epot = -21.8845360273862 | etot = -18.4280376104346 -206000 ekin = 1.73414183779997 | erot = 1.82150010232861 | epot = -21.8773801883845 | etot = -18.321738248256 -207000 ekin = 1.94750322930568 | erot = 2.48531516705681 | epot = -21.9295431113514 | etot = -17.496724714989 -208000 ekin = 2.09568882924412 | erot = 3.03912830731326 | epot = -22.0166563659434 | etot = -16.881839229386 -209000 ekin = 2.64700139449842 | erot = 2.33696819850967 | epot = -22.1001648259952 | etot = -17.1161952329871 -210000 ekin = 2.84808049130809 | erot = 3.0333180373391 | epot = -22.1925404483828 | etot = -16.3111419197356 -211000 ekin = 1.9735208459781 | erot = 2.67635943704183 | epot = -22.2979529780579 | etot = -17.648072695038 -212000 ekin = 1.60231135436244 | erot = 2.66527693950093 | epot = -22.3334257809678 | etot = -18.0658374871044 -213000 ekin = 1.33634411107147 | erot = 2.64593792571916 | epot = -22.4180515625624 | etot = -18.4357695257718 -214000 ekin = 2.2947085637024 | erot = 1.7654025455793 | epot = -22.5146947473979 | etot = -18.4545836381162 -215000 ekin = 2.54235331845419 | erot = 2.59070032226104 | epot = -22.5977548514775 | etot = -17.4647012107623 -216000 ekin = 2.50726683350059 | erot = 2.07957683306215 | epot = -22.6514435658203 | etot = -18.0645998992575 -217000 ekin = 2.56666688563484 | erot = 2.10721620203285 | epot = -22.7585726045596 | etot = -18.0846895168919 -218000 ekin = 2.3809214758614 | erot = 2.40889946821003 | epot = -22.7858427946485 | etot = -17.996021850577 -219000 ekin = 2.62297703802767 | erot = 1.72015460606372 | epot = -22.8179577818034 | etot = -18.474826137712 -220000 ekin = 2.04452501529803 | erot = 2.48366646228854 | epot = -22.8152593234185 | etot = -18.2870678458319 -221000 ekin = 2.016790382988 | erot = 1.92179513943576 | epot = -22.7675242743918 | etot = -18.8289387519681 -222000 ekin = 2.48246285927141 | erot = 2.69662232500728 | epot = -22.6922041676861 | etot = -17.5131189834074 -223000 ekin = 2.07315316544961 | erot = 2.59399918829032 | epot = -22.6977764075015 | etot = -18.0306240537616 -224000 ekin = 2.13964582929342 | erot = 2.15545737968983 | epot = -22.6791813082171 | etot = -18.3840780992338 -225000 ekin = 2.4443131371706 | erot = 3.02968637363015 | epot = -22.6416871024202 | etot = -17.1676875916194 -226000 ekin = 2.14901519929161 | erot = 2.34793235846519 | epot = -22.69101275787 | etot = -18.1940652001132 -227000 ekin = 2.85261296673757 | erot = 2.16469654263134 | epot = -22.6647959494624 | etot = -17.6474864400935 -228000 ekin = 2.0542557730781 | erot = 2.41859943175188 | epot = -22.648254263469 | etot = -18.175399058639 -229000 ekin = 1.71712866311074 | erot = 2.00134448676601 | epot = -22.656184548909 | etot = -18.9377113990323 -230000 ekin = 2.93835687549904 | erot = 2.52588891439014 | epot = -22.686473096368 | etot = -17.2222273064788 -231000 ekin = 3.65320646645271 | erot = 2.50996334898014 | epot = -22.6663620829857 | etot = -16.5031922675529 -232000 ekin = 2.74858319742744 | erot = 2.15737431011052 | epot = -22.7650781743548 | etot = -17.8591206668168 -233000 ekin = 2.20526469100055 | erot = 1.96946858309177 | epot = -22.808033211882 | etot = -18.6332999377897 -234000 ekin = 3.0329543267647 | erot = 1.91197211768344 | epot = -22.7639916522477 | etot = -17.8190652077996 -235000 ekin = 2.67265278717495 | erot = 2.49323486871604 | epot = -22.8047732486684 | etot = -17.6388855927774 -236000 ekin = 2.45357393436119 | erot = 2.51245746374309 | epot = -22.7782827985553 | etot = -17.812251400451 -237000 ekin = 2.58384683986252 | erot = 2.47764708446689 | epot = -22.8498966602044 | etot = -17.788402735875 -238000 ekin = 2.48850542531642 | erot = 2.95888408934022 | epot = -22.8461058630726 | etot = -17.3987163484159 -239000 ekin = 2.5081973607743 | erot = 2.88284977556179 | epot = -22.8253656494842 | etot = -17.4343185131481 -240000 ekin = 2.80266521029648 | erot = 2.42429156361948 | epot = -22.7822778944155 | etot = -17.5553211204995 -241000 ekin = 2.22400241744572 | erot = 2.47541442439962 | epot = -22.708502965295 | etot = -18.0090861234496 -242000 ekin = 2.1369278840666 | erot = 3.31767605383442 | epot = -22.6765710785147 | etot = -17.2219671406136 -243000 ekin = 2.31455276379189 | erot = 1.97486717843967 | epot = -22.6835713954336 | etot = -18.3941514532021 -244000 ekin = 2.08913537180933 | erot = 2.74057497391117 | epot = -22.6588502228669 | etot = -17.8291398771464 -245000 ekin = 2.13326066848594 | erot = 2.26727722045252 | epot = -22.5891755212551 | etot = -18.1886376323167 -246000 ekin = 1.98597399772947 | erot = 2.24414289909305 | epot = -22.581751166757 | etot = -18.3516342699345 -247000 ekin = 1.7029908245814 | erot = 2.65850843105303 | epot = -22.5730238533539 | etot = -18.2115245977195 -248000 ekin = 2.17045477909461 | erot = 2.21012477326125 | epot = -22.6387048466336 | etot = -18.2581252942777 -249000 ekin = 2.19972531736336 | erot = 2.93804177761671 | epot = -22.667836810757 | etot = -17.530069715777 -250000 ekin = 2.30859844416928 | erot = 2.87484738519315 | epot = -22.7208193440242 | etot = -17.5373735146618 -251000 ekin = 3.15133859857999 | erot = 2.3610033133862 | epot = -22.7532913869796 | etot = -17.2409494750134 -252000 ekin = 2.10711705767907 | erot = 2.93803244308709 | epot = -22.8141998177766 | etot = -17.7690503170104 -253000 ekin = 1.81446587076888 | erot = 3.64847052994272 | epot = -22.7589188116659 | etot = -17.2959824109543 -254000 ekin = 2.38246471864852 | erot = 2.74330406814437 | epot = -22.637470157389 | etot = -17.5117013705961 -255000 ekin = 2.82281981879266 | erot = 2.17751399966926 | epot = -22.6480625048929 | etot = -17.647728686431 -256000 ekin = 2.91721347856852 | erot = 2.29499077181347 | epot = -22.7096621530392 | etot = -17.4974579026573 -257000 ekin = 2.82748375072692 | erot = 3.52099588673786 | epot = -22.6484013012936 | etot = -16.2999216638288 -258000 ekin = 2.19992203178142 | erot = 2.12042549810482 | epot = -22.6612060734149 | etot = -18.3408585435286 -259000 ekin = 2.13920518349551 | erot = 2.2459631658656 | epot = -22.6156265174457 | etot = -18.2304581680846 -260000 ekin = 2.4332113427451 | erot = 2.77503683051912 | epot = -22.6321520875833 | etot = -17.4239039143191 -261000 ekin = 2.05779939929259 | erot = 2.13973837948785 | epot = -22.6823931019282 | etot = -18.4848553231477 -262000 ekin = 2.79110837358257 | erot = 2.25626689025766 | epot = -22.7214681566511 | etot = -17.6740928928109 -263000 ekin = 2.78883106934821 | erot = 1.69356075172848 | epot = -22.7142967476141 | etot = -18.2319049265375 -264000 ekin = 2.20259381207698 | erot = 1.55086518385097 | epot = -22.6762941554802 | etot = -18.9228351595523 -265000 ekin = 2.0317762551793 | erot = 2.12583868325911 | epot = -22.712761701767 | etot = -18.5551467633286 -266000 ekin = 2.50197151162485 | erot = 2.91236336851854 | epot = -22.8558243132671 | etot = -17.4414894331237 -267000 ekin = 2.26171294775303 | erot = 1.4691550288396 | epot = -22.8708165336687 | etot = -19.1399485570761 -268000 ekin = 2.44836854545511 | erot = 2.9937425626706 | epot = -22.7570882008955 | etot = -17.3149770927698 -269000 ekin = 1.58300780634396 | erot = 3.22395730855789 | epot = -22.3907113081099 | etot = -17.5837461932081 -270000 ekin = 2.32322184760979 | erot = 3.06382421219438 | epot = -22.3881691749602 | etot = -17.001123115156 -271000 ekin = 3.60469687596824 | erot = 1.9797358598963 | epot = -22.4683966465291 | etot = -16.8839639106645 -272000 ekin = 3.51923106402285 | erot = 2.03023285354504 | epot = -22.4603583954676 | etot = -16.9108944778997 -273000 ekin = 2.11482184852541 | erot = 2.44627955820304 | epot = -22.3849709951286 | etot = -17.8238695884002 -274000 ekin = 1.92099330523926 | erot = 1.84100701949309 | epot = -22.4079231056523 | etot = -18.64592278092 -275000 ekin = 2.00926480279114 | erot = 2.3425841103212 | epot = -22.5238525372828 | etot = -18.1720036241704 -276000 ekin = 2.63097538006804 | erot = 2.50136285103272 | epot = -22.5353755283889 | etot = -17.4030372972882 -277000 ekin = 1.82015412793384 | erot = 1.70696131852909 | epot = -22.5292430541423 | etot = -19.0021276076793 -278000 ekin = 2.01769954373528 | erot = 2.59890230516084 | epot = -22.5906588225137 | etot = -17.9740569736176 -279000 ekin = 2.25640040624717 | erot = 2.29091139708182 | epot = -22.6277099788414 | etot = -18.0803981755124 -280000 ekin = 3.04018837983384 | erot = 2.20649234309561 | epot = -22.6234289166475 | etot = -17.376748193718 -281000 ekin = 2.26774972276864 | erot = 2.21425432655914 | epot = -22.6813285841657 | etot = -18.1993245348379 -282000 ekin = 2.97313150959962 | erot = 2.86622182739124 | epot = -22.7015431862321 | etot = -16.8621898492412 -283000 ekin = 2.50361895288103 | erot = 3.01017153845275 | epot = -22.6838734010489 | etot = -17.1700829097151 -284000 ekin = 2.07988501520726 | erot = 2.53369538735043 | epot = -22.6244057852699 | etot = -18.0108253827122 -285000 ekin = 2.63544742669395 | erot = 2.22184957642688 | epot = -22.6299704571646 | etot = -17.7726734540438 -286000 ekin = 3.28190504383103 | erot = 2.59924342945106 | epot = -22.6685734662042 | etot = -16.7874249929221 -287000 ekin = 2.5201730496864 | erot = 2.47409649915194 | epot = -22.6647398556855 | etot = -17.6704703068471 -288000 ekin = 1.72383940997515 | erot = 2.2989067867213 | epot = -22.5898062623046 | etot = -18.5670600656082 -289000 ekin = 1.84179788109765 | erot = 2.70369316308707 | epot = -22.47181336009 | etot = -17.9263223159052 -290000 ekin = 1.6715135413566 | erot = 2.58080004878555 | epot = -22.4106998409513 | etot = -18.1583862508092 -291000 ekin = 1.5215220538295 | erot = 2.73428237886897 | epot = -22.3556298896499 | etot = -18.0998254569515 -292000 ekin = 1.80629028335816 | erot = 2.0852735260545 | epot = -22.4535418049614 | etot = -18.5619779955488 -293000 ekin = 2.15472126777205 | erot = 2.19759927977713 | epot = -22.5557303698456 | etot = -18.2034098222964 -294000 ekin = 2.56152704015233 | erot = 2.8613616067162 | epot = -22.6398911758506 | etot = -17.2170025289821 -295000 ekin = 2.371265169146 | erot = 3.38251794814698 | epot = -22.6865354227056 | etot = -16.9327523054126 -296000 ekin = 2.03365878847188 | erot = 2.18393142873388 | epot = -22.6560933682687 | etot = -18.438503151063 -297000 ekin = 2.49621501086621 | erot = 2.10112805919269 | epot = -22.7035635415212 | etot = -18.1062204714623 -298000 ekin = 2.77842269503177 | erot = 3.3772341506228 | epot = -22.7119153133845 | etot = -16.5562584677299 -299000 ekin = 2.67707880841785 | erot = 2.98874558313004 | epot = -22.7666464233606 | etot = -17.1008220318128 -300000 ekin = 2.27178796654212 | erot = 2.26073784829731 | epot = -22.7766831409595 | etot = -18.2441573261201 -301000 ekin = 2.20083021797287 | erot = 3.3890245069517 | epot = -22.7273506022536 | etot = -17.137495877329 -302000 ekin = 2.96489064574833 | erot = 2.84356412203241 | epot = -22.6697893088022 | etot = -16.8613345410215 -303000 ekin = 2.31874098268026 | erot = 2.61961335705569 | epot = -22.6493939125616 | etot = -17.7110395728257 -304000 ekin = 2.72610257159623 | erot = 3.02709946331765 | epot = -22.6952460519591 | etot = -16.9420440170453 -305000 ekin = 2.63459003021214 | erot = 1.919675076019 | epot = -22.6686095819004 | etot = -18.1143444756693 -306000 ekin = 2.27957015123362 | erot = 2.30903194024744 | epot = -22.6205242146107 | etot = -18.0319221231296 -307000 ekin = 2.59039939360351 | erot = 1.72550416449957 | epot = -22.5760437098146 | etot = -18.2601401517115 -308000 ekin = 2.25862282018141 | erot = 2.6613420500591 | epot = -22.4810009931421 | etot = -17.5610361229016 -309000 ekin = 2.58156867056613 | erot = 1.38162183672195 | epot = -22.4520281277666 | etot = -18.4888376204785 -310000 ekin = 2.30199887399085 | erot = 3.49424058278129 | epot = -22.4502933105603 | etot = -16.6540538537882 -311000 ekin = 1.92151496683435 | erot = 3.702621790492 | epot = -22.3972021294092 | etot = -16.7730653720828 -312000 ekin = 1.83005087613798 | erot = 2.19341081660898 | epot = -22.3720470055312 | etot = -18.3485853127842 -313000 ekin = 1.92489041812718 | erot = 1.83277045127814 | epot = -22.490802859931 | etot = -18.7331419905256 -314000 ekin = 2.09288582482849 | erot = 3.1959722998652 | epot = -22.4338118394254 | etot = -17.1449537147317 -315000 ekin = 2.16369102652801 | erot = 2.93597548628521 | epot = -22.4469736533496 | etot = -17.3473071405364 -316000 ekin = 2.09245693384264 | erot = 1.807558537396 | epot = -22.3690695710527 | etot = -18.4690540998141 -317000 ekin = 2.36588943769063 | erot = 1.70568184689724 | epot = -22.3496046632177 | etot = -18.2780333786298 -318000 ekin = 1.83301083634324 | erot = 3.09521659572646 | epot = -22.3586080730087 | etot = -17.430380640939 -319000 ekin = 1.55798533508654 | erot = 2.374400525685 | epot = -22.3769508910799 | etot = -18.4445650303083 -320000 ekin = 2.96087389710191 | erot = 2.89099773614827 | epot = -22.4288122697123 | etot = -16.5769406364621 -321000 ekin = 3.19179841293413 | erot = 2.37305905207938 | epot = -22.5447709145936 | etot = -16.9799134495801 -322000 ekin = 3.10570427346294 | erot = 3.34188038301289 | epot = -22.580443523357 | etot = -16.1328588668812 -323000 ekin = 2.22962685798083 | erot = 2.03306866549118 | epot = -22.5997373536669 | etot = -18.3370418301949 -324000 ekin = 2.28811378374166 | erot = 2.14190372685336 | epot = -22.5597352990857 | etot = -18.1297177884906 -325000 ekin = 2.85757123939544 | erot = 2.33537312761609 | epot = -22.5231085637202 | etot = -17.3301641967086 -326000 ekin = 2.30070347083078 | erot = 2.23549787294263 | epot = -22.5151413151487 | etot = -17.9789399713752 -327000 ekin = 3.29082503272818 | erot = 1.92556360043753 | epot = -22.5231816508473 | etot = -17.3067930176816 -328000 ekin = 2.38165298551354 | erot = 1.63346978078624 | epot = -22.5231376952434 | etot = -18.5080149289436 -329000 ekin = 3.46430064220694 | erot = 2.33095343034691 | epot = -22.4569686289904 | etot = -16.6617145564365 -330000 ekin = 3.03486739022287 | erot = 2.39278089551369 | epot = -22.3332523924126 | etot = -16.905604106676 -331000 ekin = 2.30557375971102 | erot = 2.07089271354998 | epot = -22.2503996798711 | etot = -17.8739332066101 -332000 ekin = 1.60842407147764 | erot = 3.110396890796 | epot = -22.2247256358723 | etot = -17.5059046735987 -333000 ekin = 1.87112469334644 | erot = 3.30899727462101 | epot = -22.130065759788 | etot = -16.9499437918205 -334000 ekin = 2.39344914466899 | erot = 2.11606499087986 | epot = -22.052515122119 | etot = -17.5430009865702 -335000 ekin = 2.58946334556546 | erot = 2.68851920162594 | epot = -21.971164793944 | etot = -16.6931822467526 -336000 ekin = 2.41988877667505 | erot = 2.41525912575628 | epot = -21.8441556082519 | etot = -17.0090077058205 -337000 ekin = 2.33064340197969 | erot = 2.60509084649572 | epot = -21.8962678452425 | etot = -16.9605335967671 -338000 ekin = 1.96206714975463 | erot = 1.65377379268676 | epot = -21.8484931449949 | etot = -18.2326522025535 -339000 ekin = 1.55631939970369 | erot = 2.24373622444027 | epot = -21.8253755182891 | etot = -18.0253198941451 -340000 ekin = 2.70749090548453 | erot = 2.95739933680002 | epot = -21.8243135462175 | etot = -16.1594233039329 -341000 ekin = 2.44634541815133 | erot = 1.84695948440237 | epot = -21.9282158516816 | etot = -17.6349109491279 -342000 ekin = 2.51784295345496 | erot = 2.73626675676614 | epot = -21.9579426326808 | etot = -16.7038329224596 -343000 ekin = 3.41670961674692 | erot = 2.43111012770705 | epot = -21.9935092107186 | etot = -16.1456894662647 -344000 ekin = 2.58780800263767 | erot = 1.6930389050268 | epot = -22.0715354699269 | etot = -17.7906885622624 -345000 ekin = 2.57576456033189 | erot = 1.99487459437559 | epot = -22.1796629942929 | etot = -17.6090238395854 -346000 ekin = 2.40404980880465 | erot = 2.31288728866961 | epot = -22.1855258065435 | etot = -17.4685887090693 -347000 ekin = 2.28146784424865 | erot = 2.74513531512625 | epot = -22.2205619484594 | etot = -17.1939587890845 -348000 ekin = 2.26319568262242 | erot = 2.43454354691427 | epot = -22.2148038230762 | etot = -17.5170645935395 -349000 ekin = 1.98764147715107 | erot = 2.21856918820044 | epot = -22.2333110495202 | etot = -18.0271003841687 -350000 ekin = 2.08440088155067 | erot = 2.55841250738978 | epot = -22.2541078972618 | etot = -17.6112945083214 -351000 ekin = 2.38201758452314 | erot = 2.17974220056875 | epot = -22.2647718284383 | etot = -17.7030120433464 -352000 ekin = 2.75130853950625 | erot = 2.25801401818502 | epot = -22.2226031541769 | etot = -17.2132805964856 -353000 ekin = 2.39316894458245 | erot = 1.9622692189896 | epot = -22.1905585968626 | etot = -17.8351204332906 -354000 ekin = 2.60613964367264 | erot = 2.45699958173639 | epot = -22.0741463551659 | etot = -17.0110071297569 -355000 ekin = 1.80064206533144 | erot = 2.59773518186197 | epot = -22.011221342413 | etot = -17.6128440952196 -356000 ekin = 2.37699640398752 | erot = 3.09710102021834 | epot = -22.0299491911754 | etot = -16.5558517669695 -357000 ekin = 2.50986884955702 | erot = 1.91180399130884 | epot = -22.0481853325197 | etot = -17.6265124916538 -358000 ekin = 2.12558610604631 | erot = 2.6479682554889 | epot = -21.9447638703624 | etot = -17.1712095088272 -359000 ekin = 2.22688919900624 | erot = 2.23931556284384 | epot = -21.8085491928632 | etot = -17.3423444310132 -360000 ekin = 3.13527943466207 | erot = 2.8147567946821 | epot = -21.7902147579702 | etot = -15.840178528626 -361000 ekin = 2.71487331879396 | erot = 2.8877144694031 | epot = -21.8322461119152 | etot = -16.2296583237181 -362000 ekin = 2.515817675735 | erot = 3.0246147355251 | epot = -21.8359960107676 | etot = -16.2955635995075 -363000 ekin = 2.70354655291949 | erot = 2.04948095390169 | epot = -21.8699556802982 | etot = -17.116928173477 -364000 ekin = 2.34554467024059 | erot = 1.36382458642029 | epot = -21.9151567775916 | etot = -18.2057875209307 -365000 ekin = 2.00291957865484 | erot = 2.38153585819252 | epot = -21.8681661882236 | etot = -17.4837107513762 -366000 ekin = 2.16416218280056 | erot = 2.11489166860241 | epot = -21.7862692661643 | etot = -17.5072154147613 -367000 ekin = 2.90642004514044 | erot = 2.66688606213217 | epot = -21.7352532339732 | etot = -16.1619471267006 -368000 ekin = 2.23185601684558 | erot = 2.34205881571908 | epot = -21.7124134746584 | etot = -17.1384986420937 -369000 ekin = 2.15521118053823 | erot = 2.93659164111176 | epot = -21.6437028615637 | etot = -16.5519000399137 -370000 ekin = 2.4198441869984 | erot = 1.73242712802795 | epot = -21.6676625868509 | etot = -17.5153912718245 -371000 ekin = 2.30492028429812 | erot = 2.61127763357756 | epot = -21.6509011744132 | etot = -16.7347032565375 -372000 ekin = 2.96963579911545 | erot = 1.88141866012236 | epot = -21.6391346229962 | etot = -16.7880801637584 -373000 ekin = 3.14075275331208 | erot = 2.93731686024779 | epot = -21.6868881994144 | etot = -15.6088185858545 -374000 ekin = 3.04463795536237 | erot = 3.14447085467475 | epot = -21.7931849017047 | etot = -15.6040760916676 -375000 ekin = 2.39986353169888 | erot = 2.66264703557189 | epot = -21.7551227714398 | etot = -16.692612204169 -376000 ekin = 2.55064647974443 | erot = 2.67473669587464 | epot = -21.696903880931 | etot = -16.4715207053119 -377000 ekin = 2.8852049591096 | erot = 2.18098614239663 | epot = -21.6952272659367 | etot = -16.6290361644304 -378000 ekin = 2.45289138323383 | erot = 2.10679058068883 | epot = -21.7288468051836 | etot = -17.1691648412609 -379000 ekin = 2.53609345690701 | erot = 1.90940679695127 | epot = -21.7506211345922 | etot = -17.3051208807339 -380000 ekin = 2.72283735812631 | erot = 3.24838500978278 | epot = -21.7463635962089 | etot = -15.7751412282998 -381000 ekin = 2.45462865405655 | erot = 2.38504307590766 | epot = -21.7562222022035 | etot = -16.9165504722393 -382000 ekin = 1.80283057853964 | erot = 2.1374935723038 | epot = -21.6701942835523 | etot = -17.7298701327088 -383000 ekin = 1.73467369524417 | erot = 2.3108192426649 | epot = -21.6923619844203 | etot = -17.6468690465113 -384000 ekin = 1.9342846276238 | erot = 2.70905668846398 | epot = -21.7127338523707 | etot = -17.0693925362829 -385000 ekin = 1.68998612656995 | erot = 1.64115683316309 | epot = -21.7718687316805 | etot = -18.4407257719475 -386000 ekin = 1.78400139488241 | erot = 1.74778393778735 | epot = -21.836680877067 | etot = -18.3048955443972 -387000 ekin = 2.07818501197508 | erot = 2.07807279268733 | epot = -21.832055454303 | etot = -17.6757976496406 -388000 ekin = 1.66290950060047 | erot = 2.60797351732765 | epot = -21.8118307069785 | etot = -17.5409476890504 -389000 ekin = 2.21198900204585 | erot = 2.23421390729077 | epot = -21.7427524360538 | etot = -17.2965495267171 -390000 ekin = 1.66652818866883 | erot = 2.31347723913494 | epot = -21.7301442799172 | etot = -17.7501388521135 -391000 ekin = 1.8533948354001 | erot = 3.3132884098265 | epot = -21.8115260458304 | etot = -16.6448428006038 -392000 ekin = 1.58742216104324 | erot = 2.82110846571971 | epot = -21.8293545192998 | etot = -17.4208238925368 -393000 ekin = 2.11722620613808 | erot = 2.34344765418119 | epot = -21.8696915886196 | etot = -17.4090177283003 -394000 ekin = 1.75812741619619 | erot = 2.82419425154452 | epot = -21.8924899919106 | etot = -17.3101683241699 -395000 ekin = 1.65095705493153 | erot = 2.81412301374871 | epot = -21.9536401970573 | etot = -17.488560128377 -396000 ekin = 1.73767503056944 | erot = 2.21765951200349 | epot = -22.1029546817349 | etot = -18.147620139162 -397000 ekin = 1.77674477730128 | erot = 2.32452598687485 | epot = -22.2130001775225 | etot = -18.1117294133464 -398000 ekin = 2.65895177503898 | erot = 2.95633927860974 | epot = -22.2752931466756 | etot = -16.6600020930269 -399000 ekin = 2.03803363665377 | erot = 2.12344232072307 | epot = -22.2652656821057 | etot = -18.1037897247289 -400000 ekin = 2.04555714339347 | erot = 2.27233839044242 | epot = -22.3051350135305 | etot = -17.9872394796946 -401000 ekin = 2.15872349230843 | erot = 2.50519181279082 | epot = -22.3726160012138 | etot = -17.7087006961145 -402000 ekin = 2.37736861330784 | erot = 2.3210196208099 | epot = -22.4002021740759 | etot = -17.7018139399582 -403000 ekin = 2.46021709434135 | erot = 1.94696118347469 | epot = -22.4595514414876 | etot = -18.0523731636716 -404000 ekin = 2.77045691339541 | erot = 2.38769700494278 | epot = -22.6029152684925 | etot = -17.4447613501544 -405000 ekin = 2.3136465567458 | erot = 2.23279102592819 | epot = -22.704170194226 | etot = -18.1577326115521 -406000 ekin = 2.41170890033499 | erot = 2.77109231953927 | epot = -22.779806571174 | etot = -17.5970053512998 -407000 ekin = 2.35942219707683 | erot = 2.74328193450569 | epot = -22.836396275899 | etot = -17.7336921443165 -408000 ekin = 3.24790924688638 | erot = 1.7391244014667 | epot = -22.7651095148446 | etot = -17.7780758664915 -409000 ekin = 2.24830289645136 | erot = 2.34265544739425 | epot = -22.6995454603056 | etot = -18.1085871164599 -410000 ekin = 1.78296326417356 | erot = 2.10343999475669 | epot = -22.7273761758661 | etot = -18.8409729169359 -411000 ekin = 2.40205079722836 | erot = 2.79371172655516 | epot = -22.7437086077248 | etot = -17.5479460839413 -412000 ekin = 2.4827447274903 | erot = 2.66642432537184 | epot = -22.7490438870461 | etot = -17.5998748341839 -413000 ekin = 2.75975825991147 | erot = 1.99252624136793 | epot = -22.7296409338909 | etot = -17.9773564326115 -414000 ekin = 2.46171754591312 | erot = 1.56532549126561 | epot = -22.7020089470024 | etot = -18.6749659098237 -415000 ekin = 2.9412491128766 | erot = 2.93447949050541 | epot = -22.7167297662641 | etot = -16.8410011628821 -416000 ekin = 2.451529226545 | erot = 2.93177240269518 | epot = -22.679285885952 | etot = -17.2959842567118 -417000 ekin = 2.02304677035706 | erot = 2.34845196496212 | epot = -22.6359674216736 | etot = -18.2644686863544 -418000 ekin = 2.27202933065743 | erot = 2.78253971259171 | epot = -22.5709417374616 | etot = -17.5163726942125 -419000 ekin = 3.11399834748007 | erot = 1.5069444804289 | epot = -22.5346711742036 | etot = -17.9137283462946 -420000 ekin = 2.43157626989745 | erot = 2.33553639635962 | epot = -22.5241645646513 | etot = -17.7570518983943 -421000 ekin = 2.52273757815056 | erot = 1.68036667639443 | epot = -22.523670591424 | etot = -18.320566336879 -422000 ekin = 2.28707428015146 | erot = 1.95211017937543 | epot = -22.4864987695302 | etot = -18.2473143100033 -423000 ekin = 2.77128027363906 | erot = 1.83509225830907 | epot = -22.4676364752475 | etot = -17.8612639432993 -424000 ekin = 2.61658126968941 | erot = 1.92044025854228 | epot = -22.5053529183204 | etot = -17.9683313900887 -425000 ekin = 2.25690716213737 | erot = 2.3485630523016 | epot = -22.5471810198293 | etot = -17.9417108053903 -426000 ekin = 2.5401911697216 | erot = 1.58168199076436 | epot = -22.599451551521 | etot = -18.4775783910351 -427000 ekin = 2.61776589335417 | erot = 2.3289376640184 | epot = -22.673196553825 | etot = -17.7264929964524 -428000 ekin = 2.11718463198403 | erot = 3.04652352541351 | epot = -22.7510529806942 | etot = -17.5873448232966 -429000 ekin = 1.69509699892837 | erot = 2.32755685540312 | epot = -22.7391772285581 | etot = -18.7165233742266 -430000 ekin = 2.21470975507857 | erot = 2.51273009568295 | epot = -22.6682263206376 | etot = -17.9407864698761 -431000 ekin = 2.94401624259271 | erot = 2.52065679136838 | epot = -22.6769821981683 | etot = -17.2123091642072 -432000 ekin = 2.86039016721639 | erot = 2.10092531726113 | epot = -22.6856922787856 | etot = -17.7243767943081 -433000 ekin = 2.38577772852308 | erot = 1.92242037772747 | epot = -22.7525956133752 | etot = -18.4443975071246 -434000 ekin = 2.38240431006896 | erot = 2.10745905578944 | epot = -22.7586540042292 | etot = -18.2687906383708 -435000 ekin = 2.12286955240469 | erot = 2.34000354159217 | epot = -22.6319118730511 | etot = -18.1690387790542 -436000 ekin = 2.67385800386604 | erot = 2.59460579166868 | epot = -22.6404996973321 | etot = -17.3720359017973 -437000 ekin = 1.75959740929828 | erot = 2.43720192360986 | epot = -22.7030079938494 | etot = -18.5062086609412 -438000 ekin = 1.75120908430786 | erot = 2.28124118651858 | epot = -22.749190610227 | etot = -18.7167403394005 -439000 ekin = 1.75073242294502 | erot = 2.03624763446663 | epot = -22.7489457185962 | etot = -18.9619656611846 -440000 ekin = 2.07721967183055 | erot = 2.85858063288596 | epot = -22.8109744065491 | etot = -17.8751741018326 -441000 ekin = 1.60202985220682 | erot = 2.85100314352584 | epot = -22.7745689858311 | etot = -18.3215359900984 -442000 ekin = 2.27654314397087 | erot = 3.22274835717702 | epot = -22.7446035204748 | etot = -17.2453120193269 -443000 ekin = 1.93733014307339 | erot = 1.57432763299075 | epot = -22.7272800276947 | etot = -19.2156222516305 -444000 ekin = 1.75731366949631 | erot = 2.25504170254907 | epot = -22.6435278528204 | etot = -18.631172480775 -445000 ekin = 2.09887119167798 | erot = 2.26627204333156 | epot = -22.5193278168198 | etot = -18.1541845818103 -446000 ekin = 2.16625669770322 | erot = 2.62168464822181 | epot = -22.4290479239373 | etot = -17.6411065780122 -447000 ekin = 2.19819598279476 | erot = 2.11162819084596 | epot = -22.3774620810792 | etot = -18.0676379074385 -448000 ekin = 1.7755208645772 | erot = 1.64284712827749 | epot = -22.3894548684582 | etot = -18.9710868756035 -449000 ekin = 2.29637528825017 | erot = 1.5286287774847 | epot = -22.4548388263691 | etot = -18.6298347606342 -450000 ekin = 2.55872726173568 | erot = 1.95244709295837 | epot = -22.4761389570735 | etot = -17.9649646023794 -451000 ekin = 1.93483929977221 | erot = 1.57730203053738 | epot = -22.4721871402484 | etot = -18.9600458099388 -452000 ekin = 1.71591960523824 | erot = 4.15592526681975 | epot = -22.3869204664751 | etot = -16.5150755944171 -453000 ekin = 2.05784261741687 | erot = 2.49754472957529 | epot = -22.4247246256638 | etot = -17.8693372786717 -454000 ekin = 2.37473664452537 | erot = 3.37363200196795 | epot = -22.496641743959 | etot = -16.7482730974657 -455000 ekin = 1.73966540098562 | erot = 3.16990427576242 | epot = -22.3919175950499 | etot = -17.4823479183019 -456000 ekin = 2.41686819433944 | erot = 2.61137211811606 | epot = -22.3203430517439 | etot = -17.2921027392884 -457000 ekin = 2.87348571875052 | erot = 2.67840099268897 | epot = -22.3129445692579 | etot = -16.7610578578184 -458000 ekin = 1.89437239565888 | erot = 2.55463878014183 | epot = -22.4202394049443 | etot = -17.9712282291436 -459000 ekin = 1.87572781245208 | erot = 2.52613531614619 | epot = -22.4249057850463 | etot = -18.023042656448 -460000 ekin = 2.04813188453058 | erot = 2.20089271831971 | epot = -22.4011710022067 | etot = -18.1521463993564 -461000 ekin = 1.47247960021922 | erot = 1.40768398836064 | epot = -22.3586363246324 | etot = -19.4784727360526 -462000 ekin = 1.38503831902219 | erot = 2.34595020862052 | epot = -22.4837409423011 | etot = -18.7527524146584 -463000 ekin = 2.00645645258759 | erot = 1.18165989843029 | epot = -22.4806738518605 | etot = -19.2925575008426 -464000 ekin = 2.08237091480074 | erot = 3.07220535335028 | epot = -22.4836460827449 | etot = -17.3290698145939 -465000 ekin = 2.0456215542015 | erot = 1.86890585180634 | epot = -22.5174143411392 | etot = -18.6028869351313 -466000 ekin = 2.95986717673676 | erot = 2.11178510069291 | epot = -22.6235722981753 | etot = -17.5519200207456 -467000 ekin = 2.20953809644101 | erot = 2.57273746506495 | epot = -22.7571181950953 | etot = -17.9748426335893 -468000 ekin = 1.5902871353447 | erot = 2.01907967468793 | epot = -22.7769947042451 | etot = -19.1676278942124 -469000 ekin = 1.9462052385748 | erot = 2.93750281149461 | epot = -22.7672520333545 | etot = -17.8835439832851 -470000 ekin = 3.38174970242104 | erot = 2.36622797398471 | epot = -22.8494270221486 | etot = -17.1014493457428 -471000 ekin = 2.19235331714116 | erot = 1.88537594669814 | epot = -22.9012671707407 | etot = -18.8235379069014 -472000 ekin = 2.09266734001604 | erot = 2.08181669723127 | epot = -22.9459604070355 | etot = -18.7714763697882 -473000 ekin = 2.36590705985013 | erot = 2.6708545089404 | epot = -23.0062159802477 | etot = -17.9694544114572 -474000 ekin = 2.77035694449384 | erot = 2.3027678515899 | epot = -23.0283042070227 | etot = -17.955179410939 -475000 ekin = 2.81469924529784 | erot = 1.74801606053043 | epot = -22.9818727611313 | etot = -18.419157455303 -476000 ekin = 1.6614371664979 | erot = 2.66895679342948 | epot = -22.9607497426557 | etot = -18.6303557827283 -477000 ekin = 3.4013813766128 | erot = 2.47762083745631 | epot = -22.9863526077737 | etot = -17.1073503937045 -478000 ekin = 2.64900083423483 | erot = 1.91407757255602 | epot = -22.9956967968773 | etot = -18.4326183900864 -479000 ekin = 1.60377176066656 | erot = 2.03690854636729 | epot = -22.9622351913009 | etot = -19.321554884267 -480000 ekin = 2.06361598114192 | erot = 2.38288961387606 | epot = -22.9444711012275 | etot = -18.4979655062095 -481000 ekin = 3.10420446629087 | erot = 2.4564857948581 | epot = -22.8947513649008 | etot = -17.3340611037518 -482000 ekin = 3.72901587351966 | erot = 2.08724672578547 | epot = -22.7565389886474 | etot = -16.9402763893423 -483000 ekin = 2.80051858170061 | erot = 2.88284961334901 | epot = -22.621270459186 | etot = -16.9379022641364 -484000 ekin = 2.0110409785781 | erot = 3.72169931738832 | epot = -22.5566278703519 | etot = -16.8238875743855 -485000 ekin = 1.87367667342341 | erot = 2.09747077779511 | epot = -22.5747713031699 | etot = -18.6036238519514 -486000 ekin = 2.01419066693786 | erot = 1.53376047222564 | epot = -22.6617353485008 | etot = -19.1137842093373 -487000 ekin = 2.62466310274651 | erot = 2.8154565495424 | epot = -22.7635996267058 | etot = -17.3234799744169 -488000 ekin = 2.20017113992739 | erot = 2.63952142846597 | epot = -22.7912824752716 | etot = -17.9515899068783 -489000 ekin = 2.48973425231097 | erot = 1.93887082378345 | epot = -22.7821173566376 | etot = -18.3535122805431 -490000 ekin = 2.82031383172613 | erot = 2.1152704692751 | epot = -22.7439109707737 | etot = -17.8083266697725 -491000 ekin = 2.67150067218103 | erot = 2.60674263371376 | epot = -22.6902612982561 | etot = -17.4120179923614 -492000 ekin = 3.35859725231851 | erot = 2.09917303380754 | epot = -22.6792026914912 | etot = -17.2214324053652 -493000 ekin = 2.92706185972913 | erot = 2.61206418345318 | epot = -22.555890100553 | etot = -17.0167640573707 -494000 ekin = 3.40592557500485 | erot = 2.00651000685379 | epot = -22.4449277885912 | etot = -17.0324922067326 -495000 ekin = 2.82913240855034 | erot = 2.68876281432575 | epot = -22.3431571155508 | etot = -16.8252618926747 -496000 ekin = 2.68873100783268 | erot = 2.65459610018584 | epot = -22.3530288226937 | etot = -17.0097017146752 -497000 ekin = 2.15916102256083 | erot = 2.58178912964776 | epot = -22.3187762548927 | etot = -17.5778261026842 -498000 ekin = 2.1250851017953 | erot = 2.58172095004275 | epot = -22.2888001544895 | etot = -17.5819941026515 -499000 ekin = 2.34130861420783 | erot = 2.33488363451604 | epot = -22.3011081875454 | etot = -17.6249159388215 -500000 ekin = 2.85749511684744 | erot = 1.82527244658259 | epot = -22.3853764151975 | etot = -17.7026088517675 -501000 ekin = 2.41179591621454 | erot = 2.07214655971995 | epot = -22.4198306535951 | etot = -17.9358881776606 -502000 ekin = 2.0580038376515 | erot = 3.03025922314732 | epot = -22.4588141208809 | etot = -17.3705510600821 -503000 ekin = 2.24464497631497 | erot = 2.99486525785898 | epot = -22.4506192513903 | etot = -17.2111090172163 -504000 ekin = 1.80022602455725 | erot = 2.4742601796155 | epot = -22.4453216224399 | etot = -18.1708354182671 -505000 ekin = 2.44409230742744 | erot = 2.02809748474755 | epot = -22.50771443196 | etot = -18.035524639785 -506000 ekin = 2.53466734821408 | erot = 1.74485074876353 | epot = -22.5311895285302 | etot = -18.2516714315526 -507000 ekin = 3.23096993979711 | erot = 2.12667588504341 | epot = -22.5272680080029 | etot = -17.1696221831624 -508000 ekin = 2.87809924914958 | erot = 2.23647435070733 | epot = -22.5735852765105 | etot = -17.4590116766536 -509000 ekin = 3.09666803691483 | erot = 2.01344817227328 | epot = -22.5531322135987 | etot = -17.4430160044106 -510000 ekin = 2.89347551190587 | erot = 1.87907637088166 | epot = -22.5722142851241 | etot = -17.7996624023365 -511000 ekin = 2.89557048228876 | erot = 2.26727517274045 | epot = -22.6021965971202 | etot = -17.439350942091 -512000 ekin = 1.80499322219008 | erot = 2.06104103685542 | epot = -22.5082384805065 | etot = -18.642204221461 -513000 ekin = 1.86582605008159 | erot = 1.80881245799596 | epot = -22.4818731450098 | etot = -18.8072346369322 -514000 ekin = 1.66893021142187 | erot = 2.76856699398954 | epot = -22.5144633272087 | etot = -18.0769661217973 -515000 ekin = 2.16870417972369 | erot = 2.03793643176127 | epot = -22.5725374419723 | etot = -18.3658968304873 -516000 ekin = 1.95862575209641 | erot = 3.55790203033117 | epot = -22.5675974691126 | etot = -17.051069686685 -517000 ekin = 2.10116190921287 | erot = 1.8703746684216 | epot = -22.5643410282357 | etot = -18.5928044506012 -518000 ekin = 2.35762114087238 | erot = 2.34678356890067 | epot = -22.5789498872261 | etot = -17.874545177453 -519000 ekin = 1.4965579156146 | erot = 1.37620919030064 | epot = -22.5775405953339 | etot = -19.7047734894186 -520000 ekin = 2.20583131350858 | erot = 2.06518236580453 | epot = -22.6051420155062 | etot = -18.3341283361931 -521000 ekin = 2.11936831082606 | erot = 1.89313676730226 | epot = -22.6824826885911 | etot = -18.6699776104628 -522000 ekin = 2.43972156166519 | erot = 2.29575985894378 | epot = -22.7597964571688 | etot = -18.0243150365599 -523000 ekin = 2.47148532971583 | erot = 2.62592855606052 | epot = -22.8218100826241 | etot = -17.7243961968478 -524000 ekin = 2.83867159838233 | erot = 1.67228239212566 | epot = -22.9130691352048 | etot = -18.4021151446968 -525000 ekin = 2.33707759686424 | erot = 2.11666157542524 | epot = -22.9343168153401 | etot = -18.4805776430506 -526000 ekin = 2.78556314383173 | erot = 2.12502967301725 | epot = -22.9632272664466 | etot = -18.0526344495976 -527000 ekin = 2.67476397366556 | erot = 2.10678170752056 | epot = -23.0109160127258 | etot = -18.2293703315396 -528000 ekin = 3.11020438334646 | erot = 2.16717572821384 | epot = -23.0743097715177 | etot = -17.7969296599574 -529000 ekin = 1.90071372306354 | erot = 2.29269386063507 | epot = -23.0742513713216 | etot = -18.880843787623 -530000 ekin = 2.54935777739561 | erot = 3.44632009130416 | epot = -22.9815707708391 | etot = -16.9858929021393 -531000 ekin = 1.98646544552742 | erot = 1.84284731266331 | epot = -22.8840867927685 | etot = -19.0547740345778 -532000 ekin = 2.34497208518389 | erot = 2.20242825249901 | epot = -22.958017128877 | etot = -18.4106167911941 -533000 ekin = 2.04465189646124 | erot = 2.5988852213048 | epot = -23.0954673727488 | etot = -18.4519302549827 -534000 ekin = 2.18099982404014 | erot = 2.24509264512596 | epot = -23.1672915876949 | etot = -18.7411991185288 -535000 ekin = 2.46459047030509 | erot = 2.52567370572274 | epot = -23.2601041392818 | etot = -18.269839963254 -536000 ekin = 2.40944341542506 | erot = 3.07014221153817 | epot = -23.3294178896885 | etot = -17.8498322627253 -537000 ekin = 1.46836063591622 | erot = 3.04877831235775 | epot = -23.3582488035726 | etot = -18.8411098552986 -538000 ekin = 2.2322723564918 | erot = 1.93698675675114 | epot = -23.3840280699676 | etot = -19.2147689567247 -539000 ekin = 2.65850305482382 | erot = 1.70915364045623 | epot = -23.4835953822242 | etot = -19.1159386869442 -540000 ekin = 2.15389248554489 | erot = 1.94073382714967 | epot = -23.5227953658549 | etot = -19.4281690531603 -541000 ekin = 2.67641186082159 | erot = 2.24709344305834 | epot = -23.5427111580002 | etot = -18.6192058541203 -542000 ekin = 2.10429644506714 | erot = 2.41109271626466 | epot = -23.504268251071 | etot = -18.9888790897392 -543000 ekin = 1.88696147522521 | erot = 2.545986170319 | epot = -23.4573858832303 | etot = -19.0244382376861 -544000 ekin = 2.53894413626458 | erot = 1.83894339654212 | epot = -23.447037705898 | etot = -19.0691501730913 -545000 ekin = 2.2449929565181 | erot = 3.05817804399732 | epot = -23.6401013875395 | etot = -18.3369303870241 -546000 ekin = 2.38995007911114 | erot = 1.73896404887933 | epot = -23.6250705214727 | etot = -19.4961563934822 -547000 ekin = 2.53772946939786 | erot = 3.02671406060461 | epot = -23.6172206165977 | etot = -18.0527770865952 -548000 ekin = 2.30643053883799 | erot = 2.12291748181918 | epot = -23.6947786726432 | etot = -19.265430651986 -549000 ekin = 2.50325148970644 | erot = 2.43753928660968 | epot = -23.6482202119214 | etot = -18.7074294356052 -550000 ekin = 2.07278457584903 | erot = 1.98823624738949 | epot = -23.6224210624574 | etot = -19.5614002392189 -551000 ekin = 2.20187048094412 | erot = 2.1743107800257 | epot = -23.5352962443151 | etot = -19.1591149833453 -552000 ekin = 2.138048712317 | erot = 2.28135917444489 | epot = -23.5978298104151 | etot = -19.1784219236532 -553000 ekin = 2.42650743515903 | erot = 2.89235296005631 | epot = -23.5454068695436 | etot = -18.2265464743283 -554000 ekin = 2.31243694700819 | erot = 2.73411780294884 | epot = -23.4404612498823 | etot = -18.3939064999252 -555000 ekin = 2.25631450111253 | erot = 2.70826767236547 | epot = -23.3810480325839 | etot = -18.4164658591059 -556000 ekin = 2.42187654466562 | erot = 1.81816757766949 | epot = -23.3335658342219 | etot = -19.0935217118868 -557000 ekin = 2.89583868407859 | erot = 2.59800113316269 | epot = -23.348377375344 | etot = -17.8545375581027 -558000 ekin = 2.65744373001509 | erot = 2.27566901958148 | epot = -23.229384025348 | etot = -18.2962712757514 -559000 ekin = 2.40736894715472 | erot = 3.48404550901825 | epot = -23.2950530086045 | etot = -17.4036385524315 -560000 ekin = 2.51394452480884 | erot = 2.4472528185523 | epot = -23.3548725200314 | etot = -18.3936751766703 -561000 ekin = 2.78696960734098 | erot = 2.18117562469108 | epot = -23.367099011436 | etot = -18.3989537794039 -562000 ekin = 2.60590866354869 | erot = 1.82255499079639 | epot = -23.3670125949106 | etot = -18.9385489405655 -563000 ekin = 2.69475597498162 | erot = 2.75081051570648 | epot = -23.3213805671121 | etot = -17.875814076424 -564000 ekin = 2.62204591899764 | erot = 2.49524198212383 | epot = -23.2345685046841 | etot = -18.1172806035626 -565000 ekin = 2.67044367859168 | erot = 2.01330141540311 | epot = -23.2168974338887 | etot = -18.5331523398939 -566000 ekin = 2.13856275677523 | erot = 3.1447022522953 | epot = -23.162471502403 | etot = -17.8792064933325 -567000 ekin = 2.52010093960199 | erot = 2.13254469832705 | epot = -23.1518584744761 | etot = -18.499212836547 -568000 ekin = 2.28303629721264 | erot = 2.38209001003274 | epot = -23.1558738946393 | etot = -18.4907475873939 -569000 ekin = 3.02199429959192 | erot = 2.33409896439 | epot = -23.098858714014 | etot = -17.742765450032 -570000 ekin = 2.68736138164811 | erot = 2.91449049675473 | epot = -23.0516588224656 | etot = -17.4498069440628 -571000 ekin = 2.4201706123568 | erot = 2.30930147292481 | epot = -22.9494196307347 | etot = -18.2199475454531 -572000 ekin = 1.96101491359208 | erot = 3.17564644151202 | epot = -22.9019671727356 | etot = -17.7653058176315 -573000 ekin = 1.77231254512265 | erot = 3.2959074591727 | epot = -23.0329704228571 | etot = -17.9647504185618 -574000 ekin = 2.45195460796476 | erot = 2.33093773153734 | epot = -23.1880178627738 | etot = -18.4051255232717 -575000 ekin = 2.45020502461256 | erot = 2.4698820279554 | epot = -23.1834275192561 | etot = -18.2633404666881 -576000 ekin = 2.39426958146274 | erot = 2.18334419303673 | epot = -23.165586753046 | etot = -18.5879729785466 -577000 ekin = 2.42087612822122 | erot = 2.8078297015673 | epot = -23.1889846114073 | etot = -17.9602787816187 -578000 ekin = 2.47469593268156 | erot = 2.22291754195604 | epot = -23.1822026147549 | etot = -18.4845891401173 -579000 ekin = 1.99641516200814 | erot = 3.00564689499868 | epot = -23.2220374443818 | etot = -18.219975387375 -580000 ekin = 1.80326364254896 | erot = 2.62493677026808 | epot = -23.2725597079199 | etot = -18.8443592951029 -581000 ekin = 2.54320565466448 | erot = 2.56546557497723 | epot = -23.2936203171846 | etot = -18.1849490875429 -582000 ekin = 2.7760920595553 | erot = 1.7054369481595 | epot = -23.3188805344426 | etot = -18.8373515267278 -583000 ekin = 3.13415689631058 | erot = 2.13862743264097 | epot = -23.4032331278423 | etot = -18.1304487988907 -584000 ekin = 2.79256202281284 | erot = 1.86237066580274 | epot = -23.4507356031754 | etot = -18.7958029145598 -585000 ekin = 2.40352636193977 | erot = 1.43972962791954 | epot = -23.4948475688155 | etot = -19.6515915789562 -586000 ekin = 2.08429136741348 | erot = 2.19251166266265 | epot = -23.4108290375219 | etot = -19.1340260074458 -587000 ekin = 2.94108400136396 | erot = 2.57342077096898 | epot = -23.3540972375961 | etot = -17.8395924652632 -588000 ekin = 2.72217756938907 | erot = 2.61651915812691 | epot = -23.229726324284 | etot = -17.891029596768 -589000 ekin = 2.21949422254638 | erot = 2.3311223729484 | epot = -23.150949548888 | etot = -18.6003329533932 -590000 ekin = 1.81402039776171 | erot = 2.05517606383124 | epot = -23.0478545255486 | etot = -19.1786580639557 -591000 ekin = 1.58417624910412 | erot = 2.41463211542345 | epot = -23.0177633874473 | etot = -19.0189550229197 -592000 ekin = 1.98644093041263 | erot = 1.96551923696644 | epot = -22.9894017313741 | etot = -19.037441563995 -593000 ekin = 1.88204814648092 | erot = 1.95829012430934 | epot = -22.9815982306237 | etot = -19.1412599598334 -594000 ekin = 2.81360399014313 | erot = 2.15645684811238 | epot = -22.9751895785633 | etot = -18.0051287403077 -595000 ekin = 3.09138667876659 | erot = 1.85939570103404 | epot = -22.9585503153314 | etot = -18.0077679355308 -596000 ekin = 2.88475079255431 | erot = 1.99291497545754 | epot = -22.9694795630784 | etot = -18.0918137950666 -597000 ekin = 3.56180105071194 | erot = 2.46630922350926 | epot = -22.9861357432383 | etot = -16.9580254690171 -598000 ekin = 4.25212279079266 | erot = 2.48959233670472 | epot = -23.0214618233768 | etot = -16.2797466958794 -599000 ekin = 3.7244632603479 | erot = 2.76139687839883 | epot = -23.0721196129427 | etot = -16.5862594741959 -600000 ekin = 3.46467571149548 | erot = 1.76392307266267 | epot = -23.1890443898223 | etot = -17.9604456056642 -601000 ekin = 3.0310177628253 | erot = 3.28042241831116 | epot = -23.2392242833269 | etot = -16.9277841021904 -602000 ekin = 2.23251522550048 | erot = 1.93410139388427 | epot = -23.2748311690052 | etot = -19.1082145496205 -603000 ekin = 1.52395184313396 | erot = 2.30579905635095 | epot = -23.3079770801695 | etot = -19.4782261806846 -604000 ekin = 1.80277509473345 | erot = 3.26982922397805 | epot = -23.3021805347927 | etot = -18.2295762160812 -605000 ekin = 1.69061269141421 | erot = 2.90357416013347 | epot = -23.2880125710927 | etot = -18.693825719545 -606000 ekin = 2.35348879310444 | erot = 2.05826930628853 | epot = -23.2259863126357 | etot = -18.8142282132427 -607000 ekin = 2.98750155196662 | erot = 1.93245034618772 | epot = -23.1569905313344 | etot = -18.2370386331801 -608000 ekin = 3.25247562357662 | erot = 2.87367209024389 | epot = -23.1243437665535 | etot = -16.998196052733 -609000 ekin = 2.74562851506243 | erot = 2.46957178784349 | epot = -23.1378453224525 | etot = -17.9226450195466 -610000 ekin = 3.56937899101944 | erot = 1.85394286166138 | epot = -23.1342553563961 | etot = -17.7109335037153 -611000 ekin = 3.25034255711548 | erot = 2.16992689142413 | epot = -23.0420891001313 | etot = -17.6218196515917 -612000 ekin = 2.95654106669507 | erot = 2.13931254426743 | epot = -23.0506038845264 | etot = -17.9547502735639 -613000 ekin = 3.04973095155775 | erot = 1.87979868094329 | epot = -22.9901336683938 | etot = -18.0606040358928 -614000 ekin = 3.00995775064021 | erot = 1.70679828403894 | epot = -23.0067400319172 | etot = -18.2899839972381 -615000 ekin = 2.21837740297639 | erot = 2.65601107560568 | epot = -22.9594109490335 | etot = -18.0850224704514 -616000 ekin = 1.9492997573226 | erot = 2.08809832862859 | epot = -22.9058047688739 | etot = -18.8684066829227 -617000 ekin = 2.34987504209514 | erot = 3.31816085594407 | epot = -22.8092343894311 | etot = -17.1411984913919 -618000 ekin = 2.24263426864651 | erot = 2.25720621146615 | epot = -22.8020578987413 | etot = -18.3022174186286 -619000 ekin = 1.97180881105029 | erot = 2.07875245552439 | epot = -22.7569606401772 | etot = -18.7063993736025 -620000 ekin = 2.39044144530086 | erot = 2.89229500628476 | epot = -22.7088725220114 | etot = -17.4261360704257 -621000 ekin = 2.15150678521736 | erot = 2.30775677443908 | epot = -22.643940119738 | etot = -18.1846765600816 -622000 ekin = 2.0028430350823 | erot = 2.78278646933244 | epot = -22.600112912221 | etot = -17.8144834078063 -623000 ekin = 2.19528283622071 | erot = 2.14002571477316 | epot = -22.666620119306 | etot = -18.3313115683121 -624000 ekin = 2.82040068944897 | erot = 2.57349826686042 | epot = -22.7167317153813 | etot = -17.3228327590719 -625000 ekin = 2.98627918034148 | erot = 1.57679569211939 | epot = -22.7237278324305 | etot = -18.1606529599696 -626000 ekin = 2.37348083921872 | erot = 1.88550722657484 | epot = -22.7032586894344 | etot = -18.4442706236409 -627000 ekin = 2.35195177608881 | erot = 2.01446777503463 | epot = -22.7112770388174 | etot = -18.344857487694 -628000 ekin = 2.50881254425373 | erot = 1.56688558879362 | epot = -22.6405205013867 | etot = -18.5648223683393 -629000 ekin = 2.58514893297873 | erot = 1.70970168729388 | epot = -22.5610370580219 | etot = -18.2661864377493 -630000 ekin = 2.78720199311866 | erot = 2.91114841200295 | epot = -22.4713018556232 | etot = -16.7729514505016 -631000 ekin = 2.4617589215552 | erot = 2.66187466993095 | epot = -22.4061953621981 | etot = -17.282561770712 -632000 ekin = 2.67568812509024 | erot = 2.67916251422212 | epot = -22.3286212206811 | etot = -16.9737705813688 -633000 ekin = 2.42046368116991 | erot = 2.0959495936055 | epot = -22.2764051897282 | etot = -17.7599919149528 -634000 ekin = 2.1766138388507 | erot = 1.75221904598353 | epot = -22.2464672562848 | etot = -18.3176343714506 -635000 ekin = 2.1303374537182 | erot = 2.11558346598702 | epot = -22.1559890122107 | etot = -17.9100680925054 -636000 ekin = 2.03262388834245 | erot = 1.68380166560562 | epot = -22.2457935658938 | etot = -18.5293680119458 -637000 ekin = 2.39791285236697 | erot = 2.55917753311606 | epot = -22.4447998775231 | etot = -17.4877094920401 -638000 ekin = 2.15469983815169 | erot = 3.28400540345815 | epot = -22.4075976338996 | etot = -16.9688923922898 -639000 ekin = 1.81811684885083 | erot = 2.75659290480155 | epot = -22.3748011521987 | etot = -17.8000913985464 -640000 ekin = 1.99907387989529 | erot = 2.08952122746439 | epot = -22.3717813517436 | etot = -18.283186244384 -641000 ekin = 2.66328164143483 | erot = 3.02619691580941 | epot = -22.2647370196577 | etot = -16.5752584624134 -642000 ekin = 2.88967061145595 | erot = 2.59057169345598 | epot = -22.23475748516 | etot = -16.7545151802481 -643000 ekin = 2.79246415244629 | erot = 2.87517098573249 | epot = -22.2468989126934 | etot = -16.5792637745146 -644000 ekin = 2.27988542188579 | erot = 3.04855388745644 | epot = -22.2349136242582 | etot = -16.906474314916 -645000 ekin = 3.01613981708155 | erot = 2.4967822399052 | epot = -22.3345075492296 | etot = -16.8215854922429 -646000 ekin = 2.21704249586791 | erot = 2.60354951531734 | epot = -22.2671914610386 | etot = -17.4465994498533 -647000 ekin = 2.37597087431337 | erot = 2.09971950840957 | epot = -22.4060809913804 | etot = -17.9303906086575 -648000 ekin = 2.4714436262309 | erot = 2.63569146556463 | epot = -22.423642714225 | etot = -17.3165076224295 -649000 ekin = 2.53468077746691 | erot = 2.34586903824308 | epot = -22.358445267116 | etot = -17.477895451406 -650000 ekin = 2.9010220783452 | erot = 2.43748900585602 | epot = -22.235082780767 | etot = -16.8965716965658 -651000 ekin = 2.43937394370796 | erot = 2.32097040047332 | epot = -22.1007717206118 | etot = -17.3404273764305 -652000 ekin = 3.22983264752039 | erot = 1.97644426162264 | epot = -22.1139672910572 | etot = -16.9076903819141 -653000 ekin = 3.42414251849354 | erot = 2.79487810087101 | epot = -22.1558408334809 | etot = -15.9368202141163 -654000 ekin = 2.15889671735112 | erot = 2.36472973550593 | epot = -22.1974951138068 | etot = -17.6738686609497 -655000 ekin = 2.65852679982884 | erot = 1.70572386028398 | epot = -22.2627111956629 | etot = -17.8984605355501 -656000 ekin = 2.48541797006401 | erot = 2.06347531107756 | epot = -22.3150691564122 | etot = -17.7661758752707 -657000 ekin = 2.69778549496517 | erot = 2.20386261244986 | epot = -22.4300467083325 | etot = -17.5283986009175 -658000 ekin = 2.77197513377729 | erot = 2.5072948475956 | epot = -22.5474407814621 | etot = -17.2681708000892 -659000 ekin = 3.66874079211363 | erot = 2.11838086144899 | epot = -22.5519111820512 | etot = -16.7647895284886 -660000 ekin = 2.97388996619018 | erot = 2.92112069101806 | epot = -22.6187600322739 | etot = -16.7237493750657 -661000 ekin = 2.78763059394641 | erot = 2.30401970578286 | epot = -22.7111345560961 | etot = -17.6194842563668 -662000 ekin = 2.98299477151657 | erot = 1.34778890968014 | epot = -22.712605002436 | etot = -18.3818213212393 -663000 ekin = 2.06206406341935 | erot = 2.49091694129999 | epot = -22.6743419399864 | etot = -18.121360935267 -664000 ekin = 1.46165423849889 | erot = 1.88506472859125 | epot = -22.7282890093398 | etot = -19.3815700422497 -665000 ekin = 1.35273695073317 | erot = 2.42195808060362 | epot = -22.7162067017985 | etot = -18.9415116704617 -666000 ekin = 1.89921915483213 | erot = 1.88531092594892 | epot = -22.7370741866503 | etot = -18.9525441058693 -667000 ekin = 2.90243379314502 | erot = 1.97614154053879 | epot = -22.7577380902139 | etot = -17.8791627565301 -668000 ekin = 2.88439733908879 | erot = 3.01316244247058 | epot = -22.6944666694957 | etot = -16.7969068879363 -669000 ekin = 2.54687231970458 | erot = 2.87359405758465 | epot = -22.6569831183116 | etot = -17.2365167410224 -670000 ekin = 2.21301768070541 | erot = 2.27765188013648 | epot = -22.6308484396801 | etot = -18.1401788788382 -671000 ekin = 2.58683275746298 | erot = 2.41409834599394 | epot = -22.7246788592801 | etot = -17.7237477558232 -672000 ekin = 3.29079177090022 | erot = 1.91261376234837 | epot = -22.8001667297379 | etot = -17.5967611964893 -673000 ekin = 2.84673402140676 | erot = 3.00764974897873 | epot = -22.7284025915001 | etot = -16.8740188211146 -674000 ekin = 2.42053568766569 | erot = 2.26590883890938 | epot = -22.6284483786375 | etot = -17.9420038520624 -675000 ekin = 1.96378820155452 | erot = 2.06502777032928 | epot = -22.51415650415 | etot = -18.4853405322662 -676000 ekin = 2.37987332690053 | erot = 1.93897030281589 | epot = -22.4622738554879 | etot = -18.1434302257714 -677000 ekin = 2.62785237684978 | erot = 2.04858248933864 | epot = -22.4668107703719 | etot = -17.7903759041835 -678000 ekin = 2.06360362245241 | erot = 2.31478537085112 | epot = -22.4535526716361 | etot = -18.0751636783326 -679000 ekin = 2.29534664965827 | erot = 3.11695224810765 | epot = -22.5315135213968 | etot = -17.1192146236308 -680000 ekin = 2.77369826886665 | erot = 2.79006418020504 | epot = -22.5458781878731 | etot = -16.9821157388014 -681000 ekin = 2.53921147867385 | erot = 2.45485065209125 | epot = -22.6209291892887 | etot = -17.6268670585236 -682000 ekin = 2.49239283345666 | erot = 2.17277195118013 | epot = -22.5585253944368 | etot = -17.8933606098 -683000 ekin = 2.31649836542777 | erot = 1.55870522096413 | epot = -22.4825872818582 | etot = -18.6073836954663 -684000 ekin = 3.16310193002238 | erot = 2.41685736208791 | epot = -22.523230555191 | etot = -16.9432712630807 -685000 ekin = 3.45688595061428 | erot = 1.65797437511731 | epot = -22.5532406426393 | etot = -17.4383803169077 -686000 ekin = 3.07151502570858 | erot = 2.40426982374968 | epot = -22.5000639933867 | etot = -17.0242791439284 -687000 ekin = 2.88949352966058 | erot = 2.7238056050836 | epot = -22.3550217707533 | etot = -16.7417226360091 -688000 ekin = 1.80054884787415 | erot = 2.30103168557514 | epot = -22.2966882319421 | etot = -18.1951076984928 -689000 ekin = 2.64615904696514 | erot = 2.02804270215569 | epot = -22.2971499666841 | etot = -17.6229482175633 -690000 ekin = 2.74509582020304 | erot = 2.21308151884789 | epot = -22.2232873685679 | etot = -17.2651100295169 -691000 ekin = 3.22973625495416 | erot = 1.79659776362201 | epot = -22.1738233446911 | etot = -17.1474893261149 -692000 ekin = 3.29006251848601 | erot = 2.65455993734058 | epot = -22.1381299825657 | etot = -16.1935075267391 -693000 ekin = 3.00782385068016 | erot = 1.87988611083812 | epot = -22.0870866906686 | etot = -17.1993767291503 -694000 ekin = 2.75349969517394 | erot = 1.96196264346628 | epot = -22.0466569559902 | etot = -17.33119461735 -695000 ekin = 2.74843837441231 | erot = 2.04242579206469 | epot = -22.0120255611129 | etot = -17.2211613946359 -696000 ekin = 2.61118397057101 | erot = 2.51560421142858 | epot = -22.0291666802225 | etot = -16.9023784982229 -697000 ekin = 2.04895161009847 | erot = 2.41377542161681 | epot = -22.0475575829813 | etot = -17.5848305512661 -698000 ekin = 2.33205499894114 | erot = 1.26426607996476 | epot = -22.0891584682771 | etot = -18.4928373893712 -699000 ekin = 2.52365738372774 | erot = 2.88607619964718 | epot = -22.0575161973125 | etot = -16.6477826139376 -700000 ekin = 2.08703154176849 | erot = 3.31918856993651 | epot = -22.043496292523 | etot = -16.637276180818 -701000 ekin = 2.63454496534449 | erot = 1.84779300509081 | epot = -22.0766662152512 | etot = -17.5943282448159 -702000 ekin = 3.08829740869393 | erot = 1.78434998288706 | epot = -22.0748863622431 | etot = -17.2022389706621 -703000 ekin = 2.56007358655962 | erot = 2.26155500183646 | epot = -22.1026908977867 | etot = -17.2810623093906 -704000 ekin = 2.12477400999169 | erot = 2.08457952130484 | epot = -22.1230711325941 | etot = -17.9137176012976 -705000 ekin = 2.23099785424598 | erot = 2.02835190629231 | epot = -22.2359796293319 | etot = -17.9766298687936 -706000 ekin = 2.85888825530194 | erot = 2.83086143547529 | epot = -22.3500389599658 | etot = -16.6602892691886 -707000 ekin = 2.3480098030021 | erot = 2.49047973295143 | epot = -22.4420709095522 | etot = -17.6035813735987 -708000 ekin = 2.15687040039009 | erot = 1.89481927076687 | epot = -22.5427181126696 | etot = -18.4910284415126 -709000 ekin = 2.06126314379796 | erot = 2.64275166601122 | epot = -22.6917747885766 | etot = -17.9877599787674 -710000 ekin = 1.82554938445181 | erot = 2.07235995944929 | epot = -22.8201377385632 | etot = -18.9222283946621 -711000 ekin = 2.12298269627501 | erot = 1.73663135406234 | epot = -22.8023637488401 | etot = -18.9427496985027 -712000 ekin = 1.89441290644275 | erot = 1.81368671766166 | epot = -22.8122394708736 | etot = -19.1041398467692 -713000 ekin = 2.34039314906729 | erot = 2.24025735859079 | epot = -22.739230452663 | etot = -18.1585799450049 -714000 ekin = 2.23394879997726 | erot = 2.28215619335759 | epot = -22.7197007411881 | etot = -18.2035957478533 -715000 ekin = 2.57842687399601 | erot = 2.70596818962316 | epot = -22.7225303697053 | etot = -17.4381353060861 -716000 ekin = 2.777342167833 | erot = 2.9530742807956 | epot = -22.7551711123855 | etot = -17.0247546637569 -717000 ekin = 3.05821476760519 | erot = 1.70402888768233 | epot = -22.805004145031 | etot = -18.0427604897435 -718000 ekin = 2.58403702020119 | erot = 2.7276869575009 | epot = -22.8377652482164 | etot = -17.5260412705143 -719000 ekin = 4.04281043169349 | erot = 2.57288772340244 | epot = -22.765151213101 | etot = -16.1494530580051 -720000 ekin = 2.2626844436645 | erot = 2.05854032263456 | epot = -22.7210270971108 | etot = -18.3998023308117 -721000 ekin = 2.61229526180485 | erot = 1.50190620429945 | epot = -22.6872472176703 | etot = -18.573045751566 -722000 ekin = 2.12130222145933 | erot = 2.47430249425283 | epot = -22.6492037761001 | etot = -18.0535990603879 -723000 ekin = 2.34495921259014 | erot = 2.00001594177129 | epot = -22.6840132581792 | etot = -18.3390381038178 -724000 ekin = 1.60988468746473 | erot = 1.86898213056776 | epot = -22.7229141429322 | etot = -19.2440473248997 -725000 ekin = 1.98873703681155 | erot = 2.69421181813058 | epot = -22.7105382062835 | etot = -18.0275893513414 -726000 ekin = 2.00486594971194 | erot = 1.88744282533496 | epot = -22.7145995160264 | etot = -18.8222907409795 -727000 ekin = 2.36965727388931 | erot = 1.97771456567968 | epot = -22.7738359375483 | etot = -18.4264640979793 -728000 ekin = 3.35107369108538 | erot = 2.66873491563057 | epot = -22.8576831721942 | etot = -16.8378745654783 -729000 ekin = 2.78137391509267 | erot = 2.39427763566612 | epot = -22.9964454563738 | etot = -17.8207939056151 -730000 ekin = 2.94732376078577 | erot = 2.46572632898526 | epot = -23.061543959858 | etot = -17.648493870087 -731000 ekin = 2.3655947471903 | erot = 2.57962564204578 | epot = -23.1418772794081 | etot = -18.196656890172 -732000 ekin = 2.37054326957061 | erot = 2.27737906066013 | epot = -23.1533463942089 | etot = -18.5054240639782 -733000 ekin = 2.84223530802968 | erot = 2.87780967364454 | epot = -23.1651159858109 | etot = -17.4450710041367 -734000 ekin = 2.07281469390073 | erot = 2.84899684376724 | epot = -23.1266412632701 | etot = -18.2048297256022 -735000 ekin = 2.24252699011017 | erot = 2.42167788333885 | epot = -23.081639080379 | etot = -18.41743420693 -736000 ekin = 1.90429954179403 | erot = 2.00615427805272 | epot = -23.0665137080943 | etot = -19.1560598882476 -737000 ekin = 2.52358234623967 | erot = 2.96408613726945 | epot = -23.0498694785062 | etot = -17.562200994997 -738000 ekin = 2.29815228938801 | erot = 2.99337630493273 | epot = -23.0531374110373 | etot = -17.7616088167165 -739000 ekin = 2.10323839566883 | erot = 2.36218654019378 | epot = -23.1209183366636 | etot = -18.655493400801 -740000 ekin = 2.65902408892739 | erot = 2.31758820313662 | epot = -23.0239864631476 | etot = -18.0473741710836 -741000 ekin = 2.88509339134713 | erot = 1.74482801012006 | epot = -22.9368579089963 | etot = -18.3069365075291 -742000 ekin = 2.11922667941259 | erot = 1.93684947156234 | epot = -22.8269253642457 | etot = -18.7708492132708 -743000 ekin = 2.34108734337621 | erot = 2.36593738673209 | epot = -22.783708876953 | etot = -18.0766841468447 -744000 ekin = 2.01297679191398 | erot = 1.65216031512074 | epot = -22.7764820246243 | etot = -19.1113449175895 -745000 ekin = 1.73133017113515 | erot = 1.7176467257586 | epot = -22.6953133444038 | etot = -19.2463364475101 -746000 ekin = 1.93685820803391 | erot = 2.16961525795798 | epot = -22.6422856732894 | etot = -18.5358122072975 -747000 ekin = 2.71054987223223 | erot = 2.52037576286435 | epot = -22.6131171255895 | etot = -17.3821914904929 -748000 ekin = 2.55015048250253 | erot = 2.69537742835584 | epot = -22.6616400107092 | etot = -17.4161120998508 -749000 ekin = 2.4743403066993 | erot = 2.01464607005272 | epot = -22.6951524837167 | etot = -18.2061661069646 -750000 ekin = 2.72230033116892 | erot = 1.60952725065647 | epot = -22.7320627310186 | etot = -18.4002351491932 -751000 ekin = 2.51043142470836 | erot = 1.80224959894129 | epot = -22.6780351335436 | etot = -18.3653541098939 -752000 ekin = 2.63659326252806 | erot = 1.51190288425088 | epot = -22.5566638983436 | etot = -18.4081677515646 -753000 ekin = 2.22777724794013 | erot = 2.36906570543334 | epot = -22.6071335797283 | etot = -18.0102906263549 -754000 ekin = 1.90064002802585 | erot = 2.4987423398728 | epot = -22.5664713331287 | etot = -18.16708896523 -755000 ekin = 1.84097054781323 | erot = 1.81660989632982 | epot = -22.3243978570986 | etot = -18.6668174129556 -756000 ekin = 1.9072977215419 | erot = 3.47869439939258 | epot = -22.3139248457301 | etot = -16.9279327247956 -757000 ekin = 2.92648412859418 | erot = 2.35165714253905 | epot = -22.4032306892798 | etot = -17.1250894181466 -758000 ekin = 2.761119937725 | erot = 2.96029457936289 | epot = -22.4093833044993 | etot = -16.6879687874114 -759000 ekin = 2.05979468653478 | erot = 2.75306043529531 | epot = -22.3978407784686 | etot = -17.5849856566385 -760000 ekin = 3.29448360098896 | erot = 3.86438603184197 | epot = -22.4057510645732 | etot = -15.2468814317423 -761000 ekin = 3.09819348686662 | erot = 1.69735163369829 | epot = -22.3918604222945 | etot = -17.5963153017295 -762000 ekin = 2.8429808573394 | erot = 2.74696984027755 | epot = -22.2799634059086 | etot = -16.6900127082917 -763000 ekin = 2.40587022296419 | erot = 1.99761718955002 | epot = -22.2245473449275 | etot = -17.8210599324133 -764000 ekin = 2.69114689966729 | erot = 2.18706151254182 | epot = -22.1158949498055 | etot = -17.2376865375964 -765000 ekin = 2.02342407409198 | erot = 2.40755354133614 | epot = -22.0801918095988 | etot = -17.6492141941707 -766000 ekin = 2.55386945841861 | erot = 2.2735300120383 | epot = -21.9453814240006 | etot = -17.1179819535437 -767000 ekin = 2.25334005789491 | erot = 3.15616241457377 | epot = -21.9591848457648 | etot = -16.5496823732961 -768000 ekin = 2.00682883228694 | erot = 2.52417129595785 | epot = -21.9372106864373 | etot = -17.4062105581925 -769000 ekin = 2.23813402043546 | erot = 2.85559067422092 | epot = -21.9700652214807 | etot = -16.8763405268243 -770000 ekin = 1.95345812792707 | erot = 1.71037618652205 | epot = -22.0309481387955 | etot = -18.3671138243464 -771000 ekin = 2.03963170914285 | erot = 2.38748698255688 | epot = -22.0082391059021 | etot = -17.5811204142023 -772000 ekin = 2.06112217022411 | erot = 2.70000480403923 | epot = -22.0060196271604 | etot = -17.2448926528971 -773000 ekin = 2.1054473406836 | erot = 2.10438313024729 | epot = -21.9856087815605 | etot = -17.7757783106296 -774000 ekin = 2.20665293417965 | erot = 1.98309808383526 | epot = -21.9846800128842 | etot = -17.7949289948693 -775000 ekin = 1.91373997893468 | erot = 2.82262340642995 | epot = -22.0452968667144 | etot = -17.3089334813498 -776000 ekin = 2.19240734852453 | erot = 2.49078961967547 | epot = -22.091057561943 | etot = -17.407860593743 -777000 ekin = 1.49861623144733 | erot = 1.30695475237057 | epot = -22.160400003221 | etot = -19.3548290194031 -778000 ekin = 1.69531477096896 | erot = 3.17990102703017 | epot = -21.9433338643409 | etot = -17.0681180663417 -779000 ekin = 2.03408275108515 | erot = 2.02083644208248 | epot = -21.8692045577056 | etot = -17.814285364538 -780000 ekin = 2.32186745464909 | erot = 1.59799877907745 | epot = -21.779259403208 | etot = -17.8593931694815 -781000 ekin = 2.81943737654873 | erot = 2.33206120657135 | epot = -21.9280199462268 | etot = -16.7765213631068 -782000 ekin = 2.78999918307152 | erot = 2.82490724099864 | epot = -21.9063368325378 | etot = -16.2914304084676 -783000 ekin = 2.75260781814664 | erot = 1.86132573030769 | epot = -21.9418725483536 | etot = -17.3279389998993 -784000 ekin = 2.98284408884117 | erot = 2.76354560233502 | epot = -21.920715473795 | etot = -16.1743257826188 -785000 ekin = 2.2365893692682 | erot = 1.78861508275494 | epot = -21.8288977108099 | etot = -17.8036932587867 -786000 ekin = 2.14414777981649 | erot = 2.07159716672848 | epot = -21.8686345308374 | etot = -17.6528895842924 -787000 ekin = 2.47319429252999 | erot = 2.28522145597639 | epot = -21.7568224131044 | etot = -16.998406664598 -788000 ekin = 2.2037125656444 | erot = 2.94983992744806 | epot = -21.807401237665 | etot = -16.6538487445726 -789000 ekin = 1.90039797522133 | erot = 2.52747460130211 | epot = -21.733582185717 | etot = -17.3057096091936 -790000 ekin = 1.84303835442002 | erot = 1.52778835767436 | epot = -21.8138250805319 | etot = -18.4429983684375 -791000 ekin = 2.55973906062281 | erot = 2.07623433695467 | epot = -21.8760673428163 | etot = -17.2400939452388 -792000 ekin = 1.64105723574641 | erot = 2.51498077776481 | epot = -21.8705113566728 | etot = -17.7144733431616 -793000 ekin = 2.18354187889159 | erot = 2.48490382483639 | epot = -21.9577315408449 | etot = -17.2892858371169 -794000 ekin = 2.82327663056602 | erot = 3.3208090455501 | epot = -21.9401298111912 | etot = -15.7960441350751 -795000 ekin = 3.35539827663487 | erot = 3.31260020346181 | epot = -21.9264520382708 | etot = -15.2584535581741 -796000 ekin = 2.40740867688621 | erot = 1.57597595059244 | epot = -21.9748654474447 | etot = -17.991480819966 -797000 ekin = 2.79764140160881 | erot = 3.21306683298178 | epot = -21.8960553216211 | etot = -15.8853470870305 -798000 ekin = 2.75235345571032 | erot = 2.16726736660523 | epot = -21.9467263944678 | etot = -17.0271055721522 -799000 ekin = 2.76203245885878 | erot = 2.97689904095233 | epot = -21.8743227138698 | etot = -16.1353912140587 -800000 ekin = 2.81032669767261 | erot = 2.21645039580168 | epot = -21.874383510595 | etot = -16.8476064171207 -801000 ekin = 3.36862076335485 | erot = 2.36357276514919 | epot = -21.8196797425216 | etot = -16.0874862140175 -802000 ekin = 3.17839060401735 | erot = 2.37456159755556 | epot = -21.6942373686297 | etot = -16.1412851670568 -803000 ekin = 2.57363536086741 | erot = 1.72140865671985 | epot = -21.5847418534903 | etot = -17.289697835903 -804000 ekin = 2.40212767593722 | erot = 1.81298666067406 | epot = -21.5293497123863 | etot = -17.314235375775 -805000 ekin = 2.77711079955076 | erot = 2.46558169578922 | epot = -21.6187696645293 | etot = -16.3760771691893 -806000 ekin = 2.55163537095457 | erot = 2.07829064761593 | epot = -21.5175633688748 | etot = -16.8876373503043 -807000 ekin = 2.16828861417546 | erot = 2.14909333685052 | epot = -21.4370785365412 | etot = -17.1196965855152 -808000 ekin = 1.52247178905684 | erot = 2.6826614265022 | epot = -21.3105524860528 | etot = -17.1054192704938 -809000 ekin = 1.92812857984838 | erot = 1.43056331824491 | epot = -21.1839259115906 | etot = -17.8252340134973 -810000 ekin = 2.22251801029333 | erot = 2.58813475636527 | epot = -21.1788629745341 | etot = -16.3682102078755 -811000 ekin = 2.30282325024527 | erot = 1.43949319809354 | epot = -21.1417336792482 | etot = -17.3994172309094 -812000 ekin = 2.15941343791814 | erot = 2.89500994256604 | epot = -21.1419338778617 | etot = -16.0875104973775 -813000 ekin = 2.32954389313432 | erot = 2.41977402200041 | epot = -21.1892335081721 | etot = -16.4399155930374 -814000 ekin = 2.26485001316768 | erot = 1.98538164115157 | epot = -21.1932468666377 | etot = -16.9430152123184 -815000 ekin = 2.41630590364713 | erot = 2.99255527397409 | epot = -21.1098074992862 | etot = -15.700946321665 -816000 ekin = 2.67026011582709 | erot = 2.65041733757061 | epot = -21.1150624925932 | etot = -15.7943850391955 -817000 ekin = 2.26330508431116 | erot = 2.44986465102853 | epot = -21.1331844070825 | etot = -16.4200146717428 -818000 ekin = 2.20996514807098 | erot = 3.727109097134 | epot = -21.1017127717073 | etot = -15.1646385265024 -819000 ekin = 2.57394897351115 | erot = 3.00884410677579 | epot = -21.041932430768 | etot = -15.4591393504811 -820000 ekin = 2.6269546487903 | erot = 2.28213489416385 | epot = -21.0722371160471 | etot = -16.163147573093 -821000 ekin = 2.61364324263858 | erot = 2.35068554002091 | epot = -21.1855362753227 | etot = -16.2212074926632 -822000 ekin = 2.36817941179088 | erot = 2.29408928197165 | epot = -21.224917006927 | etot = -16.5626483131645 -823000 ekin = 2.75982209175738 | erot = 2.28480205814775 | epot = -21.3426772027003 | etot = -16.2980530527951 -824000 ekin = 1.50978044541751 | erot = 2.23801949349373 | epot = -21.3865247649546 | etot = -17.6387248260434 -825000 ekin = 1.83128269423152 | erot = 2.38147378919583 | epot = -21.4614886551422 | etot = -17.2487321717148 -826000 ekin = 2.51131465952168 | erot = 2.83805149504081 | epot = -21.4681680733736 | etot = -16.1188019188111 -827000 ekin = 2.46554499044043 | erot = 2.50199323815042 | epot = -21.4572012069778 | etot = -16.4896629783869 -828000 ekin = 2.41378793908818 | erot = 1.68202937429718 | epot = -21.4539863774251 | etot = -17.3581690640397 -829000 ekin = 2.4681575394398 | erot = 2.76556063553637 | epot = -21.6061033580493 | etot = -16.3723851830731 -830000 ekin = 2.50947351976231 | erot = 1.95946819770171 | epot = -21.6566904098634 | etot = -17.1877486923994 -831000 ekin = 2.69088795720236 | erot = 2.34186880436294 | epot = -21.6751650606748 | etot = -16.6424082991095 -832000 ekin = 1.54455154996055 | erot = 2.80525631028289 | epot = -21.7300917306615 | etot = -17.380283870418 -833000 ekin = 1.60055229673051 | erot = 3.14700223857927 | epot = -21.7718768340911 | etot = -17.0243222987814 -834000 ekin = 1.58616945483838 | erot = 1.86597500790458 | epot = -21.7880513273337 | etot = -18.3359068645908 -835000 ekin = 3.47114373337366 | erot = 2.09781333604001 | epot = -21.8771549098142 | etot = -16.3081978404005 -836000 ekin = 2.71067283785106 | erot = 3.26177139393205 | epot = -22.0614513419415 | etot = -16.0890071101583 -837000 ekin = 2.82278761249275 | erot = 2.64917318251883 | epot = -22.2428744107532 | etot = -16.7709136157417 -838000 ekin = 2.86323560044783 | erot = 2.96285563085687 | epot = -22.3579310822412 | etot = -16.5318398509365 -839000 ekin = 2.91010528600405 | erot = 1.78968409868876 | epot = -22.3931377567277 | etot = -17.6933483720349 -840000 ekin = 2.68501939036542 | erot = 1.84551444209968 | epot = -22.4099858160921 | etot = -17.879451983627 -841000 ekin = 2.78761718016806 | erot = 2.07511139278678 | epot = -22.4502333935977 | etot = -17.5875048206429 -842000 ekin = 2.30765580411605 | erot = 2.05774495041193 | epot = -22.4188744128232 | etot = -18.0534736582952 -843000 ekin = 2.34438101892177 | erot = 2.29420407093426 | epot = -22.4349024679563 | etot = -17.7963173781003 -844000 ekin = 2.00792674828049 | erot = 2.31767327257805 | epot = -22.4786582023913 | etot = -18.1530581815328 -845000 ekin = 2.55136030290324 | erot = 2.34385902090199 | epot = -22.4799883641885 | etot = -17.5847690403832 -846000 ekin = 3.24095798236659 | erot = 2.35217012971054 | epot = -22.5063540497827 | etot = -16.9132259377056 -847000 ekin = 2.03834455975138 | erot = 2.30020941454582 | epot = -22.5309995762754 | etot = -18.1924456019782 -848000 ekin = 2.83373620504456 | erot = 2.13136296315047 | epot = -22.509666561527 | etot = -17.544567393332 -849000 ekin = 2.30412012601641 | erot = 2.33744771805384 | epot = -22.4861027555015 | etot = -17.8445349114312 -850000 ekin = 1.52103738969765 | erot = 2.15323991690878 | epot = -22.5147792441637 | etot = -18.8405019375573 -851000 ekin = 1.85927261161487 | erot = 2.05456043679611 | epot = -22.41752057705 | etot = -18.503687528639 -852000 ekin = 1.35588514515989 | erot = 1.9167555928276 | epot = -22.3689199481736 | etot = -19.0962792101861 -853000 ekin = 2.3850184465024 | erot = 2.13310598794891 | epot = -22.4485532426469 | etot = -17.9304288081955 -854000 ekin = 3.24160358995203 | erot = 2.86289112951559 | epot = -22.5134229014302 | etot = -16.4089281819626 -855000 ekin = 2.13481228779989 | erot = 1.96664100945254 | epot = -22.4546662618353 | etot = -18.3532129645828 -856000 ekin = 2.50184794641609 | erot = 1.67720759103887 | epot = -22.3993038611807 | etot = -18.2202483237257 -857000 ekin = 3.36467068168789 | erot = 2.39681039692234 | epot = -22.3226520614655 | etot = -16.5611709828553 -858000 ekin = 2.48664620814186 | erot = 2.35813115829077 | epot = -22.272278975303 | etot = -17.4275016088704 -859000 ekin = 2.32018019421645 | erot = 2.34139041664418 | epot = -22.2193920346789 | etot = -17.5578214238183 -860000 ekin = 2.22338714949804 | erot = 2.59608961594502 | epot = -22.2078599697903 | etot = -17.3883832043473 -861000 ekin = 2.78084194233445 | erot = 1.92482892867366 | epot = -22.1430552159866 | etot = -17.4373843449785 -862000 ekin = 2.44005485500116 | erot = 2.71281255016884 | epot = -22.1159986211262 | etot = -16.9631312159562 -863000 ekin = 2.24234987838148 | erot = 3.79312130641057 | epot = -22.0841490674594 | etot = -16.0486778826673 -864000 ekin = 3.01456697615184 | erot = 2.29303363412973 | epot = -22.1234826076905 | etot = -16.815881997409 -865000 ekin = 2.16000819632291 | erot = 2.15780299713575 | epot = -22.1287456416268 | etot = -17.8109344481681 -866000 ekin = 1.81163527021121 | erot = 2.32024755104635 | epot = -22.1499759612014 | etot = -18.0180931399439 -867000 ekin = 2.25540445662073 | erot = 3.35667286394567 | epot = -22.1512265495476 | etot = -16.5391492289812 -868000 ekin = 2.12606109236403 | erot = 2.09577443816696 | epot = -22.1889361717519 | etot = -17.9671006412209 -869000 ekin = 3.01588764102674 | erot = 2.28014407542063 | epot = -22.221302584169 | etot = -16.9252708677216 -870000 ekin = 2.40773894902557 | erot = 3.40007074283947 | epot = -22.1952409397611 | etot = -16.387431247896 -871000 ekin = 3.32703715357026 | erot = 3.46064712451054 | epot = -22.207619940406 | etot = -15.4199356623252 -872000 ekin = 2.67470986735512 | erot = 2.18306697620401 | epot = -22.2188283181498 | etot = -17.3610514745907 -873000 ekin = 2.52072696526388 | erot = 2.1369508485849 | epot = -22.2519152847091 | etot = -17.5942374708604 -874000 ekin = 2.27694681653708 | erot = 1.90405870618916 | epot = -22.2119486941003 | etot = -18.0309431713741 -875000 ekin = 3.04326947271929 | erot = 2.81417576356414 | epot = -22.2207355347687 | etot = -16.3632902984853 -876000 ekin = 2.65936305160015 | erot = 2.00688506244317 | epot = -22.2254483507339 | etot = -17.5592002366906 -877000 ekin = 2.1218906050998 | erot = 2.12108610918076 | epot = -22.2199840422449 | etot = -17.9770073279643 -878000 ekin = 2.04330658320778 | erot = 2.19234207701539 | epot = -22.2416061573535 | etot = -18.0059574971303 -879000 ekin = 2.32331088859055 | erot = 1.79314356421366 | epot = -22.2511349493271 | etot = -18.1346804965229 -880000 ekin = 2.7191684680603 | erot = 2.50780771372557 | epot = -22.3211844971675 | etot = -17.0942083153816 -881000 ekin = 1.99457026442112 | erot = 2.42028761684275 | epot = -22.3291049337298 | etot = -17.9142470524659 -882000 ekin = 2.17848471304109 | erot = 2.10936064799446 | epot = -22.4203903692112 | etot = -18.1325450081757 -883000 ekin = 1.77867952654183 | erot = 2.64915979670231 | epot = -22.4714725630276 | etot = -18.0436332397834 -884000 ekin = 2.14335954946475 | erot = 1.84960097278838 | epot = -22.5511502290244 | etot = -18.5581897067713 -885000 ekin = 2.1737296921439 | erot = 1.1224465172794 | epot = -22.6177136264329 | etot = -19.3215374170096 -886000 ekin = 2.42905198250288 | erot = 2.95855698435737 | epot = -22.6235099833459 | etot = -17.2359010164856 -887000 ekin = 2.48421926935623 | erot = 2.38511493603948 | epot = -22.6296650575404 | etot = -17.7603308521447 -888000 ekin = 2.70449841183027 | erot = 2.37632299730154 | epot = -22.6283104195123 | etot = -17.5474890103805 -889000 ekin = 2.16954131372983 | erot = 2.33019249573093 | epot = -22.6936030299779 | etot = -18.1938692205171 -890000 ekin = 2.47926329860922 | erot = 2.33896915658922 | epot = -22.6494572776992 | etot = -17.8312248225007 -891000 ekin = 1.94552918338144 | erot = 2.18077529869467 | epot = -22.6609703311569 | etot = -18.5346658490808 -892000 ekin = 2.28162371339856 | erot = 2.3088525744332 | epot = -22.6825434447643 | etot = -18.0920671569325 -893000 ekin = 2.88680394731139 | erot = 2.10479527485689 | epot = -22.6297583991013 | etot = -17.638159176933 -894000 ekin = 2.22095391000543 | erot = 2.6955566302385 | epot = -22.5465758433209 | etot = -17.6300653030769 -895000 ekin = 2.78422464609227 | erot = 2.65463994767233 | epot = -22.5353839067237 | etot = -17.0965193129591 -896000 ekin = 2.36290673766564 | erot = 2.68569415977408 | epot = -22.5147457657546 | etot = -17.4661448683149 -897000 ekin = 2.78793396360212 | erot = 2.64131273496852 | epot = -22.5414816276965 | etot = -17.1122349291259 -898000 ekin = 2.3402778901712 | erot = 2.19036014594362 | epot = -22.5104750621796 | etot = -17.9798370260648 -899000 ekin = 2.66788181923082 | erot = 2.47623824735052 | epot = -22.4660137235249 | etot = -17.3218936569435 -900000 ekin = 1.59318336723961 | erot = 2.21998911769617 | epot = -22.5347550915857 | etot = -18.7215826066499 -901000 ekin = 2.06417516984273 | erot = 2.10877138148894 | epot = -22.5774386825736 | etot = -18.4044921312419 -902000 ekin = 1.92723308146077 | erot = 2.68515165308711 | epot = -22.5481083061021 | etot = -17.9357235715542 -903000 ekin = 1.80993467873556 | erot = 1.57695529654776 | epot = -22.5323996660651 | etot = -19.1455096907817 -904000 ekin = 1.95575183245312 | erot = 2.60436945067914 | epot = -22.5256682806408 | etot = -17.9655469975085 -905000 ekin = 2.49381768733875 | erot = 1.66773826407627 | epot = -22.4993840902563 | etot = -18.3378281388413 -906000 ekin = 2.70456575671731 | erot = 2.32922683721416 | epot = -22.5151218166898 | etot = -17.4813292227584 -907000 ekin = 3.43903944265671 | erot = 3.0307204788449 | epot = -22.5299571834398 | etot = -16.0601972619382 -908000 ekin = 2.37356952619769 | erot = 2.64936438196245 | epot = -22.516942166439 | etot = -17.4940082582789 -909000 ekin = 2.1860703025731 | erot = 2.13921305901071 | epot = -22.5153521800656 | etot = -18.1900688184818 -910000 ekin = 2.24010023383653 | erot = 1.8514435260008 | epot = -22.5113320632559 | etot = -18.4197883034186 -911000 ekin = 2.67585852173789 | erot = 3.85348226422502 | epot = -22.4699249030924 | etot = -15.9405841171295 -912000 ekin = 3.64657818361083 | erot = 2.2905143551155 | epot = -22.4162004746889 | etot = -16.4791079359625 -913000 ekin = 2.77291999770499 | erot = 2.1022397931402 | epot = -22.2869766697588 | etot = -17.4118168789136 -914000 ekin = 1.89079293131433 | erot = 1.61085972457271 | epot = -22.2125075199665 | etot = -18.7108548640794 -915000 ekin = 2.29207178481568 | erot = 2.8656606451286 | epot = -22.1499813962335 | etot = -16.9922489662893 -916000 ekin = 2.37906860202164 | erot = 2.93218592813836 | epot = -22.1637836439351 | etot = -16.8525291137751 -917000 ekin = 2.59326894380189 | erot = 1.59995350665161 | epot = -22.1382449385233 | etot = -17.9450224880698 -918000 ekin = 2.59372186080417 | erot = 3.48686361915462 | epot = -22.1117393261149 | etot = -16.0311538461561 -919000 ekin = 3.63953975205853 | erot = 2.58422541764726 | epot = -22.1104945479772 | etot = -15.8867293782714 -920000 ekin = 2.78492990282824 | erot = 1.86208025423285 | epot = -22.0733276968689 | etot = -17.4263175398078 -921000 ekin = 3.07307788316298 | erot = 1.56848168882074 | epot = -22.0450316551233 | etot = -17.4034720831396 -922000 ekin = 2.52896264126303 | erot = 2.06804264923523 | epot = -22.0195361349236 | etot = -17.4225308444253 -923000 ekin = 2.61981998522111 | erot = 2.66954469306772 | epot = -22.0457463967354 | etot = -16.7563817184466 -924000 ekin = 2.29381022514437 | erot = 2.49801555366746 | epot = -22.0170239220671 | etot = -17.2251981432553 -925000 ekin = 2.34625944949207 | erot = 3.19587785236191 | epot = -22.028094746344 | etot = -16.4859574444901 -926000 ekin = 2.1499233373865 | erot = 2.05823289292907 | epot = -22.0551986731856 | etot = -17.84704244287 -927000 ekin = 2.70495872901843 | erot = 1.96917479663366 | epot = -22.0956495975482 | etot = -17.4215160718961 -928000 ekin = 2.20438880519295 | erot = 2.76887961394763 | epot = -22.1039091543987 | etot = -17.1306407352581 -929000 ekin = 1.66382307176874 | erot = 2.62906085068005 | epot = -22.1726645871649 | etot = -17.8797806647161 -930000 ekin = 2.44828303043728 | erot = 2.44689226426912 | epot = -22.2529456791372 | etot = -17.3577703844308 -931000 ekin = 2.34172371844874 | erot = 1.78034954048635 | epot = -22.3194053510458 | etot = -18.1973320921107 -932000 ekin = 2.86526138273858 | erot = 3.26408148037739 | epot = -22.3255275519233 | etot = -16.1961846888074 -933000 ekin = 2.82342195482862 | erot = 3.6937351987852 | epot = -22.2580157348403 | etot = -15.7408585812265 -934000 ekin = 2.38157885575329 | erot = 3.09818957660776 | epot = -22.1592884972713 | etot = -16.6795200649102 -935000 ekin = 2.47849108316876 | erot = 1.92075328373161 | epot = -22.0961420624139 | etot = -17.6968976955135 -936000 ekin = 2.49397604910015 | erot = 2.55601396404453 | epot = -22.0064014399899 | etot = -16.9564114268453 -937000 ekin = 2.6918648576103 | erot = 3.47263294076258 | epot = -22.0234522240484 | etot = -15.8589544256755 -938000 ekin = 2.48873697071885 | erot = 2.3615977813032 | epot = -21.9576739595259 | etot = -17.1073392075039 -939000 ekin = 2.7056760578856 | erot = 1.42055121093474 | epot = -22.0193047024759 | etot = -17.8930774336556 -940000 ekin = 2.88189239926779 | erot = 2.54211609996475 | epot = -21.963323771107 | etot = -16.5393152718745 -941000 ekin = 2.44770794558597 | erot = 1.8579190466837 | epot = -21.9343286748115 | etot = -17.6287016825418 -942000 ekin = 2.61959568530468 | erot = 2.22532128272654 | epot = -21.9353530015567 | etot = -17.0904360335255 -943000 ekin = 2.54153612965671 | erot = 2.71959375806095 | epot = -21.9843720500752 | etot = -16.7232421623575 -944000 ekin = 2.57930166684081 | erot = 1.60562519751619 | epot = -21.9098609218899 | etot = -17.7249340575329 -945000 ekin = 2.26017628750984 | erot = 2.67831094836454 | epot = -21.8967586325953 | etot = -16.958271396721 -946000 ekin = 2.56313399941445 | erot = 2.76984355108528 | epot = -21.885121080301 | etot = -16.5521435298013 -947000 ekin = 1.72889278969055 | erot = 1.57454364668031 | epot = -21.8264681047052 | etot = -18.5230316683343 -948000 ekin = 1.42819481646296 | erot = 2.04503560450747 | epot = -21.8391184541439 | etot = -18.3658880331735 -949000 ekin = 1.74199608841338 | erot = 1.96409283987733 | epot = -21.8667949303421 | etot = -18.1607060020513 -950000 ekin = 1.55764652514141 | erot = 2.39695530807616 | epot = -21.8856003991517 | etot = -17.9309985659341 -951000 ekin = 1.63932624900687 | erot = 2.1627973168229 | epot = -21.9503862126057 | etot = -18.1482626467759 -952000 ekin = 1.89086480907742 | erot = 2.49708005969823 | epot = -21.9454729492793 | etot = -17.5575280805036 -953000 ekin = 2.44055170062751 | erot = 2.14431771118738 | epot = -21.8959489835736 | etot = -17.3110795717587 -954000 ekin = 2.14487831289196 | erot = 3.08443398263928 | epot = -21.795825093512 | etot = -16.5665127979808 -955000 ekin = 1.60221367612371 | erot = 3.5308242347527 | epot = -21.6951891429404 | etot = -16.562151232064 -956000 ekin = 2.86347770563429 | erot = 2.69138834272026 | epot = -21.6556631266882 | etot = -16.1007970783337 -957000 ekin = 2.76520094154603 | erot = 2.16152614675844 | epot = -21.6435053042083 | etot = -16.7167782159039 -958000 ekin = 3.29226660028984 | erot = 2.62876087991651 | epot = -21.5934941292417 | etot = -15.6724666490354 -959000 ekin = 2.66337479749112 | erot = 1.93770218849588 | epot = -21.5642990170474 | etot = -16.9632220310604 -960000 ekin = 2.86423754644722 | erot = 2.19410745878017 | epot = -21.5177124722279 | etot = -16.4593674670006 -961000 ekin = 2.48295179178335 | erot = 2.43234834813273 | epot = -21.5213073923115 | etot = -16.6060072523954 -962000 ekin = 1.68087651110994 | erot = 2.11605214746261 | epot = -21.5272991731175 | etot = -17.730370514545 -963000 ekin = 2.12197709458218 | erot = 1.94777002069826 | epot = -21.5235663501543 | etot = -17.4538192348738 -964000 ekin = 2.50733406625421 | erot = 2.86610278796474 | epot = -21.6134414980076 | etot = -16.2400046437886 -965000 ekin = 2.48599183654717 | erot = 1.79499031304665 | epot = -21.5880837540441 | etot = -17.3071016044502 -966000 ekin = 2.00894333039795 | erot = 2.33897690805447 | epot = -21.6770932400157 | etot = -17.3291730015632 -967000 ekin = 2.50955412880022 | erot = 2.78273184372279 | epot = -21.7722886206001 | etot = -16.4800026480771 -968000 ekin = 2.39889345353743 | erot = 2.01767642165489 | epot = -21.8155202641564 | etot = -17.3989503889641 -969000 ekin = 2.28246497162226 | erot = 2.6610436899411 | epot = -21.8367533421236 | etot = -16.8932446805602 -970000 ekin = 2.23203775830392 | erot = 2.52493315465349 | epot = -21.7968010714725 | etot = -17.0398301585151 -971000 ekin = 2.35522817907367 | erot = 3.39194300680609 | epot = -21.8814762448495 | etot = -16.1343050589698 -972000 ekin = 2.92268851492039 | erot = 2.10931174667369 | epot = -21.8978389761888 | etot = -16.8658387145947 -973000 ekin = 2.77937322332655 | erot = 3.20264340638929 | epot = -21.8742816810463 | etot = -15.8922650513305 -974000 ekin = 2.49009389085376 | erot = 2.32800875868964 | epot = -21.7820748340866 | etot = -16.9639721845432 -975000 ekin = 2.72033534996219 | erot = 3.65469302721884 | epot = -21.7224052943306 | etot = -15.3473769171495 -976000 ekin = 2.71017392247357 | erot = 2.02557906552618 | epot = -21.6961182780945 | etot = -16.9603652900947 -977000 ekin = 2.17702730116704 | erot = 2.60235136270384 | epot = -21.6180913127583 | etot = -16.8387126488875 -978000 ekin = 1.77849232321391 | erot = 1.99858920804759 | epot = -21.5849000297842 | etot = -17.8078184985227 -979000 ekin = 2.48810087232518 | erot = 2.63640222059576 | epot = -21.6371898197889 | etot = -16.5126867268679 -980000 ekin = 1.82633711731844 | erot = 2.05813667598699 | epot = -21.6585229341326 | etot = -17.7740491408271 -981000 ekin = 1.91146199713101 | erot = 1.90004529483666 | epot = -21.7219076944834 | etot = -17.9104004025157 -982000 ekin = 1.58901547008885 | erot = 2.3998948195541 | epot = -21.7861972103806 | etot = -17.7972869207376 -983000 ekin = 1.90990791777794 | erot = 2.80966645725473 | epot = -21.7824009478711 | etot = -17.0628265728384 -984000 ekin = 3.04220145268175 | erot = 1.69588850289015 | epot = -21.8411397187458 | etot = -17.1030497631739 -985000 ekin = 2.78368169036401 | erot = 2.92615311813614 | epot = -21.9523851434087 | etot = -16.2425503349085 -986000 ekin = 2.49557629947763 | erot = 3.0544158396407 | epot = -21.9474177819392 | etot = -16.3974256428209 -987000 ekin = 2.94534789449803 | erot = 1.85813505015918 | epot = -21.9308646063833 | etot = -17.1273816617261 -988000 ekin = 3.20975095732697 | erot = 3.54928250010428 | epot = -21.8260823230639 | etot = -15.0670488656326 -989000 ekin = 2.92872893558337 | erot = 2.50053850131553 | epot = -21.7939177563688 | etot = -16.3646503194699 -990000 ekin = 1.94245878607124 | erot = 2.64876037239901 | epot = -21.7891875584096 | etot = -17.1979683999394 -991000 ekin = 2.17972550210194 | erot = 2.86510777418376 | epot = -21.8197503596152 | etot = -16.7749170833296 -992000 ekin = 2.52496188361677 | erot = 2.72509937739588 | epot = -21.7730940251365 | etot = -16.5230327641239 -993000 ekin = 2.06107125732198 | erot = 2.79131355143356 | epot = -21.7326833691733 | etot = -16.8802985604177 -994000 ekin = 2.40031262466104 | erot = 2.5219233481115 | epot = -21.7261274920277 | etot = -16.8038915192551 -995000 ekin = 1.80633536079933 | erot = 2.07468376575716 | epot = -21.7283755003117 | etot = -17.8473563737552 -996000 ekin = 2.61788487499682 | erot = 2.63730746697003 | epot = -21.6837220732346 | etot = -16.4285297312677 -997000 ekin = 3.17513078038726 | erot = 2.07778272001357 | epot = -21.6151676277683 | etot = -16.3622541273675 -998000 ekin = 2.82648577435409 | erot = 2.39219801181103 | epot = -21.4967856271291 | etot = -16.278101840964 -999000 ekin = 2.15841415676437 | erot = 2.8705487674429 | epot = -21.4943522577851 | etot = -16.4653893335778 -1000000 ekin = 2.16735910095287 | erot = 2.44618830827923 | epot = -21.395427974522 | etot = -16.7818805652899 - 1000000 0.096327071 -1.3608937 0.023679494 -1.2017543 -3.298683e-05 -Loop time of 28.7478 on 1 procs for 1000000 steps with 16 atoms - -Performance: 30054.487 tau/day, 34785.286 timesteps/s -99.2% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 23.177 | 23.177 | 23.177 | 0.0 | 80.62 -Bond | 0.9075 | 0.9075 | 0.9075 | 0.0 | 3.16 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 0.19114 | 0.19114 | 0.19114 | 0.0 | 0.66 -Output | 8e-06 | 8e-06 | 8e-06 | 0.0 | 0.00 -Modify | 4.1695 | 4.1695 | 4.1695 | 0.0 | 14.50 -Other | | 0.303 | | | 1.05 - -Nlocal: 16.0 ave 16.0 max 16.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 89.0 ave 89.0 max 89.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 89 -Ave neighs/atom = 5.5625 -Ave special neighs/atom = 3.75 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:28 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.4 deleted file mode 100644 index 773305140b..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.30Jun20.duplex2.g++.4 +++ /dev/null @@ -1,1176 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 2 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex2 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 16 atoms - reading velocities ... - 16 velocities - 16 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 13 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.004 seconds - -set atom * mass 3.1575 - 16 settings made for mass - -group all type 1 4 -16 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna/fene -bond_coeff * 2.0 0.25 0.7525 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxstk -pair_coeff * * oxdna/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna/stk seqav ${T} 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/stk seqav 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna/hbond seqav 1.077 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna/coaxstk 46.0 0.4 0.6 0.22 0.58 2.0 2.541592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 -0.65 2.0 -0.65 - -# NVE ensemble -#fix 1 all nve/dot -fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -fix 1 all nve/dotc/langevin 0.1 ${T} 0.03 457145 angmom 10 -fix 1 all nve/dotc/langevin 0.1 0.1 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 1.9560004 - ghost atom cutoff = 2.5 - binsize = 0.97800022, bins = 41 41 41 - 5 neighbor lists, perpetual/occasional/extra = 5 0 0 - (1) pair oxdna/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -0 ekin = 0 | erot = 0 | epot = -24.5312382023598 | etot = -24.5312382023598 -Per MPI rank memory allocation (min/avg/max) = 7.73 | 7.787 | 7.844 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.5402493 0.0070469125 -1.5332024 6.0760034e-06 -1000 ekin = 1.34565986428024 | erot = 2.31051421234078 | epot = -24.5061991591502 | etot = -20.8500250825292 -2000 ekin = 2.15911766687235 | erot = 2.16031365874706 | epot = -24.4723177103698 | etot = -20.1528863847504 -3000 ekin = 3.26561948796015 | erot = 2.75651822936605 | epot = -24.412573068346 | etot = -18.3904353510198 -4000 ekin = 1.92438809241066 | erot = 2.12016940074985 | epot = -24.3496233970111 | etot = -20.3050659038505 -5000 ekin = 1.35986357015476 | erot = 1.99413493074226 | epot = -24.2789445616949 | etot = -20.9249460607979 -6000 ekin = 2.19432475124593 | erot = 1.74281260409078 | epot = -24.2128064295788 | etot = -20.2756690742421 -7000 ekin = 2.65619274477635 | erot = 1.74094257048458 | epot = -24.1673462333493 | etot = -19.7702109180883 -8000 ekin = 2.51333548501169 | erot = 2.34649854571052 | epot = -24.0812769481836 | etot = -19.2214429174614 -9000 ekin = 2.24506493169711 | erot = 2.0652555461504 | epot = -23.9906736063989 | etot = -19.6803531285514 -10000 ekin = 2.36632635249862 | erot = 1.79592471761529 | epot = -23.9002627850602 | etot = -19.7380117149463 -11000 ekin = 2.03296432220126 | erot = 1.687070009478 | epot = -23.8527188138995 | etot = -20.1326844822202 -12000 ekin = 2.65352743446956 | erot = 2.50226345616878 | epot = -23.8480805937578 | etot = -18.6922897031194 -13000 ekin = 1.89067421214403 | erot = 2.35043092595414 | epot = -23.7714712440931 | etot = -19.5303661059949 -14000 ekin = 1.90680463918722 | erot = 2.12745987027399 | epot = -23.7545354032947 | etot = -19.7202708938335 -15000 ekin = 2.40428667481004 | erot = 2.06172433796653 | epot = -23.6726347642127 | etot = -19.2066237514361 -16000 ekin = 2.7510166356243 | erot = 1.18896277635344 | epot = -23.5745121257654 | etot = -19.6345327137876 -17000 ekin = 2.44090826892662 | erot = 2.38166706806441 | epot = -23.5888433865641 | etot = -18.766268049573 -18000 ekin = 2.16977970545217 | erot = 2.46915729098831 | epot = -23.6023194416344 | etot = -18.9633824451939 -19000 ekin = 2.19378610033861 | erot = 2.45183819484609 | epot = -23.5449084745393 | etot = -18.8992841793546 -20000 ekin = 2.07734013817241 | erot = 1.81448496219961 | epot = -23.5782673056893 | etot = -19.6864422053173 -21000 ekin = 2.27781532351243 | erot = 2.76369118136086 | epot = -23.5986545956161 | etot = -18.5571480907428 -22000 ekin = 2.69375785791379 | erot = 1.86436952967315 | epot = -23.5521083325077 | etot = -18.9939809449207 -23000 ekin = 1.99952884103097 | erot = 2.28032953163857 | epot = -23.4448504933921 | etot = -19.1649921207226 -24000 ekin = 2.19993258930349 | erot = 2.97916455146848 | epot = -23.365299008021 | etot = -18.1862018672491 -25000 ekin = 2.28089469652686 | erot = 2.97627567077201 | epot = -23.2873526827526 | etot = -18.0301823154537 -26000 ekin = 1.99390998801617 | erot = 2.79250495479074 | epot = -23.1859723519608 | etot = -18.3995574091539 -27000 ekin = 2.00992865272585 | erot = 2.66533768693446 | epot = -23.0781687640813 | etot = -18.402902424421 -28000 ekin = 2.00322172723407 | erot = 2.36418499091004 | epot = -23.0032647032354 | etot = -18.6358579850913 -29000 ekin = 2.52361436071784 | erot = 2.06140753694879 | epot = -22.9685706338047 | etot = -18.383548736138 -30000 ekin = 1.94969919616482 | erot = 2.13601590002587 | epot = -22.8657664932105 | etot = -18.7800513970198 -31000 ekin = 1.81286761012387 | erot = 2.31717861791922 | epot = -22.8372197907213 | etot = -18.7071735626782 -32000 ekin = 1.88389491638451 | erot = 2.00512246825909 | epot = -22.9321024454487 | etot = -19.0430850608051 -33000 ekin = 1.78524470387102 | erot = 1.83154598239148 | epot = -22.9538943248059 | etot = -19.3371036385434 -34000 ekin = 2.28023843988047 | erot = 3.11357086039974 | epot = -23.0617618407572 | etot = -17.667952540477 -35000 ekin = 2.88795920533174 | erot = 1.81662227096289 | epot = -23.1342233361349 | etot = -18.4296418598403 -36000 ekin = 2.40018487148211 | erot = 2.59182059399979 | epot = -23.2153198761915 | etot = -18.2233144107096 -37000 ekin = 2.22699211630433 | erot = 1.73889017332475 | epot = -23.2291614908027 | etot = -19.2632792011737 -38000 ekin = 2.13593461964592 | erot = 3.07590136326315 | epot = -23.1607724763685 | etot = -17.9489364934594 -39000 ekin = 2.08839393640823 | erot = 2.80471150509566 | epot = -23.1352878747759 | etot = -18.242182433272 -40000 ekin = 2.94982054413846 | erot = 2.19484102372241 | epot = -23.1842229043853 | etot = -18.0395613365244 -41000 ekin = 2.47855373480179 | erot = 3.46795094832272 | epot = -23.1698888629099 | etot = -17.2233841797854 -42000 ekin = 2.57225931171306 | erot = 3.11160980977123 | epot = -23.0914425999525 | etot = -17.4075734784682 -43000 ekin = 2.16695829201326 | erot = 2.67063324875935 | epot = -22.9841690345739 | etot = -18.1465774938013 -44000 ekin = 2.3251045436594 | erot = 3.31069456451415 | epot = -22.9099977707014 | etot = -17.2741986625279 -45000 ekin = 1.8593572517472 | erot = 3.48256913429864 | epot = -22.7853293556222 | etot = -17.4434029695763 -46000 ekin = 2.59906260222481 | erot = 2.2320785378511 | epot = -22.67184319375 | etot = -17.8407020536741 -47000 ekin = 1.90419350976819 | erot = 3.39352467596445 | epot = -22.5624536061979 | etot = -17.2647354204652 -48000 ekin = 2.46191536162942 | erot = 2.50024189038397 | epot = -22.5888330081063 | etot = -17.6266757560929 -49000 ekin = 3.18008619674969 | erot = 2.18329398142911 | epot = -22.6110647388652 | etot = -17.2476845606864 -50000 ekin = 2.92380640638812 | erot = 1.5483538313346 | epot = -22.6682279672282 | etot = -18.1960677295054 -51000 ekin = 2.8672950322524 | erot = 2.67529217516736 | epot = -22.6748886664557 | etot = -17.132301459036 -52000 ekin = 2.30283827457733 | erot = 1.82645474029551 | epot = -22.6607030819086 | etot = -18.5314100670358 -53000 ekin = 3.18697616339314 | erot = 1.6721126504968 | epot = -22.7158951183044 | etot = -17.8568063044145 -54000 ekin = 2.63274995193147 | erot = 1.96664130685842 | epot = -22.7877787224364 | etot = -18.1883874636465 -55000 ekin = 3.18311630681889 | erot = 2.85127254864952 | epot = -22.8390589862477 | etot = -16.8046701307793 -56000 ekin = 2.55275960671528 | erot = 3.05720384772626 | epot = -22.8187750450683 | etot = -17.2088115906267 -57000 ekin = 2.43682051944964 | erot = 3.45782031837858 | epot = -22.7770565571277 | etot = -16.8824157192995 -58000 ekin = 1.93888380963701 | erot = 2.51321017005837 | epot = -22.7135987564736 | etot = -18.2615047767782 -59000 ekin = 2.5584899615086 | erot = 3.52166542523796 | epot = -22.6623202639297 | etot = -16.5821648771831 -60000 ekin = 2.80661395039301 | erot = 2.89055248290058 | epot = -22.5801959967487 | etot = -16.8830295634551 -61000 ekin = 2.68598657973729 | erot = 2.54741083070049 | epot = -22.4806361765055 | etot = -17.2472387660677 -62000 ekin = 2.74493324548126 | erot = 2.23648307303268 | epot = -22.4129547813458 | etot = -17.4315384628319 -63000 ekin = 2.65627195091607 | erot = 2.46107949280746 | epot = -22.3986334001314 | etot = -17.2812819564079 -64000 ekin = 2.12379240032878 | erot = 2.79203441675509 | epot = -22.3495990435982 | etot = -17.4337722265143 -65000 ekin = 1.86782238979936 | erot = 2.70277079938777 | epot = -22.3710220966341 | etot = -17.8004289074469 -66000 ekin = 2.74983103317414 | erot = 1.93532287297332 | epot = -22.3642892005434 | etot = -17.679135294396 -67000 ekin = 2.51092055125345 | erot = 2.46618624666166 | epot = -22.3997780561407 | etot = -17.4226712582256 -68000 ekin = 2.95469759114171 | erot = 1.97026833535318 | epot = -22.465077041847 | etot = -17.5401111153521 -69000 ekin = 2.60179538487172 | erot = 2.27022574694886 | epot = -22.4013876082185 | etot = -17.529366476398 -70000 ekin = 2.38624525335422 | erot = 2.82124637267727 | epot = -22.3329612644328 | etot = -17.1254696384013 -71000 ekin = 2.6264191985346 | erot = 2.8933242992384 | epot = -22.3324946257813 | etot = -16.8127511280083 -72000 ekin = 2.93199679301318 | erot = 2.83600213853039 | epot = -22.4418753486332 | etot = -16.6738764170896 -73000 ekin = 2.20521324648382 | erot = 3.05063841714452 | epot = -22.5078076718832 | etot = -17.2519560082549 -74000 ekin = 2.16594519672766 | erot = 2.82993872672919 | epot = -22.5187768617569 | etot = -17.5228929383001 -75000 ekin = 1.52753824412461 | erot = 1.91758574309004 | epot = -22.6434864113427 | etot = -19.198362424128 -76000 ekin = 1.89477517532867 | erot = 2.83145375092216 | epot = -22.7507099037207 | etot = -18.0244809774698 -77000 ekin = 2.84722966394523 | erot = 3.20523918524772 | epot = -22.8263123696514 | etot = -16.7738435204584 -78000 ekin = 2.44900478430451 | erot = 2.80964787966681 | epot = -22.811923730311 | etot = -17.5532710663397 -79000 ekin = 2.16549328835507 | erot = 1.67531288307153 | epot = -22.8278994273521 | etot = -18.9870932559255 -80000 ekin = 2.38929173610466 | erot = 2.5835599737549 | epot = -22.7453472674482 | etot = -17.7724955575887 -81000 ekin = 2.74182188149 | erot = 1.92580771183152 | epot = -22.6872721828912 | etot = -18.0196425895697 -82000 ekin = 1.90254633515813 | erot = 1.70958501101744 | epot = -22.5904815431895 | etot = -18.9783501970139 -83000 ekin = 1.63862423461032 | erot = 1.87668722448406 | epot = -22.5030898166236 | etot = -18.9877783575292 -84000 ekin = 1.65768128899531 | erot = 2.10186039233844 | epot = -22.4199436013011 | etot = -18.6604019199674 -85000 ekin = 2.40787065796921 | erot = 2.04965431830703 | epot = -22.3401854879212 | etot = -17.882660511645 -86000 ekin = 2.51073542405177 | erot = 1.79768841940749 | epot = -22.3948638623201 | etot = -18.0864400188608 -87000 ekin = 2.13729284484532 | erot = 1.97886338867606 | epot = -22.4457225556766 | etot = -18.3295663221553 -88000 ekin = 1.7511616822056 | erot = 2.36434608342923 | epot = -22.4232555875235 | etot = -18.3077478218887 -89000 ekin = 1.85498863251071 | erot = 3.29466014836524 | epot = -22.4615925106509 | etot = -17.3119437297749 -90000 ekin = 2.22730928223451 | erot = 2.36761183779185 | epot = -22.5498488806969 | etot = -17.9549277606706 -91000 ekin = 2.40026068010467 | erot = 3.13124542611032 | epot = -22.5445138059197 | etot = -17.0130076997047 -92000 ekin = 2.69184894487886 | erot = 3.01111638487596 | epot = -22.5488335054242 | etot = -16.8458681756694 -93000 ekin = 3.04452081584098 | erot = 3.02893158250343 | epot = -22.4857514998612 | etot = -16.4122991015168 -94000 ekin = 3.21054020599498 | erot = 1.87554208928456 | epot = -22.58235617796 | etot = -17.4962738826805 -95000 ekin = 3.49164555041805 | erot = 2.891072597541 | epot = -22.651746211573 | etot = -16.269028063614 -96000 ekin = 2.89611459837769 | erot = 2.3840369162805 | epot = -22.6376886129393 | etot = -17.3575370982811 -97000 ekin = 1.94001816357314 | erot = 2.09603205774619 | epot = -22.6212143095229 | etot = -18.5851640882036 -98000 ekin = 2.21812472183551 | erot = 3.66512951907027 | epot = -22.540020786367 | etot = -16.6567665454612 -99000 ekin = 1.96304801418099 | erot = 2.78092002528642 | epot = -22.4500077741119 | etot = -17.7060397346445 -100000 ekin = 1.78146596589238 | erot = 2.66087063973067 | epot = -22.380628502186 | etot = -17.9382918965629 -101000 ekin = 2.13576431486591 | erot = 2.39189697670581 | epot = -22.3671198416411 | etot = -17.8394585500694 -102000 ekin = 1.54265458925823 | erot = 2.31301627489862 | epot = -22.3596033820569 | etot = -18.5039325179 -103000 ekin = 1.6493299781162 | erot = 2.8270014677761 | epot = -22.4044472055819 | etot = -17.9281157596896 -104000 ekin = 1.88425130865015 | erot = 3.36695629589131 | epot = -22.4614117565727 | etot = -17.2102041520312 -105000 ekin = 2.0873628063424 | erot = 1.99902589912496 | epot = -22.4857870795246 | etot = -18.3993983740573 -106000 ekin = 2.85192200005482 | erot = 1.96124421177816 | epot = -22.4885148263279 | etot = -17.6753486144949 -107000 ekin = 2.27699301124082 | erot = 1.54572940373457 | epot = -22.4328687856414 | etot = -18.610146370666 -108000 ekin = 2.43341212242249 | erot = 1.71014523953267 | epot = -22.4750159709764 | etot = -18.3314586090212 -109000 ekin = 2.3240302459673 | erot = 2.92730273400666 | epot = -22.454444740465 | etot = -17.203111760491 -110000 ekin = 2.75939007795593 | erot = 2.37261248457831 | epot = -22.4066316113364 | etot = -17.2746290488021 -111000 ekin = 2.30202775259985 | erot = 2.09098171366695 | epot = -22.340628179725 | etot = -17.9476187134582 -112000 ekin = 2.89672803093986 | erot = 1.84536318388285 | epot = -22.189229344937 | etot = -17.4471381301143 -113000 ekin = 2.80286812020301 | erot = 1.68317583122193 | epot = -22.1739192926258 | etot = -17.6878753412008 -114000 ekin = 3.41134331362354 | erot = 2.66279011393035 | epot = -22.2993892060878 | etot = -16.225255778534 -115000 ekin = 3.04096848543599 | erot = 1.72164164793761 | epot = -22.3101669297006 | etot = -17.547556796327 -116000 ekin = 3.18249263106367 | erot = 3.2187278057963 | epot = -22.376612031037 | etot = -15.975391594177 -117000 ekin = 3.04033644338919 | erot = 2.41632774149289 | epot = -22.3406101341932 | etot = -16.8839459493112 -118000 ekin = 3.22976632794611 | erot = 1.46870208555872 | epot = -22.262910646297 | etot = -17.5644422327922 -119000 ekin = 2.35815331598994 | erot = 3.0746467591689 | epot = -22.21629705762 | etot = -16.7834969824611 -120000 ekin = 1.93901604028919 | erot = 2.21087803685819 | epot = -22.1596747789505 | etot = -18.0097807018031 -121000 ekin = 1.9479198834689 | erot = 3.06697908719323 | epot = -22.1473490758083 | etot = -17.1324501051462 -122000 ekin = 1.69642311218451 | erot = 1.71065948591523 | epot = -22.235021693017 | etot = -18.8279390949172 -123000 ekin = 1.74537927001903 | erot = 2.31042772730644 | epot = -22.3250546948603 | etot = -18.2692476975348 -124000 ekin = 2.74229806685693 | erot = 1.94346011848798 | epot = -22.3376426377462 | etot = -17.6518844524013 -125000 ekin = 2.7762803161376 | erot = 1.95737420539166 | epot = -22.3561899601979 | etot = -17.6225354386687 -126000 ekin = 2.05898577806786 | erot = 1.47493157618748 | epot = -22.3918669376121 | etot = -18.8579495833568 -127000 ekin = 1.88620727578863 | erot = 1.58698481884328 | epot = -22.3753405588623 | etot = -18.9021484642304 -128000 ekin = 1.65027256647601 | erot = 1.87589048163674 | epot = -22.3576574967822 | etot = -18.8314944486694 -129000 ekin = 2.51771860981078 | erot = 2.38745668871878 | epot = -22.3622404512641 | etot = -17.4570651527345 -130000 ekin = 1.60778116741171 | erot = 2.81983062254804 | epot = -22.3043401463427 | etot = -17.8767283563829 -131000 ekin = 2.27966529707091 | erot = 2.29465997580787 | epot = -22.1860056729234 | etot = -17.6116804000446 -132000 ekin = 2.94605151024306 | erot = 2.34727265039698 | epot = -22.1004107829513 | etot = -16.8070866223112 -133000 ekin = 2.00184520718143 | erot = 2.13597622566091 | epot = -22.0860804435183 | etot = -17.948259010676 -134000 ekin = 1.54536260297594 | erot = 2.86019181856985 | epot = -22.0324797134652 | etot = -17.6269252919194 -135000 ekin = 1.7899169229158 | erot = 2.40585579784187 | epot = -22.0564792277569 | etot = -17.8607065069993 -136000 ekin = 1.63315069688348 | erot = 2.13968964990471 | epot = -22.0645410751456 | etot = -18.2917007283574 -137000 ekin = 2.36475220491125 | erot = 1.9307510547685 | epot = -22.101884847306 | etot = -17.8063815876263 -138000 ekin = 2.9554682114977 | erot = 1.58329215843879 | epot = -22.1589207193491 | etot = -17.6201603494126 -139000 ekin = 3.18559985564368 | erot = 2.24978247982886 | epot = -22.2766713145626 | etot = -16.84128897909 -140000 ekin = 2.25331500051846 | erot = 3.04264261269698 | epot = -22.4413209794808 | etot = -17.1453633662654 -141000 ekin = 1.8939664036255 | erot = 3.12730191483889 | epot = -22.6943708703896 | etot = -17.6731025519252 -142000 ekin = 2.48698722341786 | erot = 2.50204475841096 | epot = -22.8022645411413 | etot = -17.8132325593125 -143000 ekin = 2.39031114354902 | erot = 2.72027514737476 | epot = -22.7789363640122 | etot = -17.6683500730884 -144000 ekin = 1.93009742932804 | erot = 2.68112648713777 | epot = -22.6600942975093 | etot = -18.0488703810435 -145000 ekin = 1.81543048110687 | erot = 1.73927524532866 | epot = -22.6290694904769 | etot = -19.0743637640414 -146000 ekin = 2.4125202126428 | erot = 2.08569022934172 | epot = -22.5607640770181 | etot = -18.0625536350336 -147000 ekin = 1.44642974398304 | erot = 1.86921415702346 | epot = -22.4437745695726 | etot = -19.1281306685661 -148000 ekin = 1.94224767107088 | erot = 2.57935525538891 | epot = -22.4110987100047 | etot = -17.8894957835449 -149000 ekin = 2.03195649040454 | erot = 3.31786202502785 | epot = -22.312227106758 | etot = -16.9624085913257 -150000 ekin = 2.47792894576432 | erot = 2.68612874200304 | epot = -22.1392843642773 | etot = -16.97522667651 -151000 ekin = 2.75692645092955 | erot = 1.8812256584813 | epot = -21.9329416416723 | etot = -17.2947895322614 -152000 ekin = 2.7753834344323 | erot = 1.78115734250796 | epot = -21.7450724909841 | etot = -17.1885317140438 -153000 ekin = 3.09316888168833 | erot = 1.80744228044955 | epot = -21.6451473427313 | etot = -16.7445361805934 -154000 ekin = 2.31433640945477 | erot = 2.19304386678895 | epot = -21.5946356595637 | etot = -17.08725538332 -155000 ekin = 1.94169881401553 | erot = 2.67959698479411 | epot = -21.6941053409437 | etot = -17.072809542134 -156000 ekin = 2.69151609119638 | erot = 2.25048211983204 | epot = -21.7610571974251 | etot = -16.8190589863967 -157000 ekin = 3.89507004263776 | erot = 2.74501587672577 | epot = -21.8157728797743 | etot = -15.1756869604107 -158000 ekin = 2.88173407476086 | erot = 2.69702262693025 | epot = -21.8854957137509 | etot = -16.3067390120598 -159000 ekin = 3.15173323195918 | erot = 2.6174347371013 | epot = -21.8245251626835 | etot = -16.055357193623 -160000 ekin = 2.54983562435716 | erot = 3.26037467643909 | epot = -21.8527884226329 | etot = -16.0425781218367 -161000 ekin = 2.47569624391789 | erot = 2.4441841652721 | epot = -21.7973550812187 | etot = -16.8774746720287 -162000 ekin = 2.94228722137381 | erot = 2.59784970938384 | epot = -21.7813251561029 | etot = -16.2411882253452 -163000 ekin = 3.25812805712344 | erot = 2.25239331007842 | epot = -21.8200893075211 | etot = -16.3095679403192 -164000 ekin = 3.52786799143084 | erot = 2.22392713421412 | epot = -21.7646946348872 | etot = -16.0128995092423 -165000 ekin = 2.47839548873418 | erot = 2.58744140761169 | epot = -21.6790952945041 | etot = -16.6132583981583 -166000 ekin = 2.14435847552792 | erot = 3.04732688845808 | epot = -21.6219995979977 | etot = -16.4303142340117 -167000 ekin = 2.77664659649902 | erot = 2.89037999868329 | epot = -21.5339928834654 | etot = -15.8669662882831 -168000 ekin = 1.74464407802389 | erot = 2.78052653338966 | epot = -21.4288999288375 | etot = -16.903729317424 -169000 ekin = 1.8068912909333 | erot = 2.46391033708928 | epot = -21.4128285618694 | etot = -17.1420269338468 -170000 ekin = 1.69498145941511 | erot = 2.88911238881156 | epot = -21.4319269866204 | etot = -16.8478331383937 -171000 ekin = 2.15326316196646 | erot = 1.6134654780187 | epot = -21.2861470779284 | etot = -17.5194184379432 -172000 ekin = 1.67904916339532 | erot = 2.36509147316374 | epot = -21.1250864759441 | etot = -17.080945839385 -173000 ekin = 2.05349972960735 | erot = 2.18864665107749 | epot = -21.0744450592631 | etot = -16.8322986785783 -174000 ekin = 2.49402795941962 | erot = 3.1039231700088 | epot = -20.9332609664625 | etot = -15.335309837034 -175000 ekin = 2.60611029063986 | erot = 2.90993176119179 | epot = -20.8533230180669 | etot = -15.3372809662352 -176000 ekin = 2.14535974511638 | erot = 2.6771051102154 | epot = -20.8508037764829 | etot = -16.0283389211512 -177000 ekin = 2.82654664242577 | erot = 2.8064781965732 | epot = -20.9303681620826 | etot = -15.2973433230837 -178000 ekin = 3.17006270723388 | erot = 1.88204403688962 | epot = -21.0665744865168 | etot = -16.0144677423933 -179000 ekin = 2.33834827123179 | erot = 2.84870047825868 | epot = -21.1082901606944 | etot = -15.9212414112039 -180000 ekin = 2.39362550925046 | erot = 2.94575326168225 | epot = -21.1089731290028 | etot = -15.7695943580701 -181000 ekin = 2.78703231260152 | erot = 3.29998898392533 | epot = -21.0761138110654 | etot = -14.9890925145385 -182000 ekin = 3.023383912392 | erot = 2.3253310746288 | epot = -21.0444377426861 | etot = -15.6957227556653 -183000 ekin = 2.44126401356994 | erot = 2.19853056632819 | epot = -20.8846280234405 | etot = -16.2448334435424 -184000 ekin = 2.56448211253962 | erot = 2.77267067014069 | epot = -20.6657911214549 | etot = -15.3286383387746 -185000 ekin = 2.16427057092672 | erot = 1.95880146934287 | epot = -20.5647658775173 | etot = -16.4416938372477 -186000 ekin = 2.06536030915311 | erot = 3.1459346313777 | epot = -20.4537584304771 | etot = -15.2424634899463 -187000 ekin = 2.43846121057803 | erot = 1.93593042270706 | epot = -20.4775765627296 | etot = -16.1031849294445 -188000 ekin = 2.28827356508696 | erot = 2.89699235589217 | epot = -20.6028880527163 | etot = -15.4176221317372 -189000 ekin = 1.67206333515897 | erot = 3.05807378739725 | epot = -20.6184572736204 | etot = -15.8883201510642 -190000 ekin = 1.96995062226967 | erot = 2.943019674394 | epot = -20.6150380630742 | etot = -15.7020677664105 -191000 ekin = 2.31558303301195 | erot = 2.65062200614568 | epot = -20.5845049099943 | etot = -15.6182998708366 -192000 ekin = 3.58105122568799 | erot = 2.89866835149673 | epot = -20.5550364560059 | etot = -14.0753168788212 -193000 ekin = 2.69738971383614 | erot = 3.08390984677749 | epot = -20.5718609412494 | etot = -14.7905613806358 -194000 ekin = 2.65963556416735 | erot = 2.28486501061266 | epot = -20.4488832942326 | etot = -15.5043827194525 -195000 ekin = 1.85289053427901 | erot = 2.65318671222086 | epot = -20.3816844231207 | etot = -15.8756071766209 -196000 ekin = 2.28257181147918 | erot = 2.31175601065464 | epot = -20.4051132325268 | etot = -15.810785410393 -197000 ekin = 2.49770460330585 | erot = 2.55587879440512 | epot = -20.4716020539923 | etot = -15.4180186562813 -198000 ekin = 2.01700960777428 | erot = 1.51922008609382 | epot = -20.4907970823155 | etot = -16.9545673884474 -199000 ekin = 1.50027537520987 | erot = 2.19604462463445 | epot = -20.5138434458212 | etot = -16.8175234459769 -200000 ekin = 1.64850512926723 | erot = 2.45966335482571 | epot = -20.4934420686449 | etot = -16.385273584552 -201000 ekin = 2.62997533994907 | erot = 2.61637339049483 | epot = -20.5569645618355 | etot = -15.3106158313916 -202000 ekin = 2.30895175475241 | erot = 2.55653293887659 | epot = -20.6262537118088 | etot = -15.7607690181798 -203000 ekin = 1.64768887888552 | erot = 2.11556417528284 | epot = -20.6617888215465 | etot = -16.8985357673782 -204000 ekin = 2.01924097320136 | erot = 1.97748949636931 | epot = -20.7002685556681 | etot = -16.7035380860975 -205000 ekin = 2.97656554045711 | erot = 3.25408007971553 | epot = -20.9425038008424 | etot = -14.7118581806697 -206000 ekin = 2.56613069661945 | erot = 2.2162424422446 | epot = -21.0621833598182 | etot = -16.2798102209542 -207000 ekin = 3.44850636848559 | erot = 2.48816050856267 | epot = -21.2038849430866 | etot = -15.2672180660384 -208000 ekin = 2.54208934028226 | erot = 2.22605232144503 | epot = -21.3476404533667 | etot = -16.5794987916394 -209000 ekin = 3.84151461096732 | erot = 2.16534559513904 | epot = -21.4932373455843 | etot = -15.486377139478 -210000 ekin = 3.06873591712904 | erot = 2.24760815652572 | epot = -21.6427793540355 | etot = -16.3264352803807 -211000 ekin = 1.64176280869923 | erot = 2.17721976802013 | epot = -21.8130439048271 | etot = -17.9940613281078 -212000 ekin = 2.5985934050661 | erot = 2.41520703335867 | epot = -21.9964648294562 | etot = -16.9826643910315 -213000 ekin = 2.51136104390039 | erot = 1.99503544560739 | epot = -22.161492842604 | etot = -17.6550963530962 -214000 ekin = 2.77089845962619 | erot = 3.17247228684199 | epot = -22.208715104286 | etot = -16.2653443578179 -215000 ekin = 2.53408528186206 | erot = 1.84963848601796 | epot = -22.1148567901871 | etot = -17.7311330223071 -216000 ekin = 2.52671619876928 | erot = 2.77873014449688 | epot = -22.1370884570131 | etot = -16.8316421137469 -217000 ekin = 2.50171921508545 | erot = 1.89238935467003 | epot = -22.226079201001 | etot = -17.8319706312455 -218000 ekin = 2.43936294263937 | erot = 2.41974828067302 | epot = -22.2447049583244 | etot = -17.385593735012 -219000 ekin = 2.30221269367205 | erot = 2.65120674162377 | epot = -22.2807164841742 | etot = -17.3272970488784 -220000 ekin = 1.70065256620687 | erot = 2.34758543213917 | epot = -22.2809933538228 | etot = -18.2327553554767 -221000 ekin = 2.09298237125575 | erot = 2.4788648159591 | epot = -22.267957001012 | etot = -17.6961098137972 -222000 ekin = 1.58469709510937 | erot = 2.14490786301286 | epot = -22.1867412404881 | etot = -18.4571362823659 -223000 ekin = 1.83926923346352 | erot = 1.89456034969536 | epot = -22.131893392038 | etot = -18.3980638088791 -224000 ekin = 2.59583657132575 | erot = 2.93869915115498 | epot = -22.1425986650605 | etot = -16.6080629425798 -225000 ekin = 3.29351563254165 | erot = 2.84339535814139 | epot = -22.12757310355 | etot = -15.990662112867 -226000 ekin = 3.03135339447922 | erot = 2.08293143143603 | epot = -22.15283624886 | etot = -17.0385514229448 -227000 ekin = 2.50176282992082 | erot = 3.15084128846394 | epot = -22.2250438959745 | etot = -16.5724397775897 -228000 ekin = 2.32013498351673 | erot = 2.67554406359434 | epot = -22.3177515383564 | etot = -17.3220724912453 -229000 ekin = 2.89545450975318 | erot = 2.90735055857064 | epot = -22.4361496683347 | etot = -16.6333446000109 -230000 ekin = 2.28321229485933 | erot = 3.48420465632866 | epot = -22.548785995051 | etot = -16.781369043863 -231000 ekin = 2.0778632375453 | erot = 3.1067397369644 | epot = -22.5896609633152 | etot = -17.4050579888055 -232000 ekin = 2.1202374109541 | erot = 1.98747810033065 | epot = -22.5738924334392 | etot = -18.4661769221544 -233000 ekin = 2.33571877855589 | erot = 2.83585090202734 | epot = -22.5402065195541 | etot = -17.3686368389708 -234000 ekin = 2.10578223747154 | erot = 2.07381218733635 | epot = -22.5507693150832 | etot = -18.3711748902754 -235000 ekin = 2.44321041214394 | erot = 2.80846352304316 | epot = -22.5606929563186 | etot = -17.3090190211315 -236000 ekin = 2.93630791731799 | erot = 3.06315918531728 | epot = -22.4860653874721 | etot = -16.4865982848368 -237000 ekin = 3.21264879506079 | erot = 3.26866508478298 | epot = -22.3683553437861 | etot = -15.8870414639423 -238000 ekin = 2.46595539123277 | erot = 2.32502019506662 | epot = -22.3144456769666 | etot = -17.5234700906672 -239000 ekin = 2.10325864915823 | erot = 2.47631139904042 | epot = -22.301139292181 | etot = -17.7215692439824 -240000 ekin = 1.77270999777839 | erot = 2.60141429112663 | epot = -22.2344206081543 | etot = -17.8602963192493 -241000 ekin = 1.94952922244078 | erot = 1.39715216866763 | epot = -22.2207225048761 | etot = -18.8740411137677 -242000 ekin = 3.05687991591411 | erot = 2.00862394928705 | epot = -22.2213200390943 | etot = -17.1558161738932 -243000 ekin = 2.86735711945299 | erot = 1.7994811867468 | epot = -22.2697610280427 | etot = -17.6029227218429 -244000 ekin = 2.00525854269389 | erot = 2.36445341214556 | epot = -22.2726788994494 | etot = -17.90296694461 -245000 ekin = 2.28011102404838 | erot = 2.787005205328 | epot = -22.2995433574618 | etot = -17.2324271280854 -246000 ekin = 2.06819738789813 | erot = 2.24624952782284 | epot = -22.2551680110137 | etot = -17.9407210952928 -247000 ekin = 1.69964711256213 | erot = 3.22260619239826 | epot = -22.1916408256116 | etot = -17.2693875206512 -248000 ekin = 1.92997585194759 | erot = 3.61155944514366 | epot = -22.0096484177852 | etot = -16.468113120694 -249000 ekin = 2.16278530892653 | erot = 3.27771891456707 | epot = -21.8856058980726 | etot = -16.445101674579 -250000 ekin = 2.32204054211025 | erot = 2.46317574116849 | epot = -21.8028762710591 | etot = -17.0176599877804 -251000 ekin = 1.23768964067255 | erot = 2.241505337621 | epot = -21.7630657074039 | etot = -18.2838707291104 -252000 ekin = 1.79818833522214 | erot = 2.12556386664128 | epot = -21.7586349357284 | etot = -17.834882733865 -253000 ekin = 2.12809689846393 | erot = 2.59685639208403 | epot = -21.7226495687757 | etot = -16.9976962782278 -254000 ekin = 2.46813261968533 | erot = 2.00391812662871 | epot = -21.7113918037362 | etot = -17.2393410574221 -255000 ekin = 2.31566729087291 | erot = 2.03619058028117 | epot = -21.7265453183256 | etot = -17.3746874471715 -256000 ekin = 2.87223929491326 | erot = 2.61790933826622 | epot = -21.659332511914 | etot = -16.1691838787345 -257000 ekin = 2.85756762932926 | erot = 2.08174673916199 | epot = -21.6161821054731 | etot = -16.6768677369818 -258000 ekin = 2.06111021157734 | erot = 2.32748664972428 | epot = -21.5132485706726 | etot = -17.124651709371 -259000 ekin = 2.23305784057759 | erot = 2.88843859953736 | epot = -21.5040039667854 | etot = -16.3825075266705 -260000 ekin = 2.49862397932476 | erot = 2.3833688584839 | epot = -21.488210637319 | etot = -16.6062177995103 -261000 ekin = 2.09280296934734 | erot = 2.39632540029206 | epot = -21.4325331777953 | etot = -16.9434048081559 -262000 ekin = 2.33576913564289 | erot = 2.67273419354396 | epot = -21.3832241450035 | etot = -16.3747208158166 -263000 ekin = 2.20536189489354 | erot = 2.71530627040564 | epot = -21.4329409070981 | etot = -16.5122727417989 -264000 ekin = 2.2858247573423 | erot = 2.76839346219662 | epot = -21.3931084431599 | etot = -16.338890223621 -265000 ekin = 1.70928536820409 | erot = 1.79395423442895 | epot = -21.2682341921474 | etot = -17.7649945895143 -266000 ekin = 2.48721735474525 | erot = 2.08745460533225 | epot = -21.1746995817337 | etot = -16.6000276216562 -267000 ekin = 2.69283567987773 | erot = 2.10301910407212 | epot = -21.1705161290062 | etot = -16.3746613450563 -268000 ekin = 3.00000233743719 | erot = 2.80954585635721 | epot = -21.1647521126509 | etot = -15.3552039188565 -269000 ekin = 3.50713810468527 | erot = 2.35763817348002 | epot = -21.1537110688983 | etot = -15.288934790733 -270000 ekin = 3.50686942248863 | erot = 1.86462765875889 | epot = -21.1925508822801 | etot = -15.8210538010326 -271000 ekin = 3.57026082273992 | erot = 2.08172467795388 | epot = -21.277581718294 | etot = -15.6255962176003 -272000 ekin = 2.4484752533773 | erot = 3.08466485039763 | epot = -21.3619851902072 | etot = -15.8288450864322 -273000 ekin = 2.39748176307242 | erot = 3.1335505044672 | epot = -21.4386234252579 | etot = -15.9075911577183 -274000 ekin = 2.48208144431864 | erot = 2.00552494041966 | epot = -21.4476232953882 | etot = -16.9600169106499 -275000 ekin = 2.4872108114937 | erot = 3.05413598233607 | epot = -21.4713984309062 | etot = -15.9300516370765 -276000 ekin = 2.82709589676966 | erot = 2.88384306577857 | epot = -21.443459011816 | etot = -15.7325200492678 -277000 ekin = 2.23479555963312 | erot = 2.20310851955639 | epot = -21.3883073251199 | etot = -16.9504032459304 -278000 ekin = 2.81418916407429 | erot = 3.24537052192614 | epot = -21.3155364074003 | etot = -15.2559767213999 -279000 ekin = 2.57366525203698 | erot = 1.81705578305929 | epot = -21.2862101233851 | etot = -16.8954890882888 -280000 ekin = 2.41063464320149 | erot = 1.76282693004732 | epot = -21.254962528096 | etot = -17.0815009548472 -281000 ekin = 2.58126226070487 | erot = 2.29258221702168 | epot = -21.306394928225 | etot = -16.4325504504985 -282000 ekin = 3.02016903398222 | erot = 2.4309452389034 | epot = -21.4340900724633 | etot = -15.9829757995777 -283000 ekin = 2.5926914979033 | erot = 2.11330689541034 | epot = -21.6296517079942 | etot = -16.9236533146805 -284000 ekin = 2.51704243107537 | erot = 3.13156683036759 | epot = -21.7452694753527 | etot = -16.0966602139097 -285000 ekin = 2.4236537221525 | erot = 1.77228258125505 | epot = -21.8557019037769 | etot = -17.6597656003694 -286000 ekin = 1.94467195521662 | erot = 2.03660974116722 | epot = -21.901435736722 | etot = -17.9201540403382 -287000 ekin = 2.56319670376176 | erot = 2.60867050510154 | epot = -21.9067509934901 | etot = -16.7348837846268 -288000 ekin = 2.19574207425736 | erot = 1.69805542160022 | epot = -21.8143855675961 | etot = -17.9205880717385 -289000 ekin = 2.35326278833023 | erot = 1.65840109676148 | epot = -21.6976038565285 | etot = -17.6859399714368 -290000 ekin = 2.35194561775041 | erot = 1.99444238353745 | epot = -21.6551012116075 | etot = -17.3087132103196 -291000 ekin = 1.48585281531713 | erot = 2.66475825861556 | epot = -21.56036793472 | etot = -17.4097568607873 -292000 ekin = 2.1073994475645 | erot = 2.42809824662638 | epot = -21.4451596117638 | etot = -16.9096619175729 -293000 ekin = 2.11618090223715 | erot = 1.86694554151196 | epot = -21.3593625692768 | etot = -17.3762361255277 -294000 ekin = 2.06078090566327 | erot = 2.13941873359473 | epot = -21.232623310094 | etot = -17.032423670836 -295000 ekin = 2.11467178034796 | erot = 2.32673436675183 | epot = -21.1123588667461 | etot = -16.6709527196463 -296000 ekin = 1.53087058859334 | erot = 2.94008409149154 | epot = -21.2112197533848 | etot = -16.7402650732999 -297000 ekin = 2.52732986791201 | erot = 2.18380855337859 | epot = -21.1955190508786 | etot = -16.484380629588 -298000 ekin = 1.89033945823201 | erot = 2.02521913176003 | epot = -21.2593750718295 | etot = -17.3438164818375 -299000 ekin = 1.87142873048437 | erot = 1.6640456322155 | epot = -21.2919162310488 | etot = -17.7564418683489 -300000 ekin = 2.23872615546785 | erot = 1.50807257618898 | epot = -21.3339204593826 | etot = -17.5871217277257 -301000 ekin = 1.99965506724556 | erot = 2.00145094516845 | epot = -21.4707589194324 | etot = -17.4696529070184 -302000 ekin = 1.76370349732521 | erot = 2.2378770890149 | epot = -21.5675275978257 | etot = -17.5659470114856 -303000 ekin = 2.69610887251788 | erot = 1.69957221429742 | epot = -21.5563765448091 | etot = -17.1606954579938 -304000 ekin = 2.55447143501921 | erot = 2.02060813090351 | epot = -21.5692327321341 | etot = -16.9941531662114 -305000 ekin = 2.38230604232715 | erot = 2.31489374428117 | epot = -21.5335950166329 | etot = -16.8363952300246 -306000 ekin = 2.07785475765117 | erot = 2.45230660685968 | epot = -21.4550895345846 | etot = -16.9249281700738 -307000 ekin = 3.17130424567277 | erot = 3.29574614566804 | epot = -21.4151535289883 | etot = -14.9481031376475 -308000 ekin = 3.40959217051674 | erot = 2.68389483402971 | epot = -21.4778643688409 | etot = -15.3843773642944 -309000 ekin = 2.36068264180093 | erot = 2.91715332823343 | epot = -21.5794336507741 | etot = -16.3015976807397 -310000 ekin = 2.49952357229221 | erot = 2.3602895089614 | epot = -21.5982142524176 | etot = -16.738401171164 -311000 ekin = 2.53288726180907 | erot = 2.29596940545853 | epot = -21.6418553661547 | etot = -16.8129986988871 -312000 ekin = 2.05123272208704 | erot = 2.92023923411836 | epot = -21.7377547517075 | etot = -16.7662827955021 -313000 ekin = 1.80834719374889 | erot = 2.29357283142128 | epot = -21.7993116362532 | etot = -17.697391611083 -314000 ekin = 2.30684015099018 | erot = 2.20859462712275 | epot = -21.8029398081388 | etot = -17.2875050300258 -315000 ekin = 1.86413924486173 | erot = 2.14748794238473 | epot = -21.8550418960799 | etot = -17.8434147088335 -316000 ekin = 2.20558056533516 | erot = 3.03447287931581 | epot = -21.8868412075708 | etot = -16.6467877629199 -317000 ekin = 2.4782093112548 | erot = 3.56870099099487 | epot = -21.9902146748518 | etot = -15.9433043726022 -318000 ekin = 2.36582343801679 | erot = 3.01887804681551 | epot = -22.1178732891163 | etot = -16.7331718042839 -319000 ekin = 2.40464629760758 | erot = 3.15910789488741 | epot = -22.2289401281564 | etot = -16.6651859356615 -320000 ekin = 1.80206494109346 | erot = 2.83527990295433 | epot = -22.3120263401861 | etot = -17.6746814961383 -321000 ekin = 2.91146951948762 | erot = 2.25772268449837 | epot = -22.3029455835946 | etot = -17.1337533796087 -322000 ekin = 2.8226351296685 | erot = 2.67950826833979 | epot = -22.3041650189947 | etot = -16.8020216209864 -323000 ekin = 2.067323568424 | erot = 2.31975284775299 | epot = -22.3338840353559 | etot = -17.9468076191789 -324000 ekin = 2.6012747278288 | erot = 2.58351861537749 | epot = -22.3215168526943 | etot = -17.1367235094881 -325000 ekin = 3.45560055552842 | erot = 2.50162515355503 | epot = -22.1825527777624 | etot = -16.2253270686789 -326000 ekin = 3.51422890604519 | erot = 2.8442606101801 | epot = -22.0201095272524 | etot = -15.6616200110271 -327000 ekin = 2.63551490316294 | erot = 2.20570805472232 | epot = -21.9384479867006 | etot = -17.0972250288154 -328000 ekin = 1.8043914440792 | erot = 2.37599512200969 | epot = -21.8619803976419 | etot = -17.681593831553 -329000 ekin = 2.15766181563134 | erot = 2.45286496267961 | epot = -21.8518523862111 | etot = -17.2413256079002 -330000 ekin = 1.8483425992464 | erot = 2.03367429366602 | epot = -21.7684095252419 | etot = -17.8863926323295 -331000 ekin = 2.3531484336258 | erot = 1.80165819621477 | epot = -21.7197009414848 | etot = -17.5648943116442 -332000 ekin = 1.67855936307207 | erot = 2.53341219651311 | epot = -21.733643435588 | etot = -17.5216718760028 -333000 ekin = 1.60376334688456 | erot = 2.14058675025446 | epot = -21.835637958395 | etot = -18.091287861256 -334000 ekin = 2.2655199008178 | erot = 2.62486254825417 | epot = -21.879497107847 | etot = -16.989114658775 -335000 ekin = 2.91208137486082 | erot = 3.11052870452009 | epot = -21.9161692767171 | etot = -15.8935591973362 -336000 ekin = 2.73132973682385 | erot = 2.56213100489405 | epot = -21.8312488568505 | etot = -16.5377881151326 -337000 ekin = 3.15411918141902 | erot = 3.875128198312 | epot = -21.9061152574783 | etot = -14.8768678777473 -338000 ekin = 2.33141760424507 | erot = 2.13211945089679 | epot = -21.913746111238 | etot = -17.4502090560961 -339000 ekin = 1.71915361945718 | erot = 2.31270220754042 | epot = -21.9042074773719 | etot = -17.8723516503743 -340000 ekin = 1.62199393011805 | erot = 3.16990972384469 | epot = -21.8898233676231 | etot = -17.0979197136604 -341000 ekin = 1.71588704296646 | erot = 3.17642860992462 | epot = -21.8345558128149 | etot = -16.9422401599238 -342000 ekin = 1.82178091247658 | erot = 2.58875985611025 | epot = -21.7161502950572 | etot = -17.3056095264704 -343000 ekin = 3.08559255942693 | erot = 2.94813449265469 | epot = -21.7030445300996 | etot = -15.669317478018 -344000 ekin = 2.95985387154984 | erot = 3.11547515850352 | epot = -21.681548329552 | etot = -15.6062192994986 -345000 ekin = 2.33428072266864 | erot = 2.8804443128302 | epot = -21.6567075042343 | etot = -16.4419824687354 -346000 ekin = 2.02077664062698 | erot = 3.45936833964706 | epot = -21.5877268821218 | etot = -16.1075819018477 -347000 ekin = 2.34924784800441 | erot = 1.93056350805623 | epot = -21.4896151766054 | etot = -17.2098038205448 -348000 ekin = 2.79839267202794 | erot = 2.79408776517961 | epot = -21.4682057474677 | etot = -15.8757253102602 -349000 ekin = 2.33820470114615 | erot = 3.12966318670512 | epot = -21.5603039389198 | etot = -16.0924360510685 -350000 ekin = 2.22383234890832 | erot = 2.3888687038801 | epot = -21.5375784703117 | etot = -16.9248774175232 -351000 ekin = 2.33329735253339 | erot = 2.84447430695177 | epot = -21.5078106306152 | etot = -16.33003897113 -352000 ekin = 2.74923373919409 | erot = 2.76796181793622 | epot = -21.5537134920816 | etot = -16.0365179349513 -353000 ekin = 1.76111836153718 | erot = 2.12255592617517 | epot = -21.5037017999955 | etot = -17.6200275122832 -354000 ekin = 2.29967358188085 | erot = 2.37615363620183 | epot = -21.559257977819 | etot = -16.8834307597363 -355000 ekin = 2.32956787601564 | erot = 2.41406261152025 | epot = -21.5311925684016 | etot = -16.7875620808657 -356000 ekin = 2.99536507165416 | erot = 3.01337867890171 | epot = -21.461213826164 | etot = -15.4524700756081 -357000 ekin = 1.79487551861702 | erot = 2.1478177575683 | epot = -21.4425100027869 | etot = -17.4998167266015 -358000 ekin = 2.06856992699964 | erot = 1.91585051553708 | epot = -21.4597512525557 | etot = -17.475330810019 -359000 ekin = 2.03457633089973 | erot = 2.13725650388116 | epot = -21.4345843672419 | etot = -17.2627515324611 -360000 ekin = 2.64289898809605 | erot = 2.45722294398596 | epot = -21.3798303659972 | etot = -16.2797084339152 -361000 ekin = 2.44681633772951 | erot = 2.40323525392196 | epot = -21.4535746870957 | etot = -16.6035230954443 -362000 ekin = 2.27284400709389 | erot = 2.04866562998477 | epot = -21.4444048899961 | etot = -17.1228952529174 -363000 ekin = 3.23945885057604 | erot = 1.79247859381385 | epot = -21.4992698914106 | etot = -16.4673324470207 -364000 ekin = 3.01124200487832 | erot = 2.16495867321709 | epot = -21.5330648567406 | etot = -16.3568641786452 -365000 ekin = 2.51472285580871 | erot = 2.29864111879032 | epot = -21.6252096459668 | etot = -16.8118456713678 -366000 ekin = 2.59356655410024 | erot = 2.21031948632571 | epot = -21.6397726115723 | etot = -16.8358865711463 -367000 ekin = 2.23422490605625 | erot = 1.85375489374337 | epot = -21.7036464131406 | etot = -17.615666613341 -368000 ekin = 2.4774770785368 | erot = 2.36511710555107 | epot = -21.7442459693683 | etot = -16.9016517852804 -369000 ekin = 2.03854183495617 | erot = 2.80790943599038 | epot = -21.8295461127419 | etot = -16.9830948417954 -370000 ekin = 2.08495509326203 | erot = 2.15717784784086 | epot = -21.8579547558588 | etot = -17.6158218147559 -371000 ekin = 2.1649158804987 | erot = 2.10731342711639 | epot = -21.7507302872469 | etot = -17.4785009796318 -372000 ekin = 1.83416420958724 | erot = 1.90082367490456 | epot = -21.6784224725519 | etot = -17.9434345880601 -373000 ekin = 1.97176482573297 | erot = 1.7779600789095 | epot = -21.6393712386778 | etot = -17.8896463340353 -374000 ekin = 2.89940710658305 | erot = 1.91194262525378 | epot = -21.5337545453635 | etot = -16.7224048135267 -375000 ekin = 2.32339676163341 | erot = 1.92362318361284 | epot = -21.421709102519 | etot = -17.1746891572728 -376000 ekin = 2.59047552311153 | erot = 2.32394149083979 | epot = -21.4139727856534 | etot = -16.4995557717021 -377000 ekin = 2.24598863840517 | erot = 1.65770205797294 | epot = -21.3405339068232 | etot = -17.4368432104451 -378000 ekin = 2.38351514056703 | erot = 2.54156262207208 | epot = -21.3122380587448 | etot = -16.3871602961057 -379000 ekin = 2.08457212928957 | erot = 2.11819645676891 | epot = -21.2663127721437 | etot = -17.0635441860852 -380000 ekin = 2.62168026009058 | erot = 2.36576073073355 | epot = -21.2469701231191 | etot = -16.259529132295 -381000 ekin = 2.42554871977307 | erot = 2.21588725182519 | epot = -21.2594018196931 | etot = -16.6179658480948 -382000 ekin = 2.04454090532122 | erot = 3.35199327879854 | epot = -21.3507561156203 | etot = -15.9542219315006 -383000 ekin = 2.5775676978984 | erot = 1.58356833947096 | epot = -21.4206473136967 | etot = -17.2595112763273 -384000 ekin = 2.32411392435712 | erot = 2.07034159075991 | epot = -21.4254017003271 | etot = -17.0309461852101 -385000 ekin = 1.93815279071873 | erot = 3.2997037447625 | epot = -21.4993838182002 | etot = -16.2615272827189 -386000 ekin = 2.10645704249442 | erot = 2.94380940917573 | epot = -21.5050572923383 | etot = -16.4547908406681 -387000 ekin = 2.28625118399722 | erot = 2.40488022694899 | epot = -21.4350466670762 | etot = -16.74391525613 -388000 ekin = 2.84183807689895 | erot = 2.72440789072404 | epot = -21.448767296848 | etot = -15.882521329225 -389000 ekin = 3.39750799106376 | erot = 3.08194517695383 | epot = -21.6559630447603 | etot = -15.1765098767427 -390000 ekin = 2.82211920760118 | erot = 2.04880343622588 | epot = -21.7229608878358 | etot = -16.8520382440088 -391000 ekin = 2.25113345866118 | erot = 2.45876014532077 | epot = -21.7793475672487 | etot = -17.0694539632668 -392000 ekin = 2.6777973992177 | erot = 2.7527860471579 | epot = -21.9200377033298 | etot = -16.4894542569542 -393000 ekin = 2.07336639249412 | erot = 1.66102921524042 | epot = -22.0500496423093 | etot = -18.3156540345748 -394000 ekin = 2.1138614951422 | erot = 2.4065490584156 | epot = -22.0647062581752 | etot = -17.5442957046174 -395000 ekin = 2.46967791557608 | erot = 2.46187607744979 | epot = -22.0113006362931 | etot = -17.0797466432672 -396000 ekin = 3.17858061422169 | erot = 1.60030928107608 | epot = -21.9570022338792 | etot = -17.1781123385814 -397000 ekin = 2.37483507726777 | erot = 2.17387816921976 | epot = -21.8769234701934 | etot = -17.3282102237059 -398000 ekin = 2.29815779154461 | erot = 2.20148627030488 | epot = -21.8293641014529 | etot = -17.3297200396034 -399000 ekin = 2.66620669497936 | erot = 2.78316441348841 | epot = -21.7420307764657 | etot = -16.2926596679979 -400000 ekin = 1.8196142363994 | erot = 2.77573291920481 | epot = -21.7225828560707 | etot = -17.1272357004665 -401000 ekin = 2.39347596566752 | erot = 3.11237720134103 | epot = -21.763219812775 | etot = -16.2573666457665 -402000 ekin = 4.0137909252526 | erot = 3.58756310879366 | epot = -21.6952307126455 | etot = -14.0938766785993 -403000 ekin = 3.6423872335827 | erot = 3.44210139074532 | epot = -21.6932224157202 | etot = -14.6087337913922 -404000 ekin = 2.52116102522202 | erot = 2.99286839639892 | epot = -21.7395466120138 | etot = -16.2255171903929 -405000 ekin = 2.80514548558626 | erot = 3.09807228440151 | epot = -21.809681120553 | etot = -15.9064633505652 -406000 ekin = 2.32696376764902 | erot = 2.03572639782902 | epot = -21.9111381639248 | etot = -17.5484479984467 -407000 ekin = 2.33504128016394 | erot = 1.91320949168965 | epot = -21.9359478399847 | etot = -17.6876970681311 -408000 ekin = 1.90942025822264 | erot = 2.20375631379572 | epot = -21.9849314014527 | etot = -17.8717548294343 -409000 ekin = 1.98818542800297 | erot = 1.95540808206522 | epot = -22.03783497597 | etot = -18.0942414659018 -410000 ekin = 1.59823476401333 | erot = 1.9127296785249 | epot = -22.0830507565095 | etot = -18.5720863139713 -411000 ekin = 1.87320182179615 | erot = 2.46575148951074 | epot = -22.1911106440467 | etot = -17.8521573327398 -412000 ekin = 2.51909186028136 | erot = 2.65534868642726 | epot = -22.281680067606 | etot = -17.1072395208973 -413000 ekin = 2.80929435327118 | erot = 3.19888285052217 | epot = -22.190767996874 | etot = -16.1825907930807 -414000 ekin = 2.79014519733558 | erot = 2.72515195410933 | epot = -22.1448630242429 | etot = -16.629565872798 -415000 ekin = 2.4678901908732 | erot = 2.24891720770208 | epot = -22.1977268949424 | etot = -17.4809194963671 -416000 ekin = 3.30766536008867 | erot = 1.55878918639504 | epot = -22.1694878213559 | etot = -17.3030332748721 -417000 ekin = 3.95074944679109 | erot = 2.44780201516574 | epot = -22.1018895242094 | etot = -15.7033380622526 -418000 ekin = 2.77340936693416 | erot = 2.68993840817536 | epot = -21.977327562767 | etot = -16.5139797876575 -419000 ekin = 2.38275203991917 | erot = 2.97769109273479 | epot = -21.9010102007428 | etot = -16.5405670680889 -420000 ekin = 1.80397709765343 | erot = 1.82715488758969 | epot = -21.8849019003165 | etot = -18.2537699150733 -421000 ekin = 1.36681295471101 | erot = 1.76825921584578 | epot = -21.8412237154645 | etot = -18.7061515449077 -422000 ekin = 1.39959702132374 | erot = 2.73409619318274 | epot = -21.8826128255667 | etot = -17.7489196110602 -423000 ekin = 1.56944982840735 | erot = 3.0745352163647 | epot = -21.9154707534762 | etot = -17.2714857087042 -424000 ekin = 2.37132681302185 | erot = 2.02827700625919 | epot = -21.9855473914522 | etot = -17.5859435721711 -425000 ekin = 2.32398819807537 | erot = 2.54492547738624 | epot = -22.0336841510595 | etot = -17.1647704755979 -426000 ekin = 2.07554577000492 | erot = 3.12289746501957 | epot = -21.9790717327511 | etot = -16.7806284977266 -427000 ekin = 2.16798189989515 | erot = 2.43592804982976 | epot = -21.8725998895963 | etot = -17.2686899398714 -428000 ekin = 1.81044953925647 | erot = 1.65104945142325 | epot = -21.8530279543937 | etot = -18.391528963714 -429000 ekin = 1.67107266086147 | erot = 2.55773576228634 | epot = -21.8100708745401 | etot = -17.5812624513923 -430000 ekin = 2.68478182527405 | erot = 2.86091245076365 | epot = -21.8410586042845 | etot = -16.2953643282468 -431000 ekin = 2.77628795576833 | erot = 1.57824702797161 | epot = -21.8242269586438 | etot = -17.4696919749038 -432000 ekin = 2.50950337424058 | erot = 1.60698871193856 | epot = -21.7274714752277 | etot = -17.6109793890485 -433000 ekin = 1.86271272714812 | erot = 2.49153826331594 | epot = -21.7782989349596 | etot = -17.4240479444956 -434000 ekin = 2.89451059329443 | erot = 2.7999871143393 | epot = -21.9094190496406 | etot = -16.2149213420069 -435000 ekin = 3.67276301290157 | erot = 1.38568900942255 | epot = -22.090314852724 | etot = -17.0318628303999 -436000 ekin = 3.05559930935247 | erot = 2.0011229579365 | epot = -22.0922696682969 | etot = -17.0355474010079 -437000 ekin = 3.23217703427564 | erot = 1.78362343665461 | epot = -22.1039224603628 | etot = -17.0881219894326 -438000 ekin = 2.86284068923964 | erot = 1.84512171996301 | epot = -22.0628669955697 | etot = -17.3549045863671 -439000 ekin = 2.41223300999623 | erot = 2.70115548536557 | epot = -22.0444627048546 | etot = -16.9310742094928 -440000 ekin = 2.21861950215059 | erot = 3.01743511618684 | epot = -22.068610200563 | etot = -16.8325555822256 -441000 ekin = 2.8932616531564 | erot = 2.87922265473726 | epot = -22.2016049433916 | etot = -16.4291206354979 -442000 ekin = 2.05577486002272 | erot = 1.73545040283799 | epot = -22.2600410881766 | etot = -18.4688158253159 -443000 ekin = 1.86487220517439 | erot = 2.00809914782698 | epot = -22.2983494418706 | etot = -18.4253780888692 -444000 ekin = 2.06067323986939 | erot = 2.15338745019835 | epot = -22.3098473137383 | etot = -18.0957866236705 -445000 ekin = 2.10070768344239 | erot = 2.28023429868874 | epot = -22.3660019273286 | etot = -17.9850599451974 -446000 ekin = 2.41985050727236 | erot = 2.85361119161167 | epot = -22.3957509332304 | etot = -17.1222892343463 -447000 ekin = 2.19943989168951 | erot = 2.98216128214708 | epot = -22.469110173424 | etot = -17.2875089995874 -448000 ekin = 2.35402217188592 | erot = 2.94501347240091 | epot = -22.4864294789763 | etot = -17.1873938346895 -449000 ekin = 2.39054827328709 | erot = 2.92846006473406 | epot = -22.4970387577705 | etot = -17.1780304197493 -450000 ekin = 1.87726152618207 | erot = 1.69631154300644 | epot = -22.4508394587929 | etot = -18.8772663896044 -451000 ekin = 2.02069736260971 | erot = 1.92749635252742 | epot = -22.4770058621559 | etot = -18.5288121470188 -452000 ekin = 1.3666953525299 | erot = 1.87120912975428 | epot = -22.4460428971841 | etot = -19.2081384149 -453000 ekin = 2.05921418622385 | erot = 2.5605072573601 | epot = -22.2726167353286 | etot = -17.6528952917446 -454000 ekin = 1.47363002563146 | erot = 2.19122966699538 | epot = -22.1344003551401 | etot = -18.4695406625132 -455000 ekin = 1.65421215030224 | erot = 2.72189882576686 | epot = -21.9866163127307 | etot = -17.6105053366616 -456000 ekin = 2.34716429715612 | erot = 2.00764007623841 | epot = -21.90677470961 | etot = -17.5519703362155 -457000 ekin = 2.01303704889081 | erot = 2.37161581638612 | epot = -21.8782315807472 | etot = -17.4935787154703 -458000 ekin = 1.72808196373504 | erot = 2.26329030421536 | epot = -21.9079500000029 | etot = -17.9165777320525 -459000 ekin = 2.48364348461731 | erot = 2.3240575427801 | epot = -21.9914965936289 | etot = -17.1837955662315 -460000 ekin = 2.18803460742775 | erot = 2.0007959749913 | epot = -21.9555607076499 | etot = -17.7667301252308 -461000 ekin = 2.27712563450181 | erot = 2.90158501178946 | epot = -21.8847407992378 | etot = -16.7060301529466 -462000 ekin = 2.61279319699133 | erot = 1.79745093921971 | epot = -21.9114284731883 | etot = -17.5011843369773 -463000 ekin = 2.55747204597719 | erot = 3.31219898146397 | epot = -21.8470352327239 | etot = -15.9773642052827 -464000 ekin = 2.15349343963234 | erot = 2.38948322569807 | epot = -21.7801403318396 | etot = -17.2371636665092 -465000 ekin = 2.52543530387722 | erot = 3.61347339076555 | epot = -21.7051172971457 | etot = -15.5662086025029 -466000 ekin = 1.97908646325563 | erot = 2.88692153825727 | epot = -21.7203160444827 | etot = -16.8543080429698 -467000 ekin = 1.62854081734785 | erot = 2.60873315907749 | epot = -21.8060801677334 | etot = -17.568806191308 -468000 ekin = 1.09788716658785 | erot = 3.35078825295795 | epot = -21.8502881604262 | etot = -17.4016127408804 -469000 ekin = 1.70264661426319 | erot = 2.75879477289509 | epot = -21.8645169837194 | etot = -17.4030755965612 -470000 ekin = 1.85887711900485 | erot = 2.87063120254238 | epot = -21.9016760852734 | etot = -17.1721677637262 -471000 ekin = 2.74433347072485 | erot = 2.34940159205027 | epot = -21.9525184591591 | etot = -16.858783396384 -472000 ekin = 2.71861698075021 | erot = 2.13574138468281 | epot = -22.043139657379 | etot = -17.188781291946 -473000 ekin = 2.29393586139762 | erot = 2.07602652007348 | epot = -22.0689471201827 | etot = -17.6989847387116 -474000 ekin = 2.22698015950102 | erot = 2.16459704058481 | epot = -22.0688687972932 | etot = -17.6772915972074 -475000 ekin = 2.49778963349321 | erot = 2.09516395035673 | epot = -22.0493844866031 | etot = -17.4564309027531 -476000 ekin = 2.20247164730207 | erot = 1.76754680635174 | epot = -21.9411609048438 | etot = -17.97114245119 -477000 ekin = 2.45858206017653 | erot = 2.38436547911607 | epot = -21.9035926873371 | etot = -17.0606451480445 -478000 ekin = 1.89904313419097 | erot = 2.04852868041729 | epot = -21.9098024820003 | etot = -17.962230667392 -479000 ekin = 2.27135244904339 | erot = 3.08753180553182 | epot = -21.8855782232971 | etot = -16.5266939687219 -480000 ekin = 1.67006520289894 | erot = 2.76569589720094 | epot = -21.8952512589751 | etot = -17.4594901588753 -481000 ekin = 1.81868654589552 | erot = 2.9414708396822 | epot = -21.8556888607633 | etot = -17.0955314751856 -482000 ekin = 2.1529439710415 | erot = 2.07338062275435 | epot = -21.8139334476411 | etot = -17.5876088538453 -483000 ekin = 1.50003040241525 | erot = 1.99360891760259 | epot = -21.7830178599697 | etot = -18.2893785399518 -484000 ekin = 1.85249475505066 | erot = 2.33993365040866 | epot = -21.8601099434573 | etot = -17.667681537998 -485000 ekin = 1.64683537455249 | erot = 2.50435926395354 | epot = -21.8955949997619 | etot = -17.7444003612559 -486000 ekin = 1.86105919233017 | erot = 2.15998603169225 | epot = -21.8866198023574 | etot = -17.865574578335 -487000 ekin = 2.34642746027526 | erot = 3.11621484615889 | epot = -21.9694478483786 | etot = -16.5068055419444 -488000 ekin = 2.27477353342506 | erot = 3.28151732893999 | epot = -21.9413870028191 | etot = -16.3850961404541 -489000 ekin = 2.38811670508139 | erot = 2.56075035711346 | epot = -21.8588712340667 | etot = -16.9100041718718 -490000 ekin = 2.12967761012957 | erot = 3.54527785345187 | epot = -21.7605939508001 | etot = -16.0856384872187 -491000 ekin = 2.20842614718126 | erot = 2.48924156347248 | epot = -21.6457265496381 | etot = -16.9480588389844 -492000 ekin = 2.4395254440209 | erot = 2.76330603967686 | epot = -21.6220324898892 | etot = -16.4192010061915 -493000 ekin = 1.79410073842211 | erot = 2.29051754332657 | epot = -21.6936080215355 | etot = -17.6089897397868 -494000 ekin = 2.11540109224087 | erot = 3.01314449614681 | epot = -21.7627418159279 | etot = -16.6341962275402 -495000 ekin = 2.15696781071045 | erot = 2.49003984864576 | epot = -21.8774411430157 | etot = -17.2304334836595 -496000 ekin = 2.06056419551912 | erot = 2.60700167900217 | epot = -21.9267578866096 | etot = -17.2591920120883 -497000 ekin = 2.52230078856674 | erot = 1.71004976105951 | epot = -21.8761278437228 | etot = -17.6437772940965 -498000 ekin = 2.15386519150084 | erot = 1.7877582493135 | epot = -21.8235168200552 | etot = -17.8818933792409 -499000 ekin = 3.01273208137282 | erot = 1.73929065213249 | epot = -21.8383204837321 | etot = -17.0862977502268 -500000 ekin = 2.76627013489254 | erot = 2.50177083221038 | epot = -21.8296477468867 | etot = -16.5616067797838 -501000 ekin = 2.69354090483081 | erot = 2.99040340411742 | epot = -21.7028439088855 | etot = -16.0188995999373 -502000 ekin = 1.91653635860025 | erot = 3.89816773432919 | epot = -21.583432763767 | etot = -15.7687286708375 -503000 ekin = 1.8049945577739 | erot = 2.94458962426212 | epot = -21.4077198882804 | etot = -16.6581357062444 -504000 ekin = 1.7007501283395 | erot = 3.04308257832265 | epot = -21.3303407289238 | etot = -16.5865080222617 -505000 ekin = 2.75938082804563 | erot = 2.14633054935697 | epot = -21.3513040286372 | etot = -16.4455926512346 -506000 ekin = 2.29721513417039 | erot = 2.04407050893762 | epot = -21.3782890727133 | etot = -17.0370034296053 -507000 ekin = 3.17630328091397 | erot = 2.42168869077952 | epot = -21.4719630820982 | etot = -15.8739711104047 -508000 ekin = 2.53585993010305 | erot = 2.52795056175584 | epot = -21.6289259001545 | etot = -16.5651154082956 -509000 ekin = 2.12729637924758 | erot = 2.83075478444603 | epot = -21.7770419169527 | etot = -16.8189907532591 -510000 ekin = 2.16130107435063 | erot = 1.4474002808625 | epot = -21.865058134686 | etot = -18.2563567794729 -511000 ekin = 2.54314403873699 | erot = 2.77114415578344 | epot = -21.9659487167511 | etot = -16.6516605222306 -512000 ekin = 2.32805620618464 | erot = 2.80390129625045 | epot = -22.0162636771922 | etot = -16.8843061747571 -513000 ekin = 2.47643071154241 | erot = 2.16996908181989 | epot = -22.0068700128127 | etot = -17.3604702194504 -514000 ekin = 2.76735167549093 | erot = 2.5560945093739 | epot = -22.0884785602195 | etot = -16.7650323753546 -515000 ekin = 2.52241002891622 | erot = 1.82421001167332 | epot = -22.1699357425315 | etot = -17.8233157019419 -516000 ekin = 2.81865025814532 | erot = 2.22273296296804 | epot = -22.2611246405327 | etot = -17.2197414194194 -517000 ekin = 2.03359359720563 | erot = 2.04941720296977 | epot = -22.2784200990267 | etot = -18.1954092988513 -518000 ekin = 2.18715182081959 | erot = 2.76009656526116 | epot = -22.2656600846347 | etot = -17.3184116985539 -519000 ekin = 2.23054901776311 | erot = 2.23031226848963 | epot = -22.3630341627209 | etot = -17.9021728764682 -520000 ekin = 1.88803088032302 | erot = 2.2011880193367 | epot = -22.4543549024555 | etot = -18.3651360027958 -521000 ekin = 2.5788145021642 | erot = 1.87212358693392 | epot = -22.6061072334407 | etot = -18.1551691443426 -522000 ekin = 3.47616129908058 | erot = 1.7772453643546 | epot = -22.6845102288213 | etot = -17.4311035653861 -523000 ekin = 2.84567111920743 | erot = 2.47541358851175 | epot = -22.7265847722155 | etot = -17.4055000644963 -524000 ekin = 2.40295627946642 | erot = 2.37521730874542 | epot = -22.6625181827119 | etot = -17.8843445945001 -525000 ekin = 1.59533356282023 | erot = 2.61484336640372 | epot = -22.5609538171745 | etot = -18.3507768879506 -526000 ekin = 1.67014109396784 | erot = 1.59576537490726 | epot = -22.5093055920857 | etot = -19.2433991232106 -527000 ekin = 2.19651674150708 | erot = 1.9334689520564 | epot = -22.416637825963 | etot = -18.2866521323995 -528000 ekin = 2.6388100641198 | erot = 2.84216954327882 | epot = -22.4260162554832 | etot = -16.9450366480846 -529000 ekin = 2.71709856246059 | erot = 3.01205775167426 | epot = -22.459718422821 | etot = -16.7305621086861 -530000 ekin = 2.59661785995463 | erot = 2.1317538383576 | epot = -22.3199904037947 | etot = -17.5916187054825 -531000 ekin = 2.96824333148625 | erot = 2.35839785116796 | epot = -22.2231381817491 | etot = -16.8964969990948 -532000 ekin = 2.54395795354125 | erot = 2.32264886366187 | epot = -22.2374166013869 | etot = -17.3708097841837 -533000 ekin = 2.47227506927642 | erot = 2.96338827195566 | epot = -22.2425022915258 | etot = -16.8068389502938 -534000 ekin = 2.10485521169123 | erot = 2.03890745270192 | epot = -22.2614710403225 | etot = -18.1177083759294 -535000 ekin = 3.7681160256911 | erot = 2.64691499190425 | epot = -22.2333123161884 | etot = -15.8182812985931 -536000 ekin = 2.78942061222755 | erot = 1.95044966554667 | epot = -22.1701037207896 | etot = -17.4302334430154 -537000 ekin = 2.84557129562433 | erot = 2.62357964692973 | epot = -22.0783833655685 | etot = -16.6092324230145 -538000 ekin = 2.6762341850661 | erot = 2.08962851172352 | epot = -21.9551967105607 | etot = -17.1893340137711 -539000 ekin = 2.73042047481565 | erot = 2.35759238547273 | epot = -22.0351539405022 | etot = -16.9471410802139 -540000 ekin = 2.45519866431123 | erot = 2.4981181890662 | epot = -22.1989060513573 | etot = -17.2455891979799 -541000 ekin = 3.48278591732384 | erot = 2.77790849524953 | epot = -22.293113550245 | etot = -16.0324191376716 -542000 ekin = 2.48972545444614 | erot = 2.87329046778514 | epot = -22.2996895226973 | etot = -16.936673600466 -543000 ekin = 2.34702865402498 | erot = 2.86164606010259 | epot = -22.3019937721979 | etot = -17.0933190580704 -544000 ekin = 2.2292929238022 | erot = 1.46828563141241 | epot = -22.2750271034542 | etot = -18.5774485482396 -545000 ekin = 2.45402962478577 | erot = 2.14177155701245 | epot = -22.2689033162423 | etot = -17.6731021344441 -546000 ekin = 1.98437317503609 | erot = 2.24145066872857 | epot = -22.231451016773 | etot = -18.0056271730083 -547000 ekin = 2.56232506323983 | erot = 1.8957329416699 | epot = -22.2006739415904 | etot = -17.7426159366806 -548000 ekin = 1.72901692707454 | erot = 1.64127805124739 | epot = -22.1889928496838 | etot = -18.8186978713619 -549000 ekin = 1.95693771614146 | erot = 2.64543637333348 | epot = -22.3274020528097 | etot = -17.7250279633348 -550000 ekin = 1.80676199713794 | erot = 1.58556446355636 | epot = -22.4372723150787 | etot = -19.0449458543844 -551000 ekin = 2.19788558810888 | erot = 2.26343688446907 | epot = -22.4937724434742 | etot = -18.0324499708962 -552000 ekin = 2.07444206644618 | erot = 2.4924547779295 | epot = -22.5307066394854 | etot = -17.9638097951097 -553000 ekin = 2.94843364322829 | erot = 2.12309070437467 | epot = -22.5864397604241 | etot = -17.5149154128212 -554000 ekin = 2.8669013077969 | erot = 1.94289309717446 | epot = -22.7547133508173 | etot = -17.944918945846 -555000 ekin = 2.43109245651296 | erot = 2.28708567272124 | epot = -22.8403752960634 | etot = -18.1221971668292 -556000 ekin = 2.31020302439074 | erot = 2.55813703267857 | epot = -22.8772269218695 | etot = -18.0088868648002 -557000 ekin = 2.81362788715375 | erot = 1.42585523952483 | epot = -22.9385956569468 | etot = -18.6991125302682 -558000 ekin = 2.79708127877053 | erot = 1.99543683519586 | epot = -22.9818380573142 | etot = -18.1893199433478 -559000 ekin = 3.34838499070616 | erot = 2.30938187383097 | epot = -23.0552911748694 | etot = -17.3975243103323 -560000 ekin = 3.12573335081966 | erot = 2.33613155247371 | epot = -23.0531044936338 | etot = -17.5912395903404 -561000 ekin = 2.91265639708728 | erot = 2.07460770991413 | epot = -22.9816460067704 | etot = -17.994381899769 -562000 ekin = 3.33014108031755 | erot = 2.52217359738306 | epot = -22.8883444963189 | etot = -17.0360298186183 -563000 ekin = 2.70195061932616 | erot = 1.64767701341235 | epot = -22.8706676277187 | etot = -18.5210399949802 -564000 ekin = 2.82949746353249 | erot = 2.52900091959398 | epot = -22.838139252732 | etot = -17.4796408696055 -565000 ekin = 2.6799458842118 | erot = 2.05094178592405 | epot = -22.7931046586014 | etot = -18.0622169884655 -566000 ekin = 2.32981255203853 | erot = 2.16378765301413 | epot = -22.8021908760777 | etot = -18.308590671025 -567000 ekin = 1.92318241605807 | erot = 2.83258384518153 | epot = -22.7581760555384 | etot = -18.0024097942988 -568000 ekin = 2.17670374071095 | erot = 2.23391142490164 | epot = -22.7850730909043 | etot = -18.3744579252917 -569000 ekin = 2.44198813773898 | erot = 2.6516050247459 | epot = -22.7190926726892 | etot = -17.6254995102043 -570000 ekin = 2.43177788701191 | erot = 1.89766941909699 | epot = -22.6957241348109 | etot = -18.366276828702 -571000 ekin = 2.8616716748476 | erot = 2.96803868526251 | epot = -22.6955740677955 | etot = -16.8658637076854 -572000 ekin = 1.9266829320902 | erot = 3.79132932462474 | epot = -22.6581088104385 | etot = -16.9400965537235 -573000 ekin = 2.4014048576209 | erot = 2.29981222297848 | epot = -22.6359071074265 | etot = -17.9346900268271 -574000 ekin = 1.68882414912167 | erot = 2.32096306897647 | epot = -22.6777773313941 | etot = -18.667990113296 -575000 ekin = 1.85486724354783 | erot = 1.85639491114931 | epot = -22.7438316286092 | etot = -19.0325694739121 -576000 ekin = 3.24777117904094 | erot = 2.95566351376113 | epot = -22.6985695145043 | etot = -16.4951348217022 -577000 ekin = 2.89421636302283 | erot = 2.87485367144017 | epot = -22.6277887766954 | etot = -16.8587187422324 -578000 ekin = 2.40460139915755 | erot = 2.78214210780856 | epot = -22.4342254096835 | etot = -17.2474819027174 -579000 ekin = 2.40583592511148 | erot = 1.99558232802689 | epot = -22.2882462647013 | etot = -17.886828011563 -580000 ekin = 2.69821955230589 | erot = 1.94742609836086 | epot = -22.1748059732807 | etot = -17.529160322614 -581000 ekin = 2.06309002895042 | erot = 2.97622682023057 | epot = -22.0663831943618 | etot = -17.0270663451808 -582000 ekin = 2.33870950534172 | erot = 3.07899815689444 | epot = -21.9472197644711 | etot = -16.529512102235 -583000 ekin = 2.23417742887653 | erot = 2.68476937508274 | epot = -21.8372787545234 | etot = -16.9183319505641 -584000 ekin = 2.94315944829306 | erot = 2.59998006112943 | epot = -21.7510436245968 | etot = -16.2079041151743 -585000 ekin = 2.36063444131441 | erot = 2.49115855857339 | epot = -21.716664566375 | etot = -16.8648715664872 -586000 ekin = 3.56573478158494 | erot = 2.02491202456932 | epot = -21.7701198402972 | etot = -16.1794730341429 -587000 ekin = 3.53722517030309 | erot = 1.97258414970475 | epot = -21.7657911786969 | etot = -16.2559818586891 -588000 ekin = 2.82336660490038 | erot = 1.59341534726277 | epot = -21.7537853332811 | etot = -17.337003381118 -589000 ekin = 2.31627543989202 | erot = 2.20583300708156 | epot = -21.819159896967 | etot = -17.2970514499934 -590000 ekin = 2.5761147615757 | erot = 1.7276907576924 | epot = -21.8419599878986 | etot = -17.5381544686305 -591000 ekin = 1.914719960803 | erot = 3.80606547056266 | epot = -21.9343807003624 | etot = -16.2135952689968 -592000 ekin = 2.11220925054576 | erot = 2.84210516766061 | epot = -21.9632133143301 | etot = -17.0088988961237 -593000 ekin = 1.6646372491541 | erot = 2.46218741166836 | epot = -21.991443017852 | etot = -17.8646183570296 -594000 ekin = 1.86313837200261 | erot = 2.37277652331338 | epot = -22.1142340310892 | etot = -17.8783191357732 -595000 ekin = 1.63972261150116 | erot = 2.14970753455378 | epot = -22.2953930400735 | etot = -18.5059628940186 -596000 ekin = 1.86251521505325 | erot = 1.56938670177389 | epot = -22.4008561933212 | etot = -18.9689542764941 -597000 ekin = 2.21077278172449 | erot = 2.30873590521149 | epot = -22.4593134849654 | etot = -17.9398047980295 -598000 ekin = 1.86600453617805 | erot = 3.02313695685425 | epot = -22.5159510945793 | etot = -17.626809601547 -599000 ekin = 2.86269709275589 | erot = 2.19928983580779 | epot = -22.536034528565 | etot = -17.4740476000013 -600000 ekin = 2.65058373294182 | erot = 2.1453395725597 | epot = -22.4614831887335 | etot = -17.6655598832319 -601000 ekin = 2.97019047275319 | erot = 3.19822787132468 | epot = -22.326632736987 | etot = -16.1582143929091 -602000 ekin = 2.9342181584107 | erot = 2.68627396788675 | epot = -22.2239640230703 | etot = -16.6034718967729 -603000 ekin = 2.59879720190065 | erot = 2.71300694016987 | epot = -22.1699955907165 | etot = -16.8581914486459 -604000 ekin = 1.79062196644622 | erot = 2.11515604890805 | epot = -22.1925738415064 | etot = -18.2867958261521 -605000 ekin = 1.82915557452074 | erot = 2.27656815459633 | epot = -22.2178733165573 | etot = -18.1121495874403 -606000 ekin = 2.33864930282378 | erot = 2.20418036728506 | epot = -22.1612604193817 | etot = -17.6184307492728 -607000 ekin = 2.72666062231761 | erot = 2.97710490441868 | epot = -22.1567890421522 | etot = -16.453023515416 -608000 ekin = 2.45223782114265 | erot = 2.41233206147764 | epot = -22.1258176689204 | etot = -17.2612477863002 -609000 ekin = 1.9103123443041 | erot = 2.62713008552307 | epot = -22.0122680423109 | etot = -17.4748256124837 -610000 ekin = 3.01317318621525 | erot = 2.17099557280212 | epot = -21.9300149409222 | etot = -16.7458461819048 -611000 ekin = 2.44412474588955 | erot = 2.75159898142814 | epot = -21.9253433050474 | etot = -16.7296195777297 -612000 ekin = 2.50268974484936 | erot = 2.16817685060957 | epot = -21.9671518078452 | etot = -17.2962852123863 -613000 ekin = 3.01839912550875 | erot = 2.12784951047117 | epot = -22.0272786909971 | etot = -16.8810300550172 -614000 ekin = 2.25327082296097 | erot = 2.99336372547237 | epot = -22.0696405907525 | etot = -16.8230060423192 -615000 ekin = 1.66371843102219 | erot = 2.63618748290988 | epot = -21.9981136728369 | etot = -17.6982077589049 -616000 ekin = 1.8944933240536 | erot = 2.87324187406682 | epot = -22.0037089747212 | etot = -17.2359737766008 -617000 ekin = 2.14785470202862 | erot = 2.51246772527453 | epot = -22.0246986126974 | etot = -17.3643761853943 -618000 ekin = 3.11173481170738 | erot = 2.74375206798687 | epot = -21.9798263374349 | etot = -16.1243394577406 -619000 ekin = 3.41037360007647 | erot = 2.10617263526643 | epot = -21.9553411920504 | etot = -16.4387949567075 -620000 ekin = 4.28430201323245 | erot = 2.1957191595208 | epot = -21.90292903883 | etot = -15.4229078660767 -621000 ekin = 3.09569620704798 | erot = 2.5579200527576 | epot = -21.8282030152651 | etot = -16.1745867554595 -622000 ekin = 2.76028520250002 | erot = 2.60751645183696 | epot = -21.7454000468333 | etot = -16.3775983924963 -623000 ekin = 2.87264675196573 | erot = 2.90399328536428 | epot = -21.5847888275151 | etot = -15.8081487901851 -624000 ekin = 2.01886304134608 | erot = 3.41825628982886 | epot = -21.4089723845367 | etot = -15.9718530533618 -625000 ekin = 2.87961505977186 | erot = 2.69115058956302 | epot = -21.2853791748084 | etot = -15.7146135254735 -626000 ekin = 2.56085845515984 | erot = 2.15799783992829 | epot = -21.2323395606428 | etot = -16.5134832655546 -627000 ekin = 2.30201253530379 | erot = 2.40176180823354 | epot = -21.2927035084693 | etot = -16.588929164932 -628000 ekin = 2.23995601774104 | erot = 2.75333333919435 | epot = -21.455314974678 | etot = -16.4620256177426 -629000 ekin = 2.20895388847365 | erot = 1.97037787876407 | epot = -21.610417234146 | etot = -17.4310854669083 -630000 ekin = 2.4871462707876 | erot = 2.14054709042105 | epot = -21.6281308139011 | etot = -17.0004374526924 -631000 ekin = 2.05037159551177 | erot = 1.78517593497042 | epot = -21.6331433102589 | etot = -17.7975957797767 -632000 ekin = 1.65441370416735 | erot = 3.2831042715311 | epot = -21.6994880970176 | etot = -16.7619701213191 -633000 ekin = 2.34659059561855 | erot = 2.34109216039932 | epot = -21.8312685537372 | etot = -17.1435857977194 -634000 ekin = 2.31567788282477 | erot = 2.4712780706122 | epot = -21.8809017639924 | etot = -17.0939458105554 -635000 ekin = 1.99067051245485 | erot = 3.35494889731601 | epot = -21.9106362902055 | etot = -16.5650168804346 -636000 ekin = 2.50153790134664 | erot = 2.48847992577269 | epot = -21.8747399591398 | etot = -16.8847221320205 -637000 ekin = 2.76558020651622 | erot = 2.80411296109397 | epot = -21.7869209746905 | etot = -16.2172278070803 -638000 ekin = 2.45491140440701 | erot = 2.8151558595933 | epot = -21.8968446083607 | etot = -16.6267773443604 -639000 ekin = 1.89223426878329 | erot = 2.13319240780509 | epot = -21.9315821506475 | etot = -17.9061554740591 -640000 ekin = 2.12172894611398 | erot = 3.32302900673023 | epot = -21.8803218106497 | etot = -16.4355638578054 -641000 ekin = 2.09554513091345 | erot = 2.23099232244472 | epot = -21.9198354154709 | etot = -17.5932979621127 -642000 ekin = 2.28694261481673 | erot = 2.67379901999301 | epot = -21.9718627423438 | etot = -17.011121107534 -643000 ekin = 2.744472839192 | erot = 2.20403800092058 | epot = -21.9230235464268 | etot = -16.9745127063142 -644000 ekin = 2.87907701459995 | erot = 3.40687801628668 | epot = -21.9412616302816 | etot = -15.655306599395 -645000 ekin = 2.38281186883666 | erot = 2.10846097996387 | epot = -21.8300876925357 | etot = -17.3388148437352 -646000 ekin = 2.68568907435101 | erot = 1.80851531070158 | epot = -21.6847618262214 | etot = -17.1905574411688 -647000 ekin = 2.47722877856152 | erot = 2.03923301171106 | epot = -21.5874044483889 | etot = -17.0709426581163 -648000 ekin = 2.25562229204822 | erot = 1.67565814597326 | epot = -21.6993239289701 | etot = -17.7680434909486 -649000 ekin = 2.58610844989063 | erot = 1.77373064510098 | epot = -21.8575240187191 | etot = -17.4976849237275 -650000 ekin = 2.66588270497851 | erot = 2.18108360585018 | epot = -21.9508135981932 | etot = -17.1038472873645 -651000 ekin = 2.11913643076637 | erot = 3.26412345241467 | epot = -22.0193654333906 | etot = -16.6361055502095 -652000 ekin = 2.32941174826482 | erot = 2.30873319569133 | epot = -22.0419984408252 | etot = -17.4038534968691 -653000 ekin = 2.0648428652661 | erot = 2.14823788524201 | epot = -22.0572931422935 | etot = -17.8442123917854 -654000 ekin = 2.29862160782433 | erot = 1.85805598161352 | epot = -22.0910689230265 | etot = -17.9343913335886 -655000 ekin = 2.10941796901071 | erot = 1.77798843556509 | epot = -22.0694006428864 | etot = -18.1819942383106 -656000 ekin = 2.47625408636497 | erot = 2.33538026369006 | epot = -22.0466976130346 | etot = -17.2350632629796 -657000 ekin = 2.50533498663532 | erot = 2.85849882524471 | epot = -22.0769458799067 | etot = -16.7131120680267 -658000 ekin = 2.50225541618483 | erot = 2.85625932114156 | epot = -22.0511557631718 | etot = -16.6926410258454 -659000 ekin = 3.39371926051805 | erot = 2.76525782770508 | epot = -21.9060640783663 | etot = -15.7470869901432 -660000 ekin = 2.71591740302079 | erot = 2.00360570980063 | epot = -21.7628277690744 | etot = -17.043304656253 -661000 ekin = 2.22252752899417 | erot = 2.53760290280427 | epot = -21.6292254759783 | etot = -16.8690950441799 -662000 ekin = 2.05296914064405 | erot = 2.55185124215154 | epot = -21.5811922241459 | etot = -16.9763718413503 -663000 ekin = 2.25677932682754 | erot = 2.31580178345621 | epot = -21.5535923948076 | etot = -16.9810112845238 -664000 ekin = 2.34856452305364 | erot = 1.86775188552653 | epot = -21.4530740440284 | etot = -17.2367576354483 -665000 ekin = 2.63111504026501 | erot = 2.28726928484771 | epot = -21.3846024000308 | etot = -16.4662180749181 -666000 ekin = 1.64075072082918 | erot = 2.31336726697097 | epot = -21.2830441766066 | etot = -17.3289261888065 -667000 ekin = 1.67151341437157 | erot = 2.82297479485494 | epot = -21.1978062440647 | etot = -16.7033180348382 -668000 ekin = 2.49938009250085 | erot = 3.28711483409768 | epot = -21.0664148636443 | etot = -15.2799199370457 -669000 ekin = 1.62232962120344 | erot = 2.64367899162068 | epot = -20.9834308093409 | etot = -16.7174221965168 -670000 ekin = 2.22815723319758 | erot = 2.60319748550307 | epot = -20.9017148964281 | etot = -16.0703601777275 -671000 ekin = 2.27399198808932 | erot = 2.15907350601013 | epot = -20.8548869535533 | etot = -16.4218214594538 -672000 ekin = 1.96813107327782 | erot = 1.65324359657507 | epot = -20.772525080039 | etot = -17.1511504101861 -673000 ekin = 1.89901466802435 | erot = 2.07212800226185 | epot = -20.7410076393374 | etot = -16.7698649690512 -674000 ekin = 2.08208137777485 | erot = 2.16201236525253 | epot = -20.7653673426948 | etot = -16.5212735996674 -675000 ekin = 2.0453276771275 | erot = 2.48425879615287 | epot = -20.7843939429191 | etot = -16.2548074696387 -676000 ekin = 2.45143986767107 | erot = 2.78633106178593 | epot = -20.8123774066529 | etot = -15.5746064771959 -677000 ekin = 2.19157287399382 | erot = 2.62633282573085 | epot = -20.8265856172367 | etot = -16.008679917512 -678000 ekin = 2.13997346968594 | erot = 2.79122127613926 | epot = -20.7113565112497 | etot = -15.7801617654245 -679000 ekin = 2.16938962390632 | erot = 2.17589740910314 | epot = -20.6051510781816 | etot = -16.2598640451722 -680000 ekin = 2.08639324470195 | erot = 2.68206939589547 | epot = -20.6273390457908 | etot = -15.8588764051934 -681000 ekin = 2.17629732810903 | erot = 1.82420607644455 | epot = -20.7142689529019 | etot = -16.7137655483484 -682000 ekin = 3.02912978468384 | erot = 2.39650400849398 | epot = -20.6940095597209 | etot = -15.268375766543 -683000 ekin = 2.84669773609778 | erot = 2.0986204490286 | epot = -20.7021074415215 | etot = -15.7567892563951 -684000 ekin = 1.96664671503579 | erot = 2.99517270495454 | epot = -20.7465124798198 | etot = -15.7846930598294 -685000 ekin = 1.50234716171427 | erot = 2.04490190725428 | epot = -20.7574586814665 | etot = -17.2102096124979 -686000 ekin = 2.2983326300428 | erot = 2.55614840511419 | epot = -20.7458450763069 | etot = -15.8913640411499 -687000 ekin = 1.8557723170762 | erot = 2.84941631673454 | epot = -20.6738522345032 | etot = -15.9686636006925 -688000 ekin = 2.56405256659889 | erot = 2.23115057372413 | epot = -20.6302627184135 | etot = -15.8350595780904 -689000 ekin = 2.75063212318972 | erot = 2.68162291280505 | epot = -20.7838487483938 | etot = -15.351593712399 -690000 ekin = 2.6815028132868 | erot = 2.52132555802218 | epot = -21.0487980543157 | etot = -15.8459696830068 -691000 ekin = 2.29143802116346 | erot = 2.52222072052105 | epot = -21.2158695525349 | etot = -16.4022108108504 -692000 ekin = 2.4246270425625 | erot = 3.24973814883517 | epot = -21.2444446764855 | etot = -15.5700794850878 -693000 ekin = 2.38038731016142 | erot = 2.9968191678008 | epot = -21.3131544661847 | etot = -15.9359479882225 -694000 ekin = 2.69963794803277 | erot = 2.53306749808314 | epot = -21.5028226467206 | etot = -16.2701172006047 -695000 ekin = 2.49329729781653 | erot = 1.18245567143116 | epot = -21.6798414810252 | etot = -18.0040885117775 -696000 ekin = 1.86320369897189 | erot = 1.46627983716862 | epot = -21.665818352319 | etot = -18.3363348161785 -697000 ekin = 2.40483641810464 | erot = 2.10687269227545 | epot = -21.7015701067683 | etot = -17.1898609963882 -698000 ekin = 2.32104204819312 | erot = 1.91618970993301 | epot = -21.7674602711953 | etot = -17.5302285130692 -699000 ekin = 2.45122174410528 | erot = 2.56320773764919 | epot = -21.7532145628501 | etot = -16.7387850810956 -700000 ekin = 2.13478862711018 | erot = 2.28875108681682 | epot = -21.6619710583027 | etot = -17.2384313443757 -701000 ekin = 2.15430012038637 | erot = 2.18434613511233 | epot = -21.5402240218772 | etot = -17.2015777663785 -702000 ekin = 1.57710248759615 | erot = 1.99882868785594 | epot = -21.49627530475 | etot = -17.9203441292979 -703000 ekin = 2.08893022036769 | erot = 2.17530309960948 | epot = -21.5146124029064 | etot = -17.2503790829292 -704000 ekin = 2.82158558148019 | erot = 1.94529304578916 | epot = -21.5362273629372 | etot = -16.7693487356679 -705000 ekin = 2.80985515279542 | erot = 2.16764072993712 | epot = -21.4883886516798 | etot = -16.5108927689472 -706000 ekin = 1.97469093776246 | erot = 2.31446109128202 | epot = -21.4846235511326 | etot = -17.1954715220882 -707000 ekin = 1.90739234287698 | erot = 2.04402779053621 | epot = -21.5406324629157 | etot = -17.5892123295025 -708000 ekin = 2.48934210084869 | erot = 2.15886534084806 | epot = -21.5617376681341 | etot = -16.9135302264373 -709000 ekin = 2.88909793919243 | erot = 2.58134997867787 | epot = -21.6032655988125 | etot = -16.1328176809422 -710000 ekin = 2.18226376204308 | erot = 2.2781120102664 | epot = -21.5729606480227 | etot = -17.1125848757132 -711000 ekin = 2.31693491167058 | erot = 1.40165937970165 | epot = -21.59486559309 | etot = -17.8762713017178 -712000 ekin = 2.5598074081136 | erot = 2.27261456104693 | epot = -21.7093783142763 | etot = -16.8769563451158 -713000 ekin = 1.95731492543824 | erot = 2.3177907879475 | epot = -21.7925969744163 | etot = -17.5174912610306 -714000 ekin = 2.56349602857406 | erot = 2.10802762811156 | epot = -21.8549579399156 | etot = -17.18343428323 -715000 ekin = 2.42420336547985 | erot = 3.74011705339237 | epot = -21.8363873817813 | etot = -15.6720669629091 -716000 ekin = 2.83424908488974 | erot = 2.84906269643008 | epot = -21.7516725023646 | etot = -16.0683607210448 -717000 ekin = 3.449141155469 | erot = 3.20655139229296 | epot = -21.6556489626088 | etot = -14.9999564148469 -718000 ekin = 3.10544916005123 | erot = 3.94111109893272 | epot = -21.5509268479497 | etot = -14.5043665889657 -719000 ekin = 2.38560143578601 | erot = 2.95196851228004 | epot = -21.5368313311174 | etot = -16.1992613830513 -720000 ekin = 2.22547766761154 | erot = 3.14352355524054 | epot = -21.5280561989878 | etot = -16.1590549761357 -721000 ekin = 1.71648896607559 | erot = 2.23916158851569 | epot = -21.4544704731448 | etot = -17.4988199185535 -722000 ekin = 1.92969886536088 | erot = 2.81516182454304 | epot = -21.4789602411171 | etot = -16.7340995512131 -723000 ekin = 2.37878330622949 | erot = 2.55685717442619 | epot = -21.4258282544299 | etot = -16.4901877737742 -724000 ekin = 1.74694406742187 | erot = 2.45584755221003 | epot = -21.4005294054569 | etot = -17.197737785825 -725000 ekin = 2.29310276841874 | erot = 2.95220863719859 | epot = -21.4633620430606 | etot = -16.2180506374432 -726000 ekin = 1.63448654082141 | erot = 2.30654545762654 | epot = -21.5038765351965 | etot = -17.5628445367485 -727000 ekin = 2.46595168496949 | erot = 3.19849750353943 | epot = -21.5266836250346 | etot = -15.8622344365256 -728000 ekin = 2.21687538357189 | erot = 2.165919089739 | epot = -21.513377733993 | etot = -17.1305832606821 -729000 ekin = 1.89362806269803 | erot = 1.6657813694817 | epot = -21.5533880281027 | etot = -17.993978595923 -730000 ekin = 1.78199630529827 | erot = 2.15399263718836 | epot = -21.5485428072817 | etot = -17.6125538647951 -731000 ekin = 2.16845146601146 | erot = 2.96876326415235 | epot = -21.4849197438583 | etot = -16.3477050136945 -732000 ekin = 2.41098004969989 | erot = 2.27162025823661 | epot = -21.3730972185635 | etot = -16.690496910627 -733000 ekin = 3.04997179731017 | erot = 2.57297105879857 | epot = -21.4193189845269 | etot = -15.7963761284182 -734000 ekin = 2.36878310719472 | erot = 2.04459379545547 | epot = -21.4834058303776 | etot = -17.0700289277274 -735000 ekin = 2.13407288267268 | erot = 1.55092026474352 | epot = -21.5368505426165 | etot = -17.8518573952003 -736000 ekin = 2.1362063540729 | erot = 3.45790946645046 | epot = -21.6430634912022 | etot = -16.0489476706788 -737000 ekin = 1.73554233533154 | erot = 3.58779507650378 | epot = -21.6702622900886 | etot = -16.3469248782532 -738000 ekin = 2.01164487816147 | erot = 2.50514634893196 | epot = -21.6986247134705 | etot = -17.1818334863771 -739000 ekin = 1.85074759845217 | erot = 2.19370944227887 | epot = -21.7133968547419 | etot = -17.6689398140108 -740000 ekin = 2.84699687053757 | erot = 2.7912333503138 | epot = -21.7387373822546 | etot = -16.1005071614032 -741000 ekin = 2.47259234369835 | erot = 2.90849116827955 | epot = -21.7966678254519 | etot = -16.415584313474 -742000 ekin = 2.74165618770735 | erot = 3.26593517824215 | epot = -21.9343343201998 | etot = -15.9267429542503 -743000 ekin = 2.23285850131327 | erot = 3.20738521933767 | epot = -22.0692807008484 | etot = -16.6290369801974 -744000 ekin = 2.0089223878876 | erot = 3.79240058007591 | epot = -22.1503347602461 | etot = -16.3490117922826 -745000 ekin = 3.13933421257374 | erot = 2.32790266093992 | epot = -22.1471844512455 | etot = -16.6799475777318 -746000 ekin = 2.96008666942407 | erot = 2.64881993709762 | epot = -22.122986971371 | etot = -16.5140803648493 -747000 ekin = 2.31606158946103 | erot = 2.05363821834659 | epot = -22.1269013575191 | etot = -17.7572015497115 -748000 ekin = 2.36202846469555 | erot = 2.41533863458708 | epot = -22.1607507396176 | etot = -17.3833836403349 -749000 ekin = 2.07010000324332 | erot = 2.77477767451978 | epot = -22.1615532796329 | etot = -17.3166756018698 -750000 ekin = 1.65856288792329 | erot = 2.38394476194078 | epot = -22.2376789275399 | etot = -18.1951712776758 -751000 ekin = 1.79369238822413 | erot = 2.82711279056287 | epot = -22.3399930058064 | etot = -17.7191878270194 -752000 ekin = 1.3565337369664 | erot = 1.46027272724399 | epot = -22.4259407567778 | etot = -19.6091342925674 -753000 ekin = 1.88677173003379 | erot = 2.44011815977781 | epot = -22.3759237785306 | etot = -18.049033888719 -754000 ekin = 1.74757468714757 | erot = 2.73579703445366 | epot = -22.2777874333258 | etot = -17.7944157117246 -755000 ekin = 2.39540881497791 | erot = 2.40997626783999 | epot = -22.1989471718282 | etot = -17.3935620890103 -756000 ekin = 1.8374249552549 | erot = 2.7898384136326 | epot = -22.1256041210015 | etot = -17.498340752114 -757000 ekin = 1.97252620256626 | erot = 2.57811195064152 | epot = -22.0524369346386 | etot = -17.5017987814308 -758000 ekin = 1.18943353600229 | erot = 2.72305618385831 | epot = -21.9808261825123 | etot = -18.0683364626517 -759000 ekin = 2.16138393466163 | erot = 1.3977782924933 | epot = -21.9922114478071 | etot = -18.4330492206522 -760000 ekin = 2.57272139862155 | erot = 2.33385746622741 | epot = -22.0280808566088 | etot = -17.1215019917599 -761000 ekin = 2.08641160599719 | erot = 2.24969428592799 | epot = -22.1058253802024 | etot = -17.7697194882772 -762000 ekin = 2.1361825080532 | erot = 1.66094626659748 | epot = -22.1311549030111 | etot = -18.3340261283604 -763000 ekin = 2.43010472752659 | erot = 3.36039539289095 | epot = -22.2016765636182 | etot = -16.4111764432007 -764000 ekin = 2.84811842220375 | erot = 2.79168514035599 | epot = -22.2088162305687 | etot = -16.569012668009 -765000 ekin = 1.81453694547676 | erot = 2.77469277969824 | epot = -22.1144835078989 | etot = -17.5252537827239 -766000 ekin = 2.64878768483921 | erot = 2.31374812658081 | epot = -21.9875154152781 | etot = -17.0249796038581 -767000 ekin = 2.58989188969789 | erot = 2.86706483154975 | epot = -21.9043548536665 | etot = -16.4473981324189 -768000 ekin = 1.86368721962895 | erot = 2.78532510291609 | epot = -21.9343474885242 | etot = -17.2853351659791 -769000 ekin = 2.40214820980699 | erot = 2.31347943810898 | epot = -22.0333978303343 | etot = -17.3177701824184 -770000 ekin = 2.49202416232453 | erot = 3.23110904096713 | epot = -22.1402797305012 | etot = -16.4171465272095 -771000 ekin = 2.33292298096755 | erot = 2.27796352597305 | epot = -22.17790877141 | etot = -17.5670222644694 -772000 ekin = 2.29055460354208 | erot = 2.99393464583806 | epot = -22.2735812923856 | etot = -16.9890920430054 -773000 ekin = 2.23134390761289 | erot = 1.82253948832535 | epot = -22.3356201893464 | etot = -18.2817367934081 -774000 ekin = 2.82484138078993 | erot = 2.21081663204023 | epot = -22.3299367088855 | etot = -17.2942786960554 -775000 ekin = 1.82366213720863 | erot = 1.87126548470211 | epot = -22.2720238956272 | etot = -18.5770962737165 -776000 ekin = 1.39176212331748 | erot = 3.16041697920643 | epot = -22.2452599321026 | etot = -17.6930808295787 -777000 ekin = 1.62656494455193 | erot = 2.80889498236168 | epot = -22.1606670215091 | etot = -17.7252070945955 -778000 ekin = 1.49453026929824 | erot = 2.24185784607895 | epot = -22.1729818621132 | etot = -18.436593746736 -779000 ekin = 1.88163725615419 | erot = 1.90711264831679 | epot = -22.2125328330488 | etot = -18.4237829285778 -780000 ekin = 1.70286422785891 | erot = 2.30497222936397 | epot = -22.2799394088718 | etot = -18.2721029516489 -781000 ekin = 2.12678565466725 | erot = 2.5607588088585 | epot = -22.3659184198104 | etot = -17.6783739562846 -782000 ekin = 2.6031276814174 | erot = 1.95727704696267 | epot = -22.2790730674379 | etot = -17.7186683390578 -783000 ekin = 2.1948400081794 | erot = 2.90035247320886 | epot = -22.2007535116304 | etot = -17.1055610302421 -784000 ekin = 2.84936415382249 | erot = 2.24073860376602 | epot = -22.2096265501644 | etot = -17.1195237925759 -785000 ekin = 3.14239456216427 | erot = 2.92883564065743 | epot = -22.250724619048 | etot = -16.1794944162263 -786000 ekin = 2.83302205045547 | erot = 3.44600351958776 | epot = -22.2930098599336 | etot = -16.0139842898904 -787000 ekin = 2.41036243622077 | erot = 3.01402072617264 | epot = -22.2336456938648 | etot = -16.8092625314714 -788000 ekin = 1.99496987344553 | erot = 2.0160805570118 | epot = -22.2004170890862 | etot = -18.1893666586289 -789000 ekin = 2.46197992481173 | erot = 2.27411334262936 | epot = -22.132074772345 | etot = -17.3959815049039 -790000 ekin = 3.57873057583599 | erot = 2.82417596997282 | epot = -22.0695018605637 | etot = -15.6665953147549 -791000 ekin = 3.12331080904155 | erot = 2.42394177795114 | epot = -22.080644982627 | etot = -16.5333923956343 -792000 ekin = 3.95364280137309 | erot = 1.97266999125562 | epot = -22.0153287445499 | etot = -16.0890159519212 -793000 ekin = 2.26819643622963 | erot = 2.58701659000735 | epot = -21.9215549471255 | etot = -17.0663419208885 -794000 ekin = 2.16067669778386 | erot = 2.44301139774416 | epot = -21.7616964244106 | etot = -17.1580083288826 -795000 ekin = 1.62512477760333 | erot = 2.41826409844339 | epot = -21.600959390557 | etot = -17.5575705145103 -796000 ekin = 2.18368115482543 | erot = 2.13083402580691 | epot = -21.4815591943755 | etot = -17.1670440137431 -797000 ekin = 1.81443490468363 | erot = 1.99530711788362 | epot = -21.473386092747 | etot = -17.6636440701797 -798000 ekin = 2.22066977376058 | erot = 2.5136217615585 | epot = -21.5005357102706 | etot = -16.7662441749516 -799000 ekin = 1.89003567281256 | erot = 2.87071760546339 | epot = -21.4707763423861 | etot = -16.7100230641101 -800000 ekin = 2.14249138302219 | erot = 2.35217342569423 | epot = -21.3794335794328 | etot = -16.8847687707164 -801000 ekin = 1.84325206062913 | erot = 1.65490182118709 | epot = -21.2215462073953 | etot = -17.7233923255791 -802000 ekin = 2.20306916659744 | erot = 2.22362280870385 | epot = -21.1078917551145 | etot = -16.6811997798132 -803000 ekin = 2.64756180889851 | erot = 1.90771195713019 | epot = -21.075516629541 | etot = -16.5202428635123 -804000 ekin = 2.34383808048561 | erot = 2.89135072882195 | epot = -21.017800229163 | etot = -15.7826114198554 -805000 ekin = 1.79807471993961 | erot = 2.71703055229461 | epot = -20.8858735264626 | etot = -16.3707682542284 -806000 ekin = 1.74933039138001 | erot = 2.08508375084938 | epot = -20.8501295844101 | etot = -17.0157154421807 -807000 ekin = 1.57086516216332 | erot = 1.70410734557162 | epot = -20.9085753440719 | etot = -17.633602836337 -808000 ekin = 2.08081471116263 | erot = 2.40350759554646 | epot = -20.984850158389 | etot = -16.50052785168 -809000 ekin = 2.61726856088296 | erot = 1.51240481195689 | epot = -20.9779384430211 | etot = -16.8482650701812 -810000 ekin = 3.07307660201955 | erot = 2.65446786899303 | epot = -20.8951461498987 | etot = -15.1676016788862 -811000 ekin = 3.02865521289707 | erot = 3.61705494723141 | epot = -20.938700013487 | etot = -14.2929898533586 -812000 ekin = 2.13828724317889 | erot = 2.79208705150833 | epot = -21.0253177933673 | etot = -16.0949434986801 -813000 ekin = 2.19066742087212 | erot = 3.16148861694095 | epot = -21.2162063121508 | etot = -15.8640502743377 -814000 ekin = 1.70799980950659 | erot = 2.98447609556824 | epot = -21.3083573707191 | etot = -16.6158814656443 -815000 ekin = 2.14655793408327 | erot = 2.27340066456812 | epot = -21.3095101360258 | etot = -16.8895515373744 -816000 ekin = 2.70387013105122 | erot = 1.53091743336716 | epot = -21.3380867226337 | etot = -17.1032991582153 -817000 ekin = 2.55772150346674 | erot = 2.58538498973779 | epot = -21.4687911304725 | etot = -16.325684637268 -818000 ekin = 2.27829227808576 | erot = 2.2610194627647 | epot = -21.51579990444 | etot = -16.9764881635896 -819000 ekin = 2.10478468907764 | erot = 3.02372442904099 | epot = -21.5288267165814 | etot = -16.4003175984628 -820000 ekin = 2.50616680560145 | erot = 2.71768974330904 | epot = -21.5031693602738 | etot = -16.2793128113633 -821000 ekin = 2.62605779655516 | erot = 2.5517168842266 | epot = -21.4782637845704 | etot = -16.3004891037887 -822000 ekin = 3.63911022661674 | erot = 2.20246809596405 | epot = -21.4682605531632 | etot = -15.6266822305824 -823000 ekin = 3.5890614966436 | erot = 2.73568419343317 | epot = -21.4644034772322 | etot = -15.1396577871554 -824000 ekin = 4.11258611216971 | erot = 3.29177083877816 | epot = -21.4054670493164 | etot = -14.0011100983685 -825000 ekin = 2.90574167985894 | erot = 3.46418314252362 | epot = -21.2428648794989 | etot = -14.8729400571163 -826000 ekin = 1.72166879396265 | erot = 1.97031409321974 | epot = -21.0465041377165 | etot = -17.3545212505341 -827000 ekin = 1.9124296633897 | erot = 2.55758046921178 | epot = -20.9198493255665 | etot = -16.449839192965 -828000 ekin = 2.38136751134629 | erot = 2.55567683032446 | epot = -20.8197900136475 | etot = -15.8827456719767 -829000 ekin = 2.24752095426969 | erot = 1.78485397592485 | epot = -20.7078548678742 | etot = -16.6754799376796 -830000 ekin = 2.52760515907096 | erot = 2.34151737044649 | epot = -20.587853056286 | etot = -15.7187305267686 -831000 ekin = 2.68303948249783 | erot = 2.12107955860996 | epot = -20.4986251845811 | etot = -15.6945061434733 -832000 ekin = 2.5995339697481 | erot = 2.01126070882922 | epot = -20.317042202606 | etot = -15.7062475240286 -833000 ekin = 2.41782691161325 | erot = 2.6104596916825 | epot = -20.2071689208773 | etot = -15.1788823175815 -834000 ekin = 2.81812459074308 | erot = 2.32580908472724 | epot = -20.1954682788161 | etot = -15.0515346033458 -835000 ekin = 2.76877914745308 | erot = 2.73409979010148 | epot = -20.2858954358872 | etot = -14.7830164983326 -836000 ekin = 2.56414357027351 | erot = 2.85425200452209 | epot = -20.4214942021634 | etot = -15.0030986273678 -837000 ekin = 1.77982670030629 | erot = 1.97011006317925 | epot = -20.4747752062613 | etot = -16.7248384427758 -838000 ekin = 1.9809448596471 | erot = 2.7884830818994 | epot = -20.4863255993134 | etot = -15.7168976577669 -839000 ekin = 1.99257457422062 | erot = 2.69848359788971 | epot = -20.4692625343629 | etot = -15.7782043622526 -840000 ekin = 1.695727430563 | erot = 2.96442093053147 | epot = -20.5469645302134 | etot = -15.886816169119 -841000 ekin = 2.78747714781483 | erot = 2.84618551296106 | epot = -20.6836589678232 | etot = -15.0499963070473 -842000 ekin = 2.5516108705537 | erot = 2.86967631676814 | epot = -20.7215472760611 | etot = -15.3002600887392 -843000 ekin = 2.00510252228194 | erot = 2.62122625910375 | epot = -20.7126385725957 | etot = -16.08630979121 -844000 ekin = 1.53691661689193 | erot = 1.93035645367874 | epot = -20.7513861721528 | etot = -17.2841131015821 -845000 ekin = 2.30558370867946 | erot = 2.31565535118112 | epot = -20.8631357757407 | etot = -16.2418967158802 -846000 ekin = 2.08834507240676 | erot = 2.32509193883626 | epot = -20.9437811774395 | etot = -16.5303441661965 -847000 ekin = 2.47860773767064 | erot = 2.63825359015714 | epot = -20.9035842025176 | etot = -15.7867228746898 -848000 ekin = 2.15941499449244 | erot = 1.46592084588015 | epot = -20.9421067829749 | etot = -17.3167709426023 -849000 ekin = 2.00792301359513 | erot = 2.48538196855797 | epot = -20.9573985285088 | etot = -16.4640935463557 -850000 ekin = 2.54511466975944 | erot = 2.66862013426066 | epot = -20.9501688277166 | etot = -15.7364340236965 -851000 ekin = 2.16918996810547 | erot = 2.93012028589825 | epot = -20.9578305522532 | etot = -15.8585202982494 -852000 ekin = 2.48734107685338 | erot = 2.46343406489934 | epot = -20.9874894800747 | etot = -16.0367143383219 -853000 ekin = 2.41308828583826 | erot = 2.97804263482415 | epot = -20.9325497268305 | etot = -15.5414188061681 -854000 ekin = 2.35481893706787 | erot = 2.85453301930642 | epot = -20.8448014229524 | etot = -15.6354494665781 -855000 ekin = 2.37449305766123 | erot = 2.06591921004024 | epot = -20.8766751569445 | etot = -16.4362628892431 -856000 ekin = 2.52589522695461 | erot = 2.75200317380097 | epot = -20.7810899349363 | etot = -15.5031915341808 -857000 ekin = 2.56479713152188 | erot = 3.03132159965742 | epot = -20.6741126728545 | etot = -15.0779939416752 -858000 ekin = 3.12600431259895 | erot = 2.14307227855762 | epot = -20.6236416669373 | etot = -15.3545650757807 -859000 ekin = 2.91606538598306 | erot = 2.23743055034025 | epot = -20.6462917973092 | etot = -15.4927958609859 -860000 ekin = 2.88632968266491 | erot = 1.51779320350218 | epot = -20.6690491266306 | etot = -16.2649262404636 -861000 ekin = 2.33646237335095 | erot = 2.84993579191977 | epot = -20.6662989350089 | etot = -15.4799007697382 -862000 ekin = 3.06142360843216 | erot = 1.86714994928413 | epot = -20.7124901286986 | etot = -15.7839165709823 -863000 ekin = 2.88328806598044 | erot = 1.77603258370269 | epot = -20.8185427296306 | etot = -16.1592220799475 -864000 ekin = 2.96121160100481 | erot = 2.65074453444238 | epot = -21.0023810054863 | etot = -15.3904248700391 -865000 ekin = 3.32435720931815 | erot = 2.24357551683278 | epot = -21.1325456190927 | etot = -15.5646128929418 -866000 ekin = 2.85046827088543 | erot = 3.16864534840895 | epot = -21.2188104480758 | etot = -15.1996968287815 -867000 ekin = 2.74121981057393 | erot = 3.09690590629766 | epot = -21.2063169983776 | etot = -15.368191281506 -868000 ekin = 2.19317218320696 | erot = 2.23855212764239 | epot = -21.1598851105383 | etot = -16.728160799689 -869000 ekin = 2.92776187579401 | erot = 2.49696120772198 | epot = -21.1055152241549 | etot = -15.6807921406389 -870000 ekin = 2.48025968092564 | erot = 2.11893759578989 | epot = -21.0847323271701 | etot = -16.4855350504546 -871000 ekin = 2.1845388948614 | erot = 2.3744484320603 | epot = -20.9752554539106 | etot = -16.4162681269889 -872000 ekin = 1.52991727300488 | erot = 2.08936497511662 | epot = -20.9296773909044 | etot = -17.3103951427829 -873000 ekin = 1.39436098333864 | erot = 2.29076078630038 | epot = -20.9970902403712 | etot = -17.3119684707321 -874000 ekin = 1.40847516007258 | erot = 2.77014925513763 | epot = -21.1567852435976 | etot = -16.9781608283874 -875000 ekin = 1.18430169865448 | erot = 2.73096315540972 | epot = -21.2931389111423 | etot = -17.377874057078 -876000 ekin = 1.83112091845917 | erot = 2.99592495330209 | epot = -21.3275375070725 | etot = -16.5004916353113 -877000 ekin = 2.38101871692681 | erot = 2.03701942732192 | epot = -21.413314709608 | etot = -16.9952765653592 -878000 ekin = 2.13057677670605 | erot = 1.75664755774656 | epot = -21.4109592588752 | etot = -17.5237349244226 -879000 ekin = 2.23974599078717 | erot = 2.71277945678049 | epot = -21.3991125430578 | etot = -16.4465870954902 -880000 ekin = 2.68276925988414 | erot = 2.78419511289156 | epot = -21.4451599851349 | etot = -15.9781956123593 -881000 ekin = 2.86954422987714 | erot = 2.35934309050243 | epot = -21.4304898157632 | etot = -16.2016024953836 -882000 ekin = 2.33322673498713 | erot = 2.17176089427924 | epot = -21.3686767563163 | etot = -16.8636891270499 -883000 ekin = 2.36505939156363 | erot = 1.97542469807282 | epot = -21.1740561038168 | etot = -16.8335720141804 -884000 ekin = 2.53970453736975 | erot = 2.25146966956772 | epot = -21.0784914585951 | etot = -16.2873172516576 -885000 ekin = 2.86113216999841 | erot = 2.27428598539185 | epot = -21.0769714000078 | etot = -15.9415532446176 -886000 ekin = 3.16926259480325 | erot = 1.7479502049347 | epot = -21.1261039292057 | etot = -16.2088911294677 -887000 ekin = 2.66032303732719 | erot = 2.49430923572929 | epot = -21.1888853902954 | etot = -16.0342531172389 -888000 ekin = 2.14251397925541 | erot = 2.83067746317048 | epot = -21.2727723297671 | etot = -16.2995808873412 -889000 ekin = 2.13717501491483 | erot = 2.20010872789046 | epot = -21.1879846015514 | etot = -16.8507008587461 -890000 ekin = 1.76445604927834 | erot = 2.97270674684479 | epot = -21.249043049208 | etot = -16.5118802530849 -891000 ekin = 1.64410761916635 | erot = 2.28011654490668 | epot = -21.3725568550826 | etot = -17.4483326910096 -892000 ekin = 1.9736849956493 | erot = 2.35977031841883 | epot = -21.5165660475445 | etot = -17.1831107334764 -893000 ekin = 1.78063715284303 | erot = 1.84016145583949 | epot = -21.5929324441233 | etot = -17.9721338354408 -894000 ekin = 2.80890536765195 | erot = 2.8033716212873 | epot = -21.68691302035 | etot = -16.0746360314107 -895000 ekin = 2.03615797288147 | erot = 2.73640459758099 | epot = -21.7733873211515 | etot = -17.000824750689 -896000 ekin = 1.66692759050852 | erot = 2.55822798781453 | epot = -21.9049846669574 | etot = -17.6798290886343 -897000 ekin = 1.79224531734011 | erot = 2.35948275762719 | epot = -22.0434422253312 | etot = -17.8917141503639 -898000 ekin = 1.83919553961872 | erot = 2.41642222286753 | epot = -22.0758336371865 | etot = -17.8202158747002 -899000 ekin = 1.6636071320686 | erot = 3.06317427040907 | epot = -22.0015388871688 | etot = -17.2747574846912 -900000 ekin = 2.15282039168693 | erot = 2.62540512899952 | epot = -21.9732889613479 | etot = -17.1950634406614 -901000 ekin = 2.43388685834711 | erot = 2.69648861895498 | epot = -22.0420272097224 | etot = -16.9116517324203 -902000 ekin = 2.58083086140289 | erot = 2.40599679938446 | epot = -22.0470185105966 | etot = -17.0601908498092 -903000 ekin = 2.38921046669397 | erot = 2.40351321660547 | epot = -22.0515567722576 | etot = -17.2588330889581 -904000 ekin = 1.99826824339051 | erot = 3.15684651679006 | epot = -22.0749158572968 | etot = -16.9198010971163 -905000 ekin = 2.28113475313044 | erot = 2.2074638316632 | epot = -22.0890181666858 | etot = -17.6004195818921 -906000 ekin = 2.49879330353343 | erot = 1.671102945257 | epot = -22.0615337836095 | etot = -17.8916375348191 -907000 ekin = 2.34107735293828 | erot = 2.16848534916945 | epot = -21.914392426319 | etot = -17.4048297242112 -908000 ekin = 2.83000120831929 | erot = 2.3920412129948 | epot = -21.9351986192177 | etot = -16.7131561979036 -909000 ekin = 3.13472288974739 | erot = 2.07022420849154 | epot = -22.0395372123877 | etot = -16.8345901141488 -910000 ekin = 2.91535724615619 | erot = 3.54296427198744 | epot = -22.17289784711 | etot = -15.7145763289663 -911000 ekin = 1.86266697685629 | erot = 2.75432454240692 | epot = -22.2277400981541 | etot = -17.6107485788909 -912000 ekin = 2.64271590958795 | erot = 1.86909048050939 | epot = -22.2775010562684 | etot = -17.7656946661711 -913000 ekin = 2.45835510175704 | erot = 2.03340616362699 | epot = -22.4008109136254 | etot = -17.9090496482413 -914000 ekin = 2.0168446739852 | erot = 3.01916202272043 | epot = -22.5013367548475 | etot = -17.4653300581419 -915000 ekin = 2.73687318093231 | erot = 2.14033624631652 | epot = -22.5028600755747 | etot = -17.6256506483259 -916000 ekin = 2.38979306224022 | erot = 3.26197451659129 | epot = -22.5263162174438 | etot = -16.8745486386123 -917000 ekin = 2.2132313431686 | erot = 2.24407516775212 | epot = -22.5139668518706 | etot = -18.0566603409499 -918000 ekin = 2.11835073964575 | erot = 2.05693480392619 | epot = -22.4455228128791 | etot = -18.2702372693072 -919000 ekin = 2.66229415880118 | erot = 2.41897705108102 | epot = -22.4796981911192 | etot = -17.398426981237 -920000 ekin = 3.26579644340034 | erot = 2.75572713099831 | epot = -22.5844984666348 | etot = -16.5629748922361 -921000 ekin = 2.7209745531417 | erot = 1.96979925725472 | epot = -22.6385112107694 | etot = -17.9477374003729 -922000 ekin = 1.43413709665673 | erot = 1.52452785259238 | epot = -22.6908688613181 | etot = -19.732203912069 -923000 ekin = 1.67612014861287 | erot = 1.86533200287241 | epot = -22.7504417888943 | etot = -19.208989637409 -924000 ekin = 2.14999846366944 | erot = 1.53353223685726 | epot = -22.7219152384023 | etot = -19.0383845378756 -925000 ekin = 2.27775999892995 | erot = 1.35579588948189 | epot = -22.6313109881577 | etot = -18.9977550997459 -926000 ekin = 2.00325654671082 | erot = 2.07129795862533 | epot = -22.58060449698 | etot = -18.5060499916438 -927000 ekin = 2.51568207758562 | erot = 1.987163454037 | epot = -22.6950313207983 | etot = -18.1921857891757 -928000 ekin = 2.57430073568282 | erot = 2.51446833506414 | epot = -22.8476882631099 | etot = -17.758919192363 -929000 ekin = 2.65883432741931 | erot = 1.82970870115209 | epot = -22.8881462617914 | etot = -18.39960323322 -930000 ekin = 2.41679914385681 | erot = 2.00959752598338 | epot = -22.9005208742364 | etot = -18.4741242043962 -931000 ekin = 3.01841254462055 | erot = 2.11105138843169 | epot = -22.85760539327 | etot = -17.7281414602178 -932000 ekin = 2.34886657046774 | erot = 1.87108210439136 | epot = -22.8977129515892 | etot = -18.6777642767301 -933000 ekin = 2.16783340111898 | erot = 2.83769256871394 | epot = -22.9046776672478 | etot = -17.8991516974149 -934000 ekin = 2.17397600879036 | erot = 2.11893010896207 | epot = -22.9246315138634 | etot = -18.6317253961109 -935000 ekin = 2.35368321763723 | erot = 2.22721731703674 | epot = -22.9148844830612 | etot = -18.3339839483873 -936000 ekin = 2.29404484064883 | erot = 2.52125059394418 | epot = -23.022569346399 | etot = -18.207273911806 -937000 ekin = 2.32419482855967 | erot = 2.82559362345603 | epot = -23.1106534424293 | etot = -17.9608649904136 -938000 ekin = 2.46214257103075 | erot = 1.99597995904795 | epot = -23.1662772746363 | etot = -18.7081547445576 -939000 ekin = 2.9950708934893 | erot = 2.11187711132299 | epot = -23.1593663275129 | etot = -18.0524183227006 -940000 ekin = 3.76806392301913 | erot = 2.67914085708954 | epot = -23.0990741275282 | etot = -16.6518693474195 -941000 ekin = 3.15122194022389 | erot = 2.26598106832925 | epot = -23.0009732777347 | etot = -17.5837702691815 -942000 ekin = 3.50290237899686 | erot = 1.88389191282622 | epot = -22.9638174755667 | etot = -17.5770231837436 -943000 ekin = 3.81981007949588 | erot = 2.71306651628128 | epot = -22.9368745682733 | etot = -16.4039979724962 -944000 ekin = 2.68269000609243 | erot = 2.75597297355549 | epot = -22.9154634627924 | etot = -17.4768004831445 -945000 ekin = 2.5590549123222 | erot = 2.02762890141183 | epot = -22.8197752815545 | etot = -18.2330914678205 -946000 ekin = 2.47577141445405 | erot = 1.66876676951813 | epot = -22.6553996443486 | etot = -18.5108614603764 -947000 ekin = 2.41888872017238 | erot = 1.99290495105536 | epot = -22.5511355353761 | etot = -18.1393418641484 -948000 ekin = 3.55059459316711 | erot = 2.5777258708839 | epot = -22.4076841605954 | etot = -16.2793636965444 -949000 ekin = 2.98580100349108 | erot = 2.44218887595664 | epot = -22.1946740482762 | etot = -16.7666841688284 -950000 ekin = 1.821092375385 | erot = 3.05085494375851 | epot = -22.0411048551924 | etot = -17.1691575360489 -951000 ekin = 2.20017865970828 | erot = 2.37993346919584 | epot = -22.0148953004748 | etot = -17.4347831715707 -952000 ekin = 2.14109063574403 | erot = 1.67049478035644 | epot = -21.9849308950116 | etot = -18.1733454789111 -953000 ekin = 2.29825441833299 | erot = 1.97339930829895 | epot = -21.9506588951235 | etot = -17.6790051684915 -954000 ekin = 1.48812561465813 | erot = 3.35693562507496 | epot = -21.8785232616716 | etot = -17.0334620219385 -955000 ekin = 1.87464515912864 | erot = 2.65909319571748 | epot = -21.7892398748208 | etot = -17.2555015199747 -956000 ekin = 1.69455812204129 | erot = 2.15407102211541 | epot = -21.7240315558968 | etot = -17.8754024117401 -957000 ekin = 1.75583683783662 | erot = 1.6388872433372 | epot = -21.6978461721406 | etot = -18.3031220909668 -958000 ekin = 1.59915972681971 | erot = 2.20119347000054 | epot = -21.6996739320855 | etot = -17.8993207352653 -959000 ekin = 2.58508771526968 | erot = 2.48988894190743 | epot = -21.7128779048797 | etot = -16.6379012477026 -960000 ekin = 2.540004730569 | erot = 2.05993270952562 | epot = -21.7110863197264 | etot = -17.1111488796318 -961000 ekin = 2.28366644951083 | erot = 2.18351789869055 | epot = -21.713158341698 | etot = -17.2459739934967 -962000 ekin = 1.65566986683003 | erot = 3.51395446298371 | epot = -21.7309544663205 | etot = -16.5613301365068 -963000 ekin = 1.99640145079979 | erot = 1.50119578271615 | epot = -21.6827600497459 | etot = -18.1851628162299 -964000 ekin = 2.18656047252606 | erot = 2.27602589879665 | epot = -21.619418671686 | etot = -17.1568323003632 -965000 ekin = 2.1268740717332 | erot = 2.31151575363264 | epot = -21.6000680375134 | etot = -17.1616782121475 -966000 ekin = 3.18082053219097 | erot = 3.42475965115333 | epot = -21.6366484152857 | etot = -15.0310682319414 -967000 ekin = 3.07307267752021 | erot = 2.17494665586724 | epot = -21.5935818966499 | etot = -16.3455625632625 -968000 ekin = 2.08693319857779 | erot = 2.13995709056182 | epot = -21.5217214507964 | etot = -17.2948311616568 -969000 ekin = 2.26980017693321 | erot = 2.21816244485338 | epot = -21.459599392786 | etot = -16.9716367709994 -970000 ekin = 2.49153424363058 | erot = 2.62081062789337 | epot = -21.40624254365 | etot = -16.2938976721261 -971000 ekin = 2.49736294038618 | erot = 2.64542889712536 | epot = -21.3698430243897 | etot = -16.2270511868781 -972000 ekin = 3.20661406309987 | erot = 2.47006567711245 | epot = -21.3129147000401 | etot = -15.6362349598278 -973000 ekin = 3.35896769012794 | erot = 2.62914966754124 | epot = -21.2417754090084 | etot = -15.2536580513392 -974000 ekin = 2.71022162422346 | erot = 2.13950356822279 | epot = -21.1388622732984 | etot = -16.2891370808522 -975000 ekin = 1.81145289576367 | erot = 2.10207160993305 | epot = -21.048316338461 | etot = -17.1347918327643 -976000 ekin = 2.36964932252015 | erot = 1.38498778652618 | epot = -20.9787405486735 | etot = -17.2241034396272 -977000 ekin = 2.83743084482057 | erot = 3.02979079274331 | epot = -21.085451075555 | etot = -15.2182294379911 -978000 ekin = 3.14246219320392 | erot = 3.02811722693053 | epot = -21.1396703506934 | etot = -14.969090930559 -979000 ekin = 3.63780420393836 | erot = 2.4709378582899 | epot = -21.0340146720458 | etot = -14.9252726098175 -980000 ekin = 3.4264538226183 | erot = 3.24172784300214 | epot = -20.9599326810307 | etot = -14.2917510154103 -981000 ekin = 2.92833128833528 | erot = 2.44513741300221 | epot = -20.9990853641094 | etot = -15.6256166627719 -982000 ekin = 2.04564757644964 | erot = 2.21309407620317 | epot = -21.0169476544784 | etot = -16.7582060018256 -983000 ekin = 2.56027499325037 | erot = 1.98413314848097 | epot = -21.0051531932236 | etot = -16.4607450514922 -984000 ekin = 2.31412219695426 | erot = 2.58580887186898 | epot = -21.052483194614 | etot = -16.1525521257907 -985000 ekin = 2.31684810453689 | erot = 2.99962688680855 | epot = -21.126448512153 | etot = -15.8099735208075 -986000 ekin = 2.05087446711593 | erot = 2.15350712572991 | epot = -21.2175956679764 | etot = -17.0132140751306 -987000 ekin = 2.41884444903816 | erot = 1.58397554578725 | epot = -21.1898165062925 | etot = -17.1869965114671 -988000 ekin = 2.75120862227721 | erot = 2.70488585059706 | epot = -21.0891793464809 | etot = -15.6330848736066 -989000 ekin = 2.29399073499349 | erot = 2.85653684714667 | epot = -21.0165729755105 | etot = -15.8660453933703 -990000 ekin = 2.23407391829561 | erot = 2.58986750499253 | epot = -20.9399219780894 | etot = -16.1159805548012 -991000 ekin = 2.2015103509351 | erot = 2.5342789733714 | epot = -20.8272027181399 | etot = -16.0914133938334 -992000 ekin = 1.73506355750681 | erot = 2.49729588452318 | epot = -20.8968748041567 | etot = -16.6645153621267 -993000 ekin = 1.38873426581537 | erot = 1.9682630505033 | epot = -20.9926737588933 | etot = -17.6356764425747 -994000 ekin = 1.48976906105183 | erot = 2.95631655181474 | epot = -21.0595774450851 | etot = -16.6134918322185 -995000 ekin = 2.31357533477074 | erot = 1.67477965585528 | epot = -21.1250456439671 | etot = -17.1366906533411 -996000 ekin = 2.89740155011607 | erot = 2.85049856858161 | epot = -21.0862990854291 | etot = -15.3383989667315 -997000 ekin = 3.12971523768954 | erot = 2.1499509854011 | epot = -21.0771189403087 | etot = -15.7974527172181 -998000 ekin = 2.21576875556996 | erot = 3.03006905150276 | epot = -20.9969954660947 | etot = -15.751157659022 -999000 ekin = 2.60947248329622 | erot = 1.73825748506686 | epot = -20.9115307542595 | etot = -16.5638007858964 -1000000 ekin = 2.32273923275077 | erot = 2.87793771079159 | epot = -20.9050993315882 | etot = -15.7044223880458 - 1000000 0.10323285 -1.3567017 0.050132958 -1.1613975 0.00013807094 -Loop time of 30.2805 on 4 procs for 1000000 steps with 16 atoms - -Performance: 28533.226 tau/day, 33024.567 timesteps/s -99.5% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 0.57156 | 10.489 | 19.648 | 266.3 | 34.64 -Bond | 0.087018 | 0.38344 | 0.65455 | 40.7 | 1.27 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 2.5429 | 2.6691 | 2.7875 | 5.4 | 8.81 -Output | 1.5e-05 | 2.425e-05 | 2.8e-05 | 0.0 | 0.00 -Modify | 0.2134 | 2.6942 | 5.1397 | 131.4 | 8.90 -Other | | 14.05 | | | 46.38 - -Nlocal: 4.0 ave 8.0 max 0.0 min -Histogram: 1 1 0 0 0 0 0 0 1 1 -Nghost: 11.0 ave 14.0 max 8.0 min -Histogram: 1 1 0 0 0 0 0 0 1 1 -Neighs: 35.5 ave 69.0 max 0.0 min -Histogram: 1 1 0 0 0 0 0 0 0 2 - -Total # of neighbors = 142 -Ave neighs/atom = 8.875 -Ave special neighs/atom = 3.75 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:30 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/data.duplex1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/data.duplex1 index 0ef671c603..54eb2beaf5 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/data.duplex1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/data.duplex1 @@ -1,15 +1,14 @@ -# LAMMPS data file +LAMMPS data file via write_data, version 27 May 2021 + 10 atoms -10 ellipsoids -8 bonds - 4 atom types +8 bonds 1 bond types +10 ellipsoids -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi Masses @@ -18,56 +17,52 @@ Masses 3 3.1575 4 3.1575 -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms +Atoms # hybrid -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.860249842674776e-01 -3.518234140414736e-01 3.897628551303122e-01 1 1 1 -3 3 -1.874009511073395e-01 -5.699832309147915e-01 7.795257102606244e-01 1 1 1 -4 4 1.824198365552941e-01 -5.715968887521518e-01 1.169288565390937e+00 1 1 1 -5 1 4.829362784135484e-01 -3.560513319622209e-01 1.559051420521249e+00 1 1 1 -6 4 -4.829362784135484e-01 3.560513319622209e-01 1.559051420521249e+00 2 1 1 -7 1 -1.824198365552941e-01 5.715968887521516e-01 1.169288565390937e+00 2 1 1 -8 2 1.874009511073395e-01 5.699832309147913e-01 7.795257102606243e-01 2 1 1 -9 3 4.860249842674775e-01 3.518234140414733e-01 3.897628551303121e-01 2 1 1 -10 4 5.999999999999996e-01 -1.332267629550188e-16 -1.110223024625157e-16 2 1 1 +1 1 -0.33741452300167507 -0.43708835412476305 0.6450685042019271 1 1 3.7269849963023267 0 0 0 +2 2 -0.32142606102826937 -0.7137743037592722 1.1817366147004618 1 1 3.7269849963023267 0 0 0 +3 3 -0.130363628207774 -0.9147144801536078 1.62581312195109 1 1 3.7269849963023267 0 0 0 +4 4 0.16795127962282844 -0.9808507459807022 2.0894908590909003 1 1 3.7269849963023267 0 0 0 +5 1 0.46370423490634166 -0.7803347954883079 2.4251986815515827 1 1 3.7269849963023267 0 0 0 +6 4 -0.4462950185476711 0.09062163051035639 2.4668941268777607 2 1 3.7269849963023267 0 0 0 +7 1 -0.03377054097560965 0.20979847489755046 2.078208732038921 2 1 3.7269849963023267 0 0 0 +8 2 0.3297325391466579 0.17657587120899895 1.7206328374934152 2 1 3.7269849963023267 0 0 0 +9 3 0.6063699309305985 0.04682595158675571 1.2335049647817748 2 1 3.7269849963023267 0 0 0 +10 4 0.8003979559814726 -0.364393011459011 0.9884025318908612 2 1 3.7269849963023267 0 0 0 -# Atom-ID, translational velocity, angular momentum Velocities -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 +1 0.320321385294804 -0.13632815939410442 -0.029398292452023418 0.3064009492028237 -0.15808560233691588 0.35878007201886397 +2 0.16868594667473025 -0.04950805613064363 0.15811007290373785 -0.07666583909321756 -0.0008074676325318194 -0.21475821019816385 +3 -0.22924557018300165 0.08381876748892438 -0.0919832851533896 0.4039387481683193 0.6123610642545824 -0.11063432848545783 +4 -0.22186204313310393 0.04952817499985707 -0.0693642101605732 -0.1358248430264938 0.4118493572385653 -0.056529305922687775 +5 0.08156431270087049 -0.2564594759800144 0.1724544416027875 0.05439894663158808 0.09338481510384318 0.3205408219238883 +6 0.03598698404367743 -0.04868642973674152 0.02860105256592922 0.04007709957283992 -0.317943400069374 0.36438025397586354 +7 -0.00822868972307372 0.047514932936351305 -0.027726409420297023 0.18356392696891796 -0.49877294396308003 0.06993313839189567 +8 -0.07177147672242379 0.1718272727853115 0.39056151182616994 -0.16728362538690794 -0.47839708820957955 -0.17897249005947627 +9 -0.1748638855727651 -0.0781638161351808 0.0560181565271157 -0.28062568580131014 0.2405396522734162 -0.4311598357169048 +10 0.18870318272756448 -0.1066780134639517 0.12610657946741227 -0.05740397100183697 0.36748833227892685 0.1498775724372025 -# Atom-ID, shape, quaternion -Ellipsoids - -1 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.513258223252946e-01 0.000000000000000e+00 0.000000000000000e+00 3.081869234362515e-01 -3 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 8.100416404457962e-01 0.000000000000000e+00 0.000000000000000e+00 5.863723567357894e-01 -4 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.899012371043606e-01 0.000000000000000e+00 0.000000000000000e+00 8.074754054847398e-01 -5 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 3.123349185122326e-01 0.000000000000000e+00 0.000000000000000e+00 9.499720515246527e-01 -6 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.499720515246527e-01 -3.123349185122326e-01 -0.000000000000000e+00 -7 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.074754054847401e-01 -5.899012371043604e-01 0.000000000000000e+00 -8 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 5.863723567357896e-01 -8.100416404457959e-01 0.000000000000000e+00 -9 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -3.081869234362514e-01 9.513258223252947e-01 0.000000000000000e+00 -10 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 1.110223024625157e-16 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology Bonds -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 6 7 -6 1 7 8 -7 1 8 9 -8 1 9 10 +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 6 7 +6 1 7 8 +7 1 8 9 +8 1 9 10 + +Ellipsoids + +1 1.173984503142341 1.173984503142341 1.173984503142341 0.9890278201757743 0.01779228232037064 -0.14337734159225404 0.030827642240801516 +2 1.173984503142341 1.173984503142341 1.173984503142341 0.939687458852748 0.04174166924055095 -0.023337773785056866 0.338674565089608 +3 1.173984503142341 1.173984503142341 1.173984503142341 0.8210113150655425 0.03012140921736572 0.017666019956944813 0.5698429897612057 +4 1.173984503142341 1.173984503142341 1.173984503142341 0.6623662858285051 -0.028186343967346823 0.022942552517501488 0.7482981175276918 +5 1.173984503142341 1.173984503142341 1.173984503142341 0.3601488726765216 0.0513614985821682 0.0724224158335286 0.9286602067807472 +6 1.173984503142341 1.173984503142341 1.173984503142341 0.11941234710084649 0.9244660117493703 -0.35317942248051865 -0.07979711784524246 +7 1.173984503142341 1.173984503142341 1.173984503142341 -0.17949125421205164 0.7412884899431119 -0.6379094464220707 0.1065166771202199 +8 1.173984503142341 1.173984503142341 1.173984503142341 -0.10483691088405202 0.5508895999584645 -0.8250090480220789 0.06992811634525403 +9 1.173984503142341 1.173984503142341 1.173984503142341 0.07777239911646 -0.3724087549185288 0.9103052384821374 -0.1631181963720798 +10 1.173984503142341 1.173984503142341 1.173984503142341 0.16279109707978262 0.027148630125149613 0.9849325709665359 -0.0516705065113425 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/in.duplex1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/in.duplex1 index 6ae8df4ff2..860d5bfdd5 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/in.duplex1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/in.duplex1 @@ -2,6 +2,7 @@ variable number equal 1 variable ofreq equal 1000 variable efreq equal 1000 variable T equal 0.1 +variable rhos equal 0.2 units lj @@ -11,11 +12,11 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 1 delay 0 check yes read_data data.duplex1 @@ -38,30 +39,19 @@ pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 # NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" +compute quat all property/atom quatw quati quatj quatk compute erot all erotate/asphere compute ekin all ke @@ -72,10 +62,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" run 1000000 -#write_restart config.${number}.* +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 new file mode 100644 index 0000000000..0c27e603c8 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 @@ -0,0 +1,1181 @@ +LAMMPS (27 May 2021) +variable number equal 1 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex1 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 10 atoms + reading velocities ... + 10 velocities + scanning bonds ... + 2 = max bonds/atom + 10 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 8 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.003 seconds + +set atom * mass 3.1575 +Setting atom values ... + 10 settings made for mass + +group all type 1 4 +10 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA2 pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.1.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 1.10853632272819 | erot = 2.81573649976629 | epot = -12.298895791142 | etot = -8.37462296864751 +Per MPI rank memory allocation (min/avg/max) = 9.448 | 9.448 | 9.448 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.082113802 -1.3370157 0.10712616 -1.1190359 -6.6192825e-05 64000 +1000 ekin = 1.07640077431763 | erot = 2.90684392233817 | epot = -12.357867665527 | etot = -8.37462296887116 +2000 ekin = 1.05363107794411 | erot = 2.99414178935849 | epot = -12.4223958364622 | etot = -8.37462296915965 +3000 ekin = 1.04083382823095 | erot = 3.07274362339771 | epot = -12.4882004210899 | etot = -8.37462296946123 +4000 ekin = 1.03780093165924 | erot = 3.13815143503914 | epot = -12.550575336422 | etot = -8.37462296972364 +5000 ekin = 1.04371581655899 | erot = 3.18681185449856 | epot = -12.6051506409707 | etot = -8.37462296991314 +6000 ekin = 1.05738085799295 | erot = 3.21642353087479 | epot = -12.6484273588876 | etot = -8.37462297001983 +7000 ekin = 1.07739394884042 | erot = 3.22597832036696 | epot = -12.677995239256 | etot = -8.37462297004867 +8000 ekin = 1.10226637472087 | erot = 3.21563966301732 | epot = -12.6925290077505 | etot = -8.37462297001231 +9000 ekin = 1.13051291055326 | erot = 3.18656247631366 | epot = -12.6916983567816 | etot = -8.37462296991465 +10000 ekin = 1.16073704358063 | erot = 3.14076972913372 | epot = -12.6761297424775 | etot = -8.37462296976311 +11000 ekin = 1.19170449380505 | erot = 3.08098965164652 | epot = -12.6473171150236 | etot = -8.37462296957204 +12000 ekin = 1.22238189802729 | erot = 3.01040253468266 | epot = -12.6074074020775 | etot = -8.37462296936753 +13000 ekin = 1.25192691881487 | erot = 2.93230261872824 | epot = -12.5588525067181 | etot = -8.37462296917498 +14000 ekin = 1.27963857618757 | erot = 2.84975156813381 | epot = -12.5040131133432 | etot = -8.37462296902178 +15000 ekin = 1.30489368750123 | erot = 2.76534813925014 | epot = -12.444864795638 | etot = -8.37462296888667 +16000 ekin = 1.32709913751461 | erot = 2.6811818478553 | epot = -12.3829039541517 | etot = -8.37462296878182 +17000 ekin = 1.34568132349844 | erot = 2.5986128569079 | epot = -12.3189171492215 | etot = -8.37462296881515 +18000 ekin = 1.36011712604124 | erot = 2.51802979978579 | epot = -12.2527698947086 | etot = -8.37462296888154 +19000 ekin = 1.3700055901564 | erot = 2.43889875259719 | epot = -12.1835273117078 | etot = -8.37462296895424 +20000 ekin = 1.37516683465212 | erot = 2.36049590954913 | epot = -12.1102857132061 | etot = -8.37462296900481 +21000 ekin = 1.37575335509454 | erot = 2.28221618930094 | epot = -12.0325925134033 | etot = -8.37462296900785 +22000 ekin = 1.37235802310946 | erot = 2.20383846967473 | epot = -11.9508194617285 | etot = -8.37462296894431 +23000 ekin = 1.36610326249347 | erot = 2.12570839352804 | epot = -11.8664346248253 | etot = -8.37462296880382 +24000 ekin = 1.35869525710689 | erot = 2.04881568638621 | epot = -11.7821339120795 | etot = -8.3746229685864 +25000 ekin = 1.35242255125593 | erot = 1.97475968439782 | epot = -11.7018052039589 | etot = -8.37462296830517 +26000 ekin = 1.3500701244009 | erot = 1.90560954362746 | epot = -11.6303026360115 | etot = -8.37462296798316 +27000 ekin = 1.35474332970461 | erot = 1.843676291157 | epot = -11.573042588521 | etot = -8.37462296765941 +28000 ekin = 1.36954369410747 | erot = 1.79121252282618 | epot = -11.5353791843194 | etot = -8.37462296738577 +29000 ekin = 1.39711560919894 | erot = 1.75006009044062 | epot = -11.5217986668613 | etot = -8.37462296722172 +30000 ekin = 1.43911092490998 | erot = 1.72127833748021 | epot = -11.5350122296156 | etot = -8.37462296722543 +31000 ekin = 1.49567630461185 | erot = 1.70480588615783 | epot = -11.5751051582055 | etot = -8.37462296743583 +32000 ekin = 1.56511285114173 | erot = 1.69923538983358 | epot = -11.6389712088327 | etot = -8.37462296785736 +33000 ekin = 1.64385110263233 | erot = 1.70198396265071 | epot = -11.7204580336836 | etot = -8.37462296840058 +34000 ekin = 1.72681002365018 | erot = 1.70946314344897 | epot = -11.8108961361853 | etot = -8.37462296908617 +35000 ekin = 1.80812188596362 | erot = 1.71712980816865 | epot = -11.8998746638723 | etot = -8.37462296974008 +36000 ekin = 1.88201893971536 | erot = 1.72067857993906 | epot = -11.9773204899106 | etot = -8.37462297025618 +37000 ekin = 1.94364733336808 | erot = 1.71680208569968 | epot = -12.0350723896309 | etot = -8.37462297056312 +38000 ekin = 1.98961498615624 | erot = 1.70370907929488 | epot = -12.0679470360927 | etot = -8.37462297064162 +39000 ekin = 2.01818359901078 | erot = 1.68126711282219 | epot = -12.0740736823535 | etot = -8.37462297052053 +40000 ekin = 2.02914332282544 | erot = 1.65077260628057 | epot = -12.0545388993641 | etot = -8.37462297025811 +41000 ekin = 2.02349103018079 | erot = 1.61448262351112 | epot = -12.012596623611 | etot = -8.37462296991906 +42000 ekin = 2.00304412554487 | erot = 1.57509121259578 | epot = -11.9527583076989 | etot = -8.37462296955829 +43000 ekin = 1.97008148028931 | erot = 1.5352951062099 | epot = -11.8799995557137 | etot = -8.3746229692145 +44000 ekin = 1.92705109571046 | erot = 1.49750726070831 | epot = -11.7991813253589 | etot = -8.37462296894018 +45000 ekin = 1.87634986385838 | erot = 1.46354390598906 | epot = -11.714516738533 | etot = -8.37462296868559 +46000 ekin = 1.82016797429729 | erot = 1.43491031451222 | epot = -11.6297012572909 | etot = -8.37462296848134 +47000 ekin = 1.76039182008996 | erot = 1.41286016407003 | epot = -11.547874952484 | etot = -8.37462296832397 +48000 ekin = 1.69856949274756 | erot = 1.39838217522426 | epot = -11.4715746361766 | etot = -8.37462296820476 +49000 ekin = 1.6359395498873 | erot = 1.39228918140578 | epot = -11.4028516994048 | etot = -8.3746229681117 +50000 ekin = 1.57351801537284 | erot = 1.39530041169494 | epot = -11.3434413950981 | etot = -8.3746229680303 +51000 ekin = 1.51222872476346 | erot = 1.4081065034094 | epot = -11.2949581961199 | etot = -8.37462296794708 +52000 ekin = 1.45305245526488 | erot = 1.43140550730923 | epot = -11.2590809304256 | etot = -8.37462296785148 +53000 ekin = 1.39716366086918 | erot = 1.46589567493528 | epot = -11.2376823035411 | etot = -8.37462296773665 +54000 ekin = 1.34602153837048 | erot = 1.51222067984183 | epot = -11.2328651858297 | etot = -8.37462296761741 +55000 ekin = 1.30138436197332 | erot = 1.57077970891813 | epot = -11.2467870384006 | etot = -8.37462296750915 +56000 ekin = 1.26522647192232 | erot = 1.64151101613074 | epot = -11.2813604554939 | etot = -8.37462296744087 +57000 ekin = 1.23956119808438 | erot = 1.72363092633029 | epot = -11.3378150918591 | etot = -8.37462296744439 +58000 ekin = 1.22620283906727 | erot = 1.81539828229233 | epot = -11.4162240889033 | etot = -8.37462296754372 +59000 ekin = 1.22652758768649 | erot = 1.91400381193543 | epot = -11.5151543673676 | etot = -8.3746229677457 +60000 ekin = 1.24129579501614 | erot = 2.01564970996737 | epot = -11.6315684730213 | etot = -8.37462296803774 +61000 ekin = 1.27057003505313 | erot = 2.11581304358667 | epot = -11.7610060470473 | etot = -8.37462296840752 +62000 ekin = 1.31372115356086 | erot = 2.20955642503246 | epot = -11.897900547387 | etot = -8.37462296879367 +63000 ekin = 1.36947667734256 | erot = 2.29224896410234 | epot = -12.0363486106154 | etot = -8.37462296917045 +64000 ekin = 1.43596184816363 | erot = 2.35998108781807 | epot = -12.1705659055152 | etot = -8.37462296953351 +65000 ekin = 1.5108757081497 | erot = 2.40947275989094 | epot = -12.294971437873 | etot = -8.37462296983238 +66000 ekin = 1.59162978656338 | erot = 2.43872351537734 | epot = -12.404976271986 | etot = -8.37462297004532 +67000 ekin = 1.67546349074575 | erot = 2.44726186999253 | epot = -12.4973483309005 | etot = -8.37462297016222 +68000 ekin = 1.75953613825207 | erot = 2.43621057967594 | epot = -12.5703696881156 | etot = -8.37462297018761 +69000 ekin = 1.8409820145657 | erot = 2.40815676459641 | epot = -12.6237617493038 | etot = -8.37462297014167 +70000 ekin = 1.91692810522254 | erot = 2.36682660300832 | epot = -12.6583776782868 | etot = -8.3746229700559 +71000 ekin = 1.98449380473024 | erot = 2.31661131420487 | epot = -12.6757280888525 | etot = -8.37462296991744 +72000 ekin = 2.04081287193494 | erot = 2.2621517448767 | epot = -12.6775875867425 | etot = -8.37462296993089 +73000 ekin = 2.08263291328339 | erot = 2.20743363864179 | epot = -12.6646895218717 | etot = -8.37462296994653 +74000 ekin = 2.10698584150827 | erot = 2.1554442111836 | epot = -12.6370530226944 | etot = -8.37462297000255 +75000 ekin = 2.11136525908709 | erot = 2.10816940675056 | epot = -12.5941576359036 | etot = -8.37462297006593 +76000 ekin = 2.09405873141391 | erot = 2.06669472630755 | epot = -12.5353764278111 | etot = -8.37462297008964 +77000 ekin = 2.05455135347899 | erot = 2.03147933575638 | epot = -12.4606536592624 | etot = -8.37462297002701 +78000 ekin = 1.99386684227691 | erot = 2.00268171013299 | epot = -12.3711715222583 | etot = -8.3746229698484 +79000 ekin = 1.91474155283386 | erot = 1.98040758803641 | epot = -12.2697721104228 | etot = -8.37462296955254 +80000 ekin = 1.82155513477568 | erot = 1.96479734780215 | epot = -12.1609754517456 | etot = -8.37462296916772 +81000 ekin = 1.71999782481688 | erot = 1.95595086125337 | epot = -12.0505716548135 | etot = -8.37462296874324 +82000 ekin = 1.61651478139495 | erot = 1.95375810375255 | epot = -11.9448958534856 | etot = -8.37462296833808 +83000 ekin = 1.51761134750077 | erot = 1.95772774860624 | epot = -11.849962064116 | etot = -8.37462296800896 +84000 ekin = 1.42912416355164 | erot = 1.96688313409186 | epot = -11.7706302654422 | etot = -8.37462296779872 +85000 ekin = 1.35556895555394 | erot = 1.97976517498667 | epot = -11.7099570982742 | etot = -8.37462296773356 +86000 ekin = 1.29966988136843 | erot = 1.9945259327168 | epot = -11.6688187819008 | etot = -8.3746229678156 +87000 ekin = 1.26213747948961 | erot = 2.00910214170766 | epot = -11.6458625892977 | etot = -8.37462296810046 +88000 ekin = 1.24134500163864 | erot = 2.02122064243447 | epot = -11.6371886124844 | etot = -8.37462296841134 +89000 ekin = 1.23421644947613 | erot = 2.02900530500572 | epot = -11.6378447232195 | etot = -8.37462296873767 +90000 ekin = 1.23690604243568 | erot = 2.03136372571818 | epot = -11.6428927371715 | etot = -8.37462296901763 +91000 ekin = 1.24531053049743 | erot = 2.0281618826182 | epot = -11.6480953823211 | etot = -8.37462296920549 +92000 ekin = 1.25564394227055 | erot = 2.02032873397313 | epot = -11.6505956455252 | etot = -8.37462296928155 +93000 ekin = 1.26484018817412 | erot = 2.00975004471071 | epot = -11.6492132021396 | etot = -8.37462296925479 +94000 ekin = 1.27076152680827 | erot = 1.99896253062538 | epot = -11.6443470265802 | etot = -8.37462296914659 +95000 ekin = 1.27224696211167 | erot = 1.99076889271332 | epot = -11.6376388238183 | etot = -8.3746229689933 +96000 ekin = 1.26905385172905 | erot = 1.98776908505805 | epot = -11.6314459056162 | etot = -8.37462296882913 +97000 ekin = 1.26173398384337 | erot = 1.991961173075 | epot = -11.628318125602 | etot = -8.37462296868366 +98000 ekin = 1.25146122958134 | erot = 2.00445279489023 | epot = -11.630536993053 | etot = -8.37462296858144 +99000 ekin = 1.23981039935403 | erot = 2.02529911459901 | epot = -11.6397324824953 | etot = -8.37462296854225 +100000 ekin = 1.22848889431682 | erot = 2.05346079777977 | epot = -11.6565726606779 | etot = -8.37462296858135 +101000 ekin = 1.21904296342424 | erot = 2.08686922543206 | epot = -11.6805351575627 | etot = -8.37462296870644 +102000 ekin = 1.21258708443141 | erot = 2.1225925765274 | epot = -11.7098026298716 | etot = -8.37462296891277 +103000 ekin = 1.20962138127608 | erot = 2.15710417867626 | epot = -11.7413485291311 | etot = -8.37462296917873 +104000 ekin = 1.20999435064749 | erot = 2.18665201736564 | epot = -11.771269337479 | etot = -8.37462296946586 +105000 ekin = 1.21303379771947 | erot = 2.20771017012415 | epot = -11.795366937567 | etot = -8.37462296972338 +106000 ekin = 1.21781939160538 | erot = 2.21746426398237 | epot = -11.8099066254856 | etot = -8.37462296989788 +107000 ekin = 1.22352668485509 | erot = 2.21425769941227 | epot = -11.8124073542129 | etot = -8.37462296994552 +108000 ekin = 1.22975371616704 | erot = 2.19791821277326 | epot = -11.8022948987813 | etot = -8.37462296984097 +109000 ekin = 1.23675326669533 | erot = 2.16990174522985 | epot = -11.7812779815083 | etot = -8.37462296958308 +110000 ekin = 1.24552660594299 | erot = 2.13322593016575 | epot = -11.7533755053023 | etot = -8.37462296919352 +111000 ekin = 1.25776994928184 | erot = 2.09220325002859 | epot = -11.7245961680235 | etot = -8.37462296871311 +112000 ekin = 1.27568807280472 | erot = 2.05200951342182 | epot = -11.7023205544238 | etot = -8.37462296819728 +113000 ekin = 1.30169744977568 | erot = 2.01813224570247 | epot = -11.6944526631897 | etot = -8.37462296771155 +114000 ekin = 1.33804251858965 | erot = 1.99574344242871 | epot = -11.7084089283453 | etot = -8.37462296732691 +115000 ekin = 1.3864743192956 | erot = 1.98903581447767 | epot = -11.7501331008338 | etot = -8.3746229670605 +116000 ekin = 1.44876446583422 | erot = 2.00047074173015 | epot = -11.8238581746954 | etot = -8.37462296713099 +117000 ekin = 1.52378581535588 | erot = 2.0304433940819 | epot = -11.9288521768893 | etot = -8.37462296745153 +118000 ekin = 1.60840594184218 | erot = 2.07707436259006 | epot = -12.0601032724462 | etot = -8.37462296801394 +119000 ekin = 1.69804077960519 | erot = 2.13624566567623 | epot = -12.2089094140538 | etot = -8.37462296877234 +120000 ekin = 1.78696647862309 | erot = 2.20199105617489 | epot = -12.3635805044449 | etot = -8.37462296964695 +121000 ekin = 1.8688350853633 | erot = 2.2671883740785 | epot = -12.5106464299775 | etot = -8.37462297053566 +122000 ekin = 1.93731263285365 | erot = 2.3244608703497 | epot = -12.6363964745346 | etot = -8.37462297133129 +123000 ekin = 1.98673587945787 | erot = 2.36714489985521 | epot = -12.7285037512515 | etot = -8.37462297193848 +124000 ekin = 2.01268857483479 | erot = 2.39015976226582 | epot = -12.7774713093898 | etot = -8.37462297228923 +125000 ekin = 2.01242153120607 | erot = 2.39062925356809 | epot = -12.7776737571267 | etot = -8.37462297235253 +126000 ekin = 1.9850729032806 | erot = 2.36815351492884 | epot = -12.7278493903458 | etot = -8.37462297213636 +127000 ekin = 1.93167931643392 | erot = 2.3247037563462 | epot = -12.6310060444627 | etot = -8.37462297168258 +128000 ekin = 1.85500076916857 | erot = 2.26419178968054 | epot = -12.4938155299045 | etot = -8.37462297105536 +129000 ekin = 1.75920795598117 | erot = 2.19182812292618 | epot = -12.3256590492356 | etot = -8.37462297032824 +130000 ekin = 1.64949415840167 | erot = 2.11340935726356 | epot = -12.1375264852356 | etot = -8.37462296957032 +131000 ekin = 1.53167143066901 | erot = 2.03466319554018 | epot = -11.9409575950482 | etot = -8.37462296883903 +132000 ekin = 1.41179399813966 | erot = 1.96073697301942 | epot = -11.7471539393353 | etot = -8.37462296817617 +133000 ekin = 1.29582771791034 | erot = 1.89586175533322 | epot = -11.5663124408534 | etot = -8.37462296760984 +134000 ekin = 1.18933366770482 | erot = 1.84313053331036 | epot = -11.4070871682764 | etot = -8.3746229672612 +135000 ekin = 1.0969884576305 | erot = 1.80418246558963 | epot = -11.2757938901604 | etot = -8.37462296694027 +136000 ekin = 1.02270904454082 | erot = 1.77989195852219 | epot = -11.177223969814 | etot = -8.37462296675102 +137000 ekin = 0.969402888595132 | erot = 1.77022137974264 | epot = -11.1142472350352 | etot = -8.37462296669744 +138000 ekin = 0.938766242876429 | erot = 1.77423425797215 | epot = -11.0876234676255 | etot = -8.37462296677695 +139000 ekin = 0.931209536918654 | erot = 1.7902228440359 | epot = -11.09605534793 | etot = -8.37462296697548 +140000 ekin = 0.945902360873794 | erot = 1.81588277986748 | epot = -11.1364081080074 | etot = -8.37462296726613 +141000 ekin = 0.980951010695174 | erot = 1.84854552854051 | epot = -11.2041195068466 | etot = -8.37462296761095 +142000 ekin = 1.03368854660431 | erot = 1.8854617225894 | epot = -11.2937732371599 | etot = -8.37462296796614 +143000 ekin = 1.10102464558803 | erot = 1.92410215903311 | epot = -11.399749772913 | etot = -8.37462296829186 +144000 ekin = 1.17978371180474 | erot = 1.96241851789372 | epot = -11.5168251982595 | etot = -8.37462296856103 +145000 ekin = 1.26696389973277 | erot = 1.99907135517297 | epot = -11.6406582236462 | etot = -8.37462296874049 +146000 ekin = 1.35987698631731 | erot = 2.03338468070453 | epot = -11.767884635915 | etot = -8.37462296889316 +147000 ekin = 1.45616095202988 | erot = 2.06502561999195 | epot = -11.8958095410391 | etot = -8.37462296901725 +148000 ekin = 1.55369685491102 | erot = 2.09388144715374 | epot = -12.0222012712077 | etot = -8.37462296914293 +149000 ekin = 1.65047924324448 | erot = 2.11976671620324 | epot = -12.144868928744 | etot = -8.37462296929627 +150000 ekin = 1.74448791629856 | erot = 2.14217867903557 | epot = -12.2612895648265 | etot = -8.37462296949233 +151000 ekin = 1.83359650490156 | erot = 2.16016451670442 | epot = -12.3683839913408 | etot = -8.37462296973486 +152000 ekin = 1.91553611044675 | erot = 2.17231614291473 | epot = -12.4624752233742 | etot = -8.37462297001268 +153000 ekin = 1.98791755611551 | erot = 2.17689716712717 | epot = -12.5394376935489 | etot = -8.37462297030626 +154000 ekin = 2.04830722999057 | erot = 2.17205709329794 | epot = -12.5949872938789 | etot = -8.37462297059043 +155000 ekin = 2.09434778140682 | erot = 2.15608363214663 | epot = -12.6250543843914 | etot = -8.37462297083792 +156000 ekin = 2.12391577783707 | erot = 2.1276525103985 | epot = -12.6261912592572 | etot = -8.37462297102162 +157000 ekin = 2.13531004697546 | erot = 2.08604574913227 | epot = -12.5959787672234 | etot = -8.37462297111567 +158000 ekin = 2.12746223168591 | erot = 2.03132820631847 | epot = -12.5334134091003 | etot = -8.37462297109587 +159000 ekin = 2.10015103339202 | erot = 1.96448478928986 | epot = -12.4392587936246 | etot = -8.37462297094277 +160000 ekin = 2.05418416063666 | erot = 1.88751839461921 | epot = -12.3163255258998 | etot = -8.37462297064395 +161000 ekin = 1.9914954137128 | erot = 1.8035045715463 | epot = -12.1696229554608 | etot = -8.3746229702017 +162000 ekin = 1.91510266104691 | erot = 1.71656915682352 | epot = -12.0062947875078 | etot = -8.37462296963733 +163000 ekin = 1.82889680262221 | erot = 1.63175766791052 | epot = -11.8352774395238 | etot = -8.37462296899107 +164000 ekin = 1.73727850175354 | erot = 1.55477450557414 | epot = -11.6666759756466 | etot = -8.37462296831894 +165000 ekin = 1.64470875439862 | erot = 1.49159241029551 | epot = -11.5109241323765 | etot = -8.37462296768235 +166000 ekin = 1.55526715399592 | erot = 1.44796523954016 | epot = -11.3778553606754 | etot = -8.37462296713932 +167000 ekin = 1.47230568197329 | erot = 1.42890789301287 | epot = -11.2758365417203 | etot = -8.37462296673419 +168000 ekin = 1.39825202215306 | erot = 1.43822523216022 | epot = -11.2111002208051 | etot = -8.37462296649185 +169000 ekin = 1.33457196190122 | erot = 1.4781674025412 | epot = -11.1873623308595 | etot = -8.37462296641712 +170000 ekin = 1.28186404086284 | erot = 1.54925939136737 | epot = -11.2057463987275 | etot = -8.37462296649732 +171000 ekin = 1.2401053283702 | erot = 1.65031493319935 | epot = -11.2650432281454 | etot = -8.37462296657586 +172000 ekin = 1.20973432363881 | erot = 1.77850842430656 | epot = -11.3628657149171 | etot = -8.37462296697173 +173000 ekin = 1.18958106737809 | erot = 1.92939472681638 | epot = -11.4935987616333 | etot = -8.37462296743887 +174000 ekin = 1.17780375666769 | erot = 2.09752621801765 | epot = -11.6499529426374 | etot = -8.37462296795205 +175000 ekin = 1.172502841069 | erot = 2.27682305293083 | epot = -11.8239488624906 | etot = -8.37462296849078 +176000 ekin = 1.17177313417475 | erot = 2.4608623070369 | epot = -12.0072584102487 | etot = -8.37462296903704 +177000 ekin = 1.17372471418855 | erot = 2.64315812275369 | epot = -12.1915058065138 | etot = -8.37462296957157 +178000 ekin = 1.17649725816031 | erot = 2.81745378599554 | epot = -12.3685740142273 | etot = -8.37462297007148 +179000 ekin = 1.17828959842895 | erot = 2.978038856651 | epot = -12.5309514255901 | etot = -8.37462297051016 +180000 ekin = 1.1774168190097 | erot = 3.12008209304851 | epot = -12.6721218829182 | etot = -8.37462297085996 +181000 ekin = 1.17239479280051 | erot = 3.23994177497926 | epot = -12.7869595388776 | etot = -8.37462297109784 +182000 ekin = 1.16204161674153 | erot = 3.33528346670119 | epot = -12.8719480549258 | etot = -8.37462297148306 +183000 ekin = 1.14544700201154 | erot = 3.40346825728238 | epot = -12.9235382308526 | etot = -8.37462297155868 +184000 ekin = 1.12187454429724 | erot = 3.44382690739155 | epot = -12.9403244231943 | etot = -8.37462297150554 +185000 ekin = 1.09113819766543 | erot = 3.45752421108289 | epot = -12.9232853800831 | etot = -8.37462297133473 +186000 ekin = 1.05375177637538 | erot = 3.44681260248449 | epot = -12.875187349923 | etot = -8.37462297106316 +187000 ekin = 1.01100426926437 | erot = 3.41470705189622 | epot = -12.8003342918707 | etot = -8.37462297071008 +188000 ekin = 0.964980950088416 | erot = 3.3646710615679 | epot = -12.7042749819525 | etot = -8.37462297029614 +189000 ekin = 0.918502012520884 | erot = 3.30025095733202 | epot = -12.5933759397275 | etot = -8.37462296987457 +190000 ekin = 0.874955375625578 | erot = 3.22483721777132 | epot = -12.4744155628185 | etot = -8.37462296942164 +191000 ekin = 0.838012694189871 | erot = 3.14179385100168 | epot = -12.3544295141824 | etot = -8.37462296899086 +192000 ekin = 0.811264586710956 | erot = 3.05421641257334 | epot = -12.240103967897 | etot = -8.37462296861267 +193000 ekin = 0.797833231457478 | erot = 2.96485918306283 | epot = -12.1373153828319 | etot = -8.37462296831157 +194000 ekin = 0.8000323663007 | erot = 2.8761060823658 | epot = -12.0507614167682 | etot = -8.37462296810166 +195000 ekin = 0.819137512919949 | erot = 2.78998115247748 | epot = -11.9837416333827 | etot = -8.37462296798527 +196000 ekin = 0.855301818719506 | erot = 2.70818765526145 | epot = -11.9381124419352 | etot = -8.37462296795424 +197000 ekin = 0.907617485284835 | erot = 2.63215574475436 | epot = -11.9143961980334 | etot = -8.37462296799415 +198000 ekin = 0.974291517584437 | erot = 2.5630762301839 | epot = -11.9119907158566 | etot = -8.37462296808825 +199000 ekin = 1.05288651878785 | erot = 2.50190471363111 | epot = -11.9294142006405 | etot = -8.37462296822155 +200000 ekin = 1.14057530731235 | erot = 2.44933274089527 | epot = -11.9645310165903 | etot = -8.3746229683827 +201000 ekin = 1.23436945655788 | erot = 2.40573577404686 | epot = -12.014728199169 | etot = -8.37462296856431 +202000 ekin = 1.33129982084479 | erot = 2.37111655194145 | epot = -12.0770393415471 | etot = -8.37462296876082 +203000 ekin = 1.42854451444438 | erot = 2.34506402190557 | epot = -12.1482315053184 | etot = -8.37462296896845 +204000 ekin = 1.52351160571861 | erot = 2.32674290434256 | epot = -12.2248774792435 | etot = -8.37462296918235 +205000 ekin = 1.61388837060067 | erot = 2.31491995505467 | epot = -12.3034312950522 | etot = -8.37462296939689 +206000 ekin = 1.69766775260793 | erot = 2.30802500400467 | epot = -12.3803157262182 | etot = -8.37462296960556 +207000 ekin = 1.77315874687841 | erot = 2.304235629839 | epot = -12.4520173465215 | etot = -8.3746229698041 +208000 ekin = 1.83898325555921 | erot = 2.30156289475867 | epot = -12.5151691203033 | etot = -8.37462296998542 +209000 ekin = 1.89406065254659 | erot = 2.2979719308038 | epot = -12.5666555534953 | etot = -8.37462297014489 +210000 ekin = 1.93758171355955 | erot = 2.29149245614579 | epot = -12.6036971399835 | etot = -8.3746229702782 +211000 ekin = 1.9689749967881 | erot = 2.28032999988909 | epot = -12.6239279670585 | etot = -8.37462297038132 +212000 ekin = 1.98787057423958 | erot = 2.26297816329986 | epot = -12.6254717079901 | etot = -8.37462297045065 +213000 ekin = 1.9940661531065 | erot = 2.23834847729582 | epot = -12.6070376008835 | etot = -8.3746229704812 +214000 ekin = 1.98749971048336 | erot = 2.20579329600854 | epot = -12.567915976973 | etot = -8.3746229704811 +215000 ekin = 1.96823269345716 | erot = 2.16512069835608 | epot = -12.5079763622602 | etot = -8.37462297044691 +216000 ekin = 1.93645036858786 | erot = 2.11663233289595 | epot = -12.4277056718667 | etot = -8.37462297038284 +217000 ekin = 1.89249565101132 | erot = 2.06105227365551 | epot = -12.3281708949564 | etot = -8.37462297028959 +218000 ekin = 1.83696296100964 | erot = 1.99944931813356 | epot = -12.2110352493004 | etot = -8.3746229701572 +219000 ekin = 1.770879972 | erot = 1.93321768349748 | epot = -12.0787206254578 | etot = -8.37462296996032 +220000 ekin = 1.69598414200828 | erot = 1.86416918368603 | epot = -11.934776295355 | etot = -8.37462296966072 +221000 ekin = 1.61504938765098 | erot = 1.79472971030249 | epot = -11.7844020671756 | etot = -8.37462296922216 +222000 ekin = 1.53214607792005 | erot = 1.72813764736983 | epot = -11.6349066939257 | etot = -8.37462296863582 +223000 ekin = 1.45266240883154 | erot = 1.66846349300121 | epot = -11.4957488697767 | etot = -8.37462296794391 +224000 ekin = 1.3829329245014 | erot = 1.62027927221262 | epot = -11.3778351639602 | etot = -8.37462296724621 +225000 ekin = 1.32944348952769 | erot = 1.58793473617142 | epot = -11.2920011923817 | etot = -8.37462296668256 +226000 ekin = 1.29777350141005 | erot = 1.57457480049508 | epot = -11.2469712682749 | etot = -8.37462296636975 +227000 ekin = 1.29158711545493 | erot = 1.58136206120122 | epot = -11.2475721430406 | etot = -8.37462296638443 +228000 ekin = 1.31199160550491 | erot = 1.60705168356049 | epot = -11.2936662557523 | etot = -8.37462296668691 +229000 ekin = 1.35720775781583 | erot = 1.64872427968762 | epot = -11.3805550048113 | etot = -8.37462296730786 +230000 ekin = 1.42320705813343 | erot = 1.70117239435478 | epot = -11.4990024205431 | etot = -8.37462296805492 +231000 ekin = 1.50467169677599 | erot = 1.75808746579081 | epot = -11.63738213137 | etot = -8.37462296880323 +232000 ekin = 1.59576180204811 | erot = 1.8134544621678 | epot = -11.783839233675 | etot = -8.3746229694591 +233000 ekin = 1.69077156764799 | erot = 1.86233770608594 | epot = -11.927732243706 | etot = -8.37462296997204 +234000 ekin = 1.78453671679941 | erot = 1.90129507954642 | epot = -12.0604547666796 | etot = -8.37462297033374 +235000 ekin = 1.87261122259007 | erot = 1.92842207171149 | epot = -12.1756562648647 | etot = -8.37462297056318 +236000 ekin = 1.95129507586088 | erot = 1.94312673772435 | epot = -12.2690447842759 | etot = -8.37462297069067 +237000 ekin = 2.01688127570926 | erot = 1.94587838549599 | epot = -12.3373826321093 | etot = -8.37462297090404 +238000 ekin = 2.06554471096663 | erot = 1.93754713481337 | epot = -12.3777148167611 | etot = -8.37462297098108 +239000 ekin = 2.09498833917125 | erot = 1.91896908743882 | epot = -12.3885803976064 | etot = -8.37462297099629 +240000 ekin = 2.10387887335877 | erot = 1.89114067893424 | epot = -12.3696425232252 | etot = -8.37462297093216 +241000 ekin = 2.09205058134759 | erot = 1.8552423277367 | epot = -12.321915879852 | etot = -8.37462297076774 +242000 ekin = 2.06070692356718 | erot = 1.81270484104083 | epot = -12.248034735093 | etot = -8.37462297048499 +243000 ekin = 2.01255526288376 | erot = 1.76529169809243 | epot = -12.1524699310585 | etot = -8.37462297008235 +244000 ekin = 1.95178746173538 | erot = 1.71512317980711 | epot = -12.041533611113 | etot = -8.37462296957053 +245000 ekin = 1.88387514784689 | erot = 1.66462101119848 | epot = -11.9231191280346 | etot = -8.37462296898926 +246000 ekin = 1.81512558267767 | erot = 1.61637080971481 | epot = -11.806119360792 | etot = -8.37462296839955 +247000 ekin = 1.75197548737588 | erot = 1.57289129038633 | epot = -11.6994897456372 | etot = -8.37462296787495 +248000 ekin = 1.70016015194924 | erot = 1.53636641743642 | epot = -11.6111495368734 | etot = -8.3746229674877 +249000 ekin = 1.6640439145432 | erot = 1.50839677555173 | epot = -11.547063657254 | etot = -8.3746229671591 +250000 ekin = 1.64635032469252 | erot = 1.48977166427928 | epot = -11.5107449561771 | etot = -8.37462296720534 +251000 ekin = 1.64670868822438 | erot = 1.48021150770255 | epot = -11.5015431633554 | etot = -8.37462296742851 +252000 ekin = 1.66264181464409 | erot = 1.47871062656292 | epot = -11.5159754089798 | etot = -8.3746229677728 +253000 ekin = 1.69027564040423 | erot = 1.48380069510004 | epot = -11.5486993036762 | etot = -8.37462296817197 +254000 ekin = 1.7250530129175 | erot = 1.49382397147215 | epot = -11.5934999529557 | etot = -8.37462296856602 +255000 ekin = 1.76239471231546 | erot = 1.50720813838016 | epot = -11.6442258196114 | etot = -8.37462296891583 +256000 ekin = 1.79816893498598 | erot = 1.5225925446976 | epot = -11.6953844488857 | etot = -8.37462296920214 +257000 ekin = 1.82895095239721 | erot = 1.5388780186388 | epot = -11.7424519404555 | etot = -8.37462296941948 +258000 ekin = 1.85212386739591 | erot = 1.55528591409769 | epot = -11.7820327510622 | etot = -8.37462296956863 +259000 ekin = 1.86588413888244 | erot = 1.57137656836542 | epot = -11.8118836768989 | etot = -8.37462296965109 +260000 ekin = 1.86922537289895 | erot = 1.58707491263374 | epot = -11.8309232551855 | etot = -8.37462296965279 +261000 ekin = 1.86194745777981 | erot = 1.60277606186329 | epot = -11.8393464893229 | etot = -8.37462296967978 +262000 ekin = 1.84441202421319 | erot = 1.61874454524327 | epot = -11.8377795390076 | etot = -8.37462296955112 +263000 ekin = 1.81775632997628 | erot = 1.63584439963888 | epot = -11.8282236989394 | etot = -8.37462296932421 +264000 ekin = 1.78414336143469 | erot = 1.65581672859378 | epot = -11.8145830590338 | etot = -8.37462296900532 +265000 ekin = 1.74659811333676 | erot = 1.68088156362759 | epot = -11.8021026455962 | etot = -8.37462296863181 +266000 ekin = 1.70875551588599 | erot = 1.7133238753805 | epot = -11.7967023595409 | etot = -8.37462296827444 +267000 ekin = 1.67443624978586 | erot = 1.75501089284454 | epot = -11.8040701106185 | etot = -8.37462296798813 +268000 ekin = 1.64712713207532 | erot = 1.80695733277643 | epot = -11.8287074326929 | etot = -8.37462296784112 +269000 ekin = 1.6294902114269 | erot = 1.8688326756716 | epot = -11.8729458549709 | etot = -8.37462296787235 +270000 ekin = 1.62285159922476 | erot = 1.93872810894267 | epot = -11.9362026762885 | etot = -8.37462296812108 +271000 ekin = 1.62688631043752 | erot = 2.01317767222032 | epot = -12.0146869512058 | etot = -8.37462296854792 +272000 ekin = 1.63981668010417 | erot = 2.08746423747645 | epot = -12.101903886666 | etot = -8.37462296908541 +273000 ekin = 1.65880091169025 | erot = 2.15626799363775 | epot = -12.1896918749694 | etot = -8.37462296964141 +274000 ekin = 1.68050753849916 | erot = 2.21448722130891 | epot = -12.2696177299301 | etot = -8.37462297012202 +275000 ekin = 1.70172643739795 | erot = 2.25805265702223 | epot = -12.3344020648721 | etot = -8.37462297045196 +276000 ekin = 1.71987527696163 | erot = 2.28456562448947 | epot = -12.3790638720394 | etot = -8.37462297058833 +277000 ekin = 1.73331269261594 | erot = 2.2936490566384 | epot = -12.4015847197774 | etot = -8.37462297052306 +278000 ekin = 1.74143735013745 | erot = 2.28698125838951 | epot = -12.4030415787994 | etot = -8.3746229702724 +279000 ekin = 1.74460802870593 | erot = 2.26806682992324 | epot = -12.3872978285229 | etot = -8.37462296989376 +280000 ekin = 1.74394008412442 | erot = 2.2417131405199 | epot = -12.3602761940829 | etot = -8.37462296943857 +281000 ekin = 1.74088698058179 | erot = 2.21312908436347 | epot = -12.3286390340534 | etot = -8.37462296910814 +282000 ekin = 1.73669656458705 | erot = 2.1870420444962 | epot = -12.298361577878 | etot = -8.3746229687948 +283000 ekin = 1.73229007371595 | erot = 2.16744679622899 | epot = -12.2743598385786 | etot = -8.37462296863364 +284000 ekin = 1.72792109204532 | erot = 2.15675164213796 | epot = -12.2592957028516 | etot = -8.37462296866828 +285000 ekin = 1.72297480902855 | erot = 2.15537559427342 | epot = -12.2529733722 | etot = -8.37462296889804 +286000 ekin = 1.71598432453032 | erot = 2.16179000838427 | epot = -12.2523973021715 | etot = -8.37462296925687 +287000 ekin = 1.7049852422032 | erot = 2.17315503013756 | epot = -12.2527632419521 | etot = -8.37462296961137 +288000 ekin = 1.68823578051936 | erot = 2.18649203663189 | epot = -12.2493507869531 | etot = -8.37462296980184 +289000 ekin = 1.66510970376205 | erot = 2.19999055777972 | epot = -12.2397232312613 | etot = -8.37462296971956 +290000 ekin = 1.63674302037981 | erot = 2.2138125269939 | epot = -12.2251785167482 | etot = -8.37462296937453 +291000 ekin = 1.60601874197418 | erot = 2.22992661048372 | epot = -12.210568321354 | etot = -8.37462296889611 +292000 ekin = 1.57682389343772 | erot = 2.25107800691132 | epot = -12.202524868782 | etot = -8.37462296843301 +293000 ekin = 1.55301992418702 | erot = 2.27950943304652 | epot = -12.2071523254134 | etot = -8.37462296817987 +294000 ekin = 1.53731454048192 | erot = 2.31583078837931 | epot = -12.2277682970271 | etot = -8.37462296816589 +295000 ekin = 1.53083265562522 | erot = 2.35873605655334 | epot = -12.2641916805469 | etot = -8.3746229683683 +296000 ekin = 1.53318706455254 | erot = 2.40528084679105 | epot = -12.3130908800621 | etot = -8.37462296871854 +297000 ekin = 1.54281493583633 | erot = 2.45151931863516 | epot = -12.3689572236286 | etot = -8.3746229691571 +298000 ekin = 1.55733608765137 | erot = 2.49306411732002 | epot = -12.4250231746884 | etot = -8.37462296971699 +299000 ekin = 1.57407386288273 | erot = 2.52498633848825 | epot = -12.4736831715342 | etot = -8.37462297016317 +300000 ekin = 1.59001535760035 | erot = 2.54349315182925 | epot = -12.5081314800019 | etot = -8.37462297057228 +301000 ekin = 1.60189886822646 | erot = 2.54585083166253 | epot = -12.522372670814 | etot = -8.37462297092498 +302000 ekin = 1.60620251585633 | erot = 2.53039812867706 | epot = -12.5112236158412 | etot = -8.3746229713078 +303000 ekin = 1.59914065240609 | erot = 2.49598280993848 | epot = -12.4697464340454 | etot = -8.37462297170085 +304000 ekin = 1.57679795693774 | erot = 2.44177332378576 | epot = -12.3931942527979 | etot = -8.37462297207441 +305000 ekin = 1.5357430437406 | erot = 2.36761905414257 | epot = -12.2779850699661 | etot = -8.37462297208297 +306000 ekin = 1.47392866559623 | erot = 2.27453104047954 | epot = -12.1230826782582 | etot = -8.37462297218248 +307000 ekin = 1.39050823398579 | erot = 2.16376504506936 | epot = -11.9288962509199 | etot = -8.37462297186479 +308000 ekin = 1.28961522980587 | erot = 2.03977667258414 | epot = -11.704014870663 | etot = -8.37462296827299 +309000 ekin = 1.05782937493726 | erot = 1.83361716570663 | epot = -11.2660695010504 | etot = -8.37462296040654 +310000 ekin = 1.14450415449027 | erot = 1.58483272602461 | epot = -11.1039598386918 | etot = -8.37462295817693 +311000 ekin = 1.41922601312499 | erot = 1.45460499880737 | epot = -11.2484540448424 | etot = -8.37462303291008 +312000 ekin = 1.45261330232172 | erot = 1.37611906651663 | epot = -11.2033554015522 | etot = -8.37462303271387 +313000 ekin = 1.47884377174092 | erot = 1.31854286229483 | epot = -11.1720096664212 | etot = -8.37462303238549 +314000 ekin = 1.49756299811569 | erot = 1.28320357876914 | epot = -11.1553896088946 | etot = -8.37462303200974 +315000 ekin = 1.5133255918795 | erot = 1.27043025389343 | epot = -11.1583788774962 | etot = -8.37462303172332 +316000 ekin = 1.53080061117965 | erot = 1.27925593275776 | epot = -11.1846795755422 | etot = -8.37462303160482 +317000 ekin = 1.55378721590818 | erot = 1.30719554367529 | epot = -11.2356057912731 | etot = -8.37462303168967 +318000 ekin = 1.58370434541022 | erot = 1.34913652060418 | epot = -11.3074638985375 | etot = -8.37462303252313 +319000 ekin = 1.61943484148194 | erot = 1.39801478359267 | epot = -11.3920726581923 | etot = -8.37462303311765 +320000 ekin = 1.65864783760463 | erot = 1.4469667045907 | epot = -11.4802375759964 | etot = -8.37462303380111 +321000 ekin = 1.69766983847277 | erot = 1.48920524279054 | epot = -11.5614981157279 | etot = -8.37462303446459 +322000 ekin = 1.73222385845994 | erot = 1.51888544570707 | epot = -11.6257323391487 | etot = -8.37462303498174 +323000 ekin = 1.75834700852269 | erot = 1.5320295663078 | epot = -11.6649996100692 | etot = -8.3746230352387 +324000 ekin = 1.77324650046275 | erot = 1.527325970295 | epot = -11.6751955059261 | etot = -8.37462303516836 +325000 ekin = 1.77583924216909 | erot = 1.50655389358412 | epot = -11.6570161705536 | etot = -8.37462303480044 +326000 ekin = 1.76682929376801 | erot = 1.4743692828387 | epot = -11.6158216107552 | etot = -8.37462303414854 +327000 ekin = 1.74834602231056 | erot = 1.43794367202714 | epot = -11.5609127276985 | etot = -8.37462303336079 +328000 ekin = 1.72331109821159 | erot = 1.4057861507968 | epot = -11.5037202815765 | etot = -8.37462303256808 +329000 ekin = 1.69488797673298 | erot = 1.38635580023326 | epot = -11.4558668088437 | etot = -8.37462303187749 +330000 ekin = 1.66566513334673 | erot = 1.38702252391911 | epot = -11.4273106886487 | etot = -8.37462303138284 +331000 ekin = 1.63732185166116 | erot = 1.41331220646656 | epot = -11.4252570892342 | etot = -8.37462303110653 +332000 ekin = 1.61073968003925 | erot = 1.46826665363495 | epot = -11.4536293647312 | etot = -8.37462303105704 +333000 ekin = 1.58605232106421 | erot = 1.55220559043142 | epot = -11.5128809427296 | etot = -8.374623031234 +334000 ekin = 1.56284415922255 | erot = 1.66255678080467 | epot = -11.6000239716181 | etot = -8.3746230315909 +335000 ekin = 1.54014240613746 | erot = 1.79443783502769 | epot = -11.7092032732466 | etot = -8.37462303208149 +336000 ekin = 1.5167045521654 | erot = 1.94117931563276 | epot = -11.8325069004476 | etot = -8.37462303264939 +337000 ekin = 1.49128277555466 | erot = 2.09492414345266 | epot = -11.9608299522427 | etot = -8.37462303323541 +338000 ekin = 1.46282625482966 | erot = 2.24735936520935 | epot = -12.0848086538225 | etot = -8.37462303378349 +339000 ekin = 1.43063896798238 | erot = 2.39044100153427 | epot = -12.1957030037644 | etot = -8.37462303424774 +340000 ekin = 1.39448012483961 | erot = 2.51702660359023 | epot = -12.286129763026 | etot = -8.37462303459616 +341000 ekin = 1.35460313822188 | erot = 2.62135284037471 | epot = -12.3505790134085 | etot = -8.37462303481193 +342000 ekin = 1.31173936862989 | erot = 2.6993354674974 | epot = -12.385697871018 | etot = -8.37462303489068 +343000 ekin = 1.26704159860185 | erot = 2.74871044551789 | epot = -12.390375078956 | etot = -8.3746230348363 +344000 ekin = 1.22200654509462 | erot = 2.76906107654609 | epot = -12.3656906562964 | etot = -8.3746230346557 +345000 ekin = 1.17839357225679 | erot = 2.76177689465574 | epot = -12.3147935012701 | etot = -8.37462303435761 +346000 ekin = 1.138147305603 | erot = 2.72996678569899 | epot = -12.2427371252559 | etot = -8.37462303395393 +347000 ekin = 1.10331757839138 | erot = 2.67831421954011 | epot = -12.1562548313951 | etot = -8.37462303346366 +348000 ekin = 1.07595787263665 | erot = 2.61283600667709 | epot = -12.0634169122315 | etot = -8.3746230329178 +349000 ekin = 1.05798147191731 | erot = 2.54050407789471 | epot = -11.9731085821735 | etot = -8.37462303236147 +350000 ekin = 1.05096760963782 | erot = 2.46871550808049 | epot = -11.8943061495698 | etot = -8.37462303185146 +351000 ekin = 1.05593437429307 | erot = 2.40463774698071 | epot = -11.835195152722 | etot = -8.37462303144819 +352000 ekin = 1.07311971186488 | erot = 2.35449555191725 | epot = -11.8022382949892 | etot = -8.37462303120707 +353000 ekin = 1.10182415540794 | erot = 2.32288867128265 | epot = -11.7993358578589 | etot = -8.37462303116831 +354000 ekin = 1.14036300464667 | erot = 2.31223409502419 | epot = -11.8272201310211 | etot = -8.37462303135019 +355000 ekin = 1.18615564007855 | erot = 2.32242185962048 | epot = -11.8832005314417 | etot = -8.37462303174267 +356000 ekin = 1.23595386569893 | erot = 2.3507632696423 | epot = -11.9613401676474 | etot = -8.37462303230619 +357000 ekin = 1.28618457758663 | erot = 2.39228504524971 | epot = -12.0530926558099 | etot = -8.37462303297352 +358000 ekin = 1.33335672484066 | erot = 2.44036693764212 | epot = -12.1483466961435 | etot = -8.37462303366069 +359000 ekin = 1.37446611423542 | erot = 2.48763760748948 | epot = -12.2367267560058 | etot = -8.37462303428087 +360000 ekin = 1.40733698540127 | erot = 2.52696891747079 | epot = -12.3089289376308 | etot = -8.37462303475878 +361000 ekin = 1.4308523011713 | erot = 2.55266032656708 | epot = -12.3581356626699 | etot = -8.37462303493157 +362000 ekin = 1.44498023419552 | erot = 2.56161192448358 | epot = -12.3812151936925 | etot = -8.37462303501344 +363000 ekin = 1.45080808015495 | erot = 2.55177253018961 | epot = -12.3772036452513 | etot = -8.37462303490678 +364000 ekin = 1.45046982069976 | erot = 2.52283864584236 | epot = -12.3479315011823 | etot = -8.37462303464013 +365000 ekin = 1.44693366152058 | erot = 2.47609933176612 | epot = -12.2976560275497 | etot = -8.37462303426302 +366000 ekin = 1.44366094468076 | erot = 2.41401126337553 | epot = -12.232295241893 | etot = -8.37462303383673 +367000 ekin = 1.44416618229235 | erot = 2.33969773429608 | epot = -12.1584869500119 | etot = -8.37462303342343 +368000 ekin = 1.45154164412146 | erot = 2.25648465084956 | epot = -12.0826493280447 | etot = -8.37462303307363 +369000 ekin = 1.46802482611129 | erot = 2.16757470029718 | epot = -12.0102225592253 | etot = -8.37462303281687 +370000 ekin = 1.49468484158027 | erot = 2.07591739972967 | epot = -11.9452252739683 | etot = -8.37462303265834 +371000 ekin = 1.53128479294168 | erot = 1.98426522628747 | epot = -11.8901730518125 | etot = -8.37462303258338 +372000 ekin = 1.57634160155693 | erot = 1.8953362606447 | epot = -11.8463008947683 | etot = -8.3746230325667 +373000 ekin = 1.62736107596798 | erot = 1.81196417168749 | epot = -11.8139482802385 | etot = -8.37462303258302 +374000 ekin = 1.68119274504331 | erot = 1.73713269144043 | epot = -11.7929484690969 | etot = -8.37462303261319 +375000 ekin = 1.73444043053021 | erot = 1.6738588433462 | epot = -11.7829223065197 | etot = -8.37462303264332 +376000 ekin = 1.78387586144104 | erot = 1.62497473906303 | epot = -11.7834736331736 | etot = -8.3746230326695 +377000 ekin = 1.82648186092067 | erot = 1.59275354369137 | epot = -11.7938584374905 | etot = -8.37462303287845 +378000 ekin = 1.85889028460924 | erot = 1.57838589666601 | epot = -11.8118992141862 | etot = -8.37462303291091 +379000 ekin = 1.87974734421496 | erot = 1.58231910072796 | epot = -11.836689477891 | etot = -8.37462303294807 +380000 ekin = 1.88876618248049 | erot = 1.60397852042792 | epot = -11.8673677359264 | etot = -8.37462303301795 +381000 ekin = 1.88634387025689 | erot = 1.64162253507626 | epot = -11.9025894384718 | etot = -8.37462303313868 +382000 ekin = 1.87329602400055 | erot = 1.69239968364273 | epot = -11.9403187409512 | etot = -8.37462303330791 +383000 ekin = 1.85067766912144 | erot = 1.75260724973921 | epot = -11.9779079523646 | etot = -8.37462303350392 +384000 ekin = 1.81972884480806 | erot = 1.81808771260978 | epot = -12.012439591111 | etot = -8.37462303369321 +385000 ekin = 1.78192764777056 | erot = 1.8846313378667 | epot = -12.0411820195031 | etot = -8.37462303386585 +386000 ekin = 1.73896117301595 | erot = 1.94830024178108 | epot = -12.0618844487812 | etot = -8.37462303398414 +387000 ekin = 1.69261703956643 | erot = 2.00550933075303 | epot = -12.0727494044575 | etot = -8.37462303413803 +388000 ekin = 1.64442362565025 | erot = 2.0529026228811 | epot = -12.0719492828224 | etot = -8.3746230342911 +389000 ekin = 1.59562809726278 | erot = 2.08769097010042 | epot = -12.0579421017184 | etot = -8.37462303435517 +390000 ekin = 1.5472725807875 | erot = 2.10804034821809 | epot = -12.0299359634129 | etot = -8.37462303440729 +391000 ekin = 1.5004266868921 | erot = 2.11301685840023 | epot = -11.9880665795734 | etot = -8.37462303428111 +392000 ekin = 1.45669956782618 | erot = 2.1035261208382 | epot = -11.9348487226024 | etot = -8.37462303393806 +393000 ekin = 1.41857599109023 | erot = 2.08263213471356 | epot = -11.8758311591984 | etot = -8.37462303339458 +394000 ekin = 1.38932612627842 | erot = 2.05528425943449 | epot = -11.8192334184613 | etot = -8.37462303274838 +395000 ekin = 1.37246101478418 | erot = 2.02739319427218 | epot = -11.7744772412151 | etot = -8.37462303215879 +396000 ekin = 1.37078907987889 | erot = 2.00445159240655 | epot = -11.7498637040821 | etot = -8.37462303179663 +397000 ekin = 1.38538853999933 | erot = 1.99011302537629 | epot = -11.7501245971573 | etot = -8.37462303178166 +398000 ekin = 1.41490531161691 | erot = 1.98519641778415 | epot = -11.7747247615395 | etot = -8.37462303213847 +399000 ekin = 1.45547085036333 | erot = 1.98743025594793 | epot = -11.8175241391056 | etot = -8.37462303279433 +400000 ekin = 1.50126526406653 | erot = 1.99196444869351 | epot = -11.8678527463725 | etot = -8.37462303361247 +401000 ekin = 1.54549713891542 | erot = 1.99242148352483 | epot = -11.912541656877 | etot = -8.37462303443675 +402000 ekin = 1.58148802753443 | erot = 1.98217540610616 | epot = -11.938286468762 | etot = -8.3746230351214 +403000 ekin = 1.60364407572841 | erot = 1.95563446459467 | epot = -11.933901575864 | etot = -8.37462303554094 +404000 ekin = 1.60823718231444 | erot = 1.90940860689033 | epot = -11.8922688248047 | etot = -8.37462303559992 +405000 ekin = 1.59393186875409 | erot = 1.84321418438545 | epot = -11.8117690883972 | etot = -8.37462303525767 +406000 ekin = 1.56197926550456 | erot = 1.76026394072076 | epot = -11.6968662407814 | etot = -8.3746230345561 +407000 ekin = 1.51595319782283 | erot = 1.66689496115242 | epot = -11.557471192596 | etot = -8.37462303362073 +408000 ekin = 1.46103089399037 | erot = 1.57144700034375 | epot = -11.4071009269549 | etot = -8.37462303262082 +409000 ekin = 1.40302353808212 | erot = 1.48274963104999 | epot = -11.2603962008451 | etot = -8.37462303171302 +410000 ekin = 1.34747963365306 | erot = 1.40871679572269 | epot = -11.1308194603667 | etot = -8.37462303099099 +411000 ekin = 1.24142842928015 | erot = 1.36765891027326 | epot = -10.9837103545926 | etot = -8.37462301503915 +412000 ekin = 1.07606206466648 | erot = 1.44463891803928 | epot = -10.8953239884245 | etot = -8.37462300571878 +413000 ekin = 1.04694922469659 | erot = 1.51102600613158 | epot = -10.9325982588146 | etot = -8.37462302798646 +414000 ekin = 1.03606467090415 | erot = 1.52895884328637 | epot = -10.939646542314 | etot = -8.37462302812346 +415000 ekin = 1.03698178422045 | erot = 1.56970634086026 | epot = -10.9813111534882 | etot = -8.37462302840751 +416000 ekin = 1.04842794421751 | erot = 1.63005774223117 | epot = -11.0531087152571 | etot = -8.37462302880839 +417000 ekin = 1.06841333535707 | erot = 1.7057177047907 | epot = -11.148754069442 | etot = -8.37462302929419 +418000 ekin = 1.09444701005145 | erot = 1.7915840530624 | epot = -11.2606540929521 | etot = -8.37462302983822 +419000 ekin = 1.12371544113113 | erot = 1.88200392342396 | epot = -11.380342394971 | etot = -8.37462303041592 +420000 ekin = 1.15322596863779 | erot = 1.97103956947869 | epot = -11.4988885691126 | etot = -8.37462303099611 +421000 ekin = 1.17996638670259 | erot = 2.05281125535568 | epot = -11.6074006735889 | etot = -8.3746230315306 +422000 ekin = 1.20115062981169 | erot = 2.12197272517875 | epot = -11.697746386944 | etot = -8.37462303195353 +423000 ekin = 1.21456879342772 | erot = 2.1742992460712 | epot = -11.7634910716968 | etot = -8.37462303219783 +424000 ekin = 1.21895541018824 | erot = 2.20725430505372 | epot = -11.8008327474647 | etot = -8.37462303222279 +425000 ekin = 1.21420953470763 | erot = 2.22030001430828 | epot = -11.8091325810578 | etot = -8.37462303204189 +426000 ekin = 1.20134505265836 | erot = 2.21476142814857 | epot = -11.7907295125136 | etot = -8.37462303170663 +427000 ekin = 1.18219319315433 | erot = 2.19340434236639 | epot = -11.750220566811 | etot = -8.37462303129028 +428000 ekin = 1.1589992194094 | erot = 2.15981652249787 | epot = -11.6934387727652 | etot = -8.37462303085794 +429000 ekin = 1.13415683500818 | erot = 2.11790831243045 | epot = -11.6266881762552 | etot = -8.37462302881656 +430000 ekin = 1.11403963820984 | erot = 2.07460238347215 | epot = -11.5632650504425 | etot = -8.3746230287605 +431000 ekin = 1.10124843427963 | erot = 2.03325324116058 | epot = -11.5091247042081 | etot = -8.37462302876791 +432000 ekin = 1.09509673682057 | erot = 1.99414694703559 | epot = -11.4638667126922 | etot = -8.37462302883607 +433000 ekin = 1.09463609314626 | erot = 1.95711348582254 | epot = -11.4263726079124 | etot = -8.37462302894363 +434000 ekin = 1.09809472012948 | erot = 1.92111283569859 | epot = -11.3938305852088 | etot = -8.37462302938068 +435000 ekin = 1.10341624338786 | erot = 1.8849214283033 | epot = -11.3629607010965 | etot = -8.37462302940532 +436000 ekin = 1.11020757162794 | erot = 1.84854231975911 | epot = -11.3333729208365 | etot = -8.37462302944944 +437000 ekin = 1.11803889537716 | erot = 1.811869025112 | epot = -11.3045309499975 | etot = -8.37462302950836 +438000 ekin = 1.12642172160203 | erot = 1.77470718111898 | epot = -11.2757519322947 | etot = -8.37462302957371 +439000 ekin = 1.13485148153839 | erot = 1.73686282079475 | epot = -11.2463373319665 | etot = -8.37462302963338 +440000 ekin = 1.14287335820531 | erot = 1.69826079507209 | epot = -11.2157571829496 | etot = -8.37462302967224 +441000 ekin = 1.15016795452965 | erot = 1.65908318343038 | epot = -11.1838741676301 | etot = -8.37462302967003 +442000 ekin = 1.15664284201438 | erot = 1.61992313518235 | epot = -11.1511890068204 | etot = -8.3746230296237 +443000 ekin = 1.16253418068965 | erot = 1.58179210099491 | epot = -11.1189493112069 | etot = -8.37462302952238 +444000 ekin = 1.16846798531214 | erot = 1.54614466613328 | epot = -11.0892356808146 | etot = -8.37462302936922 +445000 ekin = 1.1754682034657 | erot = 1.51479732960997 | epot = -11.064888562255 | etot = -8.37462302917931 +446000 ekin = 1.18488743024638 | erot = 1.48973802088241 | epot = -11.0492484801092 | etot = -8.37462302898043 +447000 ekin = 1.19824347153595 | erot = 1.4728428998055 | epot = -11.0457094001514 | etot = -8.37462302880998 +448000 ekin = 1.21696535091515 | erot = 1.46554765995542 | epot = -11.0571360395813 | etot = -8.3746230287107 +449000 ekin = 1.24207954598512 | erot = 1.46851271093811 | epot = -11.0852152856434 | etot = -8.37462302872015 +450000 ekin = 1.27389445230309 | erot = 1.48136016742249 | epot = -11.1298776485961 | etot = -8.37462302887047 +451000 ekin = 1.31179903842769 | erot = 1.50255470267703 | epot = -11.1889767701153 | etot = -8.37462302901055 +452000 ekin = 1.35460859520352 | erot = 1.52989164327147 | epot = -11.2591232679078 | etot = -8.37462302943281 +453000 ekin = 1.39989469250035 | erot = 1.55983588432727 | epot = -11.334353606767 | etot = -8.37462302993942 +454000 ekin = 1.44437957549523 | erot = 1.58822152329922 | epot = -11.4072241292528 | etot = -8.37462303045837 +455000 ekin = 1.4845601587809 | erot = 1.6110361600437 | epot = -11.4702193497289 | etot = -8.37462303090433 +456000 ekin = 1.51733329615193 | erot = 1.62510652435356 | epot = -11.5170628516963 | etot = -8.37462303119078 +457000 ekin = 1.54029245797498 | erot = 1.62854015385641 | epot = -11.5434556431066 | etot = -8.3746230312752 +458000 ekin = 1.5520978706264 | erot = 1.62122255615416 | epot = -11.5479434578272 | etot = -8.3746230310466 +459000 ekin = 1.55414659187651 | erot = 1.60571991112788 | epot = -11.5344895335874 | etot = -8.374623030583 +460000 ekin = 1.54960099436756 | erot = 1.58640018749771 | epot = -11.5106242118325 | etot = -8.37462302996718 +461000 ekin = 1.5427312422487 | erot = 1.5687225226635 | epot = -11.4860767942378 | etot = -8.37462302932561 +462000 ekin = 1.53795589449098 | erot = 1.55825929919566 | epot = -11.4708382224919 | etot = -8.3746230288053 +463000 ekin = 1.53875903308003 | erot = 1.55959299575772 | epot = -11.4729750573648 | etot = -8.37462302852709 +464000 ekin = 1.54682029511914 | erot = 1.5753418689491 | epot = -11.4967851926244 | etot = -8.37462302855616 +465000 ekin = 1.56162946502592 | erot = 1.60564212072992 | epot = -11.5418946146286 | etot = -8.3746230288728 +466000 ekin = 1.58070265304453 | erot = 1.64822662156104 | epot = -11.6035523039889 | etot = -8.37462302938336 +467000 ekin = 1.60035208027453 | erot = 1.69905719078982 | epot = -11.6740323010127 | etot = -8.37462302994838 +468000 ekin = 1.61673623107485 | erot = 1.75335443246717 | epot = -11.7447136939726 | etot = -8.3746230304306 +469000 ekin = 1.6268308500725 | erot = 1.80670922025587 | epot = -11.8081631010582 | etot = -8.37462303072985 +470000 ekin = 1.62907239972834 | erot = 1.85596584023993 | epot = -11.8596612707767 | etot = -8.37462303080845 +471000 ekin = 1.6235468737331 | erot = 1.8996612917067 | epot = -11.8978311961327 | etot = -8.37462303069291 +472000 ekin = 1.61170510379542 | erot = 1.93800410341002 | epot = -11.9243322376459 | etot = -8.37462303044043 +473000 ekin = 1.59590324450968 | erot = 1.97246730641929 | epot = -11.9429935810559 | etot = -8.37462303012697 +474000 ekin = 1.57886523181254 | erot = 2.00526149881397 | epot = -11.9587497604453 | etot = -8.37462302981875 +475000 ekin = 1.5631207157897 | erot = 2.03882982960363 | epot = -11.9765735749599 | etot = -8.37462302956653 +476000 ekin = 1.55063074695144 | erot = 2.07545668637113 | epot = -12.000710462713 | etot = -8.37462302939048 +477000 ekin = 1.54263588410843 | erot = 2.11704231172457 | epot = -12.0343012251353 | etot = -8.37462302930229 +478000 ekin = 1.53956151542 | erot = 2.16493101565339 | epot = -12.0791155603797 | etot = -8.37462302930633 +479000 ekin = 1.54104337297934 | erot = 2.21977101927583 | epot = -12.1354374216603 | etot = -8.37462302940509 +480000 ekin = 1.54600976096943 | erot = 2.28138261400339 | epot = -12.2020154045693 | etot = -8.37462302959645 +481000 ekin = 1.55280606024705 | erot = 2.34867771788968 | epot = -12.276106808004 | etot = -8.37462302986726 +482000 ekin = 1.55937339634668 | erot = 2.41971772771286 | epot = -12.3537141542443 | etot = -8.37462303018471 +483000 ekin = 1.56350104452631 | erot = 2.49198464322841 | epot = -12.4301087182512 | etot = -8.37462303049648 +484000 ekin = 1.56314467772404 | erot = 2.5628002628049 | epot = -12.5005679712778 | etot = -8.37462303074887 +485000 ekin = 1.556770991892 | erot = 2.62990187864868 | epot = -12.5612959014248 | etot = -8.37462303088411 +486000 ekin = 1.54362230241326 | erot = 2.69196691951159 | epot = -12.6102122528178 | etot = -8.37462303089296 +487000 ekin = 1.52381043791502 | erot = 2.74866369544755 | epot = -12.6470971641617 | etot = -8.37462303079914 +488000 ekin = 1.4982285884388 | erot = 2.8004132279417 | epot = -12.673264847032 | etot = -8.37462303065147 +489000 ekin = 1.46832177710657 | erot = 2.84792010719116 | epot = -12.6908649148011 | etot = -8.37462303050336 +490000 ekin = 1.43580907600636 | erot = 2.89167668868161 | epot = -12.702108795082 | etot = -8.37462303039404 +491000 ekin = 1.40244626498215 | erot = 2.93162068130931 | epot = -12.7086899766309 | etot = -8.37462303033947 +492000 ekin = 1.36987596423187 | erot = 2.96703118868618 | epot = -12.7115301832525 | etot = -8.37462303033448 +493000 ekin = 1.33956200675514 | erot = 2.99664446239282 | epot = -12.7108294995104 | etot = -8.37462303036243 +494000 ekin = 1.3127681632094 | erot = 3.01889804551655 | epot = -12.7062892391336 | etot = -8.37462303040764 +495000 ekin = 1.29052832589674 | erot = 3.0321850552458 | epot = -12.6973364116069 | etot = -8.37462303046436 +496000 ekin = 1.27356858864352 | erot = 3.03502298577767 | epot = -12.6832146049608 | etot = -8.37462303053966 +497000 ekin = 1.26217859738907 | erot = 3.02610963123435 | epot = -12.6629112592685 | etot = -8.37462303064505 +498000 ekin = 1.25609176092381 | erot = 3.00437387242429 | epot = -12.6350886640707 | etot = -8.37462303072259 +499000 ekin = 1.2544843354408 | erot = 2.96925958209446 | epot = -12.598366948399 | etot = -8.37462303086377 +500000 ekin = 1.25592311954903 | erot = 2.92052794168189 | epot = -12.5510740922055 | etot = -8.37462303097461 +501000 ekin = 1.25866262015647 | erot = 2.8587785741333 | epot = -12.4920642252922 | etot = -8.37462303100237 +502000 ekin = 1.26101030104181 | erot = 2.78589367847505 | epot = -12.4215270104235 | etot = -8.37462303090669 +503000 ekin = 1.26168224098181 | erot = 2.7052568626583 | epot = -12.3415621343151 | etot = -8.37462303067498 +504000 ekin = 1.26006875272996 | erot = 2.62162663921943 | epot = -12.2563184222849 | etot = -8.37462303033546 +505000 ekin = 1.2563523063421 | erot = 2.54066101850803 | epot = -12.1716363547703 | etot = -8.37462302992017 +506000 ekin = 1.25147361583197 | erot = 2.46829686832148 | epot = -12.0943935136481 | etot = -8.37462302949467 +507000 ekin = 1.24695832252193 | erot = 2.40991559866156 | epot = -12.0314969503137 | etot = -8.37462302913025 +508000 ekin = 1.24460011261683 | erot = 2.3694758893424 | epot = -11.9886990309695 | etot = -8.37462302901031 +509000 ekin = 1.24584437164862 | erot = 2.34837731731248 | epot = -11.9688447179565 | etot = -8.37462302899536 +510000 ekin = 1.25172041123396 | erot = 2.34550382347595 | epot = -11.9718472639374 | etot = -8.37462302922752 +511000 ekin = 1.26248317250748 | erot = 2.35680066398032 | epot = -11.9939068661986 | etot = -8.37462302971083 +512000 ekin = 1.27739486770219 | erot = 2.37529788848956 | epot = -12.0273157865877 | etot = -8.37462303039595 +513000 ekin = 1.29481021505025 | erot = 2.39185405428493 | epot = -12.061287300512 | etot = -8.37462303117683 +514000 ekin = 1.31250889880472 | erot = 2.39651406027405 | epot = -12.083645990976 | etot = -8.37462303189726 +515000 ekin = 1.32825052581643 | erot = 2.38037057726039 | epot = -12.0832441354532 | etot = -8.37462303237634 +516000 ekin = 1.3404583142908 | erot = 2.3376026799452 | epot = -12.0526840266952 | etot = -8.37462303245918 +517000 ekin = 1.34883924084281 | erot = 2.2671315544432 | epot = -11.9905938273649 | etot = -8.37462303207885 +518000 ekin = 1.3546855068379 | erot = 2.17326127006699 | epot = -11.9025698082024 | etot = -8.37462303129752 +519000 ekin = 1.36067339624163 | erot = 2.06494828515272 | epot = -11.8002447116846 | etot = -8.37462303029026 +520000 ekin = 1.3701858282257 | erot = 1.95390329836254 | epot = -11.6987121558679 | etot = -8.37462302927969 +521000 ekin = 1.38639579380324 | erot = 1.85221057841152 | epot = -11.6132294006765 | etot = -8.37462302846172 +522000 ekin = 1.41141432490604 | erot = 1.77022445533572 | epot = -11.5562618082014 | etot = -8.37462302795968 +523000 ekin = 1.44572356453452 | erot = 1.71520045870416 | epot = -11.5355470510568 | etot = -8.37462302781811 +524000 ekin = 1.48798145409766 | erot = 1.6907300831751 | epot = -11.5533345652892 | etot = -8.37462302801646 +525000 ekin = 1.53517683781733 | erot = 1.69680296063377 | epot = -11.6066028269462 | etot = -8.3746230284951 +526000 ekin = 1.5830490011928 | erot = 1.7302550947518 | epot = -11.68792712512 | etot = -8.37462302917537 +527000 ekin = 1.62665879649449 | erot = 1.78540941263951 | epot = -11.7866912391066 | etot = -8.37462302997259 +528000 ekin = 1.66100783108942 | erot = 1.85480654803319 | epot = -11.8904374099231 | etot = -8.3746230308005 +529000 ekin = 1.68163863412941 | erot = 1.93001159413322 | epot = -11.9862732598311 | etot = -8.37462303156848 +530000 ekin = 1.68518623027426 | erot = 2.00252460865602 | epot = -12.0623338711119 | etot = -8.37462303218164 +531000 ekin = 1.6698605968592 | erot = 2.06478669655893 | epot = -12.1092703259684 | etot = -8.37462303255032 +532000 ekin = 1.63581226896465 | erot = 2.11116679184506 | epot = -12.1216020934215 | etot = -8.37462303261175 +533000 ekin = 1.58529617178035 | erot = 2.13870511838749 | epot = -12.0986243225214 | etot = -8.37462303235352 +534000 ekin = 1.52254564095872 | erot = 2.14737698822834 | epot = -12.0445456610118 | etot = -8.37462303182473 +535000 ekin = 1.45332420577088 | erot = 2.13977370493898 | epot = -11.9677209418336 | etot = -8.37462303112378 +536000 ekin = 1.3842169101196 | erot = 2.12031314070402 | epot = -11.8791530811934 | etot = -8.37462303036976 +537000 ekin = 1.32180342899991 | erot = 2.09425520394401 | epot = -11.7906816626149 | etot = -8.374623029671 +538000 ekin = 1.27187743420623 | erot = 2.06681107588936 | epot = -11.7133115392009 | etot = -8.37462302910533 +539000 ekin = 1.23883846279566 | erot = 2.04251647933663 | epot = -11.6559779708489 | etot = -8.37462302871661 +540000 ekin = 1.22531302703427 | erot = 2.02488499742776 | epot = -11.624821052984 | etot = -8.37462302852195 +541000 ekin = 1.23199882291178 | erot = 2.01625749304625 | epot = -11.622879344481 | etot = -8.37462302852296 +542000 ekin = 1.25769219451191 | erot = 2.0177488049515 | epot = -11.6500640281741 | etot = -8.37462302871065 +543000 ekin = 1.29945731407226 | erot = 2.02924170402388 | epot = -11.703322047163 | etot = -8.37462302906682 +544000 ekin = 1.35291512122218 | erot = 2.0494489332704 | epot = -11.7769870840481 | etot = -8.37462302955557 +545000 ekin = 1.41265384122181 | erot = 2.07611668223509 | epot = -11.8633935535748 | etot = -8.37462303011794 +546000 ekin = 1.47277167575213 | erot = 2.10644216880822 | epot = -11.95383687523 | etot = -8.37462303066964 +547000 ekin = 1.52754093319551 | erot = 2.13770468829054 | epot = -12.0398686526006 | etot = -8.37462303111457 +548000 ekin = 1.57213155238866 | erot = 2.1679823717642 | epot = -12.1147369555217 | etot = -8.37462303136882 +549000 ekin = 1.60327488859432 | erot = 2.1967176749586 | epot = -12.1746155949407 | etot = -8.37462303138776 +550000 ekin = 1.61972434376739 | erot = 2.22489244333346 | epot = -12.2192398182829 | etot = -8.37462303118202 +551000 ekin = 1.62240013870558 | erot = 2.25470593135916 | epot = -12.2517291008786 | etot = -8.37462303081384 +552000 ekin = 1.61417495562477 | erot = 2.28884205646897 | epot = -12.2776400424735 | etot = -8.37462303037974 +553000 ekin = 1.59932782091898 | erot = 2.32954987377534 | epot = -12.3035007246831 | etot = -8.37462302998878 +554000 ekin = 1.58274599066884 | erot = 2.37778817612988 | epot = -12.33515719654 | etot = -8.37462302974128 +555000 ekin = 1.56899856385218 | erot = 2.43263226771529 | epot = -12.3762538612776 | etot = -8.37462302971009 +556000 ekin = 1.56145041157792 | erot = 2.49106505511368 | epot = -12.4271384966165 | etot = -8.37462302992488 +557000 ekin = 1.56197837218861 | erot = 2.54829507223281 | epot = -12.4848964746449 | etot = -8.37462303022351 +558000 ekin = 1.57029216551905 | erot = 2.59810209182053 | epot = -12.543017288208 | etot = -8.37462303086841 +559000 ekin = 1.58339818320946 | erot = 2.63367391511157 | epot = -12.5916951298582 | etot = -8.37462303153717 +560000 ekin = 1.59712770481158 | erot = 2.64904697988329 | epot = -12.6207977168071 | etot = -8.37462303211223 +561000 ekin = 1.60698123343126 | erot = 2.64009683894197 | epot = -12.6217011048625 | etot = -8.37462303248925 +562000 ekin = 1.60896027782199 | erot = 2.6053270012055 | epot = -12.588910311621 | etot = -8.37462303259352 +563000 ekin = 1.60023696633128 | erot = 2.54649193869402 | epot = -12.5213519373447 | etot = -8.37462303231943 +564000 ekin = 1.5795577467728 | erot = 2.46891092806127 | epot = -12.4230917066634 | etot = -8.37462303182932 +565000 ekin = 1.54734561566717 | erot = 2.38031455632009 | epot = -12.302283203096 | etot = -8.37462303110877 +566000 ekin = 1.50554468554437 | erot = 2.29049479450161 | epot = -12.170662510294 | etot = -8.37462303024802 +567000 ekin = 1.45732250665205 | erot = 2.21025028826172 | epot = -12.0421958242637 | etot = -8.37462302934997 +568000 ekin = 1.40671207380879 | erot = 2.15003703753068 | epot = -11.9313721398985 | etot = -8.37462302855905 +569000 ekin = 1.35794157949176 | erot = 2.11775595086852 | epot = -11.8503205583493 | etot = -8.37462302798902 +570000 ekin = 1.31523212119345 | erot = 2.11799693943043 | epot = -11.8078520883711 | etot = -8.37462302774722 +571000 ekin = 1.28243871604929 | erot = 2.15081941192883 | epot = -11.8078811559412 | etot = -8.37462302796304 +572000 ekin = 1.26220633019189 | erot = 2.21027034249732 | epot = -11.8470997013802 | etot = -8.37462302869097 +573000 ekin = 1.25525341535048 | erot = 2.28456705415199 | epot = -11.9144434992935 | etot = -8.374623029791 +574000 ekin = 1.2603025143389 | erot = 2.35813787035989 | epot = -11.9930634156819 | etot = -8.37462303098308 +575000 ekin = 1.27473215622932 | erot = 2.41511328226624 | epot = -12.064468470432 | etot = -8.37462303193646 +576000 ekin = 1.29562562245725 | erot = 2.44294920216337 | epot = -12.1131978571111 | etot = -8.37462303249051 +577000 ekin = 1.32065634431921 | erot = 2.43438586779933 | epot = -12.1296652446954 | etot = -8.37462303257683 +578000 ekin = 1.34847271375288 | erot = 2.38804498568537 | epot = -12.1111407317135 | etot = -8.37462303227527 +579000 ekin = 1.3785964073131 | erot = 2.30759327889104 | epot = -12.060812717933 | etot = -8.37462303172883 +580000 ekin = 1.41115339286351 | erot = 2.20016188411942 | epot = -11.9859383079383 | etot = -8.37462303095539 +581000 ekin = 1.44674776515178 | erot = 2.07475133368168 | epot = -11.8961221291756 | etot = -8.37462303034215 +582000 ekin = 1.48514821810449 | erot = 1.94050793884983 | epot = -11.8002791867467 | etot = -8.37462302979241 +583000 ekin = 1.52576266955587 | erot = 1.80603709651234 | epot = -11.7064227954085 | etot = -8.37462302934027 +584000 ekin = 1.56772288057569 | erot = 1.67887072897741 | epot = -11.6212166385576 | etot = -8.37462302900448 +585000 ekin = 1.60990333959 | erot = 1.56509115871817 | epot = -11.5496175271052 | etot = -8.37462302879703 +586000 ekin = 1.65096359832004 | erot = 1.46905708282314 | epot = -11.4946437098701 | etot = -8.37462302872697 +587000 ekin = 1.68940411634557 | erot = 1.39319741551297 | epot = -11.4572245606556 | etot = -8.37462302879701 +588000 ekin = 1.72364170525932 | erot = 1.33790137442975 | epot = -11.4361661086859 | etot = -8.37462302899679 +589000 ekin = 1.75212209151179 | erot = 1.30158756259632 | epot = -11.4283326833844 | etot = -8.37462302927627 +590000 ekin = 1.77348776905955 | erot = 1.2811198772539 | epot = -11.4292306759299 | etot = -8.37462302961642 +591000 ekin = 1.78679652583224 | erot = 1.27228388602406 | epot = -11.4337034417706 | etot = -8.37462302991428 +592000 ekin = 1.79174476961382 | erot = 1.27074179820008 | epot = -11.4371095979219 | etot = -8.37462303010797 +593000 ekin = 1.78882244318645 | erot = 1.27295060806005 | epot = -11.4363960813917 | etot = -8.3746230301452 +594000 ekin = 1.77931578999229 | erot = 1.27682752829965 | epot = -11.4307663483189 | etot = -8.374623030027 +595000 ekin = 1.76511936071279 | erot = 1.28196044220562 | epot = -11.4217028327175 | etot = -8.37462302979909 +596000 ekin = 1.74839643259039 | erot = 1.28931412525829 | epot = -11.412333587381 | etot = -8.37462302953232 +597000 ekin = 1.73114837529092 | erot = 1.30076368908019 | epot = -11.4065350936671 | etot = -8.37462302929599 +598000 ekin = 1.71482586357245 | erot = 1.31808503745075 | epot = -11.4075339301725 | etot = -8.37462302914929 +599000 ekin = 1.70035612855445 | erot = 1.34256499055983 | epot = -11.4175441481819 | etot = -8.37462302906765 +600000 ekin = 1.68813838896107 | erot = 1.3751840399633 | epot = -11.4379454579702 | etot = -8.3746230290458 +601000 ekin = 1.67802155271563 | erot = 1.41656361607904 | epot = -11.469208197918 | etot = -8.37462302912332 +602000 ekin = 1.66952241262379 | erot = 1.46664302734519 | epot = -11.5107884691324 | etot = -8.37462302916341 +603000 ekin = 1.66207455080118 | erot = 1.52486246590567 | epot = -11.5615600459991 | etot = -8.37462302929223 +604000 ekin = 1.65429274424489 | erot = 1.590907167262 | epot = -11.6198229408988 | etot = -8.37462302939193 +605000 ekin = 1.64513458460594 | erot = 1.66451963176674 | epot = -11.6842772458416 | etot = -8.37462302946896 +606000 ekin = 1.63397297141739 | erot = 1.74533329764429 | epot = -11.7539292986215 | etot = -8.3746230295598 +607000 ekin = 1.62046446185725 | erot = 1.83246852419075 | epot = -11.8275560158114 | etot = -8.37462302976337 +608000 ekin = 1.60415138615021 | erot = 1.92384516554816 | epot = -11.9026195817845 | etot = -8.37462303008612 +609000 ekin = 1.58416607277142 | erot = 2.01562004721302 | epot = -11.9744091506944 | etot = -8.37462303070997 +610000 ekin = 1.55892234884514 | erot = 2.10126039812593 | epot = -12.0348057783745 | etot = -8.37462303140347 +611000 ekin = 1.52586403282323 | erot = 2.17351542350352 | epot = -12.0740024883755 | etot = -8.37462303204871 +612000 ekin = 1.48252796781533 | erot = 2.22604744671485 | epot = -12.0831984469306 | etot = -8.3746230324004 +613000 ekin = 1.42777710478014 | erot = 2.25549715886485 | epot = -12.0578972959114 | etot = -8.37462303226644 +614000 ekin = 1.36284302676326 | erot = 2.26309761368209 | epot = -12.0005636720647 | etot = -8.37462303161936 +615000 ekin = 1.29166682111759 | erot = 2.25472033316523 | epot = -11.9210101848976 | etot = -8.37462303061482 +616000 ekin = 1.22033159945968 | erot = 2.23929049960007 | epot = -11.8342451285656 | etot = -8.37462302950586 +617000 ekin = 1.155853130132 | erot = 2.22643765863302 | epot = -11.7569138172927 | etot = -8.37462302852767 +618000 ekin = 1.10482633868832 | erot = 2.22445549379434 | epot = -11.7039048603104 | etot = -8.37462302782777 +619000 ekin = 1.07233800596013 | erot = 2.23915844396385 | epot = -11.6861194773936 | etot = -8.37462302746959 +620000 ekin = 1.06133969548986 | erot = 2.2735659826601 | epot = -11.709528705565 | etot = -8.374623027415 +621000 ekin = 1.07250328126414 | erot = 2.3282764043813 | epot = -11.7754027132592 | etot = -8.37462302761374 +622000 ekin = 1.10448299244928 | erot = 2.40202886261559 | epot = -11.8811348830575 | etot = -8.37462302799263 +623000 ekin = 1.15443583440785 | erot = 2.49214268563966 | epot = -12.0212015485471 | etot = -8.3746230284996 +624000 ekin = 1.21858504498439 | erot = 2.59479979276155 | epot = -12.1880078668501 | etot = -8.37462302910414 +625000 ekin = 1.29260009293194 | erot = 2.70513041487597 | epot = -12.372353537652 | etot = -8.37462302984404 +626000 ekin = 1.37166908701498 | erot = 2.81669294847561 | epot = -12.5629850662662 | etot = -8.37462303077563 +627000 ekin = 1.45036408326115 | erot = 2.92095656625724 | epot = -12.7459436814224 | etot = -8.37462303190404 +628000 ekin = 1.52265779658279 | erot = 3.00738157699178 | epot = -12.904662406668 | etot = -8.3746230330934 +629000 ekin = 1.58251554245327 | erot = 3.06484099788163 | epot = -13.0219795743839 | etot = -8.37462303404902 +630000 ekin = 1.62514418880813 | erot = 3.0844301442172 | epot = -13.0841973674672 | etot = -8.3746230344419 +631000 ekin = 1.64954255051964 | erot = 3.06336922299513 | epot = -13.0875348072771 | etot = -8.37462303376236 +632000 ekin = 1.65761419154604 | erot = 3.00573585956961 | epot = -13.0379730840977 | etot = -8.37462303298202 +633000 ekin = 1.65174795094001 | erot = 2.91965232775879 | epot = -12.9460233106106 | etot = -8.37462303191181 +634000 ekin = 1.63566753657993 | erot = 2.81604656740854 | epot = -12.8263371348704 | etot = -8.3746230308819 +635000 ekin = 1.61303222684045 | erot = 2.70552755469892 | epot = -12.6931828116458 | etot = -8.37462303010643 +636000 ekin = 1.58646965556035 | erot = 2.59633719497752 | epot = -12.557429880173 | etot = -8.37462302963513 +637000 ekin = 1.55730595136457 | erot = 2.49385627804151 | epot = -12.4257852588047 | etot = -8.37462302939862 +638000 ekin = 1.52584911625177 | erot = 2.40123459740419 | epot = -12.3017067429393 | etot = -8.37462302928338 +639000 ekin = 1.49192497641212 | erot = 2.32043250457117 | epot = -12.1869805101701 | etot = -8.37462302918681 +640000 ekin = 1.45541378442365 | erot = 2.25314232064333 | epot = -12.0831791341094 | etot = -8.37462302904238 +641000 ekin = 1.41664919926913 | erot = 2.2013514425384 | epot = -11.9926236706313 | etot = -8.37462302882371 +642000 ekin = 1.37663135857175 | erot = 2.16751840710212 | epot = -11.9187727942127 | etot = -8.37462302853879 +643000 ekin = 1.33719601643019 | erot = 2.15436138730341 | epot = -11.8661804319142 | etot = -8.37462302818063 +644000 ekin = 1.30095460066691 | erot = 2.16433354913778 | epot = -11.8399111777142 | etot = -8.37462302790954 +645000 ekin = 1.270090477408 | erot = 2.19964354153053 | epot = -11.8443570466463 | etot = -8.37462302770774 +646000 ekin = 1.24673444984115 | erot = 2.26154821905305 | epot = -11.882905696536 | etot = -8.37462302764184 +647000 ekin = 1.23265873216139 | erot = 2.34972644270081 | epot = -11.957008202641 | etot = -8.37462302777877 +648000 ekin = 1.22854704148065 | erot = 2.4614698466935 | epot = -12.0646399168488 | etot = -8.37462302867466 +649000 ekin = 1.23123438276362 | erot = 2.58918284110115 | epot = -12.1950402535038 | etot = -8.37462302963905 +650000 ekin = 1.23733747326776 | erot = 2.72274115030041 | epot = -12.3347016542746 | etot = -8.37462303070646 +651000 ekin = 1.2428991851099 | erot = 2.85114575375234 | epot = -12.4686679705902 | etot = -8.37462303172792 +652000 ekin = 1.24424620799516 | erot = 2.96370857038795 | epot = -12.5825778108466 | etot = -8.37462303246346 +653000 ekin = 1.23918232849174 | erot = 3.05217314602512 | epot = -12.665978507275 | etot = -8.37462303275814 +654000 ekin = 1.22772861476404 | erot = 3.11212236728113 | epot = -12.7144740146641 | etot = -8.37462303261892 +655000 ekin = 1.21201905899399 | erot = 3.1430384085145 | epot = -12.7296804997016 | etot = -8.3746230321931 +656000 ekin = 1.19543744328571 | erot = 3.14720435564434 | epot = -12.7172648305997 | etot = -8.37462303166968 +657000 ekin = 1.18149305106273 | erot = 3.12826014301188 | epot = -12.6843762252587 | etot = -8.3746230311841 +658000 ekin = 1.1729637952008 | erot = 3.09016086422205 | epot = -12.637747690211 | etot = -8.37462303078811 +659000 ekin = 1.17154758057481 | erot = 3.03675236921285 | epot = -12.582922980262 | etot = -8.37462303047435 +660000 ekin = 1.17794903027434 | erot = 2.97172379744642 | epot = -12.5242958579403 | etot = -8.37462303021955 +661000 ekin = 1.19217998580428 | erot = 2.898584368483 | epot = -12.4653873843035 | etot = -8.37462303001626 +662000 ekin = 1.21385724617977 | erot = 2.82043608357939 | epot = -12.4089163596458 | etot = -8.37462302988661 +663000 ekin = 1.24235148672456 | erot = 2.73948706946805 | epot = -12.3564615860731 | etot = -8.37462302988048 +664000 ekin = 1.27672733537829 | erot = 2.65640555000379 | epot = -12.3077559154376 | etot = -8.37462303005548 +665000 ekin = 1.31551337033088 | erot = 2.56977925409993 | epot = -12.2599156548662 | etot = -8.37462303043538 +666000 ekin = 1.35644708325355 | erot = 2.47610382427411 | epot = -12.2071739384913 | etot = -8.37462303096362 +667000 ekin = 1.39640549572063 | erot = 2.37072397309945 | epot = -12.1417525003041 | etot = -8.37462303148401 +668000 ekin = 1.43167926156826 | erot = 2.24978389246305 | epot = -12.0560861858199 | etot = -8.37462303178861 +669000 ekin = 1.45855421041211 | erot = 2.11253877406498 | epot = -11.9457160162009 | etot = -8.3746230317238 +670000 ekin = 1.47395086469066 | erot = 1.96284004635377 | epot = -11.8114139423251 | etot = -8.37462303128072 +671000 ekin = 1.47583917683627 | erot = 1.80887360748426 | epot = -11.6593358149123 | etot = -8.37462303059173 +672000 ekin = 1.46334042173682 | erot = 1.66127989926104 | epot = -11.4992433508357 | etot = -8.37462302983784 +673000 ekin = 1.43665130212456 | erot = 1.53074210398851 | epot = -11.3420164352631 | etot = -8.37462302915007 +674000 ekin = 1.3969614764121 | erot = 1.4261974886013 | epot = -11.1977819935891 | etot = -8.37462302857573 +675000 ekin = 1.34640262234333 | erot = 1.35413730294469 | epot = -11.075162953394 | etot = -8.374623028106 +676000 ekin = 1.28794616800361 | erot = 1.31873912036149 | epot = -10.9813083160869 | etot = -8.37462302772179 +677000 ekin = 1.22516961115493 | erot = 1.32230065786344 | epot = -10.9220932964405 | etot = -8.37462302742212 +678000 ekin = 1.16189722958226 | erot = 1.36556643966811 | epot = -10.9020866964801 | etot = -8.37462302722973 +679000 ekin = 1.10179124612785 | erot = 1.44777635008968 | epot = -10.9241906234036 | etot = -8.37462302718603 +680000 ekin = 1.04797419612216 | erot = 1.56642353037421 | epot = -10.989020753842 | etot = -8.37462302734565 +681000 ekin = 1.00272279864156 | erot = 1.71676662170538 | epot = -11.0941124481172 | etot = -8.37462302777029 +682000 ekin = 0.967238825856131 | erot = 1.89118238727218 | epot = -11.2330442416449 | etot = -8.37462302851656 +683000 ekin = 0.941511133160557 | erot = 2.07856636781375 | epot = -11.3947005305733 | etot = -8.37462302959899 +684000 ekin = 0.924337639173406 | erot = 2.26421473260397 | epot = -11.5631754027141 | etot = -8.37462303093677 +685000 ekin = 0.913629093908953 | erot = 2.43080490187915 | epot = -11.7190570280991 | etot = -8.374623032311 +686000 ekin = 0.907072709288486 | erot = 2.56090643971714 | epot = -11.8426021824021 | etot = -8.37462303339643 +687000 ekin = 0.90302797100111 | erot = 2.64065323918482 | epot = -11.9183042440787 | etot = -8.37462303389278 +688000 ekin = 0.901265997346506 | erot = 2.66315283566604 | epot = -11.9390418666993 | etot = -8.37462303368679 +689000 ekin = 0.903127291409659 | erot = 2.6298992064109 | epot = -11.9076495307323 | etot = -8.37462303291179 +690000 ekin = 0.911003410961509 | erot = 2.54949432632235 | epot = -11.8351207691362 | etot = -8.37462303185234 +691000 ekin = 0.92748229019841 | erot = 2.43458909333036 | epot = -11.7366944143129 | etot = -8.37462303078414 +692000 ekin = 0.954629968085355 | erot = 2.29871133595474 | epot = -11.6279643338871 | etot = -8.37462302984701 +693000 ekin = 0.993689842548604 | erot = 2.15457291081388 | epot = -11.522885782578 | etot = -8.37462302921553 +694000 ekin = 1.04477766676284 | erot = 2.01224824489119 | epot = -11.4316489404321 | etot = -8.37462302877804 +695000 ekin = 1.1071797256016 | erot = 1.87902519875878 | epot = -11.3608279528676 | etot = -8.37462302850724 +696000 ekin = 1.17962988094298 | erot = 1.7602163643183 | epot = -11.3144692736445 | etot = -8.37462302838319 +697000 ekin = 1.26034508067033 | erot = 1.65939331949904 | epot = -11.2943614285653 | etot = -8.37462302839596 +698000 ekin = 1.34700634148091 | erot = 1.57856058320639 | epot = -11.3001899532268 | etot = -8.37462302853948 +699000 ekin = 1.43673776972452 | erot = 1.51829388886829 | epot = -11.3296546873971 | etot = -8.37462302880429 +700000 ekin = 1.52614311404747 | erot = 1.47788597100111 | epot = -11.3786521142188 | etot = -8.37462302917021 +701000 ekin = 1.6111317099382 | erot = 1.45542937143787 | epot = -11.4411841111664 | etot = -8.3746230297903 +702000 ekin = 1.68654811959795 | erot = 1.4477483513988 | epot = -11.5089195013103 | etot = -8.37462303031359 +703000 ekin = 1.74804176728567 | erot = 1.45137774866531 | epot = -11.5740425467016 | etot = -8.37462303075061 +704000 ekin = 1.79223863051376 | erot = 1.46326677106852 | epot = -11.630128432593 | etot = -8.37462303101073 +705000 ekin = 1.81722742450214 | erot = 1.48152907261392 | epot = -11.6733795281517 | etot = -8.37462303103566 +706000 ekin = 1.8228271741102 | erot = 1.50598222607878 | epot = -11.7034324310172 | etot = -8.37462303082821 +707000 ekin = 1.81047570465383 | erot = 1.5382073629024 | epot = -11.723306098011 | etot = -8.37462303045475 +708000 ekin = 1.78276828494797 | erot = 1.58105495038591 | epot = -11.7384462653531 | etot = -8.37462303001919 +709000 ekin = 1.74282721670359 | erot = 1.6377975230453 | epot = -11.7552477693668 | etot = -8.37462302961787 +710000 ekin = 1.69374790021906 | erot = 1.71129566719983 | epot = -11.7796665967243 | etot = -8.37462302930543 +711000 ekin = 1.63830193399443 | erot = 1.80347448194969 | epot = -11.8163994450335 | etot = -8.37462302908935 +712000 ekin = 1.57892460631277 | erot = 1.91516553832439 | epot = -11.8687131735894 | etot = -8.37462302895224 +713000 ekin = 1.51786752129919 | erot = 2.04613993381988 | epot = -11.9386304840018 | etot = -8.37462302888273 +714000 ekin = 1.45734042325113 | erot = 2.1950944154759 | epot = -12.0270578676213 | etot = -8.37462302889423 +715000 ekin = 1.39951776248606 | erot = 2.35946536295234 | epot = -12.1336061544591 | etot = -8.37462302902072 +716000 ekin = 1.34639246829252 | erot = 2.53511986598358 | epot = -12.2561353635767 | etot = -8.37462302930059 +717000 ekin = 1.29955432270148 | erot = 2.71613012099447 | epot = -12.3903074734244 | etot = -8.37462302972844 +718000 ekin = 1.25989829927604 | erot = 2.89465680807183 | epot = -12.5291781377308 | etot = -8.37462303038297 +719000 ekin = 1.22750607429995 | erot = 3.06092665842784 | epot = -12.6630557638775 | etot = -8.37462303114967 +720000 ekin = 1.20188187066595 | erot = 3.2042500666598 | epot = -12.780754969265 | etot = -8.37462303193927 +721000 ekin = 1.18220717983362 | erot = 3.31414882433049 | epot = -12.8709790367814 | etot = -8.37462303261729 +722000 ekin = 1.16774608427129 | erot = 3.38185582435828 | epot = -12.9242249417181 | etot = -8.37462303308856 +723000 ekin = 1.15807318397653 | erot = 3.40183188750504 | epot = -12.934528104623 | etot = -8.37462303314145 +724000 ekin = 1.15381445068158 | erot = 3.3732106752267 | epot = -12.9016481586627 | etot = -8.37462303275442 +725000 ekin = 1.15678266077602 | erot = 3.30036671004676 | epot = -12.8317724028186 | etot = -8.37462303199587 +726000 ekin = 1.16961978298356 | erot = 3.19222682083442 | epot = -12.7364696348445 | etot = -8.37462303102651 +727000 ekin = 1.19513165181247 | erot = 3.06063268781617 | epot = -12.6303873696651 | etot = -8.37462303003647 +728000 ekin = 1.23552066624224 | erot = 2.91835949412842 | epot = -12.5285031895556 | etot = -8.37462302918494 +729000 ekin = 1.29175272909064 | erot = 2.77740116858302 | epot = -12.4437769262429 | etot = -8.37462302856926 +730000 ekin = 1.36319675322324 | erot = 2.64784734354088 | epot = -12.3856671249866 | etot = -8.37462302822252 +731000 ekin = 1.44757535461521 | erot = 2.53736869400637 | epot = -12.3595670767507 | etot = -8.37462302812908 +732000 ekin = 1.54119076309941 | erot = 2.45114849793358 | epot = -12.3669622892793 | etot = -8.37462302824629 +733000 ekin = 1.63933166940199 | erot = 2.39205275840727 | epot = -12.4060074563349 | etot = -8.3746230285256 +734000 ekin = 1.7367368434987 | erot = 2.36087235950094 | epot = -12.4722322319253 | etot = -8.37462302892567 +735000 ekin = 1.82801503458571 | erot = 2.35655963726094 | epot = -12.5591977012579 | etot = -8.37462302941129 +736000 ekin = 1.90799093496242 | erot = 2.37647912513258 | epot = -12.65909309004 | etot = -8.37462302994503 +737000 ekin = 1.97201607373966 | erot = 2.41675065086897 | epot = -12.7633897550843 | etot = -8.37462303047565 +738000 ekin = 2.0163011118576 | erot = 2.47274745432255 | epot = -12.8636715971191 | etot = -8.37462303093893 +739000 ekin = 2.03827941487092 | erot = 2.53972508206351 | epot = -12.9526275282046 | etot = -8.37462303127016 +740000 ekin = 2.03693425612864 | erot = 2.61344505993329 | epot = -13.0250023474896 | etot = -8.3746230314277 +741000 ekin = 2.01297029115351 | erot = 2.69059268985713 | epot = -13.078186012423 | etot = -8.37462303141236 +742000 ekin = 1.96872639115115 | erot = 2.76882566302664 | epot = -13.1121750854493 | etot = -8.37462303127147 +743000 ekin = 1.90780895371444 | erot = 2.8464241150657 | epot = -13.1288560998646 | etot = -8.37462303108442 +744000 ekin = 1.83452633952109 | erot = 2.92167512844415 | epot = -13.1308244989009 | etot = -8.37462303093568 +745000 ekin = 1.75327142724934 | erot = 2.99223326161678 | epot = -13.1201277197533 | etot = -8.37462303088722 +746000 ekin = 1.66800377362302 | erot = 3.05470990305799 | epot = -13.0973367076402 | etot = -8.37462303095923 +747000 ekin = 1.58193446041807 | erot = 3.10466510764443 | epot = -13.0612225991782 | etot = -8.3746230311157 +748000 ekin = 1.49744243756476 | erot = 3.13708170332873 | epot = -13.0091471722143 | etot = -8.37462303132081 +749000 ekin = 1.4161800860188 | erot = 3.14699639332326 | epot = -12.9377995108341 | etot = -8.37462303149206 +750000 ekin = 1.33927892445964 | erot = 3.13031955346188 | epot = -12.844221509496 | etot = -8.37462303157452 +751000 ekin = 1.26755716712032 | erot = 3.08449081841548 | epot = -12.7266710170776 | etot = -8.37462303154178 +752000 ekin = 1.20166403421553 | erot = 3.00876367724781 | epot = -12.5850507428603 | etot = -8.37462303139698 +753000 ekin = 1.1421467145975 | erot = 2.90415589317439 | epot = -12.4209256389321 | etot = -8.37462303116017 +754000 ekin = 1.08946987137478 | erot = 2.77319742895343 | epot = -12.2372903311803 | etot = -8.37462303085211 +755000 ekin = 1.04403390693448 | erot = 2.61963797728167 | epot = -12.0382949147024 | etot = -8.37462303048624 +756000 ekin = 1.00622473319038 | erot = 2.44820898510083 | epot = -11.8290567483599 | etot = -8.37462303006865 +757000 ekin = 0.976498427351097 | erot = 2.26449263382633 | epot = -11.6156140907515 | etot = -8.37462302957403 +758000 ekin = 0.955485081992649 | erot = 2.07490082913346 | epot = -11.4050089401852 | etot = -8.37462302905913 +759000 ekin = 0.943970421441939 | erot = 1.88597944059412 | epot = -11.2045728906054 | etot = -8.37462302856937 +760000 ekin = 0.942943189128097 | erot = 1.70391676484962 | epot = -11.0214829820803 | etot = -8.37462302810259 +761000 ekin = 0.953636819965619 | erot = 1.53434362883715 | epot = -10.8626034764914 | etot = -8.37462302768859 +762000 ekin = 0.977439463713794 | erot = 1.38197793547176 | epot = -10.7340404265378 | etot = -8.37462302735223 +763000 ekin = 1.01575214957308 | erot = 1.25038414093978 | epot = -10.640759317625 | etot = -8.37462302711214 +764000 ekin = 1.06980632715139 | erot = 1.14186552721093 | epot = -10.5862948813436 | etot = -8.37462302698131 +765000 ekin = 1.14045321590852 | erot = 1.05746802222168 | epot = -10.5725442650993 | etot = -8.37462302696907 +766000 ekin = 1.22794009365096 | erot = 0.997057737110112 | epot = -10.5996208578433 | etot = -8.37462302708222 +767000 ekin = 1.33169356854961 | erot = 0.959438204818381 | epot = -10.665754800692 | etot = -8.37462302732404 +768000 ekin = 1.45013707581634 | erot = 0.942489485935241 | epot = -10.7672495894441 | etot = -8.37462302769252 +769000 ekin = 1.58057826605171 | erot = 0.943330765761272 | epot = -10.8985320599891 | etot = -8.37462302817614 +770000 ekin = 1.71920830316226 | erot = 0.958522817508915 | epot = -11.0523541494205 | etot = -8.37462302874933 +771000 ekin = 1.86125297318927 | erot = 0.984329269145668 | epot = -11.2202052717047 | etot = -8.37462302936978 +772000 ekin = 2.00111996073642 | erot = 1.0170654758504 | epot = -11.3928084666644 | etot = -8.37462303007761 +773000 ekin = 2.13179679392591 | erot = 1.05343215414772 | epot = -11.559851978766 | etot = -8.37462303069234 +774000 ekin = 2.24724323873705 | erot = 1.09038833141976 | epot = -11.7122546013449 | etot = -8.37462303118812 +775000 ekin = 2.34263593747183 | erot = 1.12564496608008 | epot = -11.8429039350733 | etot = -8.37462303152139 +776000 ekin = 2.41469510966369 | erot = 1.15782091195961 | epot = -11.9471390533002 | etot = -8.3746230316769 +777000 ekin = 2.46195564508498 | erot = 1.1863859033034 | epot = -12.02296458006 | etot = -8.3746230316716 +778000 ekin = 2.48471522536146 | erot = 1.21145891744711 | epot = -12.0707971743601 | etot = -8.37462303155156 +779000 ekin = 2.48466047806842 | erot = 1.23352809684235 | epot = -12.0928116062876 | etot = -8.3746230313768 +780000 ekin = 2.46428568676977 | erot = 1.25319615838812 | epot = -12.0921048763547 | etot = -8.37462303119683 +781000 ekin = 2.42632307022355 | erot = 1.27107093312904 | epot = -12.0720170343796 | etot = -8.37462303102705 +782000 ekin = 2.37341747179009 | erot = 1.28787882377656 | epot = -12.0359193264081 | etot = -8.37462303084147 +783000 ekin = 2.30815170371706 | erot = 1.304765317757 | epot = -11.9875400520679 | etot = -8.37462303059383 +784000 ekin = 2.23331824904156 | erot = 1.32360971124616 | epot = -11.9315509905402 | etot = -8.37462303025248 +785000 ekin = 2.15217666716759 | erot = 1.34711489735263 | epot = -11.8739145943547 | etot = -8.37462302983446 +786000 ekin = 2.0684394078577 | erot = 1.37850506799186 | epot = -11.8215675052584 | etot = -8.37462302940886 +787000 ekin = 1.98588342004422 | erot = 1.42085370631073 | epot = -11.7813601554306 | etot = -8.37462302907569 +788000 ekin = 1.90769396723903 | erot = 1.47626814207206 | epot = -11.7585851382337 | etot = -8.37462302892266 +789000 ekin = 1.83580155857728 | erot = 1.54525606071479 | epot = -11.7556806482808 | etot = -8.37462302898877 +790000 ekin = 1.77050160314964 | erot = 1.62653131912037 | epot = -11.7716559515175 | etot = -8.37462302924745 +791000 ekin = 1.71053482190253 | erot = 1.71731536906538 | epot = -11.8024732205882 | etot = -8.3746230296203 +792000 ekin = 1.65360852455089 | erot = 1.81397519201844 | epot = -11.8422067465796 | etot = -8.37462303001029 +793000 ekin = 1.59715988493823 | erot = 1.91273671404273 | epot = -11.884519629315 | etot = -8.37462303033406 +794000 ekin = 1.5390946976666 | erot = 2.01023412206034 | epot = -11.9239518502811 | etot = -8.37462303055418 +795000 ekin = 1.47829524950012 | erot = 2.10382941021462 | epot = -11.95674769034 | etot = -8.3746230306253 +796000 ekin = 1.41481662089854 | erot = 2.1919429199428 | epot = -11.9813825714088 | etot = -8.37462303056747 +797000 ekin = 1.34981308249921 | erot = 2.27401207106052 | epot = -11.9984481839615 | etot = -8.37462303040181 +798000 ekin = 1.28529636430919 | erot = 2.35042093010511 | epot = -12.0103403245725 | etot = -8.37462303015818 +799000 ekin = 1.22381948474171 | erot = 2.42233570221676 | epot = -12.0207782168121 | etot = -8.37462302985366 +800000 ekin = 1.16822785386523 | erot = 2.49143438534316 | epot = -12.0342852688226 | etot = -8.37462302961421 +801000 ekin = 1.12099278642861 | erot = 2.55928816630386 | epot = -12.0549039821722 | etot = -8.37462302943968 +802000 ekin = 1.08396505814378 | erot = 2.62689447862849 | epot = -12.0854825661029 | etot = -8.37462302933066 +803000 ekin = 1.05841636960107 | erot = 2.69442631110392 | epot = -12.1274657101638 | etot = -8.37462302945883 +804000 ekin = 1.04426779801405 | erot = 2.76024770980817 | epot = -12.1791385376392 | etot = -8.37462302981701 +805000 ekin = 1.03995925233873 | erot = 2.8204625423412 | epot = -12.2350448251523 | etot = -8.3746230304724 +806000 ekin = 1.04249639914782 | erot = 2.868971630615 | epot = -12.2860910609795 | etot = -8.3746230312167 +807000 ekin = 1.04816653315837 | erot = 2.89850351396173 | epot = -12.3212930790676 | etot = -8.3746230319475 +808000 ekin = 1.05329972431644 | erot = 2.90189493045809 | epot = -12.3298176872629 | etot = -8.37462303248839 +809000 ekin = 1.05511003117154 | erot = 2.87378175152195 | epot = -12.3035148153863 | etot = -8.3746230326928 +810000 ekin = 1.05231348649709 | erot = 2.81208782293652 | epot = -12.2390243420017 | etot = -8.37462303256804 +811000 ekin = 1.04519713626923 | erot = 2.71854122751894 | epot = -12.1383613957977 | etot = -8.37462303200948 +812000 ekin = 1.03556509620897 | erot = 2.59875418167699 | epot = -12.0089423091019 | etot = -8.37462303121595 +813000 ekin = 1.02617370806852 | erot = 2.46123250524441 | epot = -11.8620292436574 | etot = -8.3746230303445 +814000 ekin = 1.01993499389794 | erot = 2.31562695725887 | epot = -11.7101849806859 | etot = -8.37462302952905 +815000 ekin = 1.01938989930336 | erot = 2.17131439138434 | epot = -11.5653273195399 | etot = -8.37462302885224 +816000 ekin = 1.02641070194331 | erot = 2.03643247729264 | epot = -11.4374662075828 | etot = -8.37462302834684 +817000 ekin = 1.04210163740977 | erot = 1.91741411147667 | epot = -11.3341387768999 | etot = -8.37462302801341 +818000 ekin = 1.06685452879859 | erot = 1.81892194067948 | epot = -11.2603994972644 | etot = -8.37462302778628 +819000 ekin = 1.10044073145699 | erot = 1.74396570048553 | epot = -11.2190294597244 | etot = -8.3746230277819 +820000 ekin = 1.14169134058264 | erot = 1.69367065616339 | epot = -11.209985024664 | etot = -8.37462302791799 +821000 ekin = 1.1887755211563 | erot = 1.66758281677124 | epot = -11.2309813661147 | etot = -8.37462302818712 +822000 ekin = 1.2392739420278 | erot = 1.66378494635131 | epot = -11.2776819169559 | etot = -8.37462302857678 +823000 ekin = 1.29027861043584 | erot = 1.67905219550485 | epot = -11.3439538348895 | etot = -8.37462302894885 +824000 ekin = 1.33894050069248 | erot = 1.70948347746399 | epot = -11.4230470076203 | etot = -8.37462302946383 +825000 ekin = 1.38220508273142 | erot = 1.75044253330681 | epot = -11.5072706460139 | etot = -8.37462302997571 +826000 ekin = 1.41710294910242 | erot = 1.79708475166815 | epot = -11.5888107311813 | etot = -8.37462303041076 +827000 ekin = 1.44127249564998 | erot = 1.84518129446667 | epot = -11.6610768208149 | etot = -8.37462303069827 +828000 ekin = 1.4533540911642 | erot = 1.89178230950345 | epot = -11.7197594314557 | etot = -8.37462303078804 +829000 ekin = 1.45330184509344 | erot = 1.93565038631292 | epot = -11.7635752620719 | etot = -8.37462303066558 +830000 ekin = 1.44253588753392 | erot = 1.9773267325445 | epot = -11.794485650436 | etot = -8.37462303035756 +831000 ekin = 1.42321719807599 | erot = 2.01836652049872 | epot = -11.8162067486423 | etot = -8.37462303006758 +832000 ekin = 1.39798324787167 | erot = 2.06093497422121 | epot = -11.8335412516767 | etot = -8.37462302958378 +833000 ekin = 1.37122558103646 | erot = 2.10801499212972 | epot = -11.8538636023317 | etot = -8.37462302916548 +834000 ekin = 1.34739157346164 | erot = 2.16168408583633 | epot = -11.8836986881947 | etot = -8.37462302889676 +835000 ekin = 1.3303315913847 | erot = 2.22243990039652 | epot = -11.9273945206118 | etot = -8.37462302883053 +836000 ekin = 1.32279692350135 | erot = 2.28888168436647 | epot = -11.9863016368478 | etot = -8.37462302898003 +837000 ekin = 1.32614569945851 | erot = 2.35776552714792 | epot = -12.0585342559248 | etot = -8.37462302931836 +838000 ekin = 1.3403008431335 | erot = 2.42442328377153 | epot = -12.1393471566855 | etot = -8.37462302978049 +839000 ekin = 1.36395770572615 | erot = 2.48350186340868 | epot = -12.2220825994075 | etot = -8.3746230302727 +840000 ekin = 1.39499323416485 | erot = 2.52993036126728 | epot = -12.2995466261227 | etot = -8.3746230306906 +841000 ekin = 1.4309851952446 | erot = 2.5599379691765 | epot = -12.3655461953669 | etot = -8.37462303094583 +842000 ekin = 1.46971603973797 | erot = 2.57185321601873 | epot = -12.4161922867525 | etot = -8.37462303099583 +843000 ekin = 1.50953312203309 | erot = 2.56639824287622 | epot = -12.4505543957692 | etot = -8.3746230308599 +844000 ekin = 1.54948222757155 | erot = 2.54631968024369 | epot = -12.4704249384284 | etot = -8.37462303061319 +845000 ekin = 1.58921446589176 | erot = 2.51544731879033 | epot = -12.4792848150393 | etot = -8.3746230303572 +846000 ekin = 1.62874660073068 | erot = 2.47751369443259 | epot = -12.4808833253435 | etot = -8.3746230301802 +847000 ekin = 1.66818957254644 | erot = 2.43516936578449 | epot = -12.4779819684573 | etot = -8.37462303012634 +848000 ekin = 1.70754173431239 | erot = 2.38953851005097 | epot = -12.4717032745479 | etot = -8.37462303018459 +849000 ekin = 1.74659403306287 | erot = 2.34043091651518 | epot = -12.4616479798784 | etot = -8.37462303030032 +850000 ekin = 1.784943458661 | erot = 2.28706007038119 | epot = -12.4466265594454 | etot = -8.37462303040326 +851000 ekin = 1.82207688727397 | erot = 2.22891420063638 | epot = -12.4256141183509 | etot = -8.3746230304405 +852000 ekin = 1.85747606626724 | erot = 2.16637383866683 | epot = -12.3984729353335 | etot = -8.37462303039944 +853000 ekin = 1.8907050121563 | erot = 2.10080168939146 | epot = -12.3661297318568 | etot = -8.37462303030907 +854000 ekin = 1.92146598579636 | erot = 2.03409194239022 | epot = -12.3301809584089 | etot = -8.37462303022237 +855000 ekin = 1.94963553788698 | erot = 1.96792069995479 | epot = -12.2921792680294 | etot = -8.37462303018758 +856000 ekin = 1.97530408452552 | erot = 1.9030603456988 | epot = -12.2529874604489 | etot = -8.37462303022458 +857000 ekin = 1.99898235174316 | erot = 1.83954776717268 | epot = -12.2131531489779 | etot = -8.37462303006203 +858000 ekin = 2.02148966893765 | erot = 1.77712472342805 | epot = -12.1732374225859 | etot = -8.3746230302202 +859000 ekin = 2.0433298481464 | erot = 1.71372610059789 | epot = -12.1316789790802 | etot = -8.37462303033591 +860000 ekin = 2.06530510863403 | erot = 1.64761266618196 | epot = -12.0875408051656 | etot = -8.37462303034964 +861000 ekin = 2.0884404752292 | erot = 1.57839130430766 | epot = -12.0414548097738 | etot = -8.37462303023699 +862000 ekin = 2.1137299687717 | erot = 1.50759861505461 | epot = -11.9959516138508 | etot = -8.37462303002449 +863000 ekin = 2.14175193679679 | erot = 1.43866072802211 | epot = -11.955035694609 | etot = -8.37462302979006 +864000 ekin = 2.17225364143903 | erot = 1.37614575517373 | epot = -11.9230224262489 | etot = -8.37462302963615 +865000 ekin = 2.20389689304711 | erot = 1.32450432847425 | epot = -11.9030242511598 | etot = -8.37462302963841 +866000 ekin = 2.23438769160888 | erot = 1.2868132807046 | epot = -11.8958240017868 | etot = -8.37462302947332 +867000 ekin = 2.26151301831202 | erot = 1.26501341500185 | epot = -11.9011494630726 | etot = -8.37462302975869 +868000 ekin = 2.28295312633628 | erot = 1.2587638566978 | epot = -11.9163400130106 | etot = -8.37462302997656 +869000 ekin = 2.29713139087659 | erot = 1.26636363803292 | epot = -11.9381180589563 | etot = -8.37462303004681 +870000 ekin = 2.30388454565862 | erot = 1.28638972776915 | epot = -11.9648973034159 | etot = -8.37462302998818 +871000 ekin = 2.30409365411982 | erot = 1.31787621263386 | epot = -11.9965928971117 | etot = -8.37462303035806 +872000 ekin = 2.2971245530625 | erot = 1.35930276714358 | epot = -12.0310503505621 | etot = -8.374623030356 +873000 ekin = 2.28274539316158 | erot = 1.40846954678764 | epot = -12.0658379700601 | etot = -8.37462303011093 +874000 ekin = 2.26320703627556 | erot = 1.46277950106351 | epot = -12.1006095675627 | etot = -8.37462303022364 +875000 ekin = 2.24001634728649 | erot = 1.51889022328738 | epot = -12.1335296008657 | etot = -8.37462303029184 +876000 ekin = 2.21430830467283 | erot = 1.57348199615675 | epot = -12.1624133311096 | etot = -8.37462303028 +877000 ekin = 2.1877784857404 | erot = 1.62389020161488 | epot = -12.1862917175065 | etot = -8.37462303015121 +878000 ekin = 2.1625289754819 | erot = 1.6683879309108 | epot = -12.2055399364508 | etot = -8.37462303005814 +879000 ekin = 2.1404475372224 | erot = 1.70571411560852 | epot = -12.2207846828268 | etot = -8.37462302999592 +880000 ekin = 2.12277471003043 | erot = 1.73469967121919 | epot = -12.2320974112781 | etot = -8.3746230300285 +881000 ekin = 2.10977467360334 | erot = 1.75399371448932 | epot = -12.2383914182805 | etot = -8.37462303018783 +882000 ekin = 2.10050164322574 | erot = 1.76187019273892 | epot = -12.2369948664133 | etot = -8.37462303044862 +883000 ekin = 2.09290867712842 | erot = 1.75649694685339 | epot = -12.2240286547005 | etot = -8.37462303071871 +884000 ekin = 2.08433703645374 | erot = 1.73671500456543 | epot = -12.1956750719303 | etot = -8.37462303091116 +885000 ekin = 2.07202901572893 | erot = 1.70282592067543 | epot = -12.1494779673638 | etot = -8.37462303095943 +886000 ekin = 2.05378411491612 | erot = 1.65660476471994 | epot = -12.0850119102728 | etot = -8.37462303063678 +887000 ekin = 2.02874297420968 | erot = 1.60297409541394 | epot = -12.0063400996961 | etot = -8.37462303007244 +888000 ekin = 1.99720256583015 | erot = 1.54912086824504 | epot = -11.9209464635359 | etot = -8.37462302946075 +889000 ekin = 1.95913963735646 | erot = 1.50198702369115 | epot = -11.8357496899733 | etot = -8.37462302892571 +890000 ekin = 1.91617614841857 | erot = 1.46746689325793 | epot = -11.7582660702142 | etot = -8.37462302853769 +891000 ekin = 1.87023137415914 | erot = 1.44931992810307 | epot = -11.694174330589 | etot = -8.37462302832678 +892000 ekin = 1.82316218734495 | erot = 1.44889048228693 | epot = -11.6466756979052 | etot = -8.37462302827332 +893000 ekin = 1.77672781685354 | erot = 1.46538080246141 | epot = -11.6167316476455 | etot = -8.37462302833054 +894000 ekin = 1.73267401007763 | erot = 1.49642015526295 | epot = -11.6037171937795 | etot = -8.37462302843888 +895000 ekin = 1.69287615444225 | erot = 1.53876375542746 | epot = -11.6062629384097 | etot = -8.37462302854004 +896000 ekin = 1.65946528810639 | erot = 1.58897281258665 | epot = -11.6230611292894 | etot = -8.37462302859635 +897000 ekin = 1.63484229162876 | erot = 1.6438981268176 | epot = -11.6533634470444 | etot = -8.37462302859803 +898000 ekin = 1.62150447331762 | erot = 1.70104293751666 | epot = -11.6971704394071 | etot = -8.37462302857283 +899000 ekin = 1.62168394145959 | erot = 1.75850368946139 | epot = -11.754810659493 | etot = -8.37462302857204 +900000 ekin = 1.63689346403945 | erot = 1.81470313448007 | epot = -11.8262196271643 | etot = -8.37462302864476 +901000 ekin = 1.66753387742408 | erot = 1.86808611524248 | epot = -11.9102430214849 | etot = -8.37462302881832 +902000 ekin = 1.71269692237813 | erot = 1.91693084842045 | epot = -12.004250799887 | etot = -8.37462302908846 +903000 ekin = 1.77021838507979 | erot = 1.95934050990446 | epot = -12.1041819244131 | etot = -8.3746230294289 +904000 ekin = 1.83694819296289 | erot = 1.99341312084154 | epot = -12.2049843435883 | etot = -8.37462302978385 +905000 ekin = 1.9091464165372 | erot = 2.01754527647649 | epot = -12.3013147231267 | etot = -8.37462303011296 +906000 ekin = 1.98289589688102 | erot = 2.03065122058477 | epot = -12.3881701478513 | etot = -8.37462303038555 +907000 ekin = 2.05443877923773 | erot = 2.03228127523297 | epot = -12.4613430850611 | etot = -8.37462303059044 +908000 ekin = 2.12038320005751 | erot = 2.02259637574793 | epot = -12.517602606539 | etot = -8.37462303073359 +909000 ekin = 2.17777472065268 | erot = 2.0022386877673 | epot = -12.5546364392491 | etot = -8.37462303082911 +910000 ekin = 2.224072313876 | erot = 1.97218459089613 | epot = -12.5708799356598 | etot = -8.37462303088767 +911000 ekin = 2.25709881230455 | erot = 1.93367043925146 | epot = -12.565392282463 | etot = -8.37462303090695 +912000 ekin = 2.27504055965601 | erot = 1.88824345124061 | epot = -12.5379070417664 | etot = -8.37462303086978 +913000 ekin = 2.27654326616559 | erot = 1.83792322947571 | epot = -12.4890895263916 | etot = -8.37462303075026 +914000 ekin = 2.26395838707148 | erot = 1.78540897804183 | epot = -12.4239903947887 | etot = -8.37462302967534 +915000 ekin = 2.24045468912107 | erot = 1.73372810068477 | epot = -12.3488058193239 | etot = -8.37462302951804 +916000 ekin = 2.2052037020211 | erot = 1.68615105196725 | epot = -12.2659777833015 | etot = -8.37462302931314 +917000 ekin = 2.15800582906313 | erot = 1.64606783756059 | epot = -12.1786966957282 | etot = -8.37462302910446 +918000 ekin = 2.09921834411482 | erot = 1.61647797759965 | epot = -12.0903193506455 | etot = -8.37462302893102 +919000 ekin = 2.02966476142753 | erot = 1.59954949779934 | epot = -12.003837288032 | etot = -8.37462302880514 +920000 ekin = 1.95065755949545 | erot = 1.59642144855526 | epot = -11.9217020368486 | etot = -8.3746230287979 +921000 ekin = 1.8636620065119 | erot = 1.60750866079873 | epot = -11.8457936959436 | etot = -8.37462302863302 +922000 ekin = 1.77152243885553 | erot = 1.6326358742145 | epot = -11.7787813414979 | etot = -8.37462302842789 +923000 ekin = 1.67869484033335 | erot = 1.67111175334568 | epot = -11.7244296218677 | etot = -8.37462302818867 +924000 ekin = 1.59024537021618 | erot = 1.72202288864633 | epot = -11.6868912868269 | etot = -8.37462302796443 +925000 ekin = 1.51123937037396 | erot = 1.78411652411014 | epot = -11.66997892231 | etot = -8.37462302782593 +926000 ekin = 1.44599317765102 | erot = 1.85554834407384 | epot = -11.6761645495492 | etot = -8.37462302782433 +927000 ekin = 1.3975255860158 | erot = 1.93370661235733 | epot = -11.7058552263351 | etot = -8.37462302796194 +928000 ekin = 1.36763823809981 | erot = 2.01538770681073 | epot = -11.757648972801 | etot = -8.37462302789043 +929000 ekin = 1.36100399984301 | erot = 2.09737818238472 | epot = -11.8330052106942 | etot = -8.37462302846646 +930000 ekin = 1.35523134970657 | erot = 2.17722433884007 | epot = -11.9070787109349 | etot = -8.37462302238826 +931000 ekin = 1.39431469299154 | erot = 2.25435620438549 | epot = -12.0232939189505 | etot = -8.3746230215735 +932000 ekin = 1.49280866704974 | erot = 2.3184793019413 | epot = -12.1859109889649 | etot = -8.37462301997383 +933000 ekin = 1.58533340946677 | erot = 2.3649000005838 | epot = -12.3248564302756 | etot = -8.37462302022508 +934000 ekin = 1.68690712098785 | erot = 2.39298221169113 | epot = -12.454512355317 | etot = -8.37462302263803 +935000 ekin = 1.78473836463815 | erot = 2.39676204061141 | epot = -12.5561234284576 | etot = -8.37462302320806 +936000 ekin = 1.86987725386781 | erot = 2.37258693733634 | epot = -12.6170872147135 | etot = -8.37462302350935 +937000 ekin = 1.937204526385 | erot = 2.32043568374788 | epot = -12.6322632336416 | etot = -8.37462302350868 +938000 ekin = 1.98385208909957 | erot = 2.24266190733964 | epot = -12.601137019664 | etot = -8.37462302322478 +939000 ekin = 2.00910923706028 | erot = 2.14379034932744 | epot = -12.5275226091205 | etot = -8.37462302273282 +940000 ekin = 2.01395507290237 | erot = 2.02993348653878 | epot = -12.418511581536 | etot = -8.37462302209487 +941000 ekin = 2.00103743452198 | erot = 1.90808629517571 | epot = -12.2837467510763 | etot = -8.37462302137856 +942000 ekin = 1.97419824310806 | erot = 1.78546116622394 | epot = -12.1342824299748 | etot = -8.37462302064285 +943000 ekin = 1.93808318009578 | erot = 1.66892069893601 | epot = -11.9816268989658 | etot = -8.374623019934 +944000 ekin = 1.89777663358767 | erot = 1.56456198515281 | epot = -11.8369616380301 | etot = -8.37462301928966 +945000 ekin = 1.85843605736174 | erot = 1.4774221417758 | epot = -11.710481217882 | etot = -8.37462301874449 +946000 ekin = 1.82491092897083 | erot = 1.4112458813209 | epot = -11.6107798286275 | etot = -8.37462301833582 +947000 ekin = 1.80134221883796 | erot = 1.36826076777356 | epot = -11.544226004715 | etot = -8.37462301810345 +948000 ekin = 1.79076227753707 | erot = 1.34894522657524 | epot = -11.5143305221957 | etot = -8.3746230180834 +949000 ekin = 1.79475359820372 | erot = 1.35184135985125 | epot = -11.5212179763474 | etot = -8.37462301829246 +950000 ekin = 1.8132620204913 | erot = 1.37352812801278 | epot = -11.561413167216 | etot = -8.37462301871191 +951000 ekin = 1.84466122228562 | erot = 1.40888082073478 | epot = -11.6281650623007 | etot = -8.37462301928027 +952000 ekin = 1.88610598517568 | erot = 1.4516699630585 | epot = -11.7123989681361 | etot = -8.37462301990191 +953000 ekin = 1.93415626208246 | erot = 1.49545802208011 | epot = -11.8042373044917 | etot = -8.37462302032914 +954000 ekin = 1.98570845874446 | erot = 1.53486140750064 | epot = -11.8951928870162 | etot = -8.37462302077108 +955000 ekin = 2.03763688299778 | erot = 1.56575119866885 | epot = -11.9780111026948 | etot = -8.37462302102819 +956000 ekin = 2.08752516850072 | erot = 1.5857642599195 | epot = -12.0479124495162 | etot = -8.37462302109594 +957000 ekin = 2.13388693710405 | erot = 1.59443657078815 | epot = -12.1029465288985 | etot = -8.3746230210063 +958000 ekin = 2.1760313487577 | erot = 1.59291217741278 | epot = -12.1435665469837 | etot = -8.37462302081326 +959000 ekin = 2.21381255039136 | erot = 1.58343493106434 | epot = -12.1718705020318 | etot = -8.37462302057609 +960000 ekin = 2.24735101957822 | erot = 1.56876603527177 | epot = -12.1907400751985 | etot = -8.37462302034849 +961000 ekin = 2.27678636585073 | erot = 1.55164507323466 | epot = -12.2030544592556 | etot = -8.37462302017018 +962000 ekin = 2.3020881327992 | erot = 1.53436606871683 | epot = -12.2110772215842 | etot = -8.37462302006822 +963000 ekin = 2.32292955590092 | erot = 1.51849868398314 | epot = -12.2160512599392 | etot = -8.37462302005519 +964000 ekin = 2.33862421267352 | erot = 1.50476151876502 | epot = -12.2180087515682 | etot = -8.37462302012963 +965000 ekin = 2.34813222213387 | erot = 1.49304783092225 | epot = -12.2158030733308 | etot = -8.37462302027465 +966000 ekin = 2.35015122853473 | erot = 1.48260237418268 | epot = -12.2073766231751 | etot = -8.37462302045767 +967000 ekin = 2.34330726066535 | erot = 1.47233774696567 | epot = -12.1902680282632 | etot = -8.37462302063221 +968000 ekin = 2.32644504715905 | erot = 1.461252126306 | epot = -12.1623201942097 | etot = -8.37462302074463 +969000 ekin = 2.29898771920217 | erot = 1.44887277461907 | epot = -12.1224835145665 | etot = -8.37462302074525 +970000 ekin = 2.26130276214763 | erot = 1.43562016619329 | epot = -12.0715459489416 | etot = -8.3746230206007 +971000 ekin = 2.21499063336692 | erot = 1.42298879008823 | epot = -12.0126024437593 | etot = -8.3746230203042 +972000 ekin = 2.1630375745204 | erot = 1.41348472406784 | epot = -11.9511453183741 | etot = -8.37462301978584 +973000 ekin = 2.10950969273614 | erot = 1.41039391551626 | epot = -11.8945266278621 | etot = -8.37462301960967 +974000 ekin = 2.05703199419682 | erot = 1.41732503873327 | epot = -11.8489800520898 | etot = -8.37462301915975 +975000 ekin = 2.01010390574629 | erot = 1.43732066922395 | epot = -11.8220475937266 | etot = -8.37462301875631 +976000 ekin = 1.97340114977227 | erot = 1.47261385396416 | epot = -11.8206380222158 | etot = -8.37462301847941 +977000 ekin = 1.95082006444186 | erot = 1.52416835984572 | epot = -11.8496114426898 | etot = -8.37462301840224 +978000 ekin = 1.94472832270481 | erot = 1.59131019459445 | epot = -11.9106615358762 | etot = -8.37462301857695 +979000 ekin = 1.95538713570929 | erot = 1.67153495870638 | epot = -12.001545113434 | etot = -8.37462301901835 +980000 ekin = 1.98067723864866 | erot = 1.76051368575627 | epot = -12.1158139441912 | etot = -8.37462301978627 +981000 ekin = 2.01579571924553 | erot = 1.8520731953935 | epot = -12.2424919352903 | etot = -8.3746230206513 +982000 ekin = 2.05441082039146 | erot = 1.93952253756075 | epot = -12.3685563794549 | etot = -8.37462302150272 +983000 ekin = 2.08992138437964 | erot = 2.01671280308445 | epot = -12.4812572096481 | etot = -8.37462302218396 +984000 ekin = 2.11656909820778 | erot = 2.07910696967455 | epot = -12.5702990904592 | etot = -8.37462302257686 +985000 ekin = 2.13033501102014 | erot = 2.12464764346939 | epot = -12.6296056771267 | etot = -8.37462302263717 +986000 ekin = 2.12935596248208 | erot = 2.15403431725397 | epot = -12.6580133021399 | etot = -8.37462302240383 +987000 ekin = 2.11471923987423 | erot = 2.17104098415212 | epot = -12.6603832459131 | etot = -8.37462302188679 +988000 ekin = 2.09119735101019 | erot = 2.18228698931101 | epot = -12.6481073619503 | etot = -8.37462302162911 +989000 ekin = 2.06027968800895 | erot = 2.19075462083094 | epot = -12.6256573302391 | etot = -8.37462302139926 +990000 ekin = 2.02336255788368 | erot = 2.19843813688216 | epot = -12.5964237160071 | etot = -8.37462302124126 +991000 ekin = 1.98188077466274 | erot = 2.20638055719865 | epot = -12.5628843530195 | etot = -8.37462302115811 +992000 ekin = 1.93715749695425 | erot = 2.2147306976715 | epot = -12.5265112157503 | etot = -8.37462302112455 +993000 ekin = 1.89038311211131 | erot = 2.22307759878 | epot = -12.4880837319992 | etot = -8.37462302110785 +994000 ekin = 1.84266575140958 | erot = 2.23084817707666 | epot = -12.4481369495687 | etot = -8.37462302108249 +995000 ekin = 1.79502825849212 | erot = 2.23761065996978 | epot = -12.4072619394857 | etot = -8.37462302102385 +996000 ekin = 1.7486582035598 | erot = 2.2432323108615 | epot = -12.3665135353639 | etot = -8.37462302094261 +997000 ekin = 1.70508150016875 | erot = 2.24765365390294 | epot = -12.3273581749317 | etot = -8.37462302086002 +998000 ekin = 1.66588125244006 | erot = 2.25078611336184 | epot = -12.2912903865806 | etot = -8.37462302077868 +999000 ekin = 1.63259998370232 | erot = 2.25262768592883 | epot = -12.2598506903069 | etot = -8.37462302067575 +1000000 ekin = 1.60661879877941 | erot = 2.25373528619357 | epot = -12.234977105535 | etot = -8.37462302056203 + 1000000 0.1190088 -1.3493654 0.12586767 -1.0628358 0.00017426596 64000 +Loop time of 17.2417 on 1 procs for 1000000 steps with 10 atoms + +Performance: 50110.943 tau/day, 57998.777 timesteps/s +99.7% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 14.6 | 14.6 | 14.6 | 0.0 | 84.68 +Bond | 0.60678 | 0.60678 | 0.60678 | 0.0 | 3.52 +Neigh | 0.008055 | 0.008055 | 0.008055 | 0.0 | 0.05 +Comm | 0.18502 | 0.18502 | 0.18502 | 0.0 | 1.07 +Output | 0.09453 | 0.09453 | 0.09453 | 0.0 | 0.55 +Modify | 1.4778 | 1.4778 | 1.4778 | 0.0 | 8.57 +Other | | 0.2693 | | | 1.56 + +Nlocal: 10.0000 ave 10 max 10 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 37.0000 ave 37 max 37 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 37 +Ave neighs/atom = 3.7000000 +Ave special neighs/atom = 3.6000000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.1.* nocoeff +System init for write_data ... +Total wall time: 0:00:17 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 new file mode 100644 index 0000000000..e787299257 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 @@ -0,0 +1,1181 @@ +LAMMPS (27 May 2021) +variable number equal 1 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex1 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 10 atoms + reading velocities ... + 10 velocities + scanning bonds ... + 2 = max bonds/atom + 10 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 8 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +set atom * mass 3.1575 +Setting atom values ... + 10 settings made for mass + +group all type 1 4 +10 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA2 pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.1.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 1.10853632272819 | erot = 2.81573649976629 | epot = -12.298895791142 | etot = -8.37462296864754 +Per MPI rank memory allocation (min/avg/max) = 9.444 | 9.445 | 9.446 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.082113802 -1.3370157 0.10712616 -1.1190359 -6.6192825e-05 64000 +1000 ekin = 1.07640077431763 | erot = 2.90684392233818 | epot = -12.357867665527 | etot = -8.37462296887121 +2000 ekin = 1.05363107794411 | erot = 2.99414178935848 | epot = -12.4223958364623 | etot = -8.37462296915967 +3000 ekin = 1.04083382823095 | erot = 3.07274362339768 | epot = -12.48820042109 | etot = -8.37462296946132 +4000 ekin = 1.03780093165925 | erot = 3.13815143503908 | epot = -12.550575336422 | etot = -8.37462296972371 +5000 ekin = 1.04371581655901 | erot = 3.18681185449848 | epot = -12.6051506409707 | etot = -8.37462296991322 +6000 ekin = 1.05738085799297 | erot = 3.21642353087471 | epot = -12.6484273588875 | etot = -8.37462297001986 +7000 ekin = 1.07739394884044 | erot = 3.22597832036687 | epot = -12.677995239256 | etot = -8.37462297004864 +8000 ekin = 1.10226637472089 | erot = 3.21563966301723 | epot = -12.6925290077504 | etot = -8.37462297001232 +9000 ekin = 1.13051291055329 | erot = 3.18656247631356 | epot = -12.6916983567815 | etot = -8.37462296991465 +10000 ekin = 1.16073704358066 | erot = 3.14076972913363 | epot = -12.6761297424775 | etot = -8.37462296976318 +11000 ekin = 1.19170449380508 | erot = 3.08098965164643 | epot = -12.6473171150236 | etot = -8.37462296957209 +12000 ekin = 1.22238189802732 | erot = 3.01040253468258 | epot = -12.6074074020775 | etot = -8.37462296936758 +13000 ekin = 1.2519269188149 | erot = 2.93230261872817 | epot = -12.5588525067181 | etot = -8.374622969175 +14000 ekin = 1.2796385761876 | erot = 2.84975156813376 | epot = -12.5040131133431 | etot = -8.37462296902175 +15000 ekin = 1.30489368750126 | erot = 2.76534813925011 | epot = -12.444864795638 | etot = -8.37462296888665 +16000 ekin = 1.32709913751465 | erot = 2.68118184785529 | epot = -12.3829039541517 | etot = -8.37462296878176 +17000 ekin = 1.34568132349847 | erot = 2.59861285690791 | epot = -12.3189171492215 | etot = -8.37462296881507 +18000 ekin = 1.36011712604128 | erot = 2.51802979978581 | epot = -12.2527698947085 | etot = -8.37462296888145 +19000 ekin = 1.37000559015644 | erot = 2.43889875259722 | epot = -12.1835273117078 | etot = -8.37462296895412 +20000 ekin = 1.37516683465218 | erot = 2.36049590954917 | epot = -12.1102857132061 | etot = -8.37462296900474 +21000 ekin = 1.37575335509461 | erot = 2.28221618930098 | epot = -12.0325925134033 | etot = -8.37462296900774 +22000 ekin = 1.37235802310953 | erot = 2.20383846967477 | epot = -11.9508194617284 | etot = -8.37462296894413 +23000 ekin = 1.36610326249354 | erot = 2.12570839352806 | epot = -11.8664346248252 | etot = -8.37462296880362 +24000 ekin = 1.35869525710696 | erot = 2.04881568638623 | epot = -11.7821339120794 | etot = -8.37462296858617 +25000 ekin = 1.352422551256 | erot = 1.97475968439783 | epot = -11.7018052039588 | etot = -8.37462296830496 +26000 ekin = 1.35007012440096 | erot = 1.90560954362746 | epot = -11.6303026360113 | etot = -8.3746229679829 +27000 ekin = 1.35474332970467 | erot = 1.843676291157 | epot = -11.5730425885209 | etot = -8.37462296765923 +28000 ekin = 1.36954369410754 | erot = 1.79121252282617 | epot = -11.5353791843193 | etot = -8.37462296738555 +29000 ekin = 1.39711560919902 | erot = 1.7500600904406 | epot = -11.5217986668611 | etot = -8.3746229672215 +30000 ekin = 1.43911092491007 | erot = 1.72127833748019 | epot = -11.5350122296154 | etot = -8.37462296722519 +31000 ekin = 1.49567630461196 | erot = 1.70480588615781 | epot = -11.5751051582054 | etot = -8.37462296743563 +32000 ekin = 1.56511285114185 | erot = 1.69923538983356 | epot = -11.6389712088326 | etot = -8.37462296785714 +33000 ekin = 1.64385110263248 | erot = 1.70198396265069 | epot = -11.7204580336836 | etot = -8.37462296840039 +34000 ekin = 1.72681002365036 | erot = 1.70946314344895 | epot = -11.8108961361852 | etot = -8.37462296908591 +35000 ekin = 1.80812188596384 | erot = 1.71712980816862 | epot = -11.8998746638723 | etot = -8.37462296973981 +36000 ekin = 1.88201893971561 | erot = 1.72067857993903 | epot = -11.9773204899105 | etot = -8.37462297025589 +37000 ekin = 1.94364733336837 | erot = 1.71680208569965 | epot = -12.0350723896308 | etot = -8.37462297056282 +38000 ekin = 1.98961498615656 | erot = 1.70370907929485 | epot = -12.0679470360927 | etot = -8.37462297064129 +39000 ekin = 2.01818359901114 | erot = 1.68126711282216 | epot = -12.0740736823535 | etot = -8.37462297052021 +40000 ekin = 2.02914332282583 | erot = 1.65077260628054 | epot = -12.0545388993641 | etot = -8.37462297025776 +41000 ekin = 2.0234910301812 | erot = 1.61448262351109 | epot = -12.012596623611 | etot = -8.37462296991876 +42000 ekin = 2.0030441255453 | erot = 1.57509121259574 | epot = -11.952758307699 | etot = -8.374622969558 +43000 ekin = 1.97008148028974 | erot = 1.53529510620986 | epot = -11.8799995557139 | etot = -8.37462296921426 +44000 ekin = 1.92705109571088 | erot = 1.49750726070826 | epot = -11.7991813253591 | etot = -8.37462296893995 +45000 ekin = 1.87634986385877 | erot = 1.46354390598901 | epot = -11.7145167385331 | etot = -8.37462296868532 +46000 ekin = 1.82016797429764 | erot = 1.43491031451216 | epot = -11.6297012572908 | etot = -8.37462296848104 +47000 ekin = 1.76039182009025 | erot = 1.41286016406996 | epot = -11.5478749524838 | etot = -8.37462296832359 +48000 ekin = 1.6985694927478 | erot = 1.39838217522419 | epot = -11.4715746361764 | etot = -8.37462296820438 +49000 ekin = 1.6359395498875 | erot = 1.39228918140571 | epot = -11.4028516994045 | etot = -8.37462296811134 +50000 ekin = 1.57351801537301 | erot = 1.39530041169486 | epot = -11.3434413950978 | etot = -8.37462296802991 +51000 ekin = 1.5122287247636 | erot = 1.40810650340932 | epot = -11.2949581961197 | etot = -8.37462296794678 +52000 ekin = 1.45305245526499 | erot = 1.43140550730915 | epot = -11.2590809304253 | etot = -8.37462296785115 +53000 ekin = 1.39716366086928 | erot = 1.4658956749352 | epot = -11.2376823035408 | etot = -8.37462296773631 +54000 ekin = 1.34602153837057 | erot = 1.51222067984174 | epot = -11.2328651858294 | etot = -8.37462296761708 +55000 ekin = 1.30138436197342 | erot = 1.57077970891803 | epot = -11.2467870384003 | etot = -8.37462296750883 +56000 ekin = 1.26522647192243 | erot = 1.64151101613064 | epot = -11.2813604554936 | etot = -8.37462296744053 +57000 ekin = 1.23956119808448 | erot = 1.72363092633018 | epot = -11.3378150918588 | etot = -8.37462296744415 +58000 ekin = 1.22620283906737 | erot = 1.81539828229221 | epot = -11.4162240889029 | etot = -8.37462296754335 +59000 ekin = 1.22652758768659 | erot = 1.91400381193531 | epot = -11.5151543673672 | etot = -8.37462296774531 +60000 ekin = 1.24129579501624 | erot = 2.01564970996725 | epot = -11.631568473021 | etot = -8.37462296803753 +61000 ekin = 1.27057003505322 | erot = 2.11581304358654 | epot = -11.7610060470471 | etot = -8.37462296840734 +62000 ekin = 1.31372115356093 | erot = 2.20955642503234 | epot = -11.8979005473869 | etot = -8.37462296879364 +63000 ekin = 1.36947667734261 | erot = 2.29224896410223 | epot = -12.0363486106152 | etot = -8.37462296917037 +64000 ekin = 1.43596184816366 | erot = 2.35998108781798 | epot = -12.1705659055151 | etot = -8.37462296953341 +65000 ekin = 1.5108757081497 | erot = 2.40947275989089 | epot = -12.2949714378729 | etot = -8.37462296983232 +66000 ekin = 1.59162978656335 | erot = 2.43872351537734 | epot = -12.4049762719859 | etot = -8.37462297004526 +67000 ekin = 1.6754634907457 | erot = 2.44726186999258 | epot = -12.4973483309005 | etot = -8.37462297016219 +68000 ekin = 1.75953613825201 | erot = 2.43621057967602 | epot = -12.5703696881156 | etot = -8.37462297018758 +69000 ekin = 1.84098201456563 | erot = 2.40815676459652 | epot = -12.6237617493037 | etot = -8.37462297014155 +70000 ekin = 1.91692810522248 | erot = 2.36682660300844 | epot = -12.6583776782867 | etot = -8.3746229700558 +71000 ekin = 1.98449380473018 | erot = 2.31661131420501 | epot = -12.6757280888525 | etot = -8.37462296991727 +72000 ekin = 2.0408128719349 | erot = 2.26215174487685 | epot = -12.6775875867425 | etot = -8.3746229699307 +73000 ekin = 2.08263291328337 | erot = 2.20743363864194 | epot = -12.6646895218716 | etot = -8.37462296994629 +74000 ekin = 2.10698584150827 | erot = 2.15544421118373 | epot = -12.6370530226944 | etot = -8.37462297000235 +75000 ekin = 2.11136525908713 | erot = 2.10816940675065 | epot = -12.5941576359035 | etot = -8.37462297006568 +76000 ekin = 2.09405873141398 | erot = 2.06669472630762 | epot = -12.535376427811 | etot = -8.37462297008944 +77000 ekin = 2.05455135347909 | erot = 2.0314793357564 | epot = -12.4606536592623 | etot = -8.37462297002681 +78000 ekin = 1.99386684227704 | erot = 2.00268171013297 | epot = -12.3711715222582 | etot = -8.37462296984821 +79000 ekin = 1.91474155283402 | erot = 1.98040758803635 | epot = -12.2697721104228 | etot = -8.37462296955245 +80000 ekin = 1.82155513477586 | erot = 1.96479734780205 | epot = -12.1609754517454 | etot = -8.37462296916753 +81000 ekin = 1.71999782481706 | erot = 1.95595086125324 | epot = -12.0505716548133 | etot = -8.37462296874304 +82000 ekin = 1.61651478139511 | erot = 1.95375810375241 | epot = -11.9448958534855 | etot = -8.37462296833793 +83000 ekin = 1.5176113475009 | erot = 1.9577277486061 | epot = -11.8499620641158 | etot = -8.37462296800878 +84000 ekin = 1.42912416355173 | erot = 1.96688313409173 | epot = -11.770630265442 | etot = -8.37462296779853 +85000 ekin = 1.355568955554 | erot = 1.97976517498656 | epot = -11.7099570982739 | etot = -8.37462296773334 +86000 ekin = 1.29966988136846 | erot = 1.99452593271672 | epot = -11.6688187819006 | etot = -8.37462296781538 +87000 ekin = 1.26213747948961 | erot = 2.00910214170761 | epot = -11.6458625892975 | etot = -8.37462296810029 +88000 ekin = 1.24134500163863 | erot = 2.02122064243446 | epot = -11.6371886124843 | etot = -8.3746229684112 +89000 ekin = 1.2342164494761 | erot = 2.02900530500575 | epot = -11.6378447232194 | etot = -8.37462296873752 +90000 ekin = 1.23690604243565 | erot = 2.03136372571823 | epot = -11.6428927371713 | etot = -8.37462296901745 +91000 ekin = 1.24531053049741 | erot = 2.02816188261827 | epot = -11.6480953823211 | etot = -8.37462296920539 +92000 ekin = 1.25564394227053 | erot = 2.02032873397318 | epot = -11.6505956455252 | etot = -8.37462296928144 +93000 ekin = 1.26484018817411 | erot = 2.00975004471074 | epot = -11.6492132021395 | etot = -8.37462296925471 +94000 ekin = 1.27076152680826 | erot = 1.99896253062535 | epot = -11.64434702658 | etot = -8.37462296914645 +95000 ekin = 1.27224696211167 | erot = 1.9907688927132 | epot = -11.637638823818 | etot = -8.37462296899316 +96000 ekin = 1.26905385172906 | erot = 1.98776908505786 | epot = -11.6314459056159 | etot = -8.374622968829 +97000 ekin = 1.26173398384339 | erot = 1.99196117307471 | epot = -11.6283181256016 | etot = -8.37462296868348 +98000 ekin = 1.25146122958138 | erot = 2.00445279488987 | epot = -11.6305369930525 | etot = -8.37462296858129 +99000 ekin = 1.23981039935407 | erot = 2.02529911459859 | epot = -11.6397324824948 | etot = -8.3746229685421 +100000 ekin = 1.22848889431686 | erot = 2.05346079777931 | epot = -11.6565726606774 | etot = -8.37462296858124 +101000 ekin = 1.21904296342428 | erot = 2.08686922543158 | epot = -11.6805351575621 | etot = -8.37462296870625 +102000 ekin = 1.21258708443144 | erot = 2.12259257652692 | epot = -11.709802629871 | etot = -8.37462296891261 +103000 ekin = 1.2096213812761 | erot = 2.15710417867581 | epot = -11.7413485291304 | etot = -8.37462296917851 +104000 ekin = 1.20999435064748 | erot = 2.18665201736524 | epot = -11.7712693374783 | etot = -8.37462296946559 +105000 ekin = 1.21303379771945 | erot = 2.20771017012383 | epot = -11.7953669375664 | etot = -8.37462296972313 +106000 ekin = 1.21781939160535 | erot = 2.21746426398215 | epot = -11.8099066254851 | etot = -8.37462296989764 +107000 ekin = 1.22352668485505 | erot = 2.21425769941215 | epot = -11.8124073542124 | etot = -8.37462296994524 +108000 ekin = 1.22975371616698 | erot = 2.19791821277325 | epot = -11.8022948987809 | etot = -8.37462296984067 +109000 ekin = 1.23675326669525 | erot = 2.16990174522994 | epot = -11.7812779815079 | etot = -8.37462296958276 +110000 ekin = 1.24552660594288 | erot = 2.13322593016593 | epot = -11.7533755053019 | etot = -8.37462296919314 +111000 ekin = 1.2577699492817 | erot = 2.09220325002883 | epot = -11.7245961680233 | etot = -8.37462296871273 +112000 ekin = 1.27568807280454 | erot = 2.0520095134221 | epot = -11.7023205544236 | etot = -8.37462296819701 +113000 ekin = 1.30169744977547 | erot = 2.01813224570276 | epot = -11.6944526631895 | etot = -8.37462296771131 +114000 ekin = 1.3380425185894 | erot = 1.99574344242898 | epot = -11.708408928345 | etot = -8.37462296732664 +115000 ekin = 1.38647431929533 | erot = 1.9890358144779 | epot = -11.7501331008335 | etot = -8.3746229670603 +116000 ekin = 1.44876446583391 | erot = 2.00047074173031 | epot = -11.8238581746951 | etot = -8.37462296713089 +117000 ekin = 1.52378581535556 | erot = 2.03044339408199 | epot = -11.928852176889 | etot = -8.37462296745148 +118000 ekin = 1.60840594184184 | erot = 2.07707436259007 | epot = -12.0601032724458 | etot = -8.37462296801391 +119000 ekin = 1.69804077960487 | erot = 2.13624566567617 | epot = -12.2089094140534 | etot = -8.37462296877235 +120000 ekin = 1.78696647862279 | erot = 2.20199105617477 | epot = -12.3635805044446 | etot = -8.37462296964704 +121000 ekin = 1.86883508536304 | erot = 2.26718837407833 | epot = -12.5106464299772 | etot = -8.3746229705358 +122000 ekin = 1.93731263285346 | erot = 2.3244608703495 | epot = -12.6363964745344 | etot = -8.37462297133144 +123000 ekin = 1.98673587945774 | erot = 2.36714489985499 | epot = -12.7285037512514 | etot = -8.37462297193864 +124000 ekin = 2.01268857483472 | erot = 2.39015976226559 | epot = -12.7774713093897 | etot = -8.37462297228942 +125000 ekin = 2.01242153120607 | erot = 2.39062925356786 | epot = -12.7776737571266 | etot = -8.37462297235268 +126000 ekin = 1.98507290328065 | erot = 2.36815351492862 | epot = -12.7278493903457 | etot = -8.37462297213648 +127000 ekin = 1.93167931643402 | erot = 2.32470375634598 | epot = -12.6310060444627 | etot = -8.3746229716827 +128000 ekin = 1.8550007691687 | erot = 2.26419178968032 | epot = -12.4938155299045 | etot = -8.37462297105549 +129000 ekin = 1.75920795598131 | erot = 2.19182812292597 | epot = -12.3256590492356 | etot = -8.37462297032836 +130000 ekin = 1.64949415840181 | erot = 2.11340935726336 | epot = -12.1375264852356 | etot = -8.37462296957046 +131000 ekin = 1.53167143066913 | erot = 2.03466319553997 | epot = -11.9409575950483 | etot = -8.3746229688392 +132000 ekin = 1.41179399813977 | erot = 1.96073697301923 | epot = -11.7471539393354 | etot = -8.37462296817641 +133000 ekin = 1.29582771791042 | erot = 1.89586175533303 | epot = -11.5663124408536 | etot = -8.37462296761014 +134000 ekin = 1.18933366770487 | erot = 1.84313053331017 | epot = -11.4070871682765 | etot = -8.37462296726146 +135000 ekin = 1.09698845763052 | erot = 1.80418246558945 | epot = -11.2757938901605 | etot = -8.37462296694051 +136000 ekin = 1.02270904454081 | erot = 1.77989195852201 | epot = -11.1772239698142 | etot = -8.37462296675135 +137000 ekin = 0.969402888595107 | erot = 1.77022137974247 | epot = -11.1142472350355 | etot = -8.37462296669788 +138000 ekin = 0.938766242876396 | erot = 1.77423425797198 | epot = -11.0876234676258 | etot = -8.37462296677741 +139000 ekin = 0.931209536918622 | erot = 1.79022284403572 | epot = -11.0960553479303 | etot = -8.374622966976 +140000 ekin = 0.945902360873774 | erot = 1.81588277986729 | epot = -11.1364081080077 | etot = -8.37462296726662 +141000 ekin = 0.980951010695175 | erot = 1.8485455285403 | epot = -11.204119506847 | etot = -8.37462296761153 +142000 ekin = 1.03368854660433 | erot = 1.88546172258917 | epot = -11.2937732371602 | etot = -8.37462296796669 +143000 ekin = 1.10102464558806 | erot = 1.92410215903287 | epot = -11.3997497729132 | etot = -8.37462296829229 +144000 ekin = 1.17978371180479 | erot = 1.96241851789346 | epot = -11.5168251982596 | etot = -8.37462296856134 +145000 ekin = 1.26696389973282 | erot = 1.99907135517271 | epot = -11.6406582236463 | etot = -8.37462296874076 +146000 ekin = 1.35987698631737 | erot = 2.03338468070426 | epot = -11.7678846359152 | etot = -8.37462296889355 +147000 ekin = 1.45616095202992 | erot = 2.06502561999169 | epot = -11.8958095410393 | etot = -8.37462296901766 +148000 ekin = 1.55369685491102 | erot = 2.09388144715349 | epot = -12.0222012712078 | etot = -8.37462296914327 +149000 ekin = 1.65047924324446 | erot = 2.119766716203 | epot = -12.1448689287441 | etot = -8.3746229692966 +150000 ekin = 1.7444879162985 | erot = 2.14217867903534 | epot = -12.2612895648265 | etot = -8.3746229694927 +151000 ekin = 1.83359650490146 | erot = 2.16016451670422 | epot = -12.3683839913409 | etot = -8.37462296973527 +152000 ekin = 1.91553611044662 | erot = 2.17231614291454 | epot = -12.4624752233743 | etot = -8.3746229700131 +153000 ekin = 1.98791755611535 | erot = 2.176897167127 | epot = -12.5394376935491 | etot = -8.37462297030674 +154000 ekin = 2.04830722999038 | erot = 2.17205709329779 | epot = -12.5949872938791 | etot = -8.37462297059092 +155000 ekin = 2.0943477814066 | erot = 2.1560836321465 | epot = -12.6250543843915 | etot = -8.37462297083838 +156000 ekin = 2.12391577783684 | erot = 2.12765251039836 | epot = -12.6261912592573 | etot = -8.37462297102206 +157000 ekin = 2.13531004697523 | erot = 2.08604574913212 | epot = -12.5959787672234 | etot = -8.37462297111609 +158000 ekin = 2.12746223168569 | erot = 2.0313282063183 | epot = -12.5334134091002 | etot = -8.37462297109625 +159000 ekin = 2.10015103339182 | erot = 1.96448478928966 | epot = -12.4392587936247 | etot = -8.3746229709432 +160000 ekin = 2.0541841606365 | erot = 1.88751839461899 | epot = -12.3163255258998 | etot = -8.37462297064433 +161000 ekin = 1.9914954137127 | erot = 1.80350457154603 | epot = -12.1696229554607 | etot = -8.37462297020201 +162000 ekin = 1.91510266104687 | erot = 1.71656915682321 | epot = -12.0062947875077 | etot = -8.37462296963766 +163000 ekin = 1.82889680262222 | erot = 1.63175766791017 | epot = -11.8352774395237 | etot = -8.37462296899133 +164000 ekin = 1.73727850175361 | erot = 1.55477450557376 | epot = -11.6666759756467 | etot = -8.37462296831929 +165000 ekin = 1.64470875439873 | erot = 1.4915924102951 | epot = -11.5109241323765 | etot = -8.37462296768268 +166000 ekin = 1.55526715399606 | erot = 1.44796523953972 | epot = -11.3778553606755 | etot = -8.3746229671397 +167000 ekin = 1.47230568197345 | erot = 1.42890789301241 | epot = -11.2758365417204 | etot = -8.37462296673456 +168000 ekin = 1.39825202215325 | erot = 1.43822523215975 | epot = -11.2111002208052 | etot = -8.37462296649218 +169000 ekin = 1.33457196190141 | erot = 1.47816740254075 | epot = -11.1873623308595 | etot = -8.37462296641738 +170000 ekin = 1.28186404086305 | erot = 1.54925939136695 | epot = -11.2057463987275 | etot = -8.37462296649748 +171000 ekin = 1.24010532837043 | erot = 1.650314933199 | epot = -11.2650432281454 | etot = -8.37462296657596 +172000 ekin = 1.20973432363906 | erot = 1.77850842430629 | epot = -11.3628657149172 | etot = -8.37462296697185 +173000 ekin = 1.18958106737836 | erot = 1.92939472681623 | epot = -11.4935987616336 | etot = -8.37462296743901 +174000 ekin = 1.17780375666799 | erot = 2.09752621801763 | epot = -11.6499529426377 | etot = -8.37462296795207 +175000 ekin = 1.17250284106932 | erot = 2.27682305293097 | epot = -11.823948862491 | etot = -8.37462296849073 +176000 ekin = 1.1717731341751 | erot = 2.46086230703718 | epot = -12.0072584102492 | etot = -8.37462296903695 +177000 ekin = 1.17372471418892 | erot = 2.64315812275411 | epot = -12.1915058065145 | etot = -8.37462296957145 +178000 ekin = 1.1764972581607 | erot = 2.8174537859961 | epot = -12.3685740142281 | etot = -8.37462297007134 +179000 ekin = 1.17828959842936 | erot = 2.9780388566517 | epot = -12.5309514255911 | etot = -8.37462297051003 +180000 ekin = 1.17741681901011 | erot = 3.12008209304928 | epot = -12.6721218829193 | etot = -8.37462297085987 +181000 ekin = 1.17239479280091 | erot = 3.2399417749801 | epot = -12.7869595388788 | etot = -8.3746229710978 +182000 ekin = 1.16204161674191 | erot = 3.33528346670204 | epot = -12.871948054927 | etot = -8.37462297148309 +183000 ekin = 1.14544700201189 | erot = 3.40346825728322 | epot = -12.9235382308538 | etot = -8.3746229715587 +184000 ekin = 1.12187454429755 | erot = 3.44382690739235 | epot = -12.9403244231955 | etot = -8.37462297150555 +185000 ekin = 1.09113819766571 | erot = 3.45752421108363 | epot = -12.9232853800841 | etot = -8.37462297133478 +186000 ekin = 1.0537517763756 | erot = 3.44681260248516 | epot = -12.875187349924 | etot = -8.37462297106326 +187000 ekin = 1.01100426926452 | erot = 3.41470705189681 | epot = -12.8003342918715 | etot = -8.3746229707102 +188000 ekin = 0.964980950088499 | erot = 3.36467106156843 | epot = -12.7042749819531 | etot = -8.37462297029615 +189000 ekin = 0.918502012520883 | erot = 3.30025095733249 | epot = -12.5933759397279 | etot = -8.37462296987451 +190000 ekin = 0.874955375625479 | erot = 3.22483721777176 | epot = -12.4744155628188 | etot = -8.37462296942152 +191000 ekin = 0.838012694189673 | erot = 3.14179385100208 | epot = -12.3544295141826 | etot = -8.37462296899079 +192000 ekin = 0.811264586710657 | erot = 3.05421641257372 | epot = -12.2401039678971 | etot = -8.37462296861268 +193000 ekin = 0.797833231457084 | erot = 2.96485918306321 | epot = -12.1373153828317 | etot = -8.37462296831145 +194000 ekin = 0.800032366300235 | erot = 2.87610608236619 | epot = -12.050761416768 | etot = -8.37462296810153 +195000 ekin = 0.819137512919436 | erot = 2.78998115247787 | epot = -11.9837416333826 | etot = -8.37462296798526 +196000 ekin = 0.855301818718971 | erot = 2.70818765526185 | epot = -11.9381124419351 | etot = -8.37462296795428 +197000 ekin = 0.907617485284309 | erot = 2.63215574475477 | epot = -11.9143961980333 | etot = -8.37462296799419 +198000 ekin = 0.97429151758394 | erot = 2.56307623018431 | epot = -11.9119907158566 | etot = -8.37462296808834 +199000 ekin = 1.05288651878741 | erot = 2.50190471363149 | epot = -11.9294142006404 | etot = -8.37462296822155 +200000 ekin = 1.14057530731199 | erot = 2.4493327408956 | epot = -11.9645310165904 | etot = -8.37462296838278 +201000 ekin = 1.2343694565576 | erot = 2.4057357740471 | epot = -12.014728199169 | etot = -8.37462296856431 +202000 ekin = 1.33129982084458 | erot = 2.37111655194159 | epot = -12.077039341547 | etot = -8.37462296876083 +203000 ekin = 1.42854451444423 | erot = 2.34506402190562 | epot = -12.1482315053183 | etot = -8.3746229689685 +204000 ekin = 1.52351160571851 | erot = 2.3267429043425 | epot = -12.2248774792434 | etot = -8.37462296918236 +205000 ekin = 1.6138883706006 | erot = 2.31491995505448 | epot = -12.303431295052 | etot = -8.37462296939692 +206000 ekin = 1.69766775260787 | erot = 2.30802500400437 | epot = -12.3803157262179 | etot = -8.37462296960567 +207000 ekin = 1.77315874687833 | erot = 2.30423562983859 | epot = -12.4520173465211 | etot = -8.37462296980422 +208000 ekin = 1.83898325555911 | erot = 2.30156289475817 | epot = -12.5151691203028 | etot = -8.37462296998553 +209000 ekin = 1.89406065254644 | erot = 2.29797193080324 | epot = -12.5666555534947 | etot = -8.37462297014506 +210000 ekin = 1.93758171355935 | erot = 2.29149245614518 | epot = -12.6036971399829 | etot = -8.3746229702784 +211000 ekin = 1.96897499678785 | erot = 2.28032999988847 | epot = -12.6239279670578 | etot = -8.37462297038152 +212000 ekin = 1.98787057423925 | erot = 2.26297816329926 | epot = -12.6254717079893 | etot = -8.3746229704508 +213000 ekin = 1.99406615310611 | erot = 2.2383484772953 | epot = -12.6070376008827 | etot = -8.37462297048134 +214000 ekin = 1.98749971048289 | erot = 2.20579329600811 | epot = -12.5679159769723 | etot = -8.37462297048125 +215000 ekin = 1.96823269345663 | erot = 2.16512069835577 | epot = -12.5079763622595 | etot = -8.37462297044713 +216000 ekin = 1.93645036858726 | erot = 2.11663233289577 | epot = -12.4277056718661 | etot = -8.37462297038307 +217000 ekin = 1.89249565101069 | erot = 2.06105227365545 | epot = -12.328170894956 | etot = -8.37462297028983 +218000 ekin = 1.83696296100899 | erot = 1.99944931813363 | epot = -12.2110352493001 | etot = -8.37462297015747 +219000 ekin = 1.77087997199934 | erot = 1.93321768349765 | epot = -12.0787206254576 | etot = -8.37462296996059 +220000 ekin = 1.69598414200763 | erot = 1.86416918368629 | epot = -11.9347762953549 | etot = -8.37462296966094 +221000 ekin = 1.61504938765036 | erot = 1.79472971030281 | epot = -11.7844020671756 | etot = -8.37462296922238 +222000 ekin = 1.53214607791949 | erot = 1.72813764737019 | epot = -11.6349066939257 | etot = -8.37462296863602 +223000 ekin = 1.45266240883104 | erot = 1.66846349300161 | epot = -11.4957488697767 | etot = -8.37462296794408 +224000 ekin = 1.38293292450099 | erot = 1.62027927221305 | epot = -11.3778351639604 | etot = -8.37462296724631 +225000 ekin = 1.32944348952736 | erot = 1.58793473617187 | epot = -11.2920011923819 | etot = -8.37462296668269 +226000 ekin = 1.2977735014098 | erot = 1.57457480049554 | epot = -11.2469712682751 | etot = -8.37462296636981 +227000 ekin = 1.29158711545474 | erot = 1.58136206120168 | epot = -11.247572143041 | etot = -8.37462296638459 +228000 ekin = 1.31199160550476 | erot = 1.60705168356094 | epot = -11.2936662557528 | etot = -8.37462296668715 +229000 ekin = 1.35720775781569 | erot = 1.64872427968805 | epot = -11.3805550048119 | etot = -8.37462296730815 +230000 ekin = 1.42320705813326 | erot = 1.70117239435519 | epot = -11.4990024205437 | etot = -8.37462296805528 +231000 ekin = 1.50467169677578 | erot = 1.75808746579119 | epot = -11.6373821313705 | etot = -8.37462296880356 +232000 ekin = 1.59576180204784 | erot = 1.81345446216814 | epot = -11.7838392336754 | etot = -8.37462296945945 +233000 ekin = 1.69077156764766 | erot = 1.86233770608624 | epot = -11.9277322437063 | etot = -8.37462296997237 +234000 ekin = 1.78453671679902 | erot = 1.90129507954668 | epot = -12.0604547666798 | etot = -8.37462297033406 +235000 ekin = 1.87261122258964 | erot = 1.92842207171172 | epot = -12.1756562648648 | etot = -8.37462297056343 +236000 ekin = 1.95129507586045 | erot = 1.94312673772456 | epot = -12.2690447842759 | etot = -8.37462297069089 +237000 ekin = 2.01688127570888 | erot = 1.94587838549618 | epot = -12.3373826321093 | etot = -8.37462297090424 +238000 ekin = 2.06554471096632 | erot = 1.93754713481357 | epot = -12.3777148167612 | etot = -8.37462297098128 +239000 ekin = 2.09498833917105 | erot = 1.91896908743904 | epot = -12.3885803976066 | etot = -8.37462297099647 +240000 ekin = 2.10387887335868 | erot = 1.89114067893448 | epot = -12.3696425232255 | etot = -8.37462297093239 +241000 ekin = 2.09205058134763 | erot = 1.85524232773695 | epot = -12.3219158798525 | etot = -8.37462297076792 +242000 ekin = 2.06070692356732 | erot = 1.81270484104108 | epot = -12.2480347350936 | etot = -8.3746229704852 +243000 ekin = 2.01255526288397 | erot = 1.76529169809267 | epot = -12.1524699310592 | etot = -8.3746229700826 +244000 ekin = 1.95178746173565 | erot = 1.71512317980732 | epot = -12.0415336111136 | etot = -8.37462296957065 +245000 ekin = 1.88387514784715 | erot = 1.66462101119864 | epot = -11.9231191280352 | etot = -8.37462296898941 +246000 ekin = 1.81512558267788 | erot = 1.61637080971489 | epot = -11.8061193607925 | etot = -8.37462296839969 +247000 ekin = 1.75197548737598 | erot = 1.57289129038632 | epot = -11.6994897456374 | etot = -8.37462296787513 +248000 ekin = 1.70016015194921 | erot = 1.5363664174363 | epot = -11.6111495368734 | etot = -8.37462296748788 +249000 ekin = 1.664043914543 | erot = 1.50839677555149 | epot = -11.5470636572537 | etot = -8.37462296715922 +250000 ekin = 1.64635032469218 | erot = 1.48977166427894 | epot = -11.5107449561766 | etot = -8.37462296720544 +251000 ekin = 1.64670868822392 | erot = 1.48021150770214 | epot = -11.5015431633547 | etot = -8.37462296742863 +252000 ekin = 1.66264181464355 | erot = 1.47871062656248 | epot = -11.515975408979 | etot = -8.37462296777296 +253000 ekin = 1.69027564040369 | erot = 1.48380069509961 | epot = -11.5486993036754 | etot = -8.3746229681721 +254000 ekin = 1.72505301291702 | erot = 1.49382397147177 | epot = -11.593499952955 | etot = -8.37462296856621 +255000 ekin = 1.76239471231507 | erot = 1.50720813837987 | epot = -11.6442258196111 | etot = -8.37462296891614 +256000 ekin = 1.79816893498575 | erot = 1.52259254469743 | epot = -11.6953844488857 | etot = -8.37462296920248 +257000 ekin = 1.82895095239716 | erot = 1.53887801863879 | epot = -11.7424519404558 | etot = -8.37462296941987 +258000 ekin = 1.85212386739603 | erot = 1.55528591409784 | epot = -11.7820327510629 | etot = -8.37462296956901 +259000 ekin = 1.86588413888276 | erot = 1.57137656836574 | epot = -11.8118836768999 | etot = -8.37462296965144 +260000 ekin = 1.86922537289945 | erot = 1.58707491263422 | epot = -11.8309232551869 | etot = -8.37462296965321 +261000 ekin = 1.86194745778049 | erot = 1.60277606186391 | epot = -11.8393464893246 | etot = -8.37462296968025 +262000 ekin = 1.84441202421401 | erot = 1.61874454524398 | epot = -11.8377795390096 | etot = -8.37462296955156 +263000 ekin = 1.8177563299772 | erot = 1.63584439963962 | epot = -11.8282236989416 | etot = -8.37462296932473 +264000 ekin = 1.78414336143566 | erot = 1.65581672859452 | epot = -11.8145830590359 | etot = -8.37462296900575 +265000 ekin = 1.74659811333773 | erot = 1.68088156362826 | epot = -11.8021026455982 | etot = -8.37462296863218 +266000 ekin = 1.70875551588695 | erot = 1.71332387538106 | epot = -11.7967023595427 | etot = -8.37462296827472 +267000 ekin = 1.67443624978676 | erot = 1.75501089284495 | epot = -11.8040701106202 | etot = -8.37462296798845 +268000 ekin = 1.64712713207616 | erot = 1.80695733277667 | epot = -11.8287074326943 | etot = -8.37462296784148 +269000 ekin = 1.62949021142767 | erot = 1.86883267567167 | epot = -11.8729458549721 | etot = -8.37462296787273 +270000 ekin = 1.62285159922546 | erot = 1.93872810894256 | epot = -11.9362026762895 | etot = -8.37462296812145 +271000 ekin = 1.62688631043817 | erot = 2.01317767222006 | epot = -12.0146869512065 | etot = -8.37462296854828 +272000 ekin = 1.63981668010479 | erot = 2.08746423747607 | epot = -12.1019038866666 | etot = -8.37462296908573 +273000 ekin = 1.65880091169085 | erot = 2.15626799363728 | epot = -12.1896918749698 | etot = -8.37462296964172 +274000 ekin = 1.68050753849978 | erot = 2.21448722130837 | epot = -12.2696177299305 | etot = -8.37462297012236 +275000 ekin = 1.70172643739859 | erot = 2.25805265702164 | epot = -12.3344020648726 | etot = -8.37462297045236 +276000 ekin = 1.71987527696229 | erot = 2.28456562448884 | epot = -12.3790638720398 | etot = -8.37462297058871 +277000 ekin = 1.73331269261662 | erot = 2.29364905663773 | epot = -12.4015847197778 | etot = -8.37462297052348 +278000 ekin = 1.74143735013812 | erot = 2.28698125838882 | epot = -12.4030415787998 | etot = -8.37462297027286 +279000 ekin = 1.74460802870659 | erot = 2.26806682992254 | epot = -12.3872978285234 | etot = -8.37462296989426 +280000 ekin = 1.74394008412506 | erot = 2.24171314051919 | epot = -12.3602761940833 | etot = -8.37462296943905 +281000 ekin = 1.74088698058238 | erot = 2.21312908436276 | epot = -12.3286390340538 | etot = -8.37462296910862 +282000 ekin = 1.73669656458759 | erot = 2.18704204449549 | epot = -12.2983615778783 | etot = -8.37462296879524 +283000 ekin = 1.73229007371642 | erot = 2.1674467962283 | epot = -12.2743598385788 | etot = -8.37462296863409 +284000 ekin = 1.72792109204571 | erot = 2.15675164213727 | epot = -12.2592957028517 | etot = -8.3746229686687 +285000 ekin = 1.72297480902885 | erot = 2.15537559427272 | epot = -12.2529733722 | etot = -8.37462296889847 +286000 ekin = 1.71598432453051 | erot = 2.16179000838356 | epot = -12.2523973021713 | etot = -8.37462296925726 +287000 ekin = 1.70498524220327 | erot = 2.17315503013682 | epot = -12.2527632419519 | etot = -8.3746229696118 +288000 ekin = 1.68823578051931 | erot = 2.18649203663113 | epot = -12.2493507869527 | etot = -8.37462296980222 +289000 ekin = 1.66510970376189 | erot = 2.19999055777893 | epot = -12.2397232312607 | etot = -8.37462296971986 +290000 ekin = 1.63674302037956 | erot = 2.21381252699311 | epot = -12.2251785167475 | etot = -8.37462296937484 +291000 ekin = 1.60601874197386 | erot = 2.22992661048294 | epot = -12.2105683213532 | etot = -8.37462296889641 +292000 ekin = 1.57682389343734 | erot = 2.25107800691057 | epot = -12.2025248687813 | etot = -8.37462296843336 +293000 ekin = 1.55301992418662 | erot = 2.27950943304582 | epot = -12.2071523254127 | etot = -8.37462296818025 +294000 ekin = 1.53731454048149 | erot = 2.31583078837865 | epot = -12.2277682970263 | etot = -8.37462296816618 +295000 ekin = 1.53083265562476 | erot = 2.35873605655275 | epot = -12.2641916805461 | etot = -8.37462296836864 +296000 ekin = 1.53318706455205 | erot = 2.40528084679052 | epot = -12.3130908800614 | etot = -8.37462296871883 +297000 ekin = 1.54281493583582 | erot = 2.4515193186347 | epot = -12.3689572236279 | etot = -8.3746229691574 +298000 ekin = 1.55733608765083 | erot = 2.49306411731964 | epot = -12.4250231746877 | etot = -8.3746229697172 +299000 ekin = 1.57407386288216 | erot = 2.52498633848796 | epot = -12.4736831715335 | etot = -8.37462297016341 +300000 ekin = 1.59001535759976 | erot = 2.54349315182905 | epot = -12.5081314800013 | etot = -8.37462297057251 +301000 ekin = 1.60189886822585 | erot = 2.54585083166242 | epot = -12.5223726708135 | etot = -8.37462297092524 +302000 ekin = 1.60620251585571 | erot = 2.53039812867702 | epot = -12.5112236158409 | etot = -8.37462297130815 +303000 ekin = 1.59914065240547 | erot = 2.4959828099385 | epot = -12.4697464340451 | etot = -8.37462297170116 +304000 ekin = 1.57679795693713 | erot = 2.44177332378582 | epot = -12.3931942527977 | etot = -8.37462297207474 +305000 ekin = 1.53574304374 | erot = 2.36761905414264 | epot = -12.277985069966 | etot = -8.37462297208332 +306000 ekin = 1.47392866559566 | erot = 2.27453104047961 | epot = -12.1230826782581 | etot = -8.37462297218281 +307000 ekin = 1.39050823398525 | erot = 2.16376504506943 | epot = -11.9288962509197 | etot = -8.37462297186505 +308000 ekin = 1.28961522980533 | erot = 2.03977667258418 | epot = -11.7040148706627 | etot = -8.37462296827321 +309000 ekin = 1.0578293749373 | erot = 1.83361716570716 | epot = -11.2660695010511 | etot = -8.3746229604066 +310000 ekin = 1.14450415448801 | erot = 1.58483272602465 | epot = -11.1039598386899 | etot = -8.37462295817721 +311000 ekin = 1.41922601312433 | erot = 1.45460499880699 | epot = -11.2484540448416 | etot = -8.37462303291028 +312000 ekin = 1.45261330232124 | erot = 1.37611906651625 | epot = -11.2033554015516 | etot = -8.37462303271409 +313000 ekin = 1.4788437717407 | erot = 1.31854286229449 | epot = -11.1720096664209 | etot = -8.37462303238567 +314000 ekin = 1.49756299811573 | erot = 1.28320357876888 | epot = -11.1553896088945 | etot = -8.37462303200986 +315000 ekin = 1.51332559187976 | erot = 1.27043025389328 | epot = -11.1583788774964 | etot = -8.37462303172341 +316000 ekin = 1.5308006111801 | erot = 1.27925593275775 | epot = -11.1846795755428 | etot = -8.37462303160493 +317000 ekin = 1.55378721590878 | erot = 1.30719554367543 | epot = -11.235605791274 | etot = -8.37462303168982 +318000 ekin = 1.58370434541092 | erot = 1.34913652060449 | epot = -11.3074638985388 | etot = -8.3746230325234 +319000 ekin = 1.61943484148271 | erot = 1.39801478359314 | epot = -11.3920726581939 | etot = -8.37462303311803 +320000 ekin = 1.65864783760545 | erot = 1.4469667045913 | epot = -11.4802375759983 | etot = -8.37462303380153 +321000 ekin = 1.6976698384736 | erot = 1.48920524279123 | epot = -11.5614981157299 | etot = -8.3746230344651 +322000 ekin = 1.73222385846077 | erot = 1.51888544570781 | epot = -11.6257323391508 | etot = -8.37462303498217 +323000 ekin = 1.75834700852353 | erot = 1.53202956630854 | epot = -11.6649996100711 | etot = -8.37462303523908 +324000 ekin = 1.77324650046361 | erot = 1.52732597029569 | epot = -11.675195505928 | etot = -8.37462303516871 +325000 ekin = 1.77583924216996 | erot = 1.50655389358471 | epot = -11.6570161705554 | etot = -8.37462303480068 +326000 ekin = 1.76682929376892 | erot = 1.47436928283917 | epot = -11.6158216107568 | etot = -8.37462303414873 +327000 ekin = 1.74834602231152 | erot = 1.43794367202746 | epot = -11.5609127276999 | etot = -8.37462303336097 +328000 ekin = 1.7233110982126 | erot = 1.40578615079696 | epot = -11.5037202815778 | etot = -8.37462303256828 +329000 ekin = 1.69488797673405 | erot = 1.38635580023326 | epot = -11.455866808845 | etot = -8.37462303187764 +330000 ekin = 1.66566513334786 | erot = 1.38702252391897 | epot = -11.4273106886498 | etot = -8.374623031383 +331000 ekin = 1.63732185166234 | erot = 1.41331220646627 | epot = -11.4252570892353 | etot = -8.37462303110665 +332000 ekin = 1.61073968004048 | erot = 1.46826665363454 | epot = -11.4536293647323 | etot = -8.37462303105725 +333000 ekin = 1.58605232106548 | erot = 1.55220559043093 | epot = -11.5128809427306 | etot = -8.37462303123423 +334000 ekin = 1.56284415922383 | erot = 1.66255678080412 | epot = -11.6000239716191 | etot = -8.37462303159115 +335000 ekin = 1.54014240613874 | erot = 1.79443783502712 | epot = -11.7092032732476 | etot = -8.3746230320817 +336000 ekin = 1.51670455216665 | erot = 1.94117931563221 | epot = -11.8325069004485 | etot = -8.37462303264961 +337000 ekin = 1.49128277555588 | erot = 2.09492414345214 | epot = -11.9608299522436 | etot = -8.37462303323563 +338000 ekin = 1.46282625483081 | erot = 2.24735936520887 | epot = -12.0848086538234 | etot = -8.37462303378369 +339000 ekin = 1.43063896798345 | erot = 2.39044100153381 | epot = -12.1957030037652 | etot = -8.37462303424793 +340000 ekin = 1.39448012484058 | erot = 2.51702660358978 | epot = -12.2861297630267 | etot = -8.37462303459637 +341000 ekin = 1.35460313822272 | erot = 2.62135284037423 | epot = -12.3505790134091 | etot = -8.37462303481217 +342000 ekin = 1.3117393686306 | erot = 2.69933546749687 | epot = -12.3856978710184 | etot = -8.37462303489094 +343000 ekin = 1.26704159860242 | erot = 2.74871044551728 | epot = -12.3903750789562 | etot = -8.37462303483653 +344000 ekin = 1.22200654509503 | erot = 2.76906107654538 | epot = -12.3656906562963 | etot = -8.37462303465594 +345000 ekin = 1.17839357225705 | erot = 2.76177689465492 | epot = -12.3147935012698 | etot = -8.3746230343578 +346000 ekin = 1.13814730560313 | erot = 2.72996678569807 | epot = -12.2427371252553 | etot = -8.37462303395411 +347000 ekin = 1.10331757839141 | erot = 2.6783142195391 | epot = -12.1562548313944 | etot = -8.37462303346392 +348000 ekin = 1.07595787263662 | erot = 2.61283600667603 | epot = -12.0634169122307 | etot = -8.37462303291807 +349000 ekin = 1.05798147191725 | erot = 2.54050407789364 | epot = -11.9731085821725 | etot = -8.37462303236165 +350000 ekin = 1.05096760963778 | erot = 2.46871550807945 | epot = -11.8943061495688 | etot = -8.37462303185161 +351000 ekin = 1.05593437429309 | erot = 2.40463774697973 | epot = -11.8351951527212 | etot = -8.37462303144839 +352000 ekin = 1.07311971186499 | erot = 2.35449555191637 | epot = -11.8022382949886 | etot = -8.37462303120719 +353000 ekin = 1.10182415540818 | erot = 2.32288867128187 | epot = -11.7993358578585 | etot = -8.37462303116842 +354000 ekin = 1.14036300464704 | erot = 2.31223409502352 | epot = -11.8272201310208 | etot = -8.37462303135026 +355000 ekin = 1.18615564007902 | erot = 2.3224218596199 | epot = -11.8832005314417 | etot = -8.37462303174276 +356000 ekin = 1.23595386569949 | erot = 2.35076326964177 | epot = -11.9613401676474 | etot = -8.37462303230618 +357000 ekin = 1.28618457758726 | erot = 2.39228504524919 | epot = -12.0530926558101 | etot = -8.37462303297361 +358000 ekin = 1.33335672484132 | erot = 2.44036693764159 | epot = -12.1483466961437 | etot = -8.37462303366077 +359000 ekin = 1.37446611423607 | erot = 2.48763760748889 | epot = -12.236726756006 | etot = -8.37462303428102 +360000 ekin = 1.40733698540188 | erot = 2.52696891747013 | epot = -12.3089289376309 | etot = -8.3746230347589 +361000 ekin = 1.43085230117183 | erot = 2.55266032656637 | epot = -12.3581356626699 | etot = -8.37462303493173 +362000 ekin = 1.44498023419595 | erot = 2.56161192448288 | epot = -12.3812151936925 | etot = -8.37462303501363 +363000 ekin = 1.45080808015525 | erot = 2.55177253018898 | epot = -12.3772036452512 | etot = -8.37462303490697 +364000 ekin = 1.4504698206999 | erot = 2.52283864584182 | epot = -12.347931501182 | etot = -8.37462303464031 +365000 ekin = 1.44693366152056 | erot = 2.47609933176571 | epot = -12.2976560275495 | etot = -8.3746230342632 +366000 ekin = 1.44366094468055 | erot = 2.4140112633753 | epot = -12.2322952418927 | etot = -8.37462303383685 +367000 ekin = 1.44416618229195 | erot = 2.33969773429606 | epot = -12.1584869500116 | etot = -8.3746230334236 +368000 ekin = 1.45154164412086 | erot = 2.25648465084979 | epot = -12.0826493280444 | etot = -8.37462303307378 +369000 ekin = 1.46802482611048 | erot = 2.16757470029764 | epot = -12.0102225592251 | etot = -8.374623032817 +370000 ekin = 1.49468484157928 | erot = 2.07591739973036 | epot = -11.9452252739682 | etot = -8.37462303265854 +371000 ekin = 1.53128479294051 | erot = 1.98426522628833 | epot = -11.8901730518124 | etot = -8.37462303258357 +372000 ekin = 1.57634160155561 | erot = 1.89533626064572 | epot = -11.8463008947682 | etot = -8.37462303256687 +373000 ekin = 1.62736107596654 | erot = 1.81196417168862 | epot = -11.8139482802383 | etot = -8.37462303258315 +374000 ekin = 1.68119274504178 | erot = 1.73713269144164 | epot = -11.7929484690967 | etot = -8.37462303261329 +375000 ekin = 1.73444043052866 | erot = 1.67385884334747 | epot = -11.7829223065195 | etot = -8.3746230326434 +376000 ekin = 1.7838758614395 | erot = 1.62497473906432 | epot = -11.7834736331734 | etot = -8.37462303266957 +377000 ekin = 1.8264818609192 | erot = 1.59275354369267 | epot = -11.7938584374905 | etot = -8.3746230328786 +378000 ekin = 1.85889028460788 | erot = 1.57838589666728 | epot = -11.8118992141862 | etot = -8.37462303291103 +379000 ekin = 1.87974734421377 | erot = 1.58231910072918 | epot = -11.8366894778912 | etot = -8.3746230329482 +380000 ekin = 1.88876618247951 | erot = 1.60397852042908 | epot = -11.8673677359266 | etot = -8.37462303301803 +381000 ekin = 1.88634387025611 | erot = 1.64162253507735 | epot = -11.9025894384722 | etot = -8.37462303313873 +382000 ekin = 1.87329602399998 | erot = 1.69239968364376 | epot = -11.9403187409518 | etot = -8.37462303330804 +383000 ekin = 1.85067766912106 | erot = 1.75260724974019 | epot = -11.9779079523652 | etot = -8.37462303350397 +384000 ekin = 1.81972884480784 | erot = 1.81808771261072 | epot = -12.0124395911118 | etot = -8.37462303369321 +385000 ekin = 1.78192764777047 | erot = 1.8846313378676 | epot = -12.041182019504 | etot = -8.3746230338659 +386000 ekin = 1.73896117301596 | erot = 1.94830024178193 | epot = -12.0618844487821 | etot = -8.37462303398425 +387000 ekin = 1.69261703956648 | erot = 2.00550933075379 | epot = -12.0727494044584 | etot = -8.37462303413813 +388000 ekin = 1.64442362565029 | erot = 2.05290262288177 | epot = -12.0719492828234 | etot = -8.3746230342913 +389000 ekin = 1.59562809726279 | erot = 2.08769097010093 | epot = -12.0579421017191 | etot = -8.37462303435535 +390000 ekin = 1.54727258078745 | erot = 2.10804034821841 | epot = -12.0299359634133 | etot = -8.3746230344074 +391000 ekin = 1.50042668689197 | erot = 2.11301685840032 | epot = -11.9880665795736 | etot = -8.37462303428126 +392000 ekin = 1.45669956782597 | erot = 2.10352612083801 | epot = -11.9348487226021 | etot = -8.37462303393817 +393000 ekin = 1.41857599108996 | erot = 2.0826321347131 | epot = -11.8758311591979 | etot = -8.37462303339481 +394000 ekin = 1.3893261262781 | erot = 2.05528425943378 | epot = -11.8192334184605 | etot = -8.37462303274866 +395000 ekin = 1.37246101478385 | erot = 2.02739319427127 | epot = -11.7744772412142 | etot = -8.37462303215908 +396000 ekin = 1.3707890798786 | erot = 2.00445159240551 | epot = -11.749863704081 | etot = -8.37462303179692 +397000 ekin = 1.38538853999914 | erot = 1.9901130253752 | epot = -11.7501245971563 | etot = -8.37462303178196 +398000 ekin = 1.41490531161682 | erot = 1.98519641778307 | epot = -11.7747247615386 | etot = -8.37462303213875 +399000 ekin = 1.45547085036336 | erot = 1.98743025594694 | epot = -11.8175241391048 | etot = -8.37462303279453 +400000 ekin = 1.50126526406668 | erot = 1.99196444869264 | epot = -11.8678527463719 | etot = -8.37462303361261 +401000 ekin = 1.54549713891568 | erot = 1.99242148352413 | epot = -11.9125416568766 | etot = -8.37462303443679 +402000 ekin = 1.58148802753477 | erot = 1.98217540610567 | epot = -11.9382864687619 | etot = -8.37462303512143 +403000 ekin = 1.60364407572881 | erot = 1.9556344645944 | epot = -11.9339015758642 | etot = -8.37462303554099 +404000 ekin = 1.60823718231487 | erot = 1.90940860689026 | epot = -11.8922688248051 | etot = -8.37462303559999 +405000 ekin = 1.59393186875452 | erot = 1.84321418438557 | epot = -11.8117690883978 | etot = -8.37462303525771 +406000 ekin = 1.56197926550493 | erot = 1.76026394072102 | epot = -11.696866240782 | etot = -8.37462303455608 +407000 ekin = 1.51595319782311 | erot = 1.66689496115276 | epot = -11.5574711925966 | etot = -8.37462303362071 +408000 ekin = 1.46103089399052 | erot = 1.57144700034413 | epot = -11.4071009269554 | etot = -8.37462303262075 +409000 ekin = 1.40302353808213 | erot = 1.48274963105035 | epot = -11.2603962008455 | etot = -8.37462303171298 +410000 ekin = 1.34747963365293 | erot = 1.40871679572301 | epot = -11.1308194603669 | etot = -8.37462303099097 +411000 ekin = 1.24142842928345 | erot = 1.3676589102725 | epot = -10.983710354595 | etot = -8.37462301503906 +412000 ekin = 1.07606206466684 | erot = 1.44463891803659 | epot = -10.895323988422 | etot = -8.37462300571856 +413000 ekin = 1.0469492246958 | erot = 1.51102600613229 | epot = -10.9325982588143 | etot = -8.37462302798624 +414000 ekin = 1.03606467090329 | erot = 1.52895884328701 | epot = -10.9396465423135 | etot = -8.37462302812324 +415000 ekin = 1.03698178421953 | erot = 1.56970634086083 | epot = -10.9813111534877 | etot = -8.37462302840732 +416000 ekin = 1.04842794421656 | erot = 1.63005774223169 | epot = -11.0531087152564 | etot = -8.37462302880815 +417000 ekin = 1.06841333535611 | erot = 1.70571770479117 | epot = -11.1487540694412 | etot = -8.37462302929392 +418000 ekin = 1.09444701005052 | erot = 1.79158405306285 | epot = -11.2606540929514 | etot = -8.374623029838 +419000 ekin = 1.12371544113025 | erot = 1.88200392342439 | epot = -11.3803423949703 | etot = -8.37462303041567 +420000 ekin = 1.15322596863697 | erot = 1.97103956947911 | epot = -11.4988885691119 | etot = -8.37462303099584 +421000 ekin = 1.17996638670183 | erot = 2.05281125535609 | epot = -11.6074006735882 | etot = -8.37462303153032 +422000 ekin = 1.201150629811 | erot = 2.12197272517913 | epot = -11.6977463869433 | etot = -8.37462303195322 +423000 ekin = 1.21456879342709 | erot = 2.17429924607153 | epot = -11.7634910716962 | etot = -8.37462303219755 +424000 ekin = 1.21895541018766 | erot = 2.20725430505394 | epot = -11.8008327474642 | etot = -8.37462303222256 +425000 ekin = 1.21420953470709 | erot = 2.22030001430835 | epot = -11.8091325810571 | etot = -8.37462303204169 +426000 ekin = 1.20134505265786 | erot = 2.21476142814848 | epot = -11.7907295125128 | etot = -8.37462303170646 +427000 ekin = 1.18219319315386 | erot = 2.19340434236612 | epot = -11.7502205668101 | etot = -8.37462303129015 +428000 ekin = 1.15899921940896 | erot = 2.15981652249743 | epot = -11.6934387727642 | etot = -8.37462303085781 +429000 ekin = 1.13415683500777 | erot = 2.11790831242985 | epot = -11.626688176254 | etot = -8.37462302881639 +430000 ekin = 1.11403963820945 | erot = 2.07460238347142 | epot = -11.5632650504412 | etot = -8.37462302876033 +431000 ekin = 1.10124843427927 | erot = 2.03325324115979 | epot = -11.5091247042067 | etot = -8.37462302876769 +432000 ekin = 1.09509673682025 | erot = 1.9941469470348 | epot = -11.463866712691 | etot = -8.3746230288359 +433000 ekin = 1.09463609314599 | erot = 1.9571134858218 | epot = -11.4263726079113 | etot = -8.37462302894346 +434000 ekin = 1.09809472012928 | erot = 1.92111283569796 | epot = -11.3938305852077 | etot = -8.37462302938051 +435000 ekin = 1.10341624338772 | erot = 1.8849214283028 | epot = -11.3629607010957 | etot = -8.37462302940516 +436000 ekin = 1.11020757162788 | erot = 1.84854231975879 | epot = -11.3333729208359 | etot = -8.37462302944924 +437000 ekin = 1.11803889537718 | erot = 1.81186902511188 | epot = -11.3045309499972 | etot = -8.37462302950813 +438000 ekin = 1.12642172160212 | erot = 1.77470718111906 | epot = -11.2757519322947 | etot = -8.37462302957348 +439000 ekin = 1.13485148153857 | erot = 1.73686282079504 | epot = -11.2463373319668 | etot = -8.37462302963316 +440000 ekin = 1.14287335820557 | erot = 1.69826079507258 | epot = -11.2157571829501 | etot = -8.37462302967201 +441000 ekin = 1.15016795453 | erot = 1.65908318343106 | epot = -11.1838741676308 | etot = -8.37462302966978 +442000 ekin = 1.15664284201482 | erot = 1.6199231351832 | epot = -11.1511890068214 | etot = -8.37462302962339 +443000 ekin = 1.16253418069017 | erot = 1.58179210099589 | epot = -11.1189493112081 | etot = -8.37462302952203 +444000 ekin = 1.16846798531274 | erot = 1.54614466613438 | epot = -11.0892356808159 | etot = -8.37462302936875 +445000 ekin = 1.17546820346638 | erot = 1.51479732961113 | epot = -11.0648885622563 | etot = -8.37462302917878 +446000 ekin = 1.18488743024717 | erot = 1.48973802088361 | epot = -11.0492484801107 | etot = -8.37462302897993 +447000 ekin = 1.19824347153684 | erot = 1.4728428998067 | epot = -11.045709400153 | etot = -8.37462302880946 +448000 ekin = 1.21696535091614 | erot = 1.46554765995659 | epot = -11.057136039583 | etot = -8.37462302871022 +449000 ekin = 1.24207954598622 | erot = 1.4685127109392 | epot = -11.0852152856451 | etot = -8.37462302871963 +450000 ekin = 1.27389445230429 | erot = 1.48136016742347 | epot = -11.1298776485977 | etot = -8.37462302886998 +451000 ekin = 1.31179903842897 | erot = 1.50255470267787 | epot = -11.1889767701169 | etot = -8.37462302901007 +452000 ekin = 1.35460859520486 | erot = 1.52989164327214 | epot = -11.2591232679092 | etot = -8.37462302943224 +453000 ekin = 1.39989469250173 | erot = 1.55983588432776 | epot = -11.3343536067683 | etot = -8.37462302993882 +454000 ekin = 1.44437957549661 | erot = 1.58822152329951 | epot = -11.4072241292539 | etot = -8.37462303045782 +455000 ekin = 1.48456015878224 | erot = 1.61103616004378 | epot = -11.4702193497299 | etot = -8.37462303090385 +456000 ekin = 1.51733329615318 | erot = 1.62510652435346 | epot = -11.517062851697 | etot = -8.37462303119032 +457000 ekin = 1.5402924579761 | erot = 1.62854015385613 | epot = -11.5434556431069 | etot = -8.37462303127466 +458000 ekin = 1.55209787062734 | erot = 1.62122255615373 | epot = -11.5479434578271 | etot = -8.37462303104604 +459000 ekin = 1.55414659187724 | erot = 1.60571991112735 | epot = -11.534489533587 | etot = -8.37462303058242 +460000 ekin = 1.54960099436809 | erot = 1.58640018749714 | epot = -11.5106242118318 | etot = -8.37462302996654 +461000 ekin = 1.54273124224903 | erot = 1.56872252266296 | epot = -11.4860767942369 | etot = -8.37462302932495 +462000 ekin = 1.53795589449111 | erot = 1.5582592991952 | epot = -11.4708382224909 | etot = -8.37462302880455 +463000 ekin = 1.53875903307997 | erot = 1.55959299575739 | epot = -11.4729750573638 | etot = -8.3746230285264 +464000 ekin = 1.5468202951189 | erot = 1.57534186894895 | epot = -11.4967851926234 | etot = -8.37462302855553 +465000 ekin = 1.5616294650255 | erot = 1.60564212072996 | epot = -11.5418946146276 | etot = -8.37462302887219 +466000 ekin = 1.58070265304393 | erot = 1.64822662156127 | epot = -11.603552303988 | etot = -8.37462302938276 +467000 ekin = 1.60035208027376 | erot = 1.69905719079026 | epot = -11.6740323010118 | etot = -8.37462302994776 +468000 ekin = 1.61673623107391 | erot = 1.75335443246779 | epot = -11.7447136939717 | etot = -8.37462303042997 +469000 ekin = 1.6268308500714 | erot = 1.80670922025666 | epot = -11.8081631010573 | etot = -8.37462303072922 +470000 ekin = 1.62907239972708 | erot = 1.85596584024088 | epot = -11.8596612707757 | etot = -8.37462303080778 +471000 ekin = 1.62354687373172 | erot = 1.89966129170781 | epot = -11.8978311961317 | etot = -8.37462303069216 +472000 ekin = 1.61170510379399 | erot = 1.93800410341128 | epot = -11.9243322376449 | etot = -8.37462303043963 +473000 ekin = 1.59590324450823 | erot = 1.97246730642068 | epot = -11.942993581055 | etot = -8.37462303012609 +474000 ekin = 1.57886523181115 | erot = 2.0052614988155 | epot = -11.9587497604446 | etot = -8.3746230298179 +475000 ekin = 1.56312071578843 | erot = 2.03882982960528 | epot = -11.9765735749592 | etot = -8.37462302956554 +476000 ekin = 1.55063074695033 | erot = 2.07545668637289 | epot = -12.0007104627126 | etot = -8.37462302938941 +477000 ekin = 1.54263588410755 | erot = 2.1170423117264 | epot = -12.0343012251352 | etot = -8.37462302930124 +478000 ekin = 1.53956151541937 | erot = 2.16493101565526 | epot = -12.0791155603799 | etot = -8.37462302930528 +479000 ekin = 1.54104337297899 | erot = 2.21977101927769 | epot = -12.1354374216606 | etot = -8.37462302940391 +480000 ekin = 1.54600976096935 | erot = 2.28138261400517 | epot = -12.2020154045697 | etot = -8.37462302959523 +481000 ekin = 1.5528060602472 | erot = 2.34867771789131 | epot = -12.2761068080046 | etot = -8.37462302986605 +482000 ekin = 1.55937339634702 | erot = 2.41971772771426 | epot = -12.3537141542448 | etot = -8.3746230301835 +483000 ekin = 1.56350104452675 | erot = 2.49198464322954 | epot = -12.4301087182516 | etot = -8.37462303049528 +484000 ekin = 1.56314467772452 | erot = 2.56280026280573 | epot = -12.5005679712779 | etot = -8.37462303074763 +485000 ekin = 1.55677099189244 | erot = 2.62990187864922 | epot = -12.5612959014245 | etot = -8.37462303088287 +486000 ekin = 1.54362230241359 | erot = 2.69196691951186 | epot = -12.6102122528172 | etot = -8.37462303089175 +487000 ekin = 1.5238104379152 | erot = 2.74866369544762 | epot = -12.6470971641607 | etot = -8.37462303079786 +488000 ekin = 1.49822858843879 | erot = 2.80041322794163 | epot = -12.6732648470306 | etot = -8.37462303065017 +489000 ekin = 1.46832177710635 | erot = 2.84792010719105 | epot = -12.6908649147994 | etot = -8.37462303050195 +490000 ekin = 1.43580907600596 | erot = 2.89167668868156 | epot = -12.7021087950802 | etot = -8.37462303039268 +491000 ekin = 1.40244626498158 | erot = 2.9316206813094 | epot = -12.7086899766291 | etot = -8.37462303033812 +492000 ekin = 1.36987596423118 | erot = 2.96703118868649 | epot = -12.7115301832508 | etot = -8.37462303033312 +493000 ekin = 1.33956200675437 | erot = 2.99664446239339 | epot = -12.7108294995088 | etot = -8.37462303036106 +494000 ekin = 1.3127681632086 | erot = 3.01889804551742 | epot = -12.7062892391324 | etot = -8.37462303040635 +495000 ekin = 1.29052832589597 | erot = 3.03218505524697 | epot = -12.6973364116059 | etot = -8.37462303046299 +496000 ekin = 1.27356858864283 | erot = 3.0350229857791 | epot = -12.6832146049601 | etot = -8.37462303053819 +497000 ekin = 1.26217859738849 | erot = 3.02610963123598 | epot = -12.6629112592681 | etot = -8.37462303064358 +498000 ekin = 1.25609176092335 | erot = 3.00437387242604 | epot = -12.6350886640705 | etot = -8.37462303072112 +499000 ekin = 1.25448433544045 | erot = 2.96925958209619 | epot = -12.5983669483989 | etot = -8.37462303086226 +500000 ekin = 1.25592311954879 | erot = 2.92052794168349 | epot = -12.5510740922054 | etot = -8.37462303097314 +501000 ekin = 1.25866262015632 | erot = 2.85877857413469 | epot = -12.4920642252919 | etot = -8.37462303100091 +502000 ekin = 1.2610103010417 | erot = 2.78589367847612 | epot = -12.421527010423 | etot = -8.3746230309052 +503000 ekin = 1.26168224098171 | erot = 2.70525686265903 | epot = -12.3415621343142 | etot = -8.37462303067344 +504000 ekin = 1.26006875272983 | erot = 2.62162663921981 | epot = -12.2563184222836 | etot = -8.37462303033399 +505000 ekin = 1.25635230634192 | erot = 2.5406610185081 | epot = -12.1716363547687 | etot = -8.3746230299187 +506000 ekin = 1.25147361583174 | erot = 2.46829686832129 | epot = -12.0943935136462 | etot = -8.37462302949319 +507000 ekin = 1.24695832252164 | erot = 2.40991559866122 | epot = -12.0314969503117 | etot = -8.37462302912883 +508000 ekin = 1.24460011261649 | erot = 2.36947588934202 | epot = -11.9886990309674 | etot = -8.37462302900885 +509000 ekin = 1.24584437164828 | erot = 2.34837731731217 | epot = -11.9688447179543 | etot = -8.37462302899384 +510000 ekin = 1.25172041123361 | erot = 2.34550382347579 | epot = -11.9718472639353 | etot = -8.37462302922588 +511000 ekin = 1.26248317250715 | erot = 2.35680066398031 | epot = -11.9939068661965 | etot = -8.37462302970907 +512000 ekin = 1.27739486770184 | erot = 2.3752978884897 | epot = -12.0273157865857 | etot = -8.37462303039418 +513000 ekin = 1.29481021504986 | erot = 2.39185405428514 | epot = -12.0612873005101 | etot = -8.37462303117506 +514000 ekin = 1.31250889880426 | erot = 2.39651406027419 | epot = -12.0836459909739 | etot = -8.37462303189546 +515000 ekin = 1.32825052581585 | erot = 2.38037057726031 | epot = -12.0832441354508 | etot = -8.37462303237461 +516000 ekin = 1.34045831429004 | erot = 2.33760267994477 | epot = -12.0526840266922 | etot = -8.37462303245741 +517000 ekin = 1.34883924084187 | erot = 2.26713155444233 | epot = -11.9905938273613 | etot = -8.37462303207706 +518000 ekin = 1.35468550683679 | erot = 2.17326127006567 | epot = -11.9025698081983 | etot = -8.37462303129585 +519000 ekin = 1.36067339624038 | erot = 2.06494828515103 | epot = -11.8002447116801 | etot = -8.37462303028865 +520000 ekin = 1.37018582822438 | erot = 1.95390329836061 | epot = -11.6987121558631 | etot = -8.3746230292781 +521000 ekin = 1.38639579380191 | erot = 1.85221057840952 | epot = -11.6132294006716 | etot = -8.37462302846015 +522000 ekin = 1.41141432490479 | erot = 1.77022445533383 | epot = -11.5562618081968 | etot = -8.37462302795815 +523000 ekin = 1.44572356453344 | erot = 1.71520045870257 | epot = -11.5355470510526 | etot = -8.37462302781656 +524000 ekin = 1.48798145409679 | erot = 1.69073008317396 | epot = -11.5533345652857 | etot = -8.37462302801491 +525000 ekin = 1.53517683781673 | erot = 1.6968029606332 | epot = -11.6066028269435 | etot = -8.37462302849353 +526000 ekin = 1.58304900119248 | erot = 1.73025509475185 | epot = -11.6879271251181 | etot = -8.37462302917376 +527000 ekin = 1.62665879649442 | erot = 1.78540941264019 | epot = -11.7866912391056 | etot = -8.374623029971 +528000 ekin = 1.66100783108954 | erot = 1.8548065480344 | epot = -11.890437409923 | etot = -8.37462303079904 +529000 ekin = 1.68163863412964 | erot = 1.93001159413482 | epot = -11.9862732598315 | etot = -8.37462303156707 +530000 ekin = 1.6851862302745 | erot = 2.00252460865783 | epot = -12.0623338711126 | etot = -8.37462303218029 +531000 ekin = 1.66986059685934 | erot = 2.06478669656075 | epot = -12.1092703259691 | etot = -8.374623032549 +532000 ekin = 1.63581226896463 | erot = 2.1111667918467 | epot = -12.1216020934218 | etot = -8.37462303261044 +533000 ekin = 1.58529617178013 | erot = 2.13870511838882 | epot = -12.0986243225211 | etot = -8.37462303235218 +534000 ekin = 1.52254564095829 | erot = 2.14737698822929 | epot = -12.0445456610111 | etot = -8.37462303182353 +535000 ekin = 1.45332420577031 | erot = 2.13977370493955 | epot = -11.9677209418325 | etot = -8.37462303112261 +536000 ekin = 1.38421691011895 | erot = 2.12031314070428 | epot = -11.8791530811919 | etot = -8.37462303036864 +537000 ekin = 1.32180342899929 | erot = 2.09425520394406 | epot = -11.7906816626133 | etot = -8.37462302966991 +538000 ekin = 1.27187743420573 | erot = 2.06681107588934 | epot = -11.7133115391993 | etot = -8.37462302910426 +539000 ekin = 1.23883846279537 | erot = 2.04251647933667 | epot = -11.6559779708476 | etot = -8.37462302871558 +540000 ekin = 1.22531302703425 | erot = 2.02488499742798 | epot = -11.6248210529832 | etot = -8.37462302852096 +541000 ekin = 1.23199882291205 | erot = 2.01625749304676 | epot = -11.6228793444808 | etot = -8.37462302852195 +542000 ekin = 1.25769219451248 | erot = 2.01774880495238 | epot = -11.6500640281746 | etot = -8.37462302870978 +543000 ekin = 1.29945731407308 | erot = 2.02924170402515 | epot = -11.7033220471641 | etot = -8.37462302906591 +544000 ekin = 1.35291512122318 | erot = 2.04944893327204 | epot = -11.7769870840498 | etot = -8.37462302955459 +545000 ekin = 1.41265384122289 | erot = 2.07611668223704 | epot = -11.8633935535769 | etot = -8.37462303011699 +546000 ekin = 1.47277167575315 | erot = 2.10644216881038 | epot = -11.9538368752322 | etot = -8.37462303066866 +547000 ekin = 1.52754093319635 | erot = 2.13770468829281 | epot = -12.0398686526028 | etot = -8.37462303111365 +548000 ekin = 1.57213155238919 | erot = 2.16798237176649 | epot = -12.1147369555237 | etot = -8.37462303136797 +549000 ekin = 1.60327488859445 | erot = 2.19671767496084 | epot = -12.1746155949423 | etot = -8.37462303138697 +550000 ekin = 1.61972434376709 | erot = 2.22489244333565 | epot = -12.219239818284 | etot = -8.37462303118126 +551000 ekin = 1.62240013870483 | erot = 2.25470593136133 | epot = -12.2517291008792 | etot = -8.37462303081309 +552000 ekin = 1.61417495562361 | erot = 2.28884205647118 | epot = -12.2776400424738 | etot = -8.37462303037905 +553000 ekin = 1.59932782091749 | erot = 2.32954987377768 | epot = -12.3035007246832 | etot = -8.37462302998807 +554000 ekin = 1.5827459906671 | erot = 2.3777881761324 | epot = -12.3351571965401 | etot = -8.37462302974062 +555000 ekin = 1.56899856385031 | erot = 2.43263226771804 | epot = -12.3762538612779 | etot = -8.37462302970954 +556000 ekin = 1.56145041157602 | erot = 2.49106505511668 | epot = -12.4271384966169 | etot = -8.37462302992416 +557000 ekin = 1.56197837218677 | erot = 2.54829507223601 | epot = -12.4848964746456 | etot = -8.37462303022277 +558000 ekin = 1.57029216551734 | erot = 2.59810209182387 | epot = -12.5430172882088 | etot = -8.37462303086757 +559000 ekin = 1.58339818320791 | erot = 2.63367391511495 | epot = -12.5916951298592 | etot = -8.3746230315363 +560000 ekin = 1.59712770481022 | erot = 2.64904697988658 | epot = -12.6207977168081 | etot = -8.37462303211135 +561000 ekin = 1.60698123343006 | erot = 2.64009683894503 | epot = -12.6217011048634 | etot = -8.37462303248831 +562000 ekin = 1.60896027782097 | erot = 2.60532700120818 | epot = -12.5889103116217 | etot = -8.37462303259257 +563000 ekin = 1.60023696633043 | erot = 2.54649193869621 | epot = -12.5213519373451 | etot = -8.37462303231848 +564000 ekin = 1.57955774677214 | erot = 2.46891092806291 | epot = -12.4230917066634 | etot = -8.37462303182835 +565000 ekin = 1.54734561566674 | erot = 2.38031455632116 | epot = -12.3022832030957 | etot = -8.3746230311078 +566000 ekin = 1.5055446855442 | erot = 2.29049479450215 | epot = -12.1706625102933 | etot = -8.37462303024697 +567000 ekin = 1.45732250665219 | erot = 2.21025028826183 | epot = -12.0421958242629 | etot = -8.37462302934887 +568000 ekin = 1.40671207380929 | erot = 2.15003703753047 | epot = -11.9313721398977 | etot = -8.3746230285579 +569000 ekin = 1.35794157949263 | erot = 2.11775595086814 | epot = -11.8503205583487 | etot = -8.37462302798794 +570000 ekin = 1.31523212119468 | erot = 2.11799693943003 | epot = -11.8078520883709 | etot = -8.37462302774614 +571000 ekin = 1.28243871605086 | erot = 2.15081941192853 | epot = -11.8078811559413 | etot = -8.37462302796192 +572000 ekin = 1.26220633019376 | erot = 2.2102703424972 | epot = -11.8470997013807 | etot = -8.37462302868972 +573000 ekin = 1.25525341535257 | erot = 2.28456705415208 | epot = -11.9144434992943 | etot = -8.37462302978967 +574000 ekin = 1.26030251434112 | erot = 2.35813787036021 | epot = -11.9930634156831 | etot = -8.37462303098173 +575000 ekin = 1.2747321562316 | erot = 2.41511328226678 | epot = -12.0644684704335 | etot = -8.37462303193515 +576000 ekin = 1.29562562245951 | erot = 2.44294920216406 | epot = -12.1131978571128 | etot = -8.37462303248922 +577000 ekin = 1.32065634432137 | erot = 2.4343858678001 | epot = -12.129665244697 | etot = -8.37462303257555 +578000 ekin = 1.34847271375488 | erot = 2.38804498568619 | epot = -12.1111407317151 | etot = -8.37462303227407 +579000 ekin = 1.37859640731489 | erot = 2.30759327889185 | epot = -12.0608127179344 | etot = -8.37462303172763 +580000 ekin = 1.41115339286507 | erot = 2.20016188412019 | epot = -11.9859383079394 | etot = -8.37462303095417 +581000 ekin = 1.44674776515311 | erot = 2.07475133368239 | epot = -11.8961221291764 | etot = -8.3746230303409 +582000 ekin = 1.4851482181056 | erot = 1.94050793885046 | epot = -11.8002791867472 | etot = -8.37462302979113 +583000 ekin = 1.52576266955674 | erot = 1.80603709651288 | epot = -11.7064227954087 | etot = -8.37462302933907 +584000 ekin = 1.56772288057633 | erot = 1.67887072897788 | epot = -11.6212166385574 | etot = -8.37462302900324 +585000 ekin = 1.60990333959043 | erot = 1.56509115871858 | epot = -11.5496175271048 | etot = -8.37462302879577 +586000 ekin = 1.65096359832029 | erot = 1.46905708282353 | epot = -11.4946437098695 | etot = -8.37462302872568 +587000 ekin = 1.68940411634564 | erot = 1.39319741551335 | epot = -11.4572245606547 | etot = -8.37462302879574 +588000 ekin = 1.7236417052592 | erot = 1.33790137443014 | epot = -11.4361661086849 | etot = -8.37462302899558 +589000 ekin = 1.75212209151151 | erot = 1.30158756259673 | epot = -11.4283326833832 | etot = -8.37462302927499 +590000 ekin = 1.7734877690591 | erot = 1.28111987725434 | epot = -11.4292306759286 | etot = -8.37462302961515 +591000 ekin = 1.78679652583164 | erot = 1.27228388602452 | epot = -11.4337034417691 | etot = -8.37462302991292 +592000 ekin = 1.79174476961307 | erot = 1.27074179820056 | epot = -11.4371095979203 | etot = -8.37462303010663 +593000 ekin = 1.78882244318556 | erot = 1.27295060806053 | epot = -11.4363960813899 | etot = -8.37462303014385 +594000 ekin = 1.77931578999128 | erot = 1.27682752830015 | epot = -11.4307663483171 | etot = -8.37462303002563 +595000 ekin = 1.76511936071165 | erot = 1.28196044220613 | epot = -11.4217028327155 | etot = -8.37462302979776 +596000 ekin = 1.74839643258916 | erot = 1.28931412525878 | epot = -11.4123335873789 | etot = -8.37462302953091 +597000 ekin = 1.73114837528962 | erot = 1.30076368908067 | epot = -11.4065350936649 | etot = -8.37462302929462 +598000 ekin = 1.71482586357112 | erot = 1.31808503745119 | epot = -11.4075339301702 | etot = -8.37462302914792 +599000 ekin = 1.70035612855311 | erot = 1.34256499056023 | epot = -11.4175441481798 | etot = -8.37462302906646 +600000 ekin = 1.68813838895978 | erot = 1.37518403996367 | epot = -11.4379454579681 | etot = -8.37462302904461 +601000 ekin = 1.67802155271441 | erot = 1.41656361607937 | epot = -11.4692081979158 | etot = -8.37462302912207 +602000 ekin = 1.66952241262264 | erot = 1.4666430273455 | epot = -11.5107884691303 | etot = -8.37462302916217 +603000 ekin = 1.66207455080015 | erot = 1.52486246590599 | epot = -11.5615600459972 | etot = -8.3746230292911 +604000 ekin = 1.65429274424403 | erot = 1.59090716726236 | epot = -11.6198229408972 | etot = -8.37462302939085 +605000 ekin = 1.64513458460529 | erot = 1.66451963176718 | epot = -11.6842772458403 | etot = -8.37462302946786 +606000 ekin = 1.63397297141698 | erot = 1.74533329764484 | epot = -11.7539292986205 | etot = -8.3746230295587 +607000 ekin = 1.62046446185711 | erot = 1.83246852419141 | epot = -11.8275560158107 | etot = -8.37462302976218 +608000 ekin = 1.60415138615035 | erot = 1.92384516554888 | epot = -11.9026195817841 | etot = -8.37462303008485 +609000 ekin = 1.58416607277181 | erot = 2.01562004721373 | epot = -11.9744091506942 | etot = -8.37462303070865 +610000 ekin = 1.55892234884572 | erot = 2.10126039812651 | epot = -12.0348057783744 | etot = -8.37462303140216 +611000 ekin = 1.52586403282394 | erot = 2.17351542350385 | epot = -12.0740024883752 | etot = -8.37462303204737 +612000 ekin = 1.48252796781607 | erot = 2.22604744671485 | epot = -12.08319844693 | etot = -8.37462303239904 +613000 ekin = 1.42777710478085 | erot = 2.25549715886452 | epot = -12.0578972959105 | etot = -8.37462303226511 +614000 ekin = 1.3628430267639 | erot = 2.26309761368147 | epot = -12.0005636720633 | etot = -8.3746230316179 +615000 ekin = 1.29166682111812 | erot = 2.25472033316445 | epot = -11.9210101848959 | etot = -8.37462303061333 +616000 ekin = 1.22033159946011 | erot = 2.23929049959926 | epot = -11.8342451285637 | etot = -8.37462302950437 +617000 ekin = 1.15585313013231 | erot = 2.22643765863228 | epot = -11.7569138172907 | etot = -8.3746230285261 +618000 ekin = 1.10482633868852 | erot = 2.22445549379376 | epot = -11.7039048603085 | etot = -8.37462302782626 +619000 ekin = 1.07233800596022 | erot = 2.23915844396351 | epot = -11.6861194773919 | etot = -8.37462302746814 +620000 ekin = 1.06133969548983 | erot = 2.27356598266004 | epot = -11.7095287055634 | etot = -8.37462302741356 +621000 ekin = 1.07250328126401 | erot = 2.32827640438157 | epot = -11.7754027132578 | etot = -8.37462302761218 +622000 ekin = 1.1044829924491 | erot = 2.40202886261627 | epot = -11.8811348830564 | etot = -8.374623027991 +623000 ekin = 1.15443583440766 | erot = 2.49214268564081 | epot = -12.0212015485464 | etot = -8.37462302849796 +624000 ekin = 1.21858504498424 | erot = 2.5947997927632 | epot = -12.18800786685 | etot = -8.37462302910256 +625000 ekin = 1.29260009293184 | erot = 2.70513041487812 | epot = -12.3723535376525 | etot = -8.37462302984255 +626000 ekin = 1.37166908701492 | erot = 2.81669294847818 | epot = -12.5629850662672 | etot = -8.37462303077413 +627000 ekin = 1.45036408326109 | erot = 2.92095656626005 | epot = -12.7459436814237 | etot = -8.37462303190255 +628000 ekin = 1.52265779658264 | erot = 3.00738157699458 | epot = -12.9046624066692 | etot = -8.37462303309196 +629000 ekin = 1.58251554245296 | erot = 3.06484099788415 | epot = -13.0219795743847 | etot = -8.3746230340476 +630000 ekin = 1.62514418880762 | erot = 3.08443014421921 | epot = -13.0841973674672 | etot = -8.37462303444039 +631000 ekin = 1.64954255051894 | erot = 3.06336922299649 | epot = -13.0875348072763 | etot = -8.37462303376085 +632000 ekin = 1.65761419154519 | erot = 3.00573585957028 | epot = -13.0379730840961 | etot = -8.37462303298061 +633000 ekin = 1.6517479509391 | erot = 2.91965232775885 | epot = -12.9460233106084 | etot = -8.37462303191049 +634000 ekin = 1.63566753657902 | erot = 2.81604656740808 | epot = -12.8263371348676 | etot = -8.3746230308805 +635000 ekin = 1.61303222683961 | erot = 2.70552755469806 | epot = -12.6931828116427 | etot = -8.37462303010504 +636000 ekin = 1.58646965555962 | erot = 2.5963371949764 | epot = -12.5574298801698 | etot = -8.37462302963381 +637000 ekin = 1.55730595136398 | erot = 2.49385627804023 | epot = -12.4257852588016 | etot = -8.37462302939739 +638000 ekin = 1.52584911625133 | erot = 2.40123459740287 | epot = -12.3017067429364 | etot = -8.37462302928216 +639000 ekin = 1.49192497641185 | erot = 2.32043250456993 | epot = -12.1869805101672 | etot = -8.37462302918542 +640000 ekin = 1.45541378442356 | erot = 2.25314232064229 | epot = -12.0831791341069 | etot = -8.374623029041 +641000 ekin = 1.41664919926921 | erot = 2.20135144253767 | epot = -11.9926236706291 | etot = -8.37462302882226 +642000 ekin = 1.376631358572 | erot = 2.16751840710179 | epot = -11.918772794211 | etot = -8.37462302853725 +643000 ekin = 1.33719601643057 | erot = 2.15436138730356 | epot = -11.8661804319133 | etot = -8.37462302817919 +644000 ekin = 1.30095460066741 | erot = 2.16433354913846 | epot = -11.839911177714 | etot = -8.37462302790811 +645000 ekin = 1.27009047740861 | erot = 2.19964354153175 | epot = -11.8443570466466 | etot = -8.37462302770626 +646000 ekin = 1.24673444984187 | erot = 2.26154821905476 | epot = -11.8829056965369 | etot = -8.37462302764027 +647000 ekin = 1.23265873216219 | erot = 2.34972644270293 | epot = -11.9570082026423 | etot = -8.37462302777716 +648000 ekin = 1.2285470414815 | erot = 2.46146984669589 | epot = -12.0646399168505 | etot = -8.37462302867306 +649000 ekin = 1.2312343827645 | erot = 2.5891828411036 | epot = -12.1950402535055 | etot = -8.37462302963742 +650000 ekin = 1.23733747326857 | erot = 2.72274115030274 | epot = -12.3347016542761 | etot = -8.37462303070479 +651000 ekin = 1.2428991851106 | erot = 2.85114575375435 | epot = -12.4686679705912 | etot = -8.37462303172626 +652000 ekin = 1.24424620799569 | erot = 2.96370857038951 | epot = -12.582577810847 | etot = -8.37462303246178 +653000 ekin = 1.23918232849206 | erot = 3.05217314602615 | epot = -12.6659785072747 | etot = -8.37462303275648 +654000 ekin = 1.22772861476413 | erot = 3.11212236728161 | epot = -12.7144740146629 | etot = -8.37462303261719 +655000 ekin = 1.21201905899387 | erot = 3.14303840851451 | epot = -12.7296804996997 | etot = -8.37462303219133 +656000 ekin = 1.1954374432854 | erot = 3.14720435564397 | epot = -12.7172648305973 | etot = -8.37462303166789 +657000 ekin = 1.18149305106227 | erot = 3.12826014301131 | epot = -12.6843762252558 | etot = -8.37462303118225 +658000 ekin = 1.17296379520024 | erot = 3.09016086422142 | epot = -12.6377476902079 | etot = -8.37462303078623 +659000 ekin = 1.17154758057418 | erot = 3.03675236921232 | epot = -12.582922980259 | etot = -8.37462303047247 +660000 ekin = 1.17794903027368 | erot = 2.97172379744613 | epot = -12.5242958579375 | etot = -8.37462303021774 +661000 ekin = 1.19217998580361 | erot = 2.89858436848302 | epot = -12.465387384301 | etot = -8.37462303001441 +662000 ekin = 1.21385724617909 | erot = 2.8204360835798 | epot = -12.4089163596437 | etot = -8.37462302988477 +663000 ekin = 1.24235148672387 | erot = 2.73948706946881 | epot = -12.3564615860714 | etot = -8.3746230298787 +664000 ekin = 1.27672733537756 | erot = 2.65640555000488 | epot = -12.3077559154361 | etot = -8.37462303005371 +665000 ekin = 1.3155133703301 | erot = 2.56977925410127 | epot = -12.259915654865 | etot = -8.37462303043361 +666000 ekin = 1.35644708325268 | erot = 2.47610382427562 | epot = -12.2071739384901 | etot = -8.37462303096184 +667000 ekin = 1.39640549571966 | erot = 2.37072397310103 | epot = -12.141752500303 | etot = -8.37462303148232 +668000 ekin = 1.43167926156719 | erot = 2.24978389246461 | epot = -12.0560861858188 | etot = -8.37462303178698 +669000 ekin = 1.45855421041098 | erot = 2.1125387740665 | epot = -11.9457160161998 | etot = -8.3746230317223 +670000 ekin = 1.4739508646895 | erot = 1.96284004635527 | epot = -11.811413942324 | etot = -8.37462303127918 +671000 ekin = 1.47583917683516 | erot = 1.80887360748583 | epot = -11.6593358149112 | etot = -8.37462303059023 +672000 ekin = 1.46334042173585 | erot = 1.66127989926278 | epot = -11.4992433508348 | etot = -8.37462302983621 +673000 ekin = 1.43665130212379 | erot = 1.53074210399054 | epot = -11.3420164352628 | etot = -8.37462302914845 +674000 ekin = 1.39696147641158 | erot = 1.4261974886037 | epot = -11.1977819935895 | etot = -8.37462302857419 +675000 ekin = 1.34640262234309 | erot = 1.35413730294751 | epot = -11.0751629533952 | etot = -8.37462302810457 +676000 ekin = 1.28794616800361 | erot = 1.31873912036471 | epot = -10.9813083160886 | etot = -8.3746230277203 +677000 ekin = 1.22516961115512 | erot = 1.32230065786699 | epot = -10.9220932964427 | etot = -8.3746230274206 +678000 ekin = 1.16189722958258 | erot = 1.36556643967189 | epot = -10.9020866964826 | etot = -8.3746230272281 +679000 ekin = 1.10179124612821 | erot = 1.44777635009357 | epot = -10.9241906234063 | etot = -8.37462302718452 +680000 ekin = 1.04797419612249 | erot = 1.56642353037808 | epot = -10.9890207538446 | etot = -8.37462302734408 +681000 ekin = 1.0027227986418 | erot = 1.71676662170909 | epot = -11.0941124481197 | etot = -8.37462302776882 +682000 ekin = 0.967238825856233 | erot = 1.8911823872756 | epot = -11.2330442416469 | etot = -8.37462302851509 +683000 ekin = 0.941511133160514 | erot = 2.07856636781677 | epot = -11.3947005305749 | etot = -8.37462302959759 +684000 ekin = 0.924337639173223 | erot = 2.26421473260651 | epot = -11.563175402715 | etot = -8.37462303093528 +685000 ekin = 0.913629093908647 | erot = 2.43080490188115 | epot = -11.7190570280992 | etot = -8.37462303230945 +686000 ekin = 0.907072709288103 | erot = 2.5609064397186 | epot = -11.8426021824015 | etot = -8.37462303339479 +687000 ekin = 0.903027971000719 | erot = 2.64065323918573 | epot = -11.9183042440776 | etot = -8.37462303389114 +688000 ekin = 0.901265997346188 | erot = 2.6631528356665 | epot = -11.9390418666978 | etot = -8.37462303368509 +689000 ekin = 0.903127291409492 | erot = 2.62989920641101 | epot = -11.9076495307305 | etot = -8.37462303290999 +690000 ekin = 0.911003410961571 | erot = 2.54949432632226 | epot = -11.8351207691344 | etot = -8.37462303185061 +691000 ekin = 0.927482290198771 | erot = 2.4345890933302 | epot = -11.7366944143114 | etot = -8.3746230307824 +692000 ekin = 0.954629968086057 | erot = 2.29871133595466 | epot = -11.6279643338859 | etot = -8.3746230298452 +693000 ekin = 0.993689842549661 | erot = 2.15457291081397 | epot = -11.5228857825773 | etot = -8.3746230292137 +694000 ekin = 1.04477766676423 | erot = 2.01224824489153 | epot = -11.4316489404319 | etot = -8.37462302877615 +695000 ekin = 1.10717972560328 | erot = 1.87902519875939 | epot = -11.360827952868 | etot = -8.37462302850538 +696000 ekin = 1.17962988094485 | erot = 1.76021636431916 | epot = -11.3144692736453 | etot = -8.37462302838133 +697000 ekin = 1.2603450806723 | erot = 1.6593933195001 | epot = -11.2943614285665 | etot = -8.37462302839413 +698000 ekin = 1.34700634148289 | erot = 1.57856058320758 | epot = -11.300189953228 | etot = -8.37462302853757 +699000 ekin = 1.43673776972643 | erot = 1.51829388886952 | epot = -11.3296546873983 | etot = -8.37462302880231 +700000 ekin = 1.52614311404927 | erot = 1.4778859710023 | epot = -11.3786521142197 | etot = -8.37462302916816 +701000 ekin = 1.61113170993981 | erot = 1.45542937143897 | epot = -11.441184111167 | etot = -8.37462302978825 +702000 ekin = 1.68654811959934 | erot = 1.44774835139973 | epot = -11.5089195013107 | etot = -8.37462303031159 +703000 ekin = 1.74804176728682 | erot = 1.45137774866603 | epot = -11.5740425467015 | etot = -8.37462303074865 +704000 ekin = 1.79223863051471 | erot = 1.463266771069 | epot = -11.6301284325925 | etot = -8.3746230310088 +705000 ekin = 1.81722742450292 | erot = 1.48152907261418 | epot = -11.6733795281508 | etot = -8.37462303103365 +706000 ekin = 1.82282717411087 | erot = 1.50598222607883 | epot = -11.7034324310159 | etot = -8.37462303082617 +707000 ekin = 1.81047570465443 | erot = 1.53820736290229 | epot = -11.7233060980094 | etot = -8.37462303045267 +708000 ekin = 1.78276828494856 | erot = 1.5810549503857 | epot = -11.7384462653514 | etot = -8.37462303001716 +709000 ekin = 1.74282721670422 | erot = 1.63779752304503 | epot = -11.7552477693651 | etot = -8.3746230296159 +710000 ekin = 1.69374790021974 | erot = 1.71129566719954 | epot = -11.7796665967228 | etot = -8.37462302930356 +711000 ekin = 1.63830193399518 | erot = 1.80347448194939 | epot = -11.8163994450321 | etot = -8.37462302908752 +712000 ekin = 1.57892460631358 | erot = 1.91516553832407 | epot = -11.8687131735881 | etot = -8.37462302895043 +713000 ekin = 1.51786752130003 | erot = 2.04613993381954 | epot = -11.9386304840005 | etot = -8.37462302888094 +714000 ekin = 1.45734042325197 | erot = 2.19509441547551 | epot = -12.02705786762 | etot = -8.37462302889253 +715000 ekin = 1.39951776248685 | erot = 2.35946536295189 | epot = -12.1336061544577 | etot = -8.37462302901895 +716000 ekin = 1.34639246829324 | erot = 2.53511986598303 | epot = -12.2561353635752 | etot = -8.37462302929896 +717000 ekin = 1.2995543227021 | erot = 2.71613012099382 | epot = -12.3903074734227 | etot = -8.37462302972674 +718000 ekin = 1.25989829927655 | erot = 2.89465680807112 | epot = -12.529178137729 | etot = -8.37462303038131 +719000 ekin = 1.22750607430035 | erot = 3.0609266584271 | epot = -12.6630557638755 | etot = -8.37462303114804 +720000 ekin = 1.20188187066626 | erot = 3.20425006665908 | epot = -12.7807549692629 | etot = -8.37462303193757 +721000 ekin = 1.18220717983388 | erot = 3.31414882432986 | epot = -12.8709790367794 | etot = -8.37462303261566 +722000 ekin = 1.16774608427155 | erot = 3.38185582435782 | epot = -12.9242249417163 | etot = -8.3746230330869 +723000 ekin = 1.15807318397684 | erot = 3.40183188750477 | epot = -12.9345281046215 | etot = -8.37462303313988 +724000 ekin = 1.15381445068197 | erot = 3.37321067522661 | epot = -12.9016481586615 | etot = -8.3746230327529 +725000 ekin = 1.15678266077648 | erot = 3.30036671004678 | epot = -12.8317724028176 | etot = -8.37462303199429 +726000 ekin = 1.1696197829841 | erot = 3.19222682083445 | epot = -12.7364696348434 | etot = -8.37462303102484 +727000 ekin = 1.19513165181306 | erot = 3.06063268781604 | epot = -12.6303873696639 | etot = -8.37462303003481 +728000 ekin = 1.23552066624288 | erot = 2.91835949412803 | epot = -12.528503189554 | etot = -8.37462302918309 +729000 ekin = 1.29175272909129 | erot = 2.77740116858225 | epot = -12.4437769262409 | etot = -8.37462302856741 +730000 ekin = 1.36319675322391 | erot = 2.64784734353971 | epot = -12.3856671249843 | etot = -8.37462302822068 +731000 ekin = 1.44757535461589 | erot = 2.5373686940048 | epot = -12.3595670767478 | etot = -8.37462302812714 +732000 ekin = 1.54119076310014 | erot = 2.45114849793169 | epot = -12.3669622892763 | etot = -8.37462302824445 +733000 ekin = 1.63933166940277 | erot = 2.39205275840519 | epot = -12.4060074563318 | etot = -8.37462302852384 +734000 ekin = 1.73673684349954 | erot = 2.36087235949882 | epot = -12.4722322319222 | etot = -8.37462302892382 +735000 ekin = 1.82801503458665 | erot = 2.35655963725895 | epot = -12.5591977012549 | etot = -8.37462302940934 +736000 ekin = 1.90799093496349 | erot = 2.37647912513091 | epot = -12.6590930900375 | etot = -8.37462302994312 +737000 ekin = 1.97201607374088 | erot = 2.4167506508678 | epot = -12.7633897550823 | etot = -8.37462303047367 +738000 ekin = 2.01630111185894 | erot = 2.47274745432201 | epot = -12.8636715971178 | etot = -8.3746230309369 +739000 ekin = 2.03827941487237 | erot = 2.53972508206368 | epot = -12.9526275282042 | etot = -8.37462303126812 +740000 ekin = 2.03693425613014 | erot = 2.61344505993422 | epot = -13.0250023474899 | etot = -8.37462303142556 +741000 ekin = 2.01297029115499 | erot = 2.6905926898588 | epot = -13.0781860124239 | etot = -8.37462303141013 +742000 ekin = 1.96872639115255 | erot = 2.768825663029 | epot = -13.1121750854509 | etot = -8.37462303126931 +743000 ekin = 1.90780895371572 | erot = 2.84642411506864 | epot = -13.1288560998665 | etot = -8.37462303108214 +744000 ekin = 1.8345263395222 | erot = 2.92167512844754 | epot = -13.1308244989033 | etot = -8.37462303093354 +745000 ekin = 1.75327142725026 | erot = 2.99223326162045 | epot = -13.1201277197558 | etot = -8.37462303088513 +746000 ekin = 1.66800377362375 | erot = 3.05470990306177 | epot = -13.0973367076427 | etot = -8.37462303095714 +747000 ekin = 1.58193446041863 | erot = 3.10466510764813 | epot = -13.0612225991804 | etot = -8.37462303111363 +748000 ekin = 1.49744243756517 | erot = 3.13708170333216 | epot = -13.0091471722161 | etot = -8.37462303131874 +749000 ekin = 1.41618008601908 | erot = 3.14699639332627 | epot = -12.9377995108354 | etot = -8.37462303149001 +750000 ekin = 1.33927892445982 | erot = 3.13031955346438 | epot = -12.8442215094966 | etot = -8.37462303157238 +751000 ekin = 1.26755716712042 | erot = 3.08449081841744 | epot = -12.7266710170775 | etot = -8.37462303153961 +752000 ekin = 1.20166403421557 | erot = 3.00876367724929 | epot = -12.5850507428598 | etot = -8.37462303139489 +753000 ekin = 1.14214671459751 | erot = 2.90415589317544 | epot = -12.420925638931 | etot = -8.3746230311581 +754000 ekin = 1.08946987137479 | erot = 2.77319742895417 | epot = -12.237290331179 | etot = -8.37462303085001 +755000 ekin = 1.0440339069345 | erot = 2.61963797728223 | epot = -12.0382949147008 | etot = -8.37462303048408 +756000 ekin = 1.00622473319045 | erot = 2.44820898510135 | epot = -11.8290567483582 | etot = -8.37462303006641 +757000 ekin = 0.976498427351231 | erot = 2.26449263382691 | epot = -11.61561409075 | etot = -8.37462302957185 +758000 ekin = 0.955485081992856 | erot = 2.07490082913416 | epot = -11.405008940184 | etot = -8.37462302905695 +759000 ekin = 0.943970421442231 | erot = 1.88597944059498 | epot = -11.2045728906044 | etot = -8.37462302856723 +760000 ekin = 0.94294318912847 | erot = 1.70391676485065 | epot = -11.0214829820796 | etot = -8.3746230281005 +761000 ekin = 0.953636819966077 | erot = 1.53434362883834 | epot = -10.8626034764908 | etot = -8.37462302768642 +762000 ekin = 0.977439463714333 | erot = 1.38197793547307 | epot = -10.7340404265375 | etot = -8.37462302735008 +763000 ekin = 1.01575214957369 | erot = 1.25038414094113 | epot = -10.6407593176248 | etot = -8.37462302710998 +764000 ekin = 1.06980632715205 | erot = 1.14186552721226 | epot = -10.5862948813435 | etot = -8.37462302697918 +765000 ekin = 1.14045321590921 | erot = 1.05746802222288 | epot = -10.572544265099 | etot = -8.37462302696695 +766000 ekin = 1.22794009365167 | erot = 0.997057737111095 | epot = -10.5996208578428 | etot = -8.37462302708006 +767000 ekin = 1.33169356855031 | erot = 0.959438204819042 | epot = -10.6657548006913 | etot = -8.3746230273219 +768000 ekin = 1.45013707581703 | erot = 0.942489485935499 | epot = -10.7672495894428 | etot = -8.37462302769026 +769000 ekin = 1.58057826605238 | erot = 0.943330765761073 | epot = -10.8985320599873 | etot = -8.37462302817388 +770000 ekin = 1.71920830316292 | erot = 0.958522817508245 | epot = -11.0523541494183 | etot = -8.37462302874711 +771000 ekin = 1.86125297318996 | erot = 0.984329269144567 | epot = -11.220205271702 | etot = -8.37462302936751 +772000 ekin = 2.00111996073709 | erot = 1.01706547584897 | epot = -11.3928084666614 | etot = -8.37462303007532 +773000 ekin = 2.1317967939265 | erot = 1.05343215414609 | epot = -11.5598519787626 | etot = -8.37462303068999 +774000 ekin = 2.24724323873757 | erot = 1.09038833141808 | epot = -11.7122546013415 | etot = -8.37462303118583 +775000 ekin = 2.34263593747233 | erot = 1.12564496607848 | epot = -11.8429039350699 | etot = -8.37462303151911 +776000 ekin = 2.41469510966418 | erot = 1.15782091195824 | epot = -11.947139053297 | etot = -8.37462303167463 +777000 ekin = 2.4619556450855 | erot = 1.18638590330236 | epot = -12.0229645800573 | etot = -8.37462303166939 +778000 ekin = 2.48471522536204 | erot = 1.21145891744653 | epot = -12.0707971743579 | etot = -8.3746230315493 +779000 ekin = 2.4846604780691 | erot = 1.2335280968423 | epot = -12.0928116062859 | etot = -8.37462303137446 +780000 ekin = 2.46428568677061 | erot = 1.25319615838862 | epot = -12.0921048763539 | etot = -8.37462303119463 +781000 ekin = 2.42632307022458 | erot = 1.27107093313009 | epot = -12.0720170343794 | etot = -8.37462303102472 +782000 ekin = 2.3734174717913 | erot = 1.28787882377807 | epot = -12.0359193264086 | etot = -8.37462303083922 +783000 ekin = 2.30815170371841 | erot = 1.30476531775884 | epot = -11.9875400520689 | etot = -8.37462303059164 +784000 ekin = 2.23331824904295 | erot = 1.32360971124808 | epot = -11.9315509905412 | etot = -8.37462303025017 +785000 ekin = 2.1521766671689 | erot = 1.34711489735433 | epot = -11.8739145943554 | etot = -8.37462302983219 +786000 ekin = 2.0684394078588 | erot = 1.37850506799305 | epot = -11.8215675052583 | etot = -8.37462302940647 +787000 ekin = 1.98588342004498 | erot = 1.42085370631113 | epot = -11.7813601554292 | etot = -8.37462302907311 +788000 ekin = 1.90769396723937 | erot = 1.4762681420715 | epot = -11.7585851382311 | etot = -8.37462302892024 +789000 ekin = 1.83580155857719 | erot = 1.54525606071323 | epot = -11.7556806482768 | etot = -8.37462302898641 +790000 ekin = 1.77050160314919 | erot = 1.62653131911791 | epot = -11.7716559515123 | etot = -8.37462302924516 +791000 ekin = 1.71053482190188 | erot = 1.71731536906227 | epot = -11.8024732205822 | etot = -8.37462302961806 +792000 ekin = 1.65360852455023 | erot = 1.81397519201505 | epot = -11.8422067465732 | etot = -8.37462303000797 +793000 ekin = 1.59715988493776 | erot = 1.9127367140395 | epot = -11.884519629309 | etot = -8.37462303033172 +794000 ekin = 1.53909469766649 | erot = 2.01023412205765 | epot = -11.9239518502759 | etot = -8.37462303055179 +795000 ekin = 1.47829524950051 | erot = 2.1038294102128 | epot = -11.9567476903362 | etot = -8.3746230306229 +796000 ekin = 1.41481662089948 | erot = 2.19194291994204 | epot = -11.9813825714066 | etot = -8.37462303056506 +797000 ekin = 1.3498130825007 | erot = 2.27401207106091 | epot = -11.9984481839611 | etot = -8.37462303039944 +798000 ekin = 1.28529636431119 | erot = 2.35042093010661 | epot = -12.0103403245736 | etot = -8.37462303015585 +799000 ekin = 1.22381948474414 | erot = 2.42233570221925 | epot = -12.0207782168147 | etot = -8.37462302985134 +800000 ekin = 1.16822785386793 | erot = 2.49143438534642 | epot = -12.0342852688262 | etot = -8.37462302961189 +801000 ekin = 1.12099278643146 | erot = 2.55928816630765 | epot = -12.0549039821764 | etot = -8.37462302943733 +802000 ekin = 1.08396505814664 | erot = 2.62689447863251 | epot = -12.0854825661075 | etot = -8.37462302932839 +803000 ekin = 1.05841636960378 | erot = 2.69442631110788 | epot = -12.1274657101682 | etot = -8.37462302945653 +804000 ekin = 1.04426779801641 | erot = 2.76024770981174 | epot = -12.1791385376429 | etot = -8.37462302981472 +805000 ekin = 1.03995925234054 | erot = 2.82046254234402 | epot = -12.2350448251546 | etot = -8.37462303047002 +806000 ekin = 1.0424963991489 | erot = 2.86897163061675 | epot = -12.2860910609799 | etot = -8.37462303121428 +807000 ekin = 1.04816653315864 | erot = 2.89850351396218 | epot = -12.3212930790659 | etot = -8.37462303194513 +808000 ekin = 1.05329972431587 | erot = 2.9018949304571 | epot = -12.329817687259 | etot = -8.37462303248604 +809000 ekin = 1.05511003117022 | erot = 2.87378175151955 | epot = -12.3035148153802 | etot = -8.37462303269046 +810000 ekin = 1.05231348649519 | erot = 2.81208782293289 | epot = -12.2390243419939 | etot = -8.37462303256581 +811000 ekin = 1.04519713626699 | erot = 2.71854122751437 | epot = -12.1383613957887 | etot = -8.37462303200729 +812000 ekin = 1.03556509620662 | erot = 2.59875418167188 | epot = -12.0089423090923 | etot = -8.37462303121384 +813000 ekin = 1.02617370806627 | erot = 2.46123250523916 | epot = -11.8620292436477 | etot = -8.37462303034231 +814000 ekin = 1.01993499389596 | erot = 2.31562695725385 | epot = -11.7101849806766 | etot = -8.37462302952681 +815000 ekin = 1.01938989930175 | erot = 2.17131439137989 | epot = -11.5653273195317 | etot = -8.37462302885002 +816000 ekin = 1.02641070194214 | erot = 2.036432477289 | epot = -11.4374662075757 | etot = -8.3746230283446 +817000 ekin = 1.04210163740904 | erot = 1.91741411147404 | epot = -11.3341387768941 | etot = -8.37462302801105 +818000 ekin = 1.06685452879826 | erot = 1.818921940678 | epot = -11.2603994972601 | etot = -8.37462302778386 +819000 ekin = 1.100440731457 | erot = 1.74396570048527 | epot = -11.2190294597218 | etot = -8.3746230277795 +820000 ekin = 1.14169134058291 | erot = 1.69367065616436 | epot = -11.2099850246628 | etot = -8.37462302791549 +821000 ekin = 1.18877552115673 | erot = 1.66758281677341 | epot = -11.2309813661147 | etot = -8.37462302818457 +822000 ekin = 1.23927394202831 | erot = 1.6637849463546 | epot = -11.2776819169572 | etot = -8.37462302857428 +823000 ekin = 1.29027861043636 | erot = 1.67905219550916 | epot = -11.3439538348918 | etot = -8.37462302894627 +824000 ekin = 1.33894050069293 | erot = 1.70948347746921 | epot = -11.4230470076235 | etot = -8.37462302946136 +825000 ekin = 1.38220508273179 | erot = 1.75044253331283 | epot = -11.5072706460178 | etot = -8.37462302997318 +826000 ekin = 1.4171029491027 | erot = 1.79708475167485 | epot = -11.5888107311858 | etot = -8.37462303040827 +827000 ekin = 1.44127249565024 | erot = 1.84518129447392 | epot = -11.66107682082 | etot = -8.37462303069581 +828000 ekin = 1.45335409116449 | erot = 1.8917823095111 | epot = -11.7197594314613 | etot = -8.37462303078572 +829000 ekin = 1.45330184509384 | erot = 1.93565038632077 | epot = -11.7635752620779 | etot = -8.37462303066324 +830000 ekin = 1.44253588753448 | erot = 1.97732673255233 | epot = -11.7944856504421 | etot = -8.37462303035527 +831000 ekin = 1.42321719807673 | erot = 2.01836652050623 | epot = -11.8162067486483 | etot = -8.37462303006532 +832000 ekin = 1.39798324787262 | erot = 2.06093497422807 | epot = -11.8335412516822 | etot = -8.3746230295815 +833000 ekin = 1.37122558103758 | erot = 2.10801499213557 | epot = -11.8538636023364 | etot = -8.37462302916327 +834000 ekin = 1.34739157346286 | erot = 2.16168408584085 | epot = -11.8836986881983 | etot = -8.37462302889461 +835000 ekin = 1.33033159138597 | erot = 2.22243990039942 | epot = -11.9273945206137 | etot = -8.37462302882836 +836000 ekin = 1.32279692350256 | erot = 2.28888168436755 | epot = -11.986301636848 | etot = -8.3746230289779 +837000 ekin = 1.32614569945959 | erot = 2.35776552714714 | epot = -12.058534255923 | etot = -8.3746230293163 +838000 ekin = 1.3403008431344 | erot = 2.42442328376899 | epot = -12.1393471566817 | etot = -8.37462302977832 +839000 ekin = 1.36395770572684 | erot = 2.48350186340464 | epot = -12.222082599402 | etot = -8.37462303027048 +840000 ekin = 1.39499323416537 | erot = 2.52993036126219 | epot = -12.299546626116 | etot = -8.37462303068842 +841000 ekin = 1.43098519524504 | erot = 2.5599379691709 | epot = -12.3655461953596 | etot = -8.37462303094361 +842000 ekin = 1.46971603973845 | erot = 2.57185321601318 | epot = -12.4161922867453 | etot = -8.37462303099366 +843000 ekin = 1.50953312203373 | erot = 2.56639824287125 | epot = -12.4505543957627 | etot = -8.37462303085771 +844000 ekin = 1.54948222757244 | erot = 2.54631968023969 | epot = -12.4704249384232 | etot = -8.37462303061104 +845000 ekin = 1.58921446589296 | erot = 2.5154473187876 | epot = -12.4792848150357 | etot = -8.37462303035509 +846000 ekin = 1.62874660073221 | erot = 2.4775136944313 | epot = -12.4808833253415 | etot = -8.37462303017796 +847000 ekin = 1.66818957254827 | erot = 2.43516936578467 | epot = -12.477981968457 | etot = -8.37462303012405 +848000 ekin = 1.70754173431446 | erot = 2.38953851005258 | epot = -12.4717032745492 | etot = -8.37462303018218 +849000 ekin = 1.74659403306508 | erot = 2.34043091651812 | epot = -12.4616479798811 | etot = -8.37462303029795 +850000 ekin = 1.78494345866321 | erot = 2.28706007038529 | epot = -12.4466265594494 | etot = -8.37462303040093 +851000 ekin = 1.82207688727604 | erot = 2.2289142006414 | epot = -12.4256141183555 | etot = -8.3746230304381 +852000 ekin = 1.85747606626899 | erot = 2.16637383867245 | epot = -12.3984729353385 | etot = -8.37462303039711 +853000 ekin = 1.89070501215755 | erot = 2.10080168939738 | epot = -12.3661297318617 | etot = -8.37462303030681 +854000 ekin = 1.92146598579694 | erot = 2.03409194239609 | epot = -12.3301809584131 | etot = -8.3746230302201 +855000 ekin = 1.94963553788679 | erot = 1.96792069996032 | epot = -12.2921792680323 | etot = -8.37462303018517 +856000 ekin = 1.97530408452449 | erot = 1.90306034570378 | epot = -12.2529874604504 | etot = -8.37462303022214 +857000 ekin = 1.99898235174131 | erot = 1.83954776717695 | epot = -12.2131531489779 | etot = -8.37462303005959 +858000 ekin = 2.02148966893509 | erot = 1.77712472343153 | epot = -12.1732374225842 | etot = -8.37462303021759 +859000 ekin = 2.04332984814334 | erot = 1.71372610060062 | epot = -12.1316789790773 | etot = -8.37462303033332 +860000 ekin = 2.06530510863073 | erot = 1.64761266618404 | epot = -12.0875408051618 | etot = -8.374623030347 +861000 ekin = 2.08844047522602 | erot = 1.57839130430927 | epot = -12.0414548097696 | etot = -8.37462303023435 +862000 ekin = 2.11372996876901 | erot = 1.50759861505592 | epot = -11.9959516138468 | etot = -8.37462303002184 +863000 ekin = 2.14175193679491 | erot = 1.43866072802333 | epot = -11.9550356946058 | etot = -8.3746230297876 +864000 ekin = 2.17225364143819 | erot = 1.37614575517505 | epot = -11.9230224262469 | etot = -8.37462302963362 +865000 ekin = 2.20389689304742 | erot = 1.32450432847587 | epot = -11.9030242511591 | etot = -8.37462302963585 +866000 ekin = 2.23438769161032 | erot = 1.28681328070663 | epot = -11.8958240017877 | etot = -8.3746230294708 +867000 ekin = 2.26151301831441 | erot = 1.26501341500429 | epot = -11.9011494630749 | etot = -8.37462302975622 +868000 ekin = 2.28295312633932 | erot = 1.25876385670057 | epot = -11.916340013014 | etot = -8.37462302997407 +869000 ekin = 2.29713139087991 | erot = 1.26636363803581 | epot = -11.93811805896 | etot = -8.37462303004431 +870000 ekin = 2.30388454566185 | erot = 1.28638972777185 | epot = -11.9648973034193 | etot = -8.3746230299856 +871000 ekin = 2.30409365412262 | erot = 1.3178762126361 | epot = -11.9965928971142 | etot = -8.37462303035544 +872000 ekin = 2.29712455306445 | erot = 1.35930276714503 | epot = -12.0310503505629 | etot = -8.37462303035347 +873000 ekin = 2.2827453931626 | erot = 1.40846954678818 | epot = -12.065837970059 | etot = -8.37462303010826 +874000 ekin = 2.26320703627572 | erot = 1.46277950106312 | epot = -12.1006095675599 | etot = -8.37462303022103 +875000 ekin = 2.24001634728594 | erot = 1.51889022328616 | epot = -12.1335296008613 | etot = -8.37462303028924 +876000 ekin = 2.21430830467177 | erot = 1.57348199615488 | epot = -12.1624133311039 | etot = -8.37462303027722 +877000 ekin = 2.18777848573904 | erot = 1.6238902016126 | epot = -12.1862917175001 | etot = -8.37462303014841 +878000 ekin = 2.16252897548043 | erot = 1.66838793090838 | epot = -12.2055399364441 | etot = -8.3746230300553 +879000 ekin = 2.14044753722094 | erot = 1.70571411560618 | epot = -12.2207846828201 | etot = -8.37462302999299 +880000 ekin = 2.12277471002905 | erot = 1.73469967121715 | epot = -12.2320974112717 | etot = -8.37462303002546 +881000 ekin = 2.1097746736021 | erot = 1.75399371448778 | epot = -12.2383914182746 | etot = -8.37462303018477 +882000 ekin = 2.1005016432247 | erot = 1.76187019273806 | epot = -12.2369948664083 | etot = -8.37462303044556 +883000 ekin = 2.09290867712761 | erot = 1.75649694685333 | epot = -12.2240286546966 | etot = -8.37462303071566 +884000 ekin = 2.08433703645321 | erot = 1.73671500456619 | epot = -12.1956750719276 | etot = -8.37462303090818 +885000 ekin = 2.07202901572868 | erot = 1.70282592067691 | epot = -12.149477967362 | etot = -8.37462303095645 +886000 ekin = 2.05378411491616 | erot = 1.65660476472205 | epot = -12.085011910272 | etot = -8.37462303063378 +887000 ekin = 2.02874297420998 | erot = 1.60297409541633 | epot = -12.0063400996958 | etot = -8.37462303006953 +888000 ekin = 1.99720256583061 | erot = 1.54912086824732 | epot = -11.9209464635357 | etot = -8.37462302945781 +889000 ekin = 1.95913963735699 | erot = 1.50198702369296 | epot = -11.8357496899727 | etot = -8.37462302892274 +890000 ekin = 1.91617614841913 | erot = 1.46746689325901 | epot = -11.7582660702128 | etot = -8.37462302853469 +891000 ekin = 1.87023137415973 | erot = 1.44931992810327 | epot = -11.6941743305868 | etot = -8.3746230283238 +892000 ekin = 1.8231621873456 | erot = 1.44889048228621 | epot = -11.6466756979021 | etot = -8.37462302827025 +893000 ekin = 1.77672781685429 | erot = 1.46538080245983 | epot = -11.6167316476416 | etot = -8.37462302832747 +894000 ekin = 1.73267401007855 | erot = 1.49642015526062 | epot = -11.6037171937751 | etot = -8.37462302843589 +895000 ekin = 1.69287615444341 | erot = 1.53876375542455 | epot = -11.6062629384049 | etot = -8.3746230285369 +896000 ekin = 1.65946528810789 | erot = 1.58897281258336 | epot = -11.6230611292845 | etot = -8.37462302859323 +897000 ekin = 1.63484229163068 | erot = 1.64389812681416 | epot = -11.6533634470399 | etot = -8.37462302859503 +898000 ekin = 1.62150447332005 | erot = 1.70104293751331 | epot = -11.697170439403 | etot = -8.37462302856965 +899000 ekin = 1.62168394146258 | erot = 1.75850368945834 | epot = -11.7548106594898 | etot = -8.37462302856883 +900000 ekin = 1.63689346404302 | erot = 1.81470313447753 | epot = -11.8262196271621 | etot = -8.37462302864159 +901000 ekin = 1.66753387742819 | erot = 1.86808611524062 | epot = -11.9102430214838 | etot = -8.37462302881503 +902000 ekin = 1.71269692238274 | erot = 1.91693084841939 | epot = -12.0042507998873 | etot = -8.37462302908514 +903000 ekin = 1.77021838508481 | erot = 1.95934050990426 | epot = -12.1041819244145 | etot = -8.37462302942543 +904000 ekin = 1.83694819296821 | erot = 1.99341312084221 | epot = -12.2049843435908 | etot = -8.37462302978037 +905000 ekin = 1.90914641654266 | erot = 2.01754527647795 | epot = -12.30131472313 | etot = -8.37462303010942 +906000 ekin = 1.98289589688646 | erot = 2.03065122058688 | epot = -12.3881701478555 | etot = -8.37462303038212 +907000 ekin = 2.054438779243 | erot = 2.03228127523553 | epot = -12.4613430850655 | etot = -8.37462303058698 +908000 ekin = 2.12038320006242 | erot = 2.02259637575073 | epot = -12.5176026065432 | etot = -8.37462303073002 +909000 ekin = 2.17777472065707 | erot = 2.0022386877701 | epot = -12.5546364392526 | etot = -8.37462303082542 +910000 ekin = 2.22407231387976 | erot = 1.97218459089875 | epot = -12.5708799356625 | etot = -8.37462303088398 +911000 ekin = 2.25709881230759 | erot = 1.93367043925372 | epot = -12.5653922824647 | etot = -8.37462303090339 +912000 ekin = 2.27504055965831 | erot = 1.88824345124241 | epot = -12.5379070417669 | etot = -8.37462303086623 +913000 ekin = 2.27654326616713 | erot = 1.83792322947699 | epot = -12.4890895263909 | etot = -8.37462303074678 +914000 ekin = 2.26395838707267 | erot = 1.78540897804261 | epot = -12.4239903947872 | etot = -8.37462302967189 +915000 ekin = 2.24045468912196 | erot = 1.73372810068503 | epot = -12.3488058193217 | etot = -8.37462302951466 +916000 ekin = 2.20520370202174 | erot = 1.686151051967 | epot = -12.2659777832985 | etot = -8.37462302930976 +917000 ekin = 2.15800582906352 | erot = 1.64606783755989 | epot = -12.1786966957246 | etot = -8.3746230291012 +918000 ekin = 2.09921834411498 | erot = 1.61647797759857 | epot = -12.0903193506413 | etot = -8.37462302892771 +919000 ekin = 2.02966476142743 | erot = 1.599549497798 | epot = -12.0038372880272 | etot = -8.3746230288018 +920000 ekin = 1.95065755949502 | erot = 1.59642144855376 | epot = -11.9217020368434 | etot = -8.37462302879458 +921000 ekin = 1.8636620065108 | erot = 1.60750866079726 | epot = -11.8457936959376 | etot = -8.37462302862953 +922000 ekin = 1.77152243885364 | erot = 1.63263587421313 | epot = -11.7787813414912 | etot = -8.37462302842448 +923000 ekin = 1.67869484033055 | erot = 1.67111175334441 | epot = -11.7244296218603 | etot = -8.3746230281853 +924000 ekin = 1.59024537021244 | erot = 1.72202288864506 | epot = -11.6868912868186 | etot = -8.3746230279611 +925000 ekin = 1.51123937036936 | erot = 1.78411652410876 | epot = -11.6699789223007 | etot = -8.37462302782256 +926000 ekin = 1.44599317764589 | erot = 1.85554834407226 | epot = -11.6761645495391 | etot = -8.37462302782096 +927000 ekin = 1.39752558601065 | erot = 1.9337066123555 | epot = -11.7058552263247 | etot = -8.3746230279586 +928000 ekin = 1.36763823809538 | erot = 2.01538770680855 | epot = -11.757648972791 | etot = -8.37462302788704 +929000 ekin = 1.36100399983992 | erot = 2.09737818238218 | epot = -11.8330052106852 | etot = -8.37462302846307 +930000 ekin = 1.35523134970511 | erot = 2.17722433883731 | epot = -11.9070787109271 | etot = -8.37462302238468 +931000 ekin = 1.39431469299436 | erot = 2.25435620438246 | epot = -12.0232939189468 | etot = -8.37462302156997 +932000 ekin = 1.49280866705058 | erot = 2.31847930193787 | epot = -12.1859109889588 | etot = -8.37462301997038 +933000 ekin = 1.58533340946768 | erot = 2.36490000058057 | epot = -12.32485643027 | etot = -8.37462302022171 +934000 ekin = 1.68690712098869 | erot = 2.39298221168838 | epot = -12.4545123553117 | etot = -8.37462302263461 +935000 ekin = 1.78473836463911 | erot = 2.39676204060952 | epot = -12.5561234284532 | etot = -8.37462302320454 +936000 ekin = 1.8698772538689 | erot = 2.37258693733547 | epot = -12.6170872147102 | etot = -8.37462302350582 +937000 ekin = 1.93720452638615 | erot = 2.32043568374803 | epot = -12.6322632336394 | etot = -8.37462302350518 +938000 ekin = 1.98385208910065 | erot = 2.24266190734071 | epot = -12.6011370196626 | etot = -8.37462302322125 +939000 ekin = 2.00910923706108 | erot = 2.14379034932921 | epot = -12.5275226091194 | etot = -8.37462302272916 +940000 ekin = 2.01395507290262 | erot = 2.02993348654092 | epot = -12.4185115815347 | etot = -8.37462302209116 +941000 ekin = 2.00103743452152 | erot = 1.90808629517784 | epot = -12.2837467510742 | etot = -8.37462302137486 +942000 ekin = 1.97419824310677 | erot = 1.78546116622571 | epot = -12.1342824299717 | etot = -8.37462302063921 +943000 ekin = 1.93808318009367 | erot = 1.66892069893714 | epot = -11.9816268989612 | etot = -8.37462301993037 +944000 ekin = 1.89777663358483 | erot = 1.56456198515311 | epot = -11.836961638024 | etot = -8.37462301928607 +945000 ekin = 1.85843605735837 | erot = 1.4774221417752 | epot = -11.7104812178744 | etot = -8.37462301874083 +946000 ekin = 1.82491092896719 | erot = 1.41124588131947 | epot = -11.610779828619 | etot = -8.3746230183323 +947000 ekin = 1.8013422188344 | erot = 1.36826076777147 | epot = -11.5442260047056 | etot = -8.37462301809976 +948000 ekin = 1.79076227753392 | erot = 1.34894522657274 | epot = -11.5143305221863 | etot = -8.37462301807965 +949000 ekin = 1.79475359820132 | erot = 1.35184135984867 | epot = -11.5212179763387 | etot = -8.37462301828871 +950000 ekin = 1.81326202048993 | erot = 1.37352812801048 | epot = -11.5614131672086 | etot = -8.3746230187082 +951000 ekin = 1.84466122228548 | erot = 1.40888082073311 | epot = -11.6281650622951 | etot = -8.37462301927651 +952000 ekin = 1.88610598517686 | erot = 1.45166996305775 | epot = -11.7123989681328 | etot = -8.37462301989817 +953000 ekin = 1.93415626208494 | erot = 1.49545802208046 | epot = -11.8042373044908 | etot = -8.37462302032539 +954000 ekin = 1.98570845874811 | erot = 1.53486140750217 | epot = -11.8951928870177 | etot = -8.37462302076742 +955000 ekin = 2.03763688300238 | erot = 1.56575119867149 | epot = -11.9780111026985 | etot = -8.37462302102462 +956000 ekin = 2.08752516850599 | erot = 1.58576425992308 | epot = -12.0479124495213 | etot = -8.37462302109223 +957000 ekin = 2.13388693710964 | erot = 1.59443657079239 | epot = -12.1029465289046 | etot = -8.37462302100253 +958000 ekin = 2.17603134876323 | erot = 1.59291217741732 | epot = -12.1435665469902 | etot = -8.37462302080964 +959000 ekin = 2.21381255039645 | erot = 1.58343493106879 | epot = -12.1718705020378 | etot = -8.37462302057259 +960000 ekin = 2.24735101958252 | erot = 1.56876603527579 | epot = -12.1907400752033 | etot = -8.37462302034496 +961000 ekin = 2.27678636585394 | erot = 1.55164507323792 | epot = -12.2030544592584 | etot = -8.37462302016653 +962000 ekin = 2.30208813280108 | erot = 1.53436606871911 | epot = -12.2110772215847 | etot = -8.37462302006456 +963000 ekin = 2.32292955590133 | erot = 1.51849868398433 | epot = -12.2160512599371 | etot = -8.37462302005146 +964000 ekin = 2.33862421267245 | erot = 1.50476151876516 | epot = -12.2180087515633 | etot = -8.37462302012571 +965000 ekin = 2.34813222213143 | erot = 1.49304783092148 | epot = -12.2158030733237 | etot = -8.37462302027083 +966000 ekin = 2.35015122853115 | erot = 1.48260237418126 | epot = -12.2073766231662 | etot = -8.37462302045376 +967000 ekin = 2.34330726066097 | erot = 1.47233774696392 | epot = -12.1902680282532 | etot = -8.37462302062827 +968000 ekin = 2.32644504715423 | erot = 1.46125212630425 | epot = -12.1623201941992 | etot = -8.37462302074071 +969000 ekin = 2.29898771919739 | erot = 1.44887277461759 | epot = -12.1224835145563 | etot = -8.37462302074132 +970000 ekin = 2.26130276214329 | erot = 1.43562016619225 | epot = -12.0715459489323 | etot = -8.37462302059672 +971000 ekin = 2.21499063336338 | erot = 1.42298879008765 | epot = -12.0126024437513 | etot = -8.37462302030023 +972000 ekin = 2.16303757451795 | erot = 1.41348472406763 | epot = -11.9511453183675 | etot = -8.37462301978193 +973000 ekin = 2.10950969273511 | erot = 1.41039391551614 | epot = -11.8945266278569 | etot = -8.37462301960568 +974000 ekin = 2.05703199419742 | erot = 1.41732503873297 | epot = -11.8489800520861 | etot = -8.37462301915571 +975000 ekin = 2.01010390574851 | erot = 1.43732066922317 | epot = -11.8220475937238 | etot = -8.37462301875209 +976000 ekin = 1.97340114977604 | erot = 1.47261385396266 | epot = -11.8206380222139 | etot = -8.37462301847519 +977000 ekin = 1.95082006444706 | erot = 1.52416835984337 | epot = -11.8496114426886 | etot = -8.37462301839813 +978000 ekin = 1.94472832271128 | erot = 1.59131019459127 | epot = -11.9106615358755 | etot = -8.37462301857292 +979000 ekin = 1.95538713571685 | erot = 1.67153495870254 | epot = -12.0015451134338 | etot = -8.37462301901437 +980000 ekin = 1.9806772386571 | erot = 1.76051368575205 | epot = -12.1158139441915 | etot = -8.37462301978231 +981000 ekin = 2.0157957192546 | erot = 1.85207319538924 | epot = -12.2424919352912 | etot = -8.37462302064736 +982000 ekin = 2.05441082040089 | erot = 1.93952253755685 | epot = -12.3685563794566 | etot = -8.37462302149882 +983000 ekin = 2.08992138438914 | erot = 2.01671280308128 | epot = -12.4812572096503 | etot = -8.37462302217987 +984000 ekin = 2.11656909821701 | erot = 2.0791069696724 | epot = -12.5702990904621 | etot = -8.37462302257267 +985000 ekin = 2.13033501102878 | erot = 2.12464764346843 | epot = -12.6296056771301 | etot = -8.37462302263285 +986000 ekin = 2.12935596248979 | erot = 2.15403431725422 | epot = -12.6580133021435 | etot = -8.37462302239946 +987000 ekin = 2.11471923988066 | erot = 2.17104098415337 | epot = -12.6603832459165 | etot = -8.37462302188252 +988000 ekin = 2.09119735101514 | erot = 2.18228698931312 | epot = -12.6481073619531 | etot = -8.37462302162481 +989000 ekin = 2.06027968801239 | erot = 2.19075462083379 | epot = -12.6256573302412 | etot = -8.37462302139499 +990000 ekin = 2.02336255788569 | erot = 2.19843813688565 | epot = -12.5964237160084 | etot = -8.3746230212371 +991000 ekin = 1.9818807746635 | erot = 2.20638055720266 | epot = -12.5628843530201 | etot = -8.37462302115396 +992000 ekin = 1.93715749695397 | erot = 2.21473069767593 | epot = -12.5265112157503 | etot = -8.3746230211204 +993000 ekin = 1.89038311211027 | erot = 2.22307759878468 | epot = -12.4880837319987 | etot = -8.37462302110374 +994000 ekin = 1.84266575140808 | erot = 2.23084817708143 | epot = -12.4481369495678 | etot = -8.37462302107828 +995000 ekin = 1.79502825849046 | erot = 2.23761065997445 | epot = -12.4072619394846 | etot = -8.37462302101966 +996000 ekin = 1.74865820355827 | erot = 2.24323231086594 | epot = -12.3665135353626 | etot = -8.37462302093837 +997000 ekin = 1.70508150016762 | erot = 2.24765365390706 | epot = -12.3273581749305 | etot = -8.37462302085581 +998000 ekin = 1.66588125243956 | erot = 2.25078611336562 | epot = -12.2912903865797 | etot = -8.37462302077456 +999000 ekin = 1.63259998370264 | erot = 2.25262768593231 | epot = -12.2598506903066 | etot = -8.37462302067164 +1000000 ekin = 1.60661879878063 | erot = 2.2537352861968 | epot = -12.2349771055354 | etot = -8.37462302055793 + 1000000 0.1190088 -1.3493654 0.12586767 -1.0628358 0.00017426596 64000 +Loop time of 13.9702 on 4 procs for 1000000 steps with 10 atoms + +Performance: 61846.133 tau/day, 71581.172 timesteps/s +99.6% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 5.73 | 7.4134 | 9.1286 | 56.7 | 53.07 +Bond | 0.26662 | 0.33045 | 0.41401 | 10.3 | 2.37 +Neigh | 0.006735 | 0.0067415 | 0.006755 | 0.0 | 0.05 +Comm | 1.8191 | 2.0224 | 2.2513 | 11.6 | 14.48 +Output | 0.080433 | 0.083152 | 0.087335 | 0.9 | 0.60 +Modify | 0.52945 | 0.63648 | 0.73642 | 12.3 | 4.56 +Other | | 3.477 | | | 24.89 + +Nlocal: 2.50000 ave 3 max 2 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Nghost: 7.50000 ave 8 max 7 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Neighs: 17.5000 ave 20 max 15 min +Histogram: 2 0 0 0 0 0 0 0 0 2 + +Total # of neighbors = 70 +Ave neighs/atom = 7.0000000 +Ave special neighs/atom = 3.6000000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.1.* nocoeff +System init for write_data ... +Total wall time: 0:00:13 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.1 deleted file mode 100644 index 25cbf1e8a3..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.1 +++ /dev/null @@ -1,1182 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex1 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 10 atoms - reading velocities ... - 10 velocities - 10 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 8 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.003 seconds - -set atom * mass 3.1575 - 10 settings made for mass - -group all type 1 4 -10 atoms in group all - -# oxDNA2 bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA2 pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 -pair_coeff * * oxdna2/dh 0.1 1.0 0.815 - -# NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 2.6274048 - ghost atom cutoff = 2.6274048 - binsize = 1.3137024, bins = 31 31 31 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 2.627404783947349 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -14.6175140343334 | etot = -14.6175140343334 -Per MPI rank memory allocation (min/avg/max) = 8.021 | 8.021 | 8.021 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.4712768 0.009525411 -1.4617514 4.663076e-06 -1000 ekin = 0.00113086229080528 | erot = 0.0043101016040658 | epot = -14.6229549982368 | etot = -14.617514034342 -2000 ekin = 0.0044853322434243 | erot = 0.0171407706505008 | epot = -14.6391401372615 | etot = -14.6175140343675 -3000 ekin = 0.00995035259649285 | erot = 0.0381961780846484 | epot = -14.6656605650904 | etot = -14.6175140344093 -4000 ekin = 0.0173418024862054 | erot = 0.0669935184860634 | epot = -14.7018493554381 | etot = -14.6175140344659 -5000 ekin = 0.0264109356286075 | erot = 0.102878288094517 | epot = -14.7468032582586 | etot = -14.6175140345355 -6000 ekin = 0.0368533113591442 | erot = 0.14504542056987 | epot = -14.7994127665447 | etot = -14.6175140346157 -7000 ekin = 0.0483200640564843 | erot = 0.192565862515508 | epot = -14.8583999612756 | etot = -14.6175140347036 -8000 ekin = 0.0604312317605998 | erot = 0.244417870131508 | epot = -14.9223631366883 | etot = -14.6175140347962 -9000 ekin = 0.0727907119671751 | erot = 0.299521949931839 | epot = -14.989826696789 | etot = -14.6175140348899 -10000 ekin = 0.0850022498875221 | erot = 0.356777997217902 | epot = -15.0592942820869 | etot = -14.6175140349815 -11000 ekin = 0.0966857134041704 | erot = 0.415102860829614 | epot = -15.1293026093013 | etot = -14.6175140350675 -12000 ekin = 0.107492790688446 | erot = 0.473466334178045 | epot = -15.1984731600115 | etot = -14.617514035145 -13000 ekin = 0.117121180381715 | erot = 0.530923485009724 | epot = -15.2655587006029 | etot = -14.6175140352115 -14000 ekin = 0.125326348459166 | erot = 0.586641324447693 | epot = -15.329481708172 | etot = -14.6175140352651 -15000 ekin = 0.131930017119452 | erot = 0.639918104234695 | epot = -15.389362156659 | etot = -14.6175140353048 -16000 ekin = 0.136824741331535 | erot = 0.690194029501056 | epot = -15.4445328061632 | etot = -14.6175140353306 -17000 ekin = 0.139974218116303 | erot = 0.73705286614779 | epot = -15.4945411196072 | etot = -14.6175140353432 -18000 ekin = 0.141409342139924 | erot = 0.780214750583505 | epot = -15.5391381280674 | etot = -14.617514035344 -19000 ekin = 0.14122042490348 | erot = 0.819521373491594 | epot = -15.5782558337303 | etot = -14.6175140353352 -20000 ekin = 0.139546371890615 | erot = 0.854915474127934 | epot = -15.6119758813378 | etot = -14.6175140353193 -21000 ekin = 0.136561897558623 | erot = 0.886417110947779 | epot = -15.6404930438051 | etot = -14.6175140352987 -22000 ekin = 0.132464002543739 | erot = 0.914099368829953 | epot = -15.6640774066495 | etot = -14.6175140352758 -23000 ekin = 0.127458921012922 | erot = 0.938065991541773 | epot = -15.6830389478072 | etot = -14.6175140352525 -24000 ekin = 0.121750582423385 | erot = 0.958432936326242 | epot = -15.6976975539802 | etot = -14.6175140352305 -25000 ekin = 0.115531361418989 | erot = 0.97531514293118 | epot = -15.7083605395609 | etot = -14.6175140352107 -26000 ekin = 0.108975565586104 | erot = 0.988819027952036 | epot = -15.7153086287315 | etot = -14.6175140351934 -27000 ekin = 0.102235785319049 | erot = 0.999040485514132 | epot = -15.7187903060115 | etot = -14.6175140351783 -28000 ekin = 0.095441943431881 | erot = 1.00606759140964 | epot = -15.7190235700066 | etot = -14.6175140351651 -29000 ekin = 0.0887026587343887 | erot = 1.00998681843601 | epot = -15.7162035123233 | etot = -14.6175140351529 -30000 ekin = 0.0821083868014372 | erot = 1.01089138149893 | epot = -15.7105138034411 | etot = -14.6175140351407 -31000 ekin = 0.0757357206087773 | erot = 1.00889031641317 | epot = -15.7021400721498 | etot = -14.6175140351278 -32000 ekin = 0.0696522149388972 | erot = 1.00411701389994 | epot = -15.691283263952 | etot = -14.6175140351132 -33000 ekin = 0.0639211300028632 | erot = 0.996736133735177 | epot = -15.6781712988344 | etot = -14.6175140350964 -34000 ekin = 0.0586055597939536 | erot = 0.986948071943124 | epot = -15.6630676668141 | etot = -14.617514035077 -35000 ekin = 0.0537715085519321 | erot = 0.97499041461744 | epot = -15.6462759582244 | etot = -14.617514035055 -36000 ekin = 0.0494895953264297 | erot = 0.961136064967259 | epot = -15.6281396953245 | etot = -14.6175140350308 -37000 ekin = 0.0458351949405726 | erot = 0.945687966086967 | epot = -15.6090371960325 | etot = -14.617514035005 -38000 ekin = 0.0428869588016531 | erot = 0.928970560852795 | epot = -15.5893715546332 | etot = -14.6175140349787 -39000 ekin = 0.0407237982122988 | erot = 0.9113183396798 | epot = -15.5695561728451 | etot = -14.617514034953 -40000 ekin = 0.0394205547754457 | erot = 0.893062038097747 | epot = -15.5499966278026 | etot = -14.6175140349294 -41000 ekin = 0.0390427256107104 | erot = 0.874513269990878 | epot = -15.5310700305109 | etot = -14.6175140349093 -42000 ekin = 0.0396407506458402 | erot = 0.855948622306271 | epot = -15.5131034078461 | etot = -14.617514034894 -43000 ekin = 0.0412444930542154 | erot = 0.837594480923697 | epot = -15.4963530088628 | etot = -14.6175140348849 -44000 ekin = 0.0438586280730372 | erot = 0.819614069272971 | epot = -15.4809867322287 | etot = -14.6175140348826 -45000 ekin = 0.0474596621516281 | erot = 0.802098297010783 | epot = -15.4670719940501 | etot = -14.6175140348877 -46000 ekin = 0.0519951857192148 | erot = 0.785061947877571 | epot = -15.4545711684965 | etot = -14.6175140348997 -47000 ekin = 0.0573856747191636 | erot = 0.76844639238657 | epot = -15.4433461020232 | etot = -14.6175140349174 -48000 ekin = 0.0635286843632004 | erot = 0.75212933501618 | epot = -15.433172054319 | etot = -14.6175140349396 -49000 ekin = 0.070304673538874 | erot = 0.735941123250837 | epot = -15.4237598317539 | etot = -14.6175140349642 -50000 ekin = 0.0775831019857076 | erot = 0.719686007781425 | epot = -15.4147831447563 | etot = -14.6175140349892 -51000 ekin = 0.0852270843845694 | erot = 0.703165726695028 | epot = -15.4059068460928 | etot = -14.6175140350132 -52000 ekin = 0.0930950223451647 | erot = 0.686202231166125 | epot = -15.396811288546 | etot = -14.6175140350347 -53000 ekin = 0.101038429252995 | erot = 0.668656546988927 | epot = -15.3872090112954 | etot = -14.6175140350535 -54000 ekin = 0.10889654098061 | erot = 0.650441726174306 | epot = -15.3768523022246 | etot = -14.6175140350697 -55000 ekin = 0.116489881626234 | erot = 0.631529329348001 | epot = -15.3655332460579 | etot = -14.6175140350836 -56000 ekin = 0.12361610349192 | erot = 0.611950383382611 | epot = -15.35308052197 | etot = -14.6175140350954 -57000 ekin = 0.130051530401153 | erot = 0.591792721317295 | epot = -15.3393582868232 | etot = -14.6175140351048 -58000 ekin = 0.135560625193501 | erot = 0.571196690673292 | epot = -15.3242713509773 | etot = -14.6175140351105 -59000 ekin = 0.139913350827135 | erot = 0.550350463180279 | epot = -15.307777849119 | etot = -14.6175140351115 -60000 ekin = 0.142907875045794 | erot = 0.529485019662529 | epot = -15.2899069298147 | etot = -14.6175140351063 -61000 ekin = 0.144394224777542 | erot = 0.508867904998907 | epot = -15.2707761648706 | etot = -14.6175140350941 -62000 ekin = 0.144294003785763 | erot = 0.488794507592477 | epot = -15.2506025464531 | etot = -14.6175140350748 -63000 ekin = 0.142612256998146 | erot = 0.469576039421557 | epot = -15.2297023314688 | etot = -14.6175140350491 -64000 ekin = 0.139439544726902 | erot = 0.45152434495459 | epot = -15.2084779247003 | etot = -14.6175140350188 -65000 ekin = 0.134944526553566 | erot = 0.434934714913839 | epot = -15.1873932764535 | etot = -14.6175140349861 -66000 ekin = 0.129359146358223 | erot = 0.420068607767106 | epot = -15.1669417890788 | etot = -14.6175140349535 -67000 ekin = 0.122959458764236 | erot = 0.407138362059705 | epot = -15.1476118557469 | etot = -14.617514034923 -68000 ekin = 0.116045210525559 | erot = 0.396295631876262 | epot = -15.1298548772986 | etot = -14.6175140348968 -69000 ekin = 0.108920722072365 | erot = 0.38762458997195 | epot = -15.1140593469202 | etot = -14.6175140348758 -70000 ekin = 0.101878740729572 | erot = 0.381140173640836 | epot = -15.1005329492313 | etot = -14.6175140348609 -71000 ekin = 0.0951880561484016 | erot = 0.376791007701538 | epot = -15.0894930987019 | etot = -14.617514034852 -72000 ekin = 0.0890849677261927 | erot = 0.374466237250371 | epot = -15.0810652398255 | etot = -14.6175140348489 -73000 ekin = 0.0837682427021612 | erot = 0.374005347599889 | epot = -15.0752876251531 | etot = -14.617514034851 -74000 ekin = 0.0793969849744096 | erot = 0.375210076750601 | epot = -15.0721210965825 | etot = -14.6175140348575 -75000 ekin = 0.0760907865069267 | erot = 0.377857644572265 | epot = -15.0714624659463 | etot = -14.6175140348671 -76000 ekin = 0.0739315834908328 | erot = 0.381714646755152 | epot = -15.0731602651247 | etot = -14.6175140348788 -77000 ekin = 0.0729667273608161 | erot = 0.386551032956121 | epot = -15.0770317952083 | etot = -14.6175140348914 -78000 ekin = 0.073212865507933 | erot = 0.392153586683229 | epot = -15.0828804870951 | etot = -14.617514034904 -79000 ekin = 0.074660287835072 | erot = 0.398338263929461 | epot = -15.09051258668 | etot = -14.6175140349155 -80000 ekin = 0.0772774298944847 | erot = 0.404960669863083 | epot = -15.0997521346826 | etot = -14.6175140349251 -81000 ekin = 0.0810152396746107 | erot = 0.411923913359048 | epot = -15.1104531879657 | etot = -14.617514034932 -82000 ekin = 0.0858111278279411 | erot = 0.419183131304986 | epot = -15.1225082940691 | etot = -14.6175140349362 -83000 ekin = 0.0915922459205373 | erot = 0.426746154030553 | epot = -15.1358524348887 | etot = -14.6175140349376 -84000 ekin = 0.0982778862653023 | erot = 0.434670094582779 | epot = -15.1504620157846 | etot = -14.6175140349365 -85000 ekin = 0.105780875252123 | erot = 0.443054055542032 | epot = -15.1663489657278 | etot = -14.6175140349337 -86000 ekin = 0.114007936320491 | erot = 0.452028591870552 | epot = -15.183550563121 | etot = -14.6175140349299 -87000 ekin = 0.122859117093021 | erot = 0.461742961599068 | epot = -15.2021161136185 | etot = -14.6175140349264 -88000 ekin = 0.132226490250365 | erot = 0.472351454260961 | epot = -15.2220919794351 | etot = -14.6175140349238 -89000 ekin = 0.14199243043518 | erot = 0.484000150228927 | epot = -15.2435066155872 | etot = -14.6175140349231 -90000 ekin = 0.152027823848745 | erot = 0.49681531383988 | epot = -15.2663571726137 | etot = -14.6175140349251 -91000 ekin = 0.162190574344125 | erot = 0.510894287760631 | epot = -15.2905988970349 | etot = -14.6175140349302 -92000 ekin = 0.172324730223241 | erot = 0.526299304076712 | epot = -15.3161380692387 | etot = -14.6175140349387 -93000 ekin = 0.182260479602514 | erot = 0.543054150883983 | epot = -15.342828665437 | etot = -14.6175140349505 -94000 ekin = 0.191815166424497 | erot = 0.561143224560487 | epot = -15.3704724259505 | etot = -14.6175140349655 -95000 ekin = 0.200795384589871 | erot = 0.580512230413669 | epot = -15.398821649987 | etot = -14.6175140349834 -96000 ekin = 0.209000133284301 | erot = 0.601069706845445 | epot = -15.4275838751336 | etot = -14.6175140350039 -97000 ekin = 0.216224974983076 | erot = 0.622688639933065 | epot = -15.4564276499427 | etot = -14.6175140350266 -98000 ekin = 0.222267131485452 | erot = 0.645207670246426 | epot = -15.4849888367829 | etot = -14.617514035051 -99000 ekin = 0.226931474008822 | erot = 0.668431711040234 | epot = -15.5128772201258 | etot = -14.6175140350768 -100000 ekin = 0.230037392185194 | erot = 0.692132125756912 | epot = -15.5396835530455 | etot = -14.6175140351034 -101000 ekin = 0.231426538774339 | erot = 0.716046886549487 | epot = -15.5649874604541 | etot = -14.6175140351302 -102000 ekin = 0.230971416186116 | erot = 0.739881303910906 | epot = -15.5883667552535 | etot = -14.6175140351565 -103000 ekin = 0.228584676860968 | erot = 0.763309953365433 | epot = -15.6094086654079 | etot = -14.6175140351815 -104000 ekin = 0.224228843046698 | erot = 0.785980326921886 | epot = -15.6277232051725 | etot = -14.6175140352039 -105000 ekin = 0.217925953180593 | erot = 0.807518535460022 | epot = -15.6429585238635 | etot = -14.6175140352229 -106000 ekin = 0.209766205881976 | erot = 0.827537066837565 | epot = -15.6548173079567 | etot = -14.6175140352372 -107000 ekin = 0.19991466311948 | erot = 0.845644346598459 | epot = -15.6630730449638 | etot = -14.6175140352459 -108000 ekin = 0.188614735691129 | erot = 0.861455562303715 | epot = -15.6675843332431 | etot = -14.6175140352483 -109000 ekin = 0.176187061061687 | erot = 0.874603999194433 | epot = -15.6683050955002 | etot = -14.6175140352441 -110000 ekin = 0.163022626611995 | erot = 0.88475208463374 | epot = -15.6652887464792 | etot = -14.6175140352335 -111000 ekin = 0.14956938211077 | erot = 0.89160140093568 | epot = -15.6586848182637 | etot = -14.6175140352173 -112000 ekin = 0.136312261124986 | erot = 0.8949011206007 | epot = -15.6487274169225 | etot = -14.6175140351968 -113000 ekin = 0.123747404857758 | erot = 0.894454602033368 | epot = -15.6357160420648 | etot = -14.6175140351736 -114000 ekin = 0.112352324429831 | erot = 0.890124196452667 | epot = -15.6199905560322 | etot = -14.6175140351497 -115000 ekin = 0.102554569787556 | erot = 0.881834585426713 | epot = -15.6019031903412 | etot = -14.6175140351269 -116000 ekin = 0.0947020047096738 | erot = 0.869575126614186 | epot = -15.5817911664307 | etot = -14.6175140351068 -117000 ekin = 0.0890378681937318 | erot = 0.853401690493949 | epot = -15.559953593778 | etot = -14.6175140350903 -118000 ekin = 0.0856833736308548 | erot = 0.833438318818926 | epot = -15.5366357275277 | etot = -14.6175140350779 -119000 ekin = 0.0846297171118248 | erot = 0.809878764032089 | epot = -15.5120225162133 | etot = -14.6175140350694 -120000 ekin = 0.0857402026936468 | erot = 0.782987649501416 | epot = -15.4862418872589 | etot = -14.6175140350638 -121000 ekin = 0.088761978164944 | erot = 0.753100709615785 | epot = -15.4593767228408 | etot = -14.61751403506 -122000 ekin = 0.0933458418336512 | erot = 0.720623403982127 | epot = -15.4314832808722 | etot = -14.6175140350564 -123000 ekin = 0.0990718975139699 | erot = 0.68602719834959 | epot = -15.4026131309152 | etot = -14.6175140350516 -124000 ekin = 0.105478567535099 | erot = 0.649842971567299 | epot = -15.3728355741467 | etot = -14.6175140350443 -125000 ekin = 0.112092583657528 | erot = 0.61265130691034 | epot = -15.3422579256011 | etot = -14.6175140350332 -126000 ekin = 0.118457948670349 | erot = 0.575069793125981 | epot = -15.3110417768144 | etot = -14.617514035018 -127000 ekin = 0.124162352097832 | erot = 0.537737821903371 | epot = -15.2794142089993 | etot = -14.6175140349981 -128000 ekin = 0.128860000475183 | erot = 0.501299660072983 | epot = -15.2476736955218 | etot = -14.6175140349736 -129000 ekin = 0.132290197681538 | erot = 0.466386755141783 | epot = -15.2161909877681 | etot = -14.6175140349448 -130000 ekin = 0.134291248323408 | erot = 0.433600287194685 | epot = -15.1854055704302 | etot = -14.6175140349121 -131000 ekin = 0.134809368079367 | erot = 0.403494917851113 | epot = -15.1558183208069 | etot = -14.6175140348764 -132000 ekin = 0.133902311413259 | erot = 0.376564532721602 | epot = -15.1279808789733 | etot = -14.6175140348385 -133000 ekin = 0.131737425950174 | erot = 0.353230559449875 | epot = -15.1024820201993 | etot = -14.6175140347993 -134000 ekin = 0.128583872250139 | erot = 0.333833200745338 | epot = -15.0799311077557 | etot = -14.6175140347602 -135000 ekin = 0.124798858319487 | erot = 0.31862567876175 | epot = -15.0609385718037 | etot = -14.6175140347224 -136000 ekin = 0.12080796695122 | erot = 0.307771366705934 | epot = -15.0460933683448 | etot = -14.6175140346877 -137000 ekin = 0.117080018573556 | erot = 0.301343503849859 | epot = -15.0359375570811 | etot = -14.6175140346577 -138000 ekin = 0.114097404451637 | erot = 0.299327064918768 | epot = -15.0309385040046 | etot = -14.6175140346342 -139000 ekin = 0.112323403877397 | erot = 0.301622293047273 | epot = -15.0314597315437 | etot = -14.6175140346191 -140000 ekin = 0.112168587317134 | erot = 0.308049410073558 | epot = -15.0377320320047 | etot = -14.617514034614 -141000 ekin = 0.113958896787483 | erot = 0.318354084563277 | epot = -15.0498270159712 | etot = -14.6175140346204 -142000 ekin = 0.117908250110044 | erot = 0.332213334114174 | epot = -15.0676356188633 | etot = -14.6175140346391 -143000 ekin = 0.124098500240116 | erot = 0.349241744868859 | epot = -15.0908542797794 | etot = -14.6175140346704 -144000 ekin = 0.132469049162244 | erot = 0.36899804234383 | epot = -15.1189811262199 | etot = -14.6175140347138 -145000 ekin = 0.142817534773294 | erot = 0.390992018433025 | epot = -15.1513235879745 | etot = -14.6175140347682 -146000 ekin = 0.154812002594044 | erot = 0.414692148538822 | epot = -15.1870181859643 | etot = -14.6175140348315 -147000 ekin = 0.168013608208165 | erot = 0.43953414756317 | epot = -15.2250617906724 | etot = -14.6175140349011 -148000 ekin = 0.181907755044192 | erot = 0.46493071599216 | epot = -15.2643525060103 | etot = -14.617514034974 -149000 ekin = 0.195940689918404 | erot = 0.490282644230507 | epot = -15.3037373691959 | etot = -14.6175140350469 -150000 ekin = 0.209558115498161 | erot = 0.514991307802203 | epot = -15.3420634584171 | etot = -14.6175140351168 -151000 ekin = 0.222242375358722 | erot = 0.538472447669863 | epot = -15.3782288582089 | etot = -14.6175140351803 -152000 ekin = 0.233545181100895 | erot = 0.560170967504241 | epot = -15.4112301838403 | etot = -14.6175140352351 -153000 ekin = 0.243113638171897 | erot = 0.579575715963473 | epot = -15.4402033894145 | etot = -14.6175140352791 -154000 ekin = 0.250708030719563 | erot = 0.596234520730074 | epot = -15.4644565867606 | etot = -14.617514035311 -155000 ekin = 0.256210874594961 | erot = 0.609768185048496 | epot = -15.4834930949732 | etot = -14.6175140353298 -156000 ekin = 0.259627463842806 | erot = 0.619882772314079 | epot = -15.4970242714923 | etot = -14.6175140353354 -157000 ekin = 0.26107875673392 | erot = 0.626379517381585 | epot = -15.5049723094438 | etot = -14.6175140353283 -158000 ekin = 0.260787877594978 | erot = 0.629161788909624 | epot = -15.5074637018139 | etot = -14.6175140353093 -159000 ekin = 0.259061752299553 | erot = 0.628238692725195 | epot = -15.5048144803046 | etot = -14.6175140352799 -160000 ekin = 0.256269476948141 | erot = 0.623725097357881 | epot = -15.4975086095477 | etot = -14.6175140352417 -161000 ekin = 0.252818974262866 | erot = 0.615838055765116 | epot = -15.4861710652245 | etot = -14.6175140351965 -162000 ekin = 0.249133354781009 | erot = 0.604889772114047 | epot = -15.4715371620415 | etot = -14.6175140351465 -163000 ekin = 0.245628201594233 | erot = 0.591277407066157 | epot = -15.4544196437542 | etot = -14.6175140350938 -164000 ekin = 0.242690765770646 | erot = 0.5754701254003 | epot = -15.4356749262112 | etot = -14.6175140350402 -165000 ekin = 0.240661818237773 | erot = 0.557993868664013 | epot = -15.4161697218898 | etot = -14.617514034988 -166000 ekin = 0.239820672159938 | erot = 0.539414388849556 | epot = -15.3967490959484 | etot = -14.6175140349389 -167000 ekin = 0.24037368261711 | erot = 0.520319112884873 | epot = -15.3782068303964 | etot = -14.6175140348944 -168000 ekin = 0.24244635767351 | erot = 0.501298426047331 | epot = -15.3612588185771 | etot = -14.6175140348562 -169000 ekin = 0.246079081489649 | erot = 0.482926967022199 | epot = -15.3465200833372 | etot = -14.6175140348253 -170000 ekin = 0.2512263556708 | erot = 0.465745518941327 | epot = -15.334485909415 | etot = -14.6175140348028 -171000 ekin = 0.257759407502687 | erot = 0.450244072412507 | epot = -15.3255175147045 | etot = -14.6175140347893 -172000 ekin = 0.265471962315305 | erot = 0.436846557572436 | epot = -15.3198325546728 | etot = -14.617514034785 -173000 ekin = 0.274088992052948 | erot = 0.425897760801831 | epot = -15.3175007876449 | etot = -14.6175140347901 -174000 ekin = 0.283278228108448 | erot = 0.417652965987037 | epot = -15.3184452288997 | etot = -14.6175140348042 -175000 ekin = 0.292664164217591 | erot = 0.412270652066437 | epot = -15.3224488511105 | etot = -14.6175140348264 -176000 ekin = 0.301844276744599 | erot = 0.409808663992694 | epot = -15.3291669755931 | etot = -14.6175140348558 -177000 ekin = 0.310407103278429 | erot = 0.410224178772685 | epot = -15.3381453169418 | etot = -14.6175140348907 -178000 ekin = 0.317951707449239 | erot = 0.413377690532346 | epot = -15.3488434329111 | etot = -14.6175140349295 -179000 ekin = 0.324107901132174 | erot = 0.419041092198358 | epot = -15.3606630283006 | etot = -14.6175140349701 -180000 ekin = 0.328556397749118 | erot = 0.426909726006353 | epot = -15.3729801587658 | etot = -14.6175140350103 -181000 ekin = 0.331047834154798 | erot = 0.436618006901549 | epot = -15.3851798761042 | etot = -14.6175140350478 -182000 ekin = 0.331419420115411 | erot = 0.447757936313848 | epot = -15.3966913915096 | etot = -14.6175140350804 -183000 ekin = 0.329607792338432 | erot = 0.459899520064776 | epot = -15.4070213475094 | etot = -14.6175140351062 -184000 ekin = 0.325656516855951 | erot = 0.472611792132538 | epot = -15.4157823441122 | etot = -14.6175140351237 -185000 ekin = 0.319716934488103 | erot = 0.485483030926984 | epot = -15.4227140005474 | etot = -14.6175140351323 -186000 ekin = 0.312041347783061 | erot = 0.498138700397667 | epot = -15.4276940833127 | etot = -14.6175140351319 -187000 ekin = 0.302968200961952 | erot = 0.510255791848641 | epot = -15.4307380279341 | etot = -14.6175140351235 -188000 ekin = 0.292899787357099 | erot = 0.521572552051206 | epot = -15.4319863745165 | etot = -14.6175140351082 -189000 ekin = 0.282274048056294 | erot = 0.531893031493142 | epot = -15.4316811146379 | etot = -14.6175140350885 -190000 ekin = 0.271533034589587 | erot = 0.541086413296707 | epot = -15.4301334829529 | etot = -14.6175140350666 -191000 ekin = 0.261091384545769 | erot = 0.54908161018572 | epot = -15.4276870297764 | etot = -14.6175140350449 -192000 ekin = 0.251308489708551 | erot = 0.555858063434352 | epot = -15.4246805881686 | etot = -14.6175140350257 -193000 ekin = 0.242467771120031 | erot = 0.561433978654736 | epot = -15.4214157847852 | etot = -14.6175140350104 -194000 ekin = 0.2347655816246 | erot = 0.565853352187793 | epot = -15.4181329688123 | etot = -14.6175140349999 -195000 ekin = 0.228310848061445 | erot = 0.569173077812631 | epot = -15.4149979608682 | etot = -14.6175140349941 -196000 ekin = 0.223134890550306 | erot = 0.57145120860725 | epot = -15.4121001341502 | etot = -14.6175140349926 -197000 ekin = 0.219209242156003 | erot = 0.572737138233763 | epot = -15.409460415384 | etot = -14.6175140349943 -198000 ekin = 0.216468062809104 | erot = 0.573064123808166 | epot = -15.4070462216152 | etot = -14.6175140349979 -199000 ekin = 0.214831137522652 | erot = 0.572444258403913 | epot = -15.4047894309289 | etot = -14.6175140350023 -200000 ekin = 0.214223573902254 | erot = 0.57086576066316 | epot = -15.4026033695722 | etot = -14.6175140350067 -201000 ekin = 0.214589119166907 | erot = 0.568292309386801 | epot = -15.4003954635645 | etot = -14.6175140350107 -202000 ekin = 0.215895325602457 | erot = 0.564664121433424 | epot = -15.3980734820503 | etot = -14.6175140350145 -203000 ekin = 0.218130347570136 | erot = 0.559900543318492 | epot = -15.395544925907 | etot = -14.6175140350184 -204000 ekin = 0.221292667473869 | erot = 0.553904074217835 | epot = -15.3927107767149 | etot = -14.6175140350232 -205000 ekin = 0.225376258610798 | erot = 0.546565915588112 | epot = -15.3894562092286 | etot = -14.6175140350297 -206000 ekin = 0.230354397529151 | erot = 0.537773288683187 | epot = -15.3856417212507 | etot = -14.6175140350384 -207000 ekin = 0.236165428414771 | erot = 0.527418806929786 | epot = -15.3810982703936 | etot = -14.617514035049 -208000 ekin = 0.242703261860427 | erot = 0.515412077175151 | epot = -15.3756293740966 | etot = -14.617514035061 -209000 ekin = 0.249814382550021 | erot = 0.501693407691568 | epot = -15.3690218253148 | etot = -14.6175140350732 -210000 ekin = 0.257301864855649 | erot = 0.486249049965564 | epot = -15.361064949905 | etot = -14.6175140350838 -211000 ekin = 0.264935635394273 | erot = 0.469126912720557 | epot = -15.3515765832057 | etot = -14.6175140350909 -212000 ekin = 0.272467183646406 | erot = 0.450451153648061 | epot = -15.3404323723872 | etot = -14.6175140350927 -213000 ekin = 0.279646306736793 | erot = 0.430433702677846 | epot = -15.3275940445023 | etot = -14.6175140350876 -214000 ekin = 0.286237611276688 | erot = 0.409381288017783 | epot = -15.3131329343691 | etot = -14.6175140350746 -215000 ekin = 0.292034643872632 | erot = 0.387696263734527 | epot = -15.2972449426606 | etot = -14.6175140350534 -216000 ekin = 0.296870258152624 | erot = 0.365870567411729 | epot = -15.2802548605889 | etot = -14.6175140350245 -217000 ekin = 0.300622666324868 | erot = 0.344472695102956 | epot = -15.2626093964168 | etot = -14.617514034989 -218000 ekin = 0.303217269541043 | erot = 0.324128407398458 | epot = -15.2448597118882 | etot = -14.6175140349487 -219000 ekin = 0.304624843911682 | erot = 0.305496496152239 | epot = -15.2276353749694 | etot = -14.6175140349055 -220000 ekin = 0.304856982073792 | erot = 0.289241221676068 | epot = -15.2116122386118 | etot = -14.6175140348619 -221000 ekin = 0.303959749544065 | erot = 0.276003133762455 | epot = -15.1974769181266 | etot = -14.61751403482 -222000 ekin = 0.302006434070655 | erot = 0.266369862265548 | epot = -15.1858903311184 | etot = -14.6175140347822 -223000 ekin = 0.299090105490396 | erot = 0.260848208954625 | epot = -15.1774523491954 | etot = -14.6175140347503 -224000 ekin = 0.29531650374511 | erot = 0.259838588557332 | epot = -15.1726691270288 | etot = -14.6175140347264 -225000 ekin = 0.290797600317434 | erot = 0.263612591735795 | epot = -15.1719242267649 | etot = -14.6175140347117 -226000 ekin = 0.285646103232653 | erot = 0.272294318080247 | epot = -15.1754544560203 | etot = -14.6175140347074 -227000 ekin = 0.279971018689074 | erot = 0.285846075011501 | epot = -15.1833311284151 | etot = -14.6175140347145 -228000 ekin = 0.273874374727583 | erot = 0.304059069119542 | epot = -15.1954474785804 | etot = -14.6175140347333 -229000 ekin = 0.267449174159942 | erot = 0.326549807965912 | epot = -15.2115130168895 | etot = -14.6175140347636 -230000 ekin = 0.260778614118952 | erot = 0.352763004039877 | epot = -15.2310556529637 | etot = -14.6175140348048 -231000 ekin = 0.253936564976955 | erot = 0.381981763344646 | epot = -15.2534323631772 | etot = -14.6175140348556 -232000 ekin = 0.24698923084228 | erot = 0.413345683736504 | epot = -15.2778489494931 | etot = -14.6175140349143 -233000 ekin = 0.239997814735683 | erot = 0.445877135783545 | epot = -15.3033889854978 | etot = -14.6175140349785 -234000 ekin = 0.233021891669698 | erot = 0.478515439398703 | epot = -15.3290513661138 | etot = -14.6175140350454 -235000 ekin = 0.226123071286244 | erot = 0.510157919201248 | epot = -15.3537950255994 | etot = -14.6175140351119 -236000 ekin = 0.219368436952614 | erot = 0.539706010633753 | epot = -15.3765884827609 | etot = -14.6175140351745 -237000 ekin = 0.212833212708479 | erot = 0.566113832023268 | epot = -15.3964610799618 | etot = -14.6175140352301 -238000 ekin = 0.206602165162757 | erot = 0.588436180449468 | epot = -15.412552380888 | etot = -14.6175140352757 -239000 ekin = 0.200769360307635 | erot = 0.605872583258753 | epot = -15.4241559788757 | etot = -14.6175140353093 -240000 ekin = 0.195436190928488 | erot = 0.617803458378408 | epot = -15.4307536846362 | etot = -14.6175140353293 -241000 ekin = 0.190707920284559 | erot = 0.623817360381655 | epot = -15.4320393160013 | etot = -14.6175140353351 -242000 ekin = 0.186689132523883 | erot = 0.623726737660644 | epot = -15.4279299055112 | etot = -14.6175140353267 -243000 ekin = 0.18347888087463 | erot = 0.61757185737741 | epot = -15.418564773557 | etot = -14.617514035305 -244000 ekin = 0.181166166759762 | erot = 0.60561292371356 | epot = -15.4042931257446 | etot = -14.6175140352713 -245000 ekin = 0.179826690515581 | erot = 0.588311983398978 | epot = -15.3856527091421 | etot = -14.6175140352276 -246000 ekin = 0.179521473344392 | erot = 0.566306329740652 | epot = -15.3633418382609 | etot = -14.6175140351758 -247000 ekin = 0.180297726608685 | erot = 0.54037552872489 | epot = -15.3381872904519 | etot = -14.6175140351184 -248000 ekin = 0.182192022180427 | erot = 0.511404282992934 | epot = -15.3111103402306 | etot = -14.6175140350572 -249000 ekin = 0.185235475058219 | erot = 0.480343275338998 | epot = -15.2830927853917 | etot = -14.6175140349945 -250000 ekin = 0.18946032457762 | erot = 0.448169956263045 | epot = -15.2551443157728 | etot = -14.6175140349321 -251000 ekin = 0.194907020011059 | erot = 0.415851007133659 | epot = -15.2282720620165 | etot = -14.6175140348718 -252000 ekin = 0.201630699422451 | erot = 0.384307951122869 | epot = -15.2034526853603 | etot = -14.617514034815 -253000 ekin = 0.209705815254746 | erot = 0.354387113740477 | epot = -15.1816069637584 | etot = -14.6175140347632 -254000 ekin = 0.219227629545986 | erot = 0.326834860919931 | epot = -15.1635765251836 | etot = -14.6175140347177 -255000 ekin = 0.230309407956005 | erot = 0.302278768995696 | epot = -15.1501022116313 | etot = -14.6175140346796 -256000 ekin = 0.243074422920893 | erot = 0.281215109558497 | epot = -15.1418035671295 | etot = -14.6175140346501 -257000 ekin = 0.257642364628865 | erot = 0.264002762945737 | epot = -15.139159162205 | etot = -14.6175140346304 -258000 ekin = 0.274110461102935 | erot = 0.250863404057276 | epot = -15.1424878997817 | etot = -14.6175140346215 -259000 ekin = 0.292530483428745 | erot = 0.241887528332562 | epot = -15.1519320463858 | etot = -14.6175140346245 -260000 ekin = 0.312883750214262 | erot = 0.237045600990929 | epot = -15.167443385845 | etot = -14.6175140346398 -261000 ekin = 0.335057071665646 | erot = 0.23620332462488 | epot = -15.1887744309582 | etot = -14.6175140346677 -262000 ekin = 0.358823075932977 | erot = 0.239139750883904 | epot = -15.2154768615246 | etot = -14.6175140347077 -263000 ekin = 0.383828346058697 | erot = 0.24556675356939 | epot = -15.2469091343868 | etot = -14.6175140347588 -264000 ekin = 0.409592161639846 | erot = 0.25514829095879 | epot = -15.2822544874178 | etot = -14.6175140348192 -265000 ekin = 0.435517425641053 | erot = 0.267517972446926 | epot = -15.3205494329745 | etot = -14.6175140348865 -266000 ekin = 0.460913759434934 | erot = 0.28229374222826 | epot = -15.3607215366211 | etot = -14.6175140349579 -267000 ekin = 0.485031075314244 | erot = 0.299088986461549 | epot = -15.4016340968062 | etot = -14.6175140350304 -268000 ekin = 0.507100517474285 | erot = 0.317519986657596 | epot = -15.4421345392328 | etot = -14.6175140351009 -269000 ekin = 0.526378761164296 | erot = 0.337210258004039 | epot = -15.4811030543346 | etot = -14.6175140351662 -270000 ekin = 0.542191399558024 | erot = 0.357792786171182 | epot = -15.5174982209533 | etot = -14.6175140352241 -271000 ekin = 0.55397150127625 | erot = 0.378911394713957 | epot = -15.5503969312626 | etot = -14.6175140352724 -272000 ekin = 0.561290243477908 | erot = 0.400222387434508 | epot = -15.579026666222 | etot = -14.6175140353095 -273000 ekin = 0.563877614618956 | erot = 0.421397250044594 | epot = -15.6027888999983 | etot = -14.6175140353347 -274000 ekin = 0.561632338448697 | erot = 0.442126671656052 | epot = -15.6212730454525 | etot = -14.6175140353478 -275000 ekin = 0.554621238225524 | erot = 0.462125606775959 | epot = -15.6342608803503 | etot = -14.6175140353488 -276000 ekin = 0.543069132888247 | erot = 0.481138682332307 | epot = -15.6417218505594 | etot = -14.6175140353389 -277000 ekin = 0.527340979966703 | erot = 0.498945052082944 | epot = -15.6438000673687 | etot = -14.617514035319 -278000 ekin = 0.507918337218215 | erot = 0.515361832412993 | epot = -15.6407942049222 | etot = -14.617514035291 -279000 ekin = 0.485372319602766 | erot = 0.53024547360125 | epot = -15.6331318284605 | etot = -14.6175140352565 -280000 ekin = 0.460335116507262 | erot = 0.543490744710295 | epot = -15.6213398964351 | etot = -14.6175140352175 -281000 ekin = 0.433471859961099 | erot = 0.555027349455695 | epot = -15.606013244593 | etot = -14.6175140351762 -282000 ekin = 0.405454262481042 | erot = 0.564814480005611 | epot = -15.5877827776215 | etot = -14.6175140351348 -283000 ekin = 0.376937038993841 | erot = 0.572833827991569 | epot = -15.56728490208 | etot = -14.6175140350946 -284000 ekin = 0.348537747962758 | erot = 0.579081711929156 | epot = -15.5451334949486 | etot = -14.6175140350567 -285000 ekin = 0.320820372083395 | erot = 0.583561068644996 | epot = -15.5218954757513 | etot = -14.6175140350229 -286000 ekin = 0.294282726921591 | erot = 0.586274110944376 | epot = -15.49807087286 | etot = -14.617514034994 -287000 ekin = 0.269347634013421 | erot = 0.58721647590847 | epot = -15.4740781448926 | etot = -14.6175140349707 -288000 ekin = 0.246357704467551 | erot = 0.586373659771232 | epot = -15.450245399192 | etot = -14.6175140349532 -289000 ekin = 0.22557352214567 | erot = 0.583720426230562 | epot = -15.4268079833179 | etot = -14.6175140349417 -290000 ekin = 0.207174962818393 | erot = 0.57922365744791 | epot = -15.4039126552014 | etot = -14.6175140349351 -291000 ekin = 0.191265313940187 | erot = 0.572848780862473 | epot = -15.3816281297352 | etot = -14.6175140349326 -292000 ekin = 0.177877757396419 | erot = 0.564569470031942 | epot = -15.3599612623613 | etot = -14.617514034933 -293000 ekin = 0.166983649288418 | erot = 0.554379837681261 | epot = -15.3388775219044 | etot = -14.6175140349348 -294000 ekin = 0.158501898150678 | erot = 0.542307895558042 | epot = -15.3183238286452 | etot = -14.6175140349364 -295000 ekin = 0.152308641379645 | erot = 0.528428741575596 | epot = -15.298251417892 | etot = -14.6175140349367 -296000 ekin = 0.148246390134139 | erot = 0.512875830575803 | epot = -15.2786362556445 | etot = -14.6175140349346 -297000 ekin = 0.146131889948737 | erot = 0.495848833634457 | epot = -15.2594947585125 | etot = -14.6175140349293 -298000 ekin = 0.145762142540829 | erot = 0.477616979344766 | epot = -15.2408931568064 | etot = -14.6175140349208 -299000 ekin = 0.146918339842591 | erot = 0.458517327975552 | epot = -15.2229497027275 | etot = -14.6175140349094 -300000 ekin = 0.149367830717969 | erot = 0.438948042713275 | epot = -15.205829908327 | etot = -14.6175140348958 -301000 ekin = 0.152864610233931 | erot = 0.419357266834875 | epot = -15.1897359119496 | etot = -14.6175140348808 -302000 ekin = 0.157149122640062 | erot = 0.400228590599294 | epot = -15.1748917481051 | etot = -14.6175140348658 -303000 ekin = 0.16194834771892 | erot = 0.382064246008704 | epot = -15.1615266285792 | etot = -14.6175140348516 -304000 ekin = 0.166977167327322 | erot = 0.365367110080369 | epot = -15.1498583122469 | etot = -14.6175140348392 -305000 ekin = 0.171941885875759 | erot = 0.350622387002877 | epot = -15.1400783077083 | etot = -14.6175140348297 -306000 ekin = 0.176546522696758 | erot = 0.338279561365245 | epot = -15.1323401188853 | etot = -14.6175140348233 -307000 ekin = 0.180502080572099 | erot = 0.328734935092634 | epot = -15.1267510504853 | etot = -14.6175140348206 -308000 ekin = 0.183539117579173 | erot = 0.32231506851894 | epot = -15.1233682209196 | etot = -14.6175140348214 -309000 ekin = 0.185422589168761 | erot = 0.31926113518105 | epot = -15.1221977591756 | etot = -14.6175140348258 -310000 ekin = 0.18596838252546 | erot = 0.319714556778101 | epot = -15.1231969741369 | etot = -14.6175140348333 -311000 ekin = 0.185060444471766 | erot = 0.323704474533048 | epot = -15.1262789538485 | etot = -14.6175140348436 -312000 ekin = 0.18266705569995 | erot = 0.331137883754578 | epot = -15.1313189743107 | etot = -14.6175140348562 -313000 ekin = 0.178854671448202 | erot = 0.341793554574001 | epot = -15.1381622608926 | etot = -14.6175140348704 -314000 ekin = 0.173797674113419 | erot = 0.355321045101389 | epot = -15.1466327541005 | etot = -14.6175140348857 -315000 ekin = 0.167782440686126 | erot = 0.371246117949507 | epot = -15.1565425935371 | etot = -14.6175140349014 -316000 ekin = 0.161204347699483 | erot = 0.388983636697569 | epot = -15.1677020193138 | etot = -14.6175140349167 -317000 ekin = 0.154556738723145 | erot = 0.407858516720337 | epot = -15.1799292903744 | etot = -14.6175140349309 -318000 ekin = 0.148411457828143 | erot = 0.427134549770667 | epot = -15.1930600425422 | etot = -14.6175140349434 -319000 ekin = 0.143391260343367 | erot = 0.446049980955804 | epot = -15.2069552762529 | etot = -14.6175140349537 -320000 ekin = 0.140135163879429 | erot = 0.463857713006082 | epot = -15.2215069118471 | etot = -14.6175140349616 -321000 ekin = 0.139258496830789 | erot = 0.479867117343116 | epot = -15.2366396491412 | etot = -14.6175140349673 -322000 ekin = 0.141309963686665 | erot = 0.493483840953484 | epot = -15.2523078396112 | etot = -14.6175140349711 -323000 ekin = 0.146728465401823 | erot = 0.504243890594755 | epot = -15.2684863909706 | etot = -14.6175140349741 -324000 ekin = 0.155802740978128 | erot = 0.511838753068286 | epot = -15.285155529024 | etot = -14.6175140349776 -325000 ekin = 0.168637192339279 | erot = 0.516129344219886 | epot = -15.3022805715426 | etot = -14.6175140349834 -326000 ekin = 0.185127492740314 | erot = 0.517147991937071 | epot = -15.31978951967 | etot = -14.6175140349926 -327000 ekin = 0.204949583924698 | erot = 0.515089155112464 | epot = -15.3375527740434 | etot = -14.6175140350062 -328000 ekin = 0.227565145375698 | erot = 0.510290835145397 | epot = -15.3553700155455 | etot = -14.6175140350244 -329000 ekin = 0.252245305620947 | erot = 0.503209396461946 | epot = -15.3729687371292 | etot = -14.6175140350463 -330000 ekin = 0.278112223737838 | erot = 0.494390678508285 | epot = -15.3900169373164 | etot = -14.6175140350703 -331000 ekin = 0.304195517643728 | erot = 0.484439927615862 | epot = -15.4061494803532 | etot = -14.6175140350936 -332000 ekin = 0.329497983391289 | erot = 0.473992405220338 | epot = -15.4210044237253 | etot = -14.6175140351137 -333000 ekin = 0.353063353197021 | erot = 0.463685785197061 | epot = -15.4342631735221 | etot = -14.617514035128 -334000 ekin = 0.374038491014966 | erot = 0.454134842084351 | epot = -15.4456873682339 | etot = -14.6175140351346 -335000 ekin = 0.391723520498624 | erot = 0.44590856262641 | epot = -15.4551461182577 | etot = -14.6175140351327 -336000 ekin = 0.405605581596876 | erot = 0.439509690041266 | epot = -15.4626293067607 | etot = -14.6175140351225 -337000 ekin = 0.415374601836511 | erot = 0.435356764652945 | epot = -15.4682454015947 | etot = -14.6175140351053 -338000 ekin = 0.420921997008494 | erot = 0.4337688621957 | epot = -15.4722048942871 | etot = -14.6175140350829 -339000 ekin = 0.422325110445994 | erot = 0.434953376212245 | epot = -15.4747925217162 | etot = -14.6175140350579 -340000 ekin = 0.419821259879065 | erot = 0.438997304560045 | epot = -15.4763325994719 | etot = -14.6175140350328 -341000 ekin = 0.413775534579932 | erot = 0.445862573585468 | epot = -15.4771521431752 | etot = -14.6175140350098 -342000 ekin = 0.404646174019828 | erot = 0.455385967573506 | epot = -15.4775461765844 | etot = -14.617514034991 -343000 ekin = 0.392950705832007 | erot = 0.467284215126369 | epot = -15.4777489559361 | etot = -14.6175140349777 -344000 ekin = 0.379235231728315 | erot = 0.481164689425287 | epot = -15.4779139561242 | etot = -14.6175140349706 -345000 ekin = 0.364048459932831 | erot = 0.49654196729344 | epot = -15.4781044621959 | etot = -14.6175140349696 -346000 ekin = 0.347921358320248 | erot = 0.512860132814242 | epot = -15.4782955261082 | etot = -14.6175140349738 -347000 ekin = 0.331352665808313 | erot = 0.529520204052381 | epot = -15.4783869048424 | etot = -14.6175140349817 -348000 ekin = 0.314799955037007 | erot = 0.545911447468509 | epot = -15.478225437497 | etot = -14.6175140349915 -349000 ekin = 0.298675493175969 | erot = 0.561444708833552 | epot = -15.4776342370106 | etot = -14.6175140350011 -350000 ekin = 0.28334581552179 | erot = 0.575585348315622 | epot = -15.4764451988457 | etot = -14.6175140350083 -351000 ekin = 0.269133730328657 | erot = 0.587883045338955 | epot = -15.474530810679 | etot = -14.6175140350114 -352000 ekin = 0.256321431306528 | erot = 0.597995738138102 | epot = -15.4718312044538 | etot = -14.6175140350092 -353000 ekin = 0.245153509655857 | erot = 0.605705335206491 | epot = -15.4683728798634 | etot = -14.617514035001 -354000 ekin = 0.235838910987786 | erot = 0.610923562934953 | epot = -15.4642765089099 | etot = -14.6175140349872 -355000 ekin = 0.228551231301984 | erot = 0.613687305426088 | epot = -15.4597525716969 | etot = -14.6175140349688 -356000 ekin = 0.223427131308619 | erot = 0.61414390282533 | epot = -15.4550850690815 | etot = -14.6175140349475 -357000 ekin = 0.220563006919496 | erot = 0.612527933402533 | epot = -15.4506049752473 | etot = -14.6175140349253 -358000 ekin = 0.220010333199303 | erot = 0.609131855544879 | epot = -15.4466562236489 | etot = -14.6175140349047 -359000 ekin = 0.221770268741646 | erot = 0.604273418958276 | epot = -15.443557722588 | etot = -14.6175140348881 -360000 ekin = 0.225788163654918 | erot = 0.598262925571842 | epot = -15.4415651241044 | etot = -14.6175140348777 -361000 ekin = 0.231948578438913 | erot = 0.59137325198523 | epot = -15.4408358652996 | etot = -14.6175140348754 -362000 ekin = 0.240071331019464 | erot = 0.583815109039738 | epot = -15.4414004749418 | etot = -14.6175140348826 -363000 ekin = 0.249908988059078 | erot = 0.575719406612622 | epot = -15.4431424295716 | etot = -14.6175140348999 -364000 ekin = 0.261146140583132 | erot = 0.56712790648618 | epot = -15.4457880819966 | etot = -14.6175140349273 -365000 ekin = 0.273400773646818 | erot = 0.557992653604894 | epot = -15.4489074622159 | etot = -14.6175140349642 -366000 ekin = 0.286228056504663 | erot = 0.548184015757871 | epot = -15.4519261072718 | etot = -14.6175140350093 -367000 ekin = 0.299126926926786 | erot = 0.537506547610907 | epot = -15.4541475095983 | etot = -14.6175140350606 -368000 ekin = 0.311549892639084 | erot = 0.525721330951755 | epot = -15.4547852587065 | etot = -14.6175140351156 -369000 ekin = 0.322916493342769 | erot = 0.512572942753926 | epot = -15.4530034712682 | etot = -14.6175140351715 -370000 ekin = 0.332630833324557 | erot = 0.497818805481132 | epot = -15.4479636740308 | etot = -14.6175140352251 -371000 ekin = 0.340103492446634 | erot = 0.481258447415918 | epot = -15.4388759751356 | etot = -14.6175140352731 -372000 ekin = 0.344777943664193 | erot = 0.462760223983496 | epot = -15.4250522029596 | etot = -14.6175140353119 -373000 ekin = 0.346161332162081 | erot = 0.442283380417406 | epot = -15.405958747918 | etot = -14.6175140353385 -374000 ekin = 0.343859062980667 | erot = 0.419893962766177 | epot = -15.3812670610967 | etot = -14.6175140353498 -375000 ekin = 0.337612023151491 | erot = 0.395773904235502 | epot = -15.35089996273 | etot = -14.617514035343 -376000 ekin = 0.327334336193659 | erot = 0.370223433835828 | epot = -15.3150718053453 | etot = -14.6175140353159 -377000 ekin = 0.313148263712968 | erot = 0.3436575453366 | epot = -15.2743198443167 | etot = -14.6175140352671 -378000 ekin = 0.295411338277735 | erot = 0.316597454537734 | epot = -15.2295228280119 | etot = -14.6175140351964 -379000 ekin = 0.274729408510529 | erot = 0.289657740939432 | epot = -15.1819011845551 | etot = -14.6175140351051 -380000 ekin = 0.251948675267414 | erot = 0.263529414055011 | epot = -15.1329921243187 | etot = -14.6175140349963 -381000 ekin = 0.228120837035203 | erot = 0.238958749468097 | epot = -15.0845936213794 | etot = -14.6175140348761 -382000 ekin = 0.204438854506746 | erot = 0.216721270519329 | epot = -15.0386741597779 | etot = -14.6175140347518 -383000 ekin = 0.182146263755385 | erot = 0.19759188098445 | epot = -14.9972521793722 | etot = -14.6175140346323 -384000 ekin = 0.162429780679522 | erot = 0.182311896924387 | epot = -14.9622557121308 | etot = -14.6175140345269 -385000 ekin = 0.146310622123822 | erot = 0.171555128911536 | epot = -14.9353797854792 | etot = -14.6175140344439 -386000 ekin = 0.134552389652403 | erot = 0.165895597224741 | epot = -14.9179620212657 | etot = -14.6175140343886 -387000 ekin = 0.127600986328395 | erot = 0.165779213534325 | epot = -14.9108942342266 | etot = -14.6175140343639 -388000 ekin = 0.125565151523028 | erot = 0.171500950984996 | epot = -14.9145801368772 | etot = -14.6175140343691 -389000 ekin = 0.128237001096973 | erot = 0.183188026636525 | epot = -14.9289390621349 | etot = -14.6175140344014 -390000 ekin = 0.135143637923168 | erot = 0.200788930663413 | epot = -14.9534466030433 | etot = -14.6175140344567 -391000 ekin = 0.145616156499953 | erot = 0.224068074688611 | epot = -14.9871982657191 | etot = -14.6175140345306 -392000 ekin = 0.158862235246809 | erot = 0.252606362171908 | epot = -15.0289826320371 | etot = -14.6175140346184 -393000 ekin = 0.174032087603698 | erot = 0.285808726839658 | epot = -15.0773548491589 | etot = -14.6175140347155 -394000 ekin = 0.190272707003915 | erot = 0.322920107512839 | epot = -15.1307068493349 | etot = -14.6175140348181 -395000 ekin = 0.206769905102427 | erot = 0.363051013228117 | epot = -15.1873349532527 | etot = -14.6175140349221 -396000 ekin = 0.222780272470673 | erot = 0.405212687947373 | epot = -15.2455069954414 | etot = -14.6175140350234 -397000 ekin = 0.23765569871957 | erot = 0.448360183482314 | epot = -15.3035299173199 | etot = -14.6175140351181 -398000 ekin = 0.250862154070766 | erot = 0.491439914329229 | epot = -15.3598161036022 | etot = -14.6175140352022 -399000 ekin = 0.261993055954332 | erot = 0.533437059170124 | epot = -15.4129441503972 | etot = -14.6175140352727 -400000 ekin = 0.270776550507805 | erot = 0.573417887949055 | epot = -15.4617084737844 | etot = -14.6175140353276 -401000 ekin = 0.277075831016468 | erot = 0.610562842823512 | epot = -15.505152709206 | etot = -14.617514035366 -402000 ekin = 0.280882158892238 | erot = 0.644187798759056 | epot = -15.5425839930397 | etot = -14.6175140353884 -403000 ekin = 0.282301228579434 | erot = 0.673752968641712 | epot = -15.5735682326173 | etot = -14.6175140353962 -404000 ekin = 0.281534519812515 | erot = 0.698860907481931 | epot = -15.5979094626858 | etot = -14.6175140353913 -405000 ekin = 0.278857975737129 | erot = 0.719246574878154 | epot = -15.6156185859915 | etot = -14.6175140353763 -406000 ekin = 0.274600555759475 | erot = 0.73476315739679 | epot = -15.6268777485094 | etot = -14.6175140353531 -407000 ekin = 0.269124923358509 | erot = 0.745367259285065 | epot = -15.6320062179673 | etot = -14.6175140353237 -408000 ekin = 0.262811853165719 | erot = 0.751106276665231 | epot = -15.63143216512 | etot = -14.6175140352891 -409000 ekin = 0.256049112192117 | erot = 0.752109968276187 | epot = -15.6256731157185 | etot = -14.6175140352502 -410000 ekin = 0.249224269809732 | erot = 0.74858433225965 | epot = -15.6153226372768 | etot = -14.6175140352074 -411000 ekin = 0.242720888553437 | erot = 0.740809103918433 | epot = -15.6010440276326 | etot = -14.6175140351607 -412000 ekin = 0.236916379506095 | erot = 0.729136085380854 | epot = -15.5835664999974 | etot = -14.6175140351104 -413000 ekin = 0.232179735243653 | erot = 0.713985498456999 | epot = -15.5636792687578 | etot = -14.6175140350572 -414000 ekin = 0.228867632642243 | erot = 0.695838652585891 | epot = -15.5422203202302 | etot = -14.6175140350021 -415000 ekin = 0.227317772307856 | erot = 0.675225695396218 | epot = -15.5200575026509 | etot = -14.6175140349469 -416000 ekin = 0.227838940777607 | erot = 0.652708261105161 | epot = -15.4980612367764 | etot = -14.6175140348937 -417000 ekin = 0.230697970866891 | erot = 0.628857925336047 | epot = -15.4770699310479 | etot = -14.617514034845 -418000 ekin = 0.236104416120681 | erot = 0.604232291329749 | epot = -15.4578507422538 | etot = -14.6175140348034 -419000 ekin = 0.244194252200401 | erot = 0.579351108945114 | epot = -15.4410593959166 | etot = -14.6175140347711 -420000 ekin = 0.255014214168464 | erot = 0.554674986841152 | epot = -15.4272032357598 | etot = -14.6175140347502 -421000 ekin = 0.268508458340295 | erot = 0.530589008736334 | epot = -15.4166115018185 | etot = -14.6175140347418 -422000 ekin = 0.284509119560496 | erot = 0.507392982380571 | epot = -15.4094161366875 | etot = -14.6175140347464 -423000 ekin = 0.302732060426934 | erot = 0.485299248118979 | epot = -15.4055453433093 | etot = -14.6175140347634 -424000 ekin = 0.322778728051398 | erot = 0.464438075670481 | epot = -15.4047308385137 | etot = -14.6175140347918 -425000 ekin = 0.344144594922637 | erot = 0.444869796712131 | epot = -15.4065284264641 | etot = -14.6175140348293 -426000 ekin = 0.366234204300038 | erot = 0.426602052983704 | epot = -15.4103502921573 | etot = -14.6175140348735 -427000 ekin = 0.388382398339816 | erot = 0.409609962240036 | epot = -15.4155063955013 | etot = -14.6175140349214 -428000 ekin = 0.409880900047524 | erot = 0.393856678091899 | epot = -15.4212516131094 | etot = -14.6175140349699 -429000 ekin = 0.430009061106479 | erot = 0.379311788381591 | epot = -15.4268348845041 | etot = -14.617514035016 -430000 ekin = 0.448067283636575 | erot = 0.3659652824005 | epot = -15.4315466010941 | etot = -14.617514035057 -431000 ekin = 0.463411378723588 | erot = 0.353835411175161 | epot = -15.4347608249895 | etot = -14.6175140350907 -432000 ekin = 0.475485941535269 | erot = 0.342969616703674 | epot = -15.4359695933546 | etot = -14.6175140351156 -433000 ekin = 0.483854704021334 | erot = 0.333438714396283 | epot = -15.4348074535483 | etot = -14.6175140351307 -434000 ekin = 0.488225698519521 | erot = 0.325325491782385 | epot = -15.4310652254377 | etot = -14.6175140351358 -435000 ekin = 0.48846961521868 | erot = 0.318709988965965 | epot = -15.4246936393157 | etot = -14.6175140351311 -436000 ekin = 0.484629100798397 | erot = 0.313653867974891 | epot = -15.4157970038909 | etot = -14.6175140351176 -437000 ekin = 0.476917712285193 | erot = 0.310186654191006 | epot = -15.4046184015729 | etot = -14.6175140350967 -438000 ekin = 0.465707830236428 | erot = 0.308296241623089 | epot = -15.3915181069294 | etot = -14.6175140350699 -439000 ekin = 0.45150753680146 | erot = 0.30792515377069 | epot = -15.3769467256113 | etot = -14.6175140350391 -440000 ekin = 0.434927659014138 | erot = 0.308973010492868 | epot = -15.3614147045135 | etot = -14.6175140350065 -441000 ekin = 0.416641657349937 | erot = 0.311304747383582 | epot = -15.3454604397074 | etot = -14.6175140349739 -442000 ekin = 0.397341542601571 | erot = 0.314762618736297 | epot = -15.3296181962812 | etot = -14.6175140349433 -443000 ekin = 0.377694362715545 | erot = 0.319179725729324 | epot = -15.314388123361 | etot = -14.6175140349161 -444000 ekin = 0.358304425136817 | erot = 0.32439329819003 | epot = -15.3002117582203 | etot = -14.6175140348934 -445000 ekin = 0.339684383335156 | erot = 0.330254911559461 | epot = -15.2874533297707 | etot = -14.6175140348761 -446000 ekin = 0.322237701351822 | erot = 0.336636009508 | epot = -15.2763877457241 | etot = -14.6175140348643 -447000 ekin = 0.30625308658371 | erot = 0.34342824275766 | epot = -15.2671953641993 | etot = -14.6175140348579 -448000 ekin = 0.291909091343975 | erot = 0.350538602019967 | epot = -15.2599617282208 | etot = -14.6175140348568 -449000 ekin = 0.279285717664377 | erot = 0.357880263087886 | epot = -15.254680015613 | etot = -14.6175140348608 -450000 ekin = 0.268379332693754 | erot = 0.365360767815974 | epot = -15.2512541353793 | etot = -14.6175140348696 -451000 ekin = 0.259117719163031 | erot = 0.372869677558793 | epot = -15.2495014316051 | etot = -14.6175140348833 -452000 ekin = 0.251373384973835 | erot = 0.380268095669032 | epot = -15.2491555155445 | etot = -14.6175140349017 -453000 ekin = 0.24497482412797 | erot = 0.387382402362676 | epot = -15.2498712614149 | etot = -14.6175140349243 -454000 ekin = 0.239716691076598 | erot = 0.394004131859313 | epot = -15.251234857886 | etot = -14.6175140349501 -455000 ekin = 0.235370413814522 | erot = 0.399897145639913 | epot = -15.252781594432 | etot = -14.6175140349776 -456000 ekin = 0.231696513790871 | erot = 0.404812188422525 | epot = -15.254022737218 | etot = -14.6175140350046 -457000 ekin = 0.22845901443235 | erot = 0.408507709512969 | epot = -15.2544807589739 | etot = -14.6175140350285 -458000 ekin = 0.225441196082656 | erot = 0.41077470562198 | epot = -15.2537299367515 | etot = -14.6175140350469 -459000 ekin = 0.22246101894078 | erot = 0.411462514810095 | epot = -15.251437568808 | etot = -14.6175140350572 -460000 ekin = 0.219384094438714 | erot = 0.410502136527495 | epot = -15.2474002660241 | etot = -14.6175140350579 -461000 ekin = 0.21613224524022 | erot = 0.40792384413126 | epot = -15.2415701244196 | etot = -14.6175140350481 -462000 ekin = 0.212686361973382 | erot = 0.403866554422734 | epot = -15.2340669514243 | etot = -14.6175140350282 -463000 ekin = 0.209083218482854 | erot = 0.398577486489151 | epot = -15.2251747399712 | etot = -14.6175140349992 -464000 ekin = 0.20540688826373 | erot = 0.392401883856613 | epot = -15.2153228070836 | etot = -14.6175140349633 -465000 ekin = 0.201776197881068 | erot = 0.385763783461919 | epot = -15.2050540162659 | etot = -14.6175140349229 -466000 ekin = 0.198330130961181 | erot = 0.379139817336986 | epot = -15.1949839831793 | etot = -14.6175140348811 -467000 ekin = 0.195213224017124 | erot = 0.373028711257475 | epot = -15.1857559701151 | etot = -14.6175140348405 -468000 ekin = 0.192562810062158 | erot = 0.367919448414916 | epot = -15.1779962932808 | etot = -14.6175140348037 -469000 ekin = 0.190499545154769 | erot = 0.364261004085612 | epot = -15.1722745840131 | etot = -14.6175140347727 -470000 ekin = 0.18912208603274 | erot = 0.362436180586983 | epot = -15.1690723013684 | etot = -14.6175140347487 -471000 ekin = 0.188506156938867 | erot = 0.362741456207278 | epot = -15.1687616478786 | etot = -14.6175140347325 -472000 ekin = 0.188707621222394 | erot = 0.365373993438347 | epot = -15.1715956493845 | etot = -14.6175140347238 -473000 ekin = 0.189768618622282 | erot = 0.370426120543888 | epot = -15.1777087738883 | etot = -14.6175140347222 -474000 ekin = 0.191725397341772 | erot = 0.377886798112635 | epot = -15.1871262301808 | etot = -14.6175140347264 -475000 ekin = 0.194616213071371 | erot = 0.387648901412467 | epot = -15.1997791492193 | etot = -14.6175140347354 -476000 ekin = 0.19848763616133 | erot = 0.399520678155556 | epot = -15.2155223490651 | etot = -14.6175140347483 -477000 ekin = 0.203397790430575 | erot = 0.413239540254448 | epot = -15.234151365449 | etot = -14.617514034764 -478000 ekin = 0.209415519783994 | erot = 0.428486466926518 | epot = -15.2554160214928 | etot = -14.6175140347823 -479000 ekin = 0.216615156595488 | erot = 0.444899686771521 | epot = -15.2790288781697 | etot = -14.6175140348027 -480000 ekin = 0.225067223158495 | erot = 0.462086880017487 | epot = -15.3046681380014 | etot = -14.6175140348255 -481000 ekin = 0.234826185148526 | erot = 0.479635803738694 | epot = -15.3319760237382 | etot = -14.6175140348509 -482000 ekin = 0.24591693935593 | erot = 0.497123799837189 | epot = -15.3605547740723 | etot = -14.6175140348792 -483000 ekin = 0.258322039581471 | erot = 0.514126984880484 | epot = -15.3899630593723 | etot = -14.6175140349103 -484000 ekin = 0.271971667055458 | erot = 0.530229960568097 | epot = -15.4197156625675 | etot = -14.617514034944 -485000 ekin = 0.286738030810237 | erot = 0.545036619609161 | epot = -15.4492886853988 | etot = -14.6175140349794 -486000 ekin = 0.302435294442602 | erot = 0.558182125190157 | epot = -15.4781314546481 | etot = -14.6175140350154 -487000 ekin = 0.318825369858635 | erot = 0.569345540302413 | epot = -15.5056849452114 | etot = -14.6175140350504 -488000 ekin = 0.335629120856599 | erot = 0.578262027782435 | epot = -15.5314051837218 | etot = -14.6175140350827 -489000 ekin = 0.352541803825719 | erot = 0.584733173542254 | epot = -15.5547890124787 | etot = -14.6175140351108 -490000 ekin = 0.369251041133798 | erot = 0.58863390237619 | epot = -15.5753989786432 | etot = -14.6175140351332 -491000 ekin = 0.385455339944008 | erot = 0.589914693970058 | epot = -15.5928840690631 | etot = -14.6175140351491 -492000 ekin = 0.40088115647899 | erot = 0.588598334680754 | epot = -15.6069935263179 | etot = -14.6175140351581 -493000 ekin = 0.415296746377553 | erot = 0.584771169137649 | epot = -15.6175819506758 | etot = -14.6175140351606 -494000 ekin = 0.428521503102931 | erot = 0.578569614095801 | epot = -15.6246051523561 | etot = -14.6175140351573 -495000 ekin = 0.440430011858771 | erot = 0.570163426568569 | epot = -15.6281074735768 | etot = -14.6175140351495 -496000 ekin = 0.450950706316734 | erot = 0.559737766477586 | epot = -15.628202507933 | etot = -14.6175140351387 -497000 ekin = 0.460059581798191 | erot = 0.547476355485745 | epot = -15.6250499724103 | etot = -14.6175140351264 -498000 ekin = 0.467769906492318 | erot = 0.533547985555278 | epot = -15.6188319271617 | etot = -14.6175140351141 -499000 ekin = 0.474119221073082 | erot = 0.518098277332704 | epot = -15.6097315335085 | etot = -14.6175140351027 -500000 ekin = 0.47915510663518 | erot = 0.501247978937513 | epot = -15.5979171206656 | etot = -14.6175140350929 -501000 ekin = 0.482921233338969 | erot = 0.483098304082662 | epot = -15.5835335725064 | etot = -14.6175140350848 -502000 ekin = 0.485445093649088 | erot = 0.463742920559554 | epot = -15.5667020492864 | etot = -14.6175140350777 -503000 ekin = 0.486728599209648 | erot = 0.443285305605623 | epot = -15.5475279398862 | etot = -14.6175140350709 -504000 ekin = 0.486742408087926 | erot = 0.421859374631785 | epot = -15.5261158177828 | etot = -14.6175140350631 -505000 ekin = 0.485424480827694 | erot = 0.399650657768087 | epot = -15.5025891736488 | etot = -14.617514035053 -506000 ekin = 0.48268297341187 | erot = 0.376914939267219 | epot = -15.4771119477182 | etot = -14.6175140350392 -507000 ekin = 0.478403198154612 | erot = 0.353991273961029 | epot = -15.4499085071364 | etot = -14.6175140350208 -508000 ekin = 0.472458052935441 | erot = 0.331306710133916 | epot = -15.4212787980666 | etot = -14.6175140349972 -509000 ekin = 0.46472106285539 | erot = 0.309370883447747 | epot = -15.3916059812718 | etot = -14.6175140349687 -510000 ekin = 0.455081004104095 | erot = 0.288759823578743 | epot = -15.3613548626186 | etot = -14.6175140349358 -511000 ekin = 0.443456979180403 | erot = 0.270089690707411 | epot = -15.3310607047875 | etot = -14.6175140348996 -512000 ekin = 0.429812848219575 | erot = 0.25398253489869 | epot = -15.3013094179802 | etot = -14.6175140348619 -513000 ekin = 0.414169942618988 | erot = 0.241027258547328 | epot = -15.2727112359908 | etot = -14.6175140348245 -514000 ekin = 0.396617122319459 | erot = 0.231739657368316 | epot = -15.245870814477 | etot = -14.6175140347893 -515000 ekin = 0.377317407138787 | erot = 0.226525548757195 | epot = -15.2213569906539 | etot = -14.6175140347579 -516000 ekin = 0.356510629533613 | erot = 0.225650587239684 | epot = -15.1996752515051 | etot = -14.6175140347318 -517000 ekin = 0.334511811731556 | erot = 0.229219509886492 | epot = -15.1812453563299 | etot = -14.6175140347118 -518000 ekin = 0.311705249160021 | erot = 0.23716641592675 | epot = -15.1663856997854 | etot = -14.6175140346987 -519000 ekin = 0.288534562405509 | erot = 0.249256456193826 | epot = -15.1553050532917 | etot = -14.6175140346923 -520000 ekin = 0.265489234982404 | erot = 0.265098165451267 | epot = -15.1481014351262 | etot = -14.6175140346925 -521000 ekin = 0.243088358087729 | erot = 0.284164745160129 | epot = -15.1447671379464 | etot = -14.6175140346986 -522000 ekin = 0.221862437060792 | erot = 0.305821970140486 | epot = -15.1451984419111 | etot = -14.6175140347098 -523000 ekin = 0.202334169776215 | erot = 0.329360070797338 | epot = -15.149208275299 | etot = -14.6175140347255 -524000 ekin = 0.184999091076189 | erot = 0.354026911471086 | epot = -15.1565400372918 | etot = -14.6175140347445 -525000 ekin = 0.170306912739355 | erot = 0.379059948771691 | epot = -15.1668808962774 | etot = -14.6175140347664 -526000 ekin = 0.158644243148445 | erot = 0.403715126925631 | epot = -15.1798734048646 | etot = -14.6175140347905 -527000 ekin = 0.150319367666608 | erot = 0.427291025812717 | epot = -15.1951244282958 | etot = -14.6175140348165 -528000 ekin = 0.145549592055318 | erot = 0.449147424933815 | epot = -15.2122110518333 | etot = -14.6175140348441 -529000 ekin = 0.144451603984815 | erot = 0.46871812185095 | epot = -15.2306837607091 | etot = -14.6175140348734 -530000 ekin = 0.147035267138349 | erot = 0.485518371011605 | epot = -15.2500676730542 | etot = -14.6175140349042 -531000 ekin = 0.153201203684292 | erot = 0.499147835497304 | epot = -15.2698630741182 | etot = -14.6175140349366 -532000 ekin = 0.162742448479717 | erot = 0.509290301682708 | epot = -15.2895467851327 | etot = -14.6175140349702 -533000 ekin = 0.175350354881916 | erot = 0.515711587206721 | epot = -15.3085759770934 | etot = -14.6175140350047 -534000 ekin = 0.190624856013519 | erot = 0.518257146630614 | epot = -15.3263960376834 | etot = -14.6175140350393 -535000 ekin = 0.208088493536824 | erot = 0.516850140104756 | epot = -15.3424526687142 | etot = -14.6175140350726 -536000 ekin = 0.227204325842689 | erot = 0.511491240065728 | epot = -15.3562096010119 | etot = -14.6175140351035 -537000 ekin = 0.247396768812984 | erot = 0.502260311074185 | epot = -15.3671711150173 | etot = -14.6175140351302 -538000 ekin = 0.268074342413392 | erot = 0.489319600961478 | epot = -15.3749079785256 | etot = -14.6175140351508 -539000 ekin = 0.288653182933449 | erot = 0.4729176796722 | epot = -15.3790848977693 | etot = -14.6175140351637 -540000 ekin = 0.308579985825782 | erot = 0.453392904739592 | epot = -15.3794869257329 | etot = -14.6175140351675 -541000 ekin = 0.327353008191246 | erot = 0.431174973010967 | epot = -15.3760420163633 | etot = -14.6175140351611 -542000 ekin = 0.344539853506965 | erot = 0.406783142889028 | epot = -15.3688370315399 | etot = -14.6175140351439 -543000 ekin = 0.359790986513993 | erot = 0.380819988063805 | epot = -15.3581250096939 | etot = -14.6175140351161 -544000 ekin = 0.37284826309085 | erot = 0.353960030672464 | epot = -15.344322328842 | etot = -14.6175140350787 -545000 ekin = 0.383548167009815 | erot = 0.326933212481791 | epot = -15.3279954145248 | etot = -14.6175140350332 -546000 ekin = 0.391819867385749 | erot = 0.300503784237994 | epot = -15.3098376866053 | etot = -14.6175140349815 -547000 ekin = 0.397678590182396 | erot = 0.275445713887096 | epot = -15.2906383389958 | etot = -14.6175140349263 -548000 ekin = 0.401215088504832 | erot = 0.252516050366015 | epot = -15.2712451737408 | etot = -14.6175140348699 -549000 ekin = 0.402582175512791 | erot = 0.232427794767637 | epot = -15.2525240050959 | etot = -14.6175140348155 -550000 ekin = 0.401979352687969 | erot = 0.215823740833009 | epot = -15.2353171282862 | etot = -14.6175140347652 -551000 ekin = 0.399636550193996 | erot = 0.203252510909739 | epot = -15.220403095825 | etot = -14.6175140347213 -552000 ekin = 0.395797934840894 | erot = 0.195147714573778 | epot = -15.2084596841007 | etot = -14.617514034686 -553000 ekin = 0.390706676476196 | erot = 0.191810879117336 | epot = -15.2000315902546 | etot = -14.6175140346611 -554000 ekin = 0.384591526958096 | erot = 0.19339860945437 | epot = -15.1955041710601 | etot = -14.6175140346476 -555000 ekin = 0.377656068332676 | erot = 0.199914362894006 | epot = -15.1950844658734 | etot = -14.6175140346467 -556000 ekin = 0.370071512615683 | erot = 0.211205266307111 | epot = -15.1987908135806 | etot = -14.6175140346578 -557000 ekin = 0.361973939272813 | erot = 0.226964515102972 | epot = -15.2064524890562 | etot = -14.6175140346805 -558000 ekin = 0.353466765020817 | erot = 0.246739996102199 | epot = -15.2177207958362 | etot = -14.6175140347132 -559000 ekin = 0.344628961765223 | erot = 0.269949765670651 | epot = -15.2320927621895 | etot = -14.6175140347536 -560000 ekin = 0.335528980568065 | erot = 0.295904778796298 | epot = -15.248947794163 | etot = -14.6175140347986 -561000 ekin = 0.326243446081694 | erot = 0.32383871490908 | epot = -15.2675961958353 | etot = -14.6175140348445 -562000 ekin = 0.316878486813705 | erot = 0.352943857553535 | epot = -15.2873363792542 | etot = -14.617514034887 -563000 ekin = 0.307590234581993 | erot = 0.382410843957943 | epot = -15.3075151134627 | etot = -14.6175140349227 -564000 ekin = 0.298599911427723 | erot = 0.411468934029848 | epot = -15.3275828804063 | etot = -14.6175140349488 -565000 ekin = 0.290198521501613 | erot = 0.439422606477982 | epot = -15.3471351629436 | etot = -14.617514034964 -566000 ekin = 0.282736992095915 | erot = 0.465680158920146 | epot = -15.3659311859852 | etot = -14.6175140349691 -567000 ekin = 0.276599956454237 | erot = 0.489770841523137 | epot = -15.3838848329439 | etot = -14.6175140349665 -568000 ekin = 0.272165052790849 | erot = 0.51134888782089 | epot = -15.4010279755719 | etot = -14.6175140349602 -569000 ekin = 0.269753809413351 | erot = 0.530185258477429 | epot = -15.4174531028455 | etot = -14.6175140349547 -570000 ekin = 0.269583567607364 | erot = 0.546150320474836 | epot = -15.4332479230362 | etot = -14.617514034954 -571000 ekin = 0.271731068577875 | erot = 0.559192265325752 | epot = -15.4484373688642 | etot = -14.6175140349606 -572000 ekin = 0.276116495687091 | erot = 0.569316321634121 | epot = -15.4629468522959 | etot = -14.6175140349747 -573000 ekin = 0.282512256444534 | erot = 0.576569321998237 | epot = -15.4765956134374 | etot = -14.6175140349946 -574000 ekin = 0.290574483947443 | erot = 0.58103049076154 | epot = -15.4891190097262 | etot = -14.6175140350172 -575000 ekin = 0.299890113326593 | erot = 0.582808418137594 | epot = -15.5002125665028 | etot = -14.6175140350386 -576000 ekin = 0.310029076130859 | erot = 0.582041678954832 | epot = -15.5095847901412 | etot = -14.6175140350555 -577000 ekin = 0.320591144135675 | erot = 0.578899817193377 | epot = -15.5170049963946 | etot = -14.6175140350655 -578000 ekin = 0.331239680817734 | erot = 0.573581904321388 | epot = -15.5223356202072 | etot = -14.6175140350681 -579000 ekin = 0.341718767395713 | erot = 0.566311213814816 | epot = -15.5255440162742 | etot = -14.6175140350637 -580000 ekin = 0.351854361646192 | erot = 0.557326170820746 | epot = -15.5266945675209 | etot = -14.617514035054 -581000 ekin = 0.361543170719959 | erot = 0.546869043111512 | epot = -15.5259262488727 | etot = -14.6175140350412 -582000 ekin = 0.370734291431731 | erot = 0.535174473618127 | epot = -15.5234228000774 | etot = -14.6175140350275 -583000 ekin = 0.37940854514636 | erot = 0.522459863754317 | epot = -15.5193824439152 | etot = -14.6175140350145 -584000 ekin = 0.387559338332064 | erot = 0.50891899993969 | epot = -15.5139923732753 | etot = -14.6175140350036 -585000 ekin = 0.395177418309436 | erot = 0.494719483694829 | epot = -15.5074109369994 | etot = -14.6175140349952 -586000 ekin = 0.402240533516594 | erot = 0.480003760424791 | epot = -15.4997583289309 | etot = -14.6175140349895 -587000 ekin = 0.408707997145263 | erot = 0.464893014294175 | epot = -15.4911150464257 | etot = -14.6175140349862 -588000 ekin = 0.41451954577295 | erot = 0.449492951760516 | epot = -15.4815265325182 | etot = -14.6175140349847 -589000 ekin = 0.419597612555334 | erot = 0.43390048790532 | epot = -15.4710121354448 | etot = -14.6175140349841 -590000 ekin = 0.423852083806567 | erot = 0.418210489542958 | epot = -15.4595766083332 | etot = -14.6175140349837 -591000 ekin = 0.427186671517479 | erot = 0.402521929657892 | epot = -15.447222636158 | etot = -14.6175140349826 -592000 ekin = 0.429506137373686 | erot = 0.386943005728737 | epot = -15.4339631780827 | etot = -14.6175140349802 -593000 ekin = 0.430723706116615 | erot = 0.371594936609099 | epot = -15.4198326777017 | etot = -14.617514034976 -594000 ekin = 0.430768094953839 | erot = 0.356614269836478 | epot = -15.4048963997596 | etot = -14.6175140349693 -595000 ekin = 0.42958966483036 | erot = 0.34215360916983 | epot = -15.3892573089602 | etot = -14.61751403496 -596000 ekin = 0.427165296133674 | erot = 0.328380718540701 | epot = -15.3730600496226 | etot = -14.6175140349482 -597000 ekin = 0.423501658500188 | erot = 0.315475989401846 | epot = -15.3564916828361 | etot = -14.617514034934 -598000 ekin = 0.418636501255824 | erot = 0.30362835958022 | epot = -15.3397788957539 | etot = -14.6175140349178 -599000 ekin = 0.412638207582771 | erot = 0.293029673722298 | epot = -15.3231819162053 | etot = -14.6175140349002 -600000 ekin = 0.405603414753992 | erot = 0.283867637225037 | epot = -15.306985086861 | etot = -14.6175140348819 -601000 ekin = 0.397652939448924 | erot = 0.27631757335997 | epot = -15.2914845476729 | etot = -14.617514034864 -602000 ekin = 0.388926339151977 | erot = 0.270533300127966 | epot = -15.2769736741272 | etot = -14.6175140348472 -603000 ekin = 0.379575547711323 | erot = 0.266637582798157 | epot = -15.2637271653422 | etot = -14.6175140348327 -604000 ekin = 0.369758112224678 | erot = 0.264712769809213 | epot = -15.2519849168553 | etot = -14.6175140348214 -605000 ekin = 0.359630614964776 | erot = 0.264792359550131 | epot = -15.241937009329 | etot = -14.617514034814 -606000 ekin = 0.349342882571482 | erot = 0.266854337886994 | epot = -15.2337112552696 | etot = -14.6175140348111 -607000 ekin = 0.339033558751721 | erot = 0.270817131627805 | epot = -15.2273647251923 | etot = -14.6175140348128 -608000 ekin = 0.328827538259558 | erot = 0.276538908097645 | epot = -15.2228804811762 | etot = -14.617514034819 -609000 ekin = 0.318835621087791 | erot = 0.283820700144912 | epot = -15.2201703560617 | etot = -14.617514034829 -610000 ekin = 0.309156542568471 | erot = 0.292413461056483 | epot = -15.2190840384669 | etot = -14.617514034842 -611000 ekin = 0.29988127210835 | erot = 0.302028697870677 | epot = -15.2194240048356 | etot = -14.6175140348566 -612000 ekin = 0.291099167856382 | erot = 0.312351863790435 | epot = -15.2209650665183 | etot = -14.6175140348715 -613000 ekin = 0.282905257831731 | erot = 0.323057294042835 | epot = -15.2234765867597 | etot = -14.6175140348851 -614000 ekin = 0.275407632339994 | erot = 0.333823223653581 | epot = -15.2267448908899 | etot = -14.6175140348963 -615000 ekin = 0.268733725567278 | erot = 0.344345386321387 | epot = -15.2305931467927 | etot = -14.617514034904 -616000 ekin = 0.263034181136557 | erot = 0.35434787992739 | epot = -15.2348960959719 | etot = -14.6175140349079 -617000 ekin = 0.258483071857821 | erot = 0.363590372787447 | epot = -15.2395874795532 | etot = -14.6175140349079 -618000 ekin = 0.255273496413574 | erot = 0.371871254538827 | epot = -15.2446587858571 | etot = -14.6175140349047 -619000 ekin = 0.253608004174632 | erot = 0.37902692128715 | epot = -15.2501489603613 | etot = -14.6175140348995 -620000 ekin = 0.253683881421992 | erot = 0.384927934513618 | epot = -15.2561258508295 | etot = -14.6175140348939 -621000 ekin = 0.255674023709804 | erot = 0.389473226071993 | epot = -15.2626612846714 | etot = -14.6175140348896 -622000 ekin = 0.25970485336757 | erot = 0.392583779639758 | epot = -15.2698026678959 | etot = -14.6175140348885 -623000 ekin = 0.265833429999403 | erot = 0.394197274405735 | epot = -15.2775447392974 | etot = -14.6175140348923 -624000 ekin = 0.274026439188228 | erot = 0.394265031624551 | epot = -15.2858055057147 | etot = -14.6175140349019 -625000 ekin = 0.284144015738384 | erot = 0.392752285176118 | epot = -15.2944103358322 | etot = -14.6175140349177 -626000 ekin = 0.295931256226139 | erot = 0.389642344380343 | epot = -15.3030876355457 | etot = -14.6175140349392 -627000 ekin = 0.309019727829663 | erot = 0.38494467650416 | epot = -15.3114784392987 | etot = -14.6175140349649 -628000 ekin = 0.322940275279064 | erot = 0.378706350959343 | epot = -15.3191606612307 | etot = -14.6175140349923 -629000 ekin = 0.337147043698277 | erot = 0.37102569897414 | epot = -15.3256867776908 | etot = -14.6175140350184 -630000 ekin = 0.351051052994981 | erot = 0.362066500826367 | epot = -15.3306315888613 | etot = -14.6175140350399 -631000 ekin = 0.364060148819096 | erot = 0.352070586245494 | epot = -15.333644770118 | etot = -14.6175140350534 -632000 ekin = 0.375621025661737 | erot = 0.341366514680777 | epot = -15.3345015753988 | etot = -14.6175140350563 -633000 ekin = 0.385258541224816 | erot = 0.33037209230534 | epot = -15.3331446685769 | etot = -14.6175140350467 -634000 ekin = 0.392607865616762 | erot = 0.31958895649352 | epot = -15.3297108571345 | etot = -14.6175140350242 -635000 ekin = 0.39743609727868 | erot = 0.309588318033271 | epot = -15.3245384503017 | etot = -14.6175140349897 -636000 ekin = 0.399651602685353 | erot = 0.30098809437835 | epot = -15.318153732009 | etot = -14.6175140349453 -637000 ekin = 0.399301141333129 | erot = 0.294422893568983 | epot = -15.3112380697961 | etot = -14.617514034894 -638000 ekin = 0.396556439147407 | erot = 0.290509369489655 | epot = -15.3045798434767 | etot = -14.6175140348397 -639000 ekin = 0.391692975513997 | erot = 0.289810143797434 | epot = -15.2990171540975 | etot = -14.617514034786 -640000 ekin = 0.385064212934161 | erot = 0.292799653113688 | epot = -15.2953779007847 | etot = -14.6175140347369 -641000 ekin = 0.377074355551302 | erot = 0.299834934663062 | epot = -15.2944233249094 | etot = -14.6175140346951 -642000 ekin = 0.368152133961515 | erot = 0.311133625026309 | epot = -15.2967997936509 | etot = -14.6175140346631 -643000 ekin = 0.358727298275111 | erot = 0.326760494743868 | epot = -15.3030018276614 | etot = -14.6175140346424 -644000 ekin = 0.349210670243499 | erot = 0.346622862554325 | epot = -15.3133475674317 | etot = -14.6175140346339 -645000 ekin = 0.339977915474886 | erot = 0.370474376280189 | epot = -15.3279663263927 | etot = -14.6175140346376 -646000 ekin = 0.331356734049287 | erot = 0.397926004729598 | epot = -15.3467967734319 | etot = -14.617514034653 -647000 ekin = 0.323616951062021 | erot = 0.428462692622343 | epot = -15.3695936783637 | etot = -14.6175140346794 -648000 ekin = 0.316962984679749 | erot = 0.461463981264525 | epot = -15.3959410006599 | etot = -14.6175140347156 -649000 ekin = 0.311528303721769 | erot = 0.496226945506609 | epot = -15.4252692839889 | etot = -14.6175140347605 -650000 ekin = 0.307371814502051 | erot = 0.53199011331203 | epot = -15.4568759626267 | etot = -14.6175140348127 -651000 ekin = 0.304476169211528 | erot = 0.567957247023637 | epot = -15.4899474511057 | etot = -14.6175140348705 -652000 ekin = 0.302748327843063 | erot = 0.603320352539344 | epot = -15.523582715315 | etot = -14.6175140349325 -653000 ekin = 0.302022769689561 | erot = 0.637281675063983 | epot = -15.5568184797505 | etot = -14.617514034997 -654000 ekin = 0.302067723594154 | erot = 0.669074745116258 | epot = -15.5886565037723 | etot = -14.6175140350619 -655000 ekin = 0.302594671774775 | erot = 0.697984728110365 | epot = -15.6180934350103 | etot = -14.6175140351252 -656000 ekin = 0.303271161273661 | erot = 0.723368330432067 | epot = -15.6441535268902 | etot = -14.6175140351845 -657000 ekin = 0.303736663270792 | erot = 0.744673311812443 | epot = -15.6659240103206 | etot = -14.6175140352373 -658000 ekin = 0.303620889262384 | erot = 0.761457272710392 | epot = -15.6825921972542 | etot = -14.6175140352814 -659000 ekin = 0.302563666907984 | erot = 0.773404945481054 | epot = -15.6934826477032 | etot = -14.6175140353142 -660000 ekin = 0.300235395695091 | erot = 0.780343280385843 | epot = -15.698092711415 | etot = -14.6175140353341 -661000 ekin = 0.296355710531902 | erot = 0.782250083093143 | epot = -15.6961198289647 | etot = -14.6175140353397 -662000 ekin = 0.290710478297184 | erot = 0.779257959177687 | epot = -15.6874824728051 | etot = -14.6175140353302 -663000 ekin = 0.283165147463639 | erot = 0.77165065199169 | epot = -15.6723298347614 | etot = -14.6175140353061 -664000 ekin = 0.273673427176448 | erot = 0.759850562455872 | epot = -15.6510380249006 | etot = -14.6175140352683 -665000 ekin = 0.262280913452385 | erot = 0.744397727319057 | epot = -15.6241926759903 | etot = -14.6175140352189 -666000 ekin = 0.249123647022483 | erot = 0.7259212317447 | epot = -15.5925589139278 | etot = -14.6175140351606 -667000 ekin = 0.234422061210147 | erot = 0.705104954965032 | epot = -15.5570410512716 | etot = -14.6175140350964 -668000 ekin = 0.218471158369324 | erot = 0.682650243124776 | epot = -15.5186354365237 | etot = -14.6175140350296 -669000 ekin = 0.201627981911843 | erot = 0.659238455806553 | epot = -15.4783804726815 | etot = -14.6175140349632 -670000 ekin = 0.184297501939065 | erot = 0.635496303880898 | epot = -15.43730784072 | etot = -14.6175140349001 -671000 ekin = 0.166917915805004 | erot = 0.611966525748027 | epot = -15.3963984763956 | etot = -14.6175140348426 -672000 ekin = 0.149946120674196 | erot = 0.589085832361493 | epot = -15.3565459878282 | etot = -14.6175140347926 -673000 ekin = 0.133843801904582 | erot = 0.567171306812613 | epot = -15.318529143468 | etot = -14.6175140347508 -674000 ekin = 0.119064262674576 | erot = 0.546415679820867 | epot = -15.2829939772136 | etot = -14.6175140347181 -675000 ekin = 0.106039855017085 | erot = 0.526891195482506 | epot = -15.250445085194 | etot = -14.6175140346944 -676000 ekin = 0.0951697078773878 | erot = 0.508561175678473 | epot = -15.2212449182352 | etot = -14.6175140346793 -677000 ekin = 0.086807451986192 | erot = 0.491297978909966 | epot = -15.1956194655683 | etot = -14.6175140346722 -678000 ekin = 0.0812485969712828 | erot = 0.474905301099178 | epot = -15.1736679327427 | etot = -14.6175140346722 -679000 ekin = 0.0787177619800211 | erot = 0.459143233464763 | epot = -15.1553750301234 | etot = -14.6175140346787 -680000 ekin = 0.0793562024648552 | erot = 0.443753980649329 | epot = -15.140624217805 | etot = -14.6175140346908 -681000 ekin = 0.0832104900789999 | erot = 0.428486254341784 | epot = -15.1292107791285 | etot = -14.6175140347077 -682000 ekin = 0.0902236865225188 | erot = 0.413116880933304 | epot = -15.1208546021847 | etot = -14.6175140347289 -683000 ekin = 0.100230543462408 | erot = 0.397468585264377 | epot = -15.11521316348 | etot = -14.6175140347533 -684000 ekin = 0.112958164258869 | erot = 0.381423459018597 | epot = -15.1118956580574 | etot = -14.6175140347799 -685000 ekin = 0.128033094046148 | erot = 0.364932120277307 | epot = -15.1104792491311 | etot = -14.6175140348076 -686000 ekin = 0.144995008361601 | erot = 0.348018922992647 | epot = -15.1105279661894 | etot = -14.6175140348351 -687000 ekin = 0.163316207854767 | erot = 0.330783730221022 | epot = -15.1116139729365 | etot = -14.6175140348607 -688000 ekin = 0.182425234215551 | erot = 0.313400732953855 | epot = -15.1133400020525 | etot = -14.6175140348831 -689000 ekin = 0.201732335852577 | erot = 0.296114640201443 | epot = -15.1153610109551 | etot = -14.6175140349011 -690000 ekin = 0.220654383891154 | erot = 0.279234374240434 | epot = -15.1174027930453 | etot = -14.6175140349137 -691000 ekin = 0.23863718992453 | erot = 0.263124260136862 | epot = -15.1192754849819 | etot = -14.6175140349205 -692000 ekin = 0.255173895596428 | erot = 0.248192653897472 | epot = -15.1208805844156 | etot = -14.6175140349217 -693000 ekin = 0.269818995118043 | erot = 0.234878024009109 | epot = -15.1222110540446 | etot = -14.6175140349175 -694000 ekin = 0.282198402189113 | erot = 0.223632668706427 | epot = -15.1233451058044 | etot = -14.6175140349089 -695000 ekin = 0.292016609393231 | erot = 0.214904477348993 | epot = -15.124435121639 | etot = -14.6175140348968 -696000 ekin = 0.299062308191112 | erot = 0.209117382947945 | epot = -15.1256937260212 | etot = -14.6175140348821 -697000 ekin = 0.30321380997214 | erot = 0.206651361568493 | epot = -15.1273792064064 | etot = -14.6175140348658 -698000 ekin = 0.30444525619219 | erot = 0.207822979229873 | epot = -15.1297822702705 | etot = -14.6175140348484 -699000 ekin = 0.302833983904948 | erot = 0.212867544425277 | epot = -15.1332155631607 | etot = -14.6175140348305 -700000 ekin = 0.29856859634332 | erot = 0.221923881123336 | epot = -15.1380065122785 | etot = -14.6175140348118 -701000 ekin = 0.291956369738242 | erot = 0.235022588976831 | epot = -15.1444929935074 | etot = -14.6175140347924 -702000 ekin = 0.283427734153835 | erot = 0.252078414121472 | epot = -15.153020183048 | etot = -14.6175140347727 -703000 ekin = 0.273534855576746 | erot = 0.272887068861365 | epot = -15.1639359591909 | etot = -14.6175140347528 -704000 ekin = 0.262941046164233 | erot = 0.297126498876432 | epot = -15.1775815797744 | etot = -14.6175140347337 -705000 ekin = 0.252398060444365 | erot = 0.324362359960393 | epot = -15.194274455122 | etot = -14.6175140347173 -706000 ekin = 0.242709489752073 | erot = 0.354057349893491 | epot = -15.2142808743513 | etot = -14.6175140347058 -707000 ekin = 0.234680465258637 | erot = 0.385584073394242 | epot = -15.2377785733552 | etot = -14.6175140347023 -708000 ekin = 0.229056562326157 | erot = 0.418241319394871 | epot = -15.264811916431 | etot = -14.61751403471 -709000 ekin = 0.226457657533258 | erot = 0.451273895783649 | epot = -15.2952455880485 | etot = -14.6175140347316 -710000 ekin = 0.227314828595311 | erot = 0.483896330830945 | epot = -15.3287251941949 | etot = -14.6175140347687 -711000 ekin = 0.231819479497128 | erot = 0.515320742171203 | epot = -15.3646542564898 | etot = -14.6175140348215 -712000 ekin = 0.239893150548963 | erot = 0.544788749312711 | epot = -15.4021959347498 | etot = -14.6175140348881 -713000 ekin = 0.251183758823288 | erot = 0.571606341188824 | epot = -15.4403041349766 | etot = -14.6175140349645 -714000 ekin = 0.265090036185525 | erot = 0.595179886372787 | epot = -15.4777839576035 | etot = -14.6175140350452 -715000 ekin = 0.280811306968559 | erot = 0.615050345044272 | epot = -15.5133756871366 | etot = -14.6175140351238 -716000 ekin = 0.297415784950407 | erot = 0.630922165703626 | epot = -15.5458519858478 | etot = -14.6175140351937 -717000 ekin = 0.313918116237917 | erot = 0.642683345316706 | epot = -15.5741154968041 | etot = -14.6175140352494 -718000 ekin = 0.329356373327112 | erot = 0.650413757300199 | epot = -15.597284165914 | etot = -14.6175140352867 -719000 ekin = 0.342860093484457 | erot = 0.654380316354483 | epot = -15.6147544451421 | etot = -14.6175140353032 -720000 ekin = 0.353703497403049 | erot = 0.655019233384572 | epot = -15.6262367660863 | etot = -14.6175140352987 -721000 ekin = 0.361340844905849 | erot = 0.652906431496321 | epot = -15.6317613116767 | etot = -14.6175140352745 -722000 ekin = 0.365423978941575 | erot = 0.648719378780931 | epot = -15.6316573929561 | etot = -14.6175140352336 -723000 ekin = 0.365803989072306 | erot = 0.643193727890481 | epot = -15.6265117521426 | etot = -14.6175140351798 -724000 ekin = 0.362520178745313 | erot = 0.637078359573022 | epot = -15.6171125734355 | etot = -14.6175140351172 -725000 ekin = 0.355779938480366 | erot = 0.631092082280502 | epot = -15.604386055811 | etot = -14.6175140350501 -726000 ekin = 0.345932952941823 | erot = 0.625884613514235 | epot = -15.5893316014386 | etot = -14.6175140349825 -727000 ekin = 0.333442641405672 | erot = 0.622003743386422 | epot = -15.5729604197101 | etot = -14.617514034918 -728000 ekin = 0.318857050497248 | erot = 0.619869891937897 | epot = -15.5562409772948 | etot = -14.6175140348596 -729000 ekin = 0.302780724957378 | erot = 0.619758691690217 | epot = -15.5400534514572 | etot = -14.6175140348096 -730000 ekin = 0.285848455041315 | erot = 0.621791770570811 | epot = -15.5251542603814 | etot = -14.6175140347693 -731000 ekin = 0.268701272205162 | erot = 0.625935552811657 | epot = -15.5121508597566 | etot = -14.6175140347398 -732000 ekin = 0.251964649664151 | erot = 0.632007594592174 | epot = -15.5014862789777 | etot = -14.6175140347214 -733000 ekin = 0.236228569496788 | erot = 0.639689689353094 | epot = -15.4934322935639 | etot = -14.617514034714 -734000 ekin = 0.222028960746823 | erot = 0.648546698715163 | epot = -15.4880896941794 | etot = -14.6175140347174 -735000 ekin = 0.209830023527925 | erot = 0.658049804517654 | epot = -15.4853938627761 | etot = -14.6175140347305 -736000 ekin = 0.200007166761159 | erot = 0.667602683399479 | epot = -15.4851238849135 | etot = -14.6175140347528 -737000 ekin = 0.192830719625055 | erot = 0.676569044421098 | epot = -15.4869137988298 | etot = -14.6175140347837 -738000 ekin = 0.188451200585547 | erot = 0.684300102137718 | epot = -15.4902653375453 | etot = -14.6175140348221 -739000 ekin = 0.186887639936592 | erot = 0.690160900651566 | epot = -15.4945625754552 | etot = -14.617514034867 -740000 ekin = 0.188021068410451 | erot = 0.693554915034906 | epot = -15.4990900183625 | etot = -14.6175140349172 -741000 ekin = 0.191595568995028 | erot = 0.693946922730537 | epot = -15.5030565266959 | etot = -14.6175140349703 -742000 ekin = 0.197228843628196 | erot = 0.690884208638673 | epot = -15.5056270872912 | etot = -14.6175140350243 -743000 ekin = 0.20443350363757 | erot = 0.684016821527744 | epot = -15.5059643602408 | etot = -14.6175140350755 -744000 ekin = 0.212648433381533 | erot = 0.673116668202852 | epot = -15.5032791367049 | etot = -14.6175140351205 -745000 ekin = 0.221277722248148 | erot = 0.658094727365387 | epot = -15.496886484769 | etot = -14.6175140351555 -746000 ekin = 0.229733012317517 | erot = 0.639014583781424 | epot = -15.4862616312763 | etot = -14.6175140351774 -747000 ekin = 0.2374740441444 | erot = 0.61610009667291 | epot = -15.4710881760011 | etot = -14.6175140351838 -748000 ekin = 0.244042266762953 | erot = 0.5897348727874 | epot = -15.4512911747243 | etot = -14.617514035174 -749000 ekin = 0.249083597953252 | erot = 0.56045151840338 | epot = -15.4270491515053 | etot = -14.6175140351487 -750000 ekin = 0.252358330147216 | erot = 0.528910066811307 | epot = -15.3987824320685 | etot = -14.61751403511 -751000 ekin = 0.253738423481735 | erot = 0.495866496254582 | epot = -15.3671189547979 | etot = -14.6175140350616 -752000 ekin = 0.253194394015788 | erot = 0.462133785333153 | epot = -15.3328422143563 | etot = -14.6175140350074 -753000 ekin = 0.250775308155868 | erot = 0.428539072350445 | epot = -15.2968284154581 | etot = -14.6175140349518 -754000 ekin = 0.246585878547032 | erot = 0.395880964578706 | epot = -15.2599808780244 | etot = -14.6175140348987 -755000 ekin = 0.240764398113293 | erot = 0.364890850085532 | epot = -15.2231692830501 | etot = -14.6175140348513 -756000 ekin = 0.23346447104344 | erot = 0.33620133003045 | epot = -15.1871798358857 | etot = -14.6175140348118 -757000 ekin = 0.224842467158388 | erot = 0.310323830730243 | epot = -15.1526803326699 | etot = -14.6175140347812 -758000 ekin = 0.215051562421428 | erot = 0.287636293952697 | epot = -15.120201891134 | etot = -14.6175140347599 -759000 ekin = 0.204242275876271 | erot = 0.268380753509857 | epot = -15.0901370641325 | etot = -14.6175140347464 -760000 ekin = 0.192568636065474 | erot = 0.252669695562842 | epot = -15.0627523663679 | etot = -14.6175140347396 -761000 ekin = 0.180198520175885 | erot = 0.240499428911651 | epot = -15.0382119838247 | etot = -14.6175140347371 -762000 ekin = 0.167326299029189 | erot = 0.231768292967787 | epot = -15.0166086267339 | etot = -14.6175140347369 -763000 ekin = 0.154185685901956 | erot = 0.226297425416186 | epot = -14.9979971460548 | etot = -14.6175140347367 -764000 ekin = 0.141060632748886 | erot = 0.22385200334864 | epot = -14.9824266708322 | etot = -14.6175140347347 -765000 ekin = 0.128292252296688 | erot = 0.224161332818126 | epot = -14.9699676198447 | etot = -14.6175140347299 -766000 ekin = 0.116280064488099 | erot = 0.226936813023238 | epot = -14.9607309122326 | etot = -14.6175140347212 -767000 ekin = 0.105476340626969 | erot = 0.23188750727037 | epot = -14.9548778826066 | etot = -14.6175140347093 -768000 ekin = 0.096372890945937 | erot = 0.238733641345087 | epot = -14.9526205669852 | etot = -14.6175140346942 -769000 ekin = 0.0894802427431669 | erot = 0.247218655409017 | epot = -14.9542129328294 | etot = -14.6175140346772 -770000 ekin = 0.0852997361093092 | erot = 0.257120353608164 | epot = -14.9599341243773 | etot = -14.6175140346598 -771000 ekin = 0.0842896183570599 | erot = 0.268261228608835 | epot = -14.9700648816096 | etot = -14.6175140346437 -772000 ekin = 0.0868267987477346 | erot = 0.280517313419992 | epot = -14.9848581467989 | etot = -14.6175140346312 -773000 ekin = 0.0931666172480206 | erot = 0.293824162660099 | epot = -15.0045048145328 | etot = -14.6175140346247 -774000 ekin = 0.103403843826671 | erot = 0.308178073397117 | epot = -15.0290959518505 | etot = -14.6175140346267 -775000 ekin = 0.117439110045757 | erot = 0.323630675217794 | epot = -15.0585838199034 | etot = -14.6175140346399 -776000 ekin = 0.134955835365974 | erot = 0.340275613675452 | epot = -15.0927454837074 | etot = -14.617514034666 -777000 ekin = 0.155413263635979 | erot = 0.358227842745911 | epot = -15.131155141088 | etot = -14.6175140347061 -778000 ekin = 0.178060391221893 | erot = 0.377596905889502 | epot = -15.1731713318714 | etot = -14.61751403476 -779000 ekin = 0.201973803865647 | erot = 0.398457850158065 | epot = -15.2179456888489 | etot = -14.6175140348252 -780000 ekin = 0.226119091214274 | erot = 0.420824480238275 | epot = -15.2644576063504 | etot = -14.6175140348978 -781000 ekin = 0.249431156626622 | erot = 0.444629585314847 | epot = -15.3115747769139 | etot = -14.6175140349725 -782000 ekin = 0.270904470269639 | erot = 0.469715692367583 | epot = -15.3581341976801 | etot = -14.6175140350429 -783000 ekin = 0.289681273783551 | erot = 0.495837747641305 | epot = -15.4030330565279 | etot = -14.617514035103 -784000 ekin = 0.305125009986927 | erot = 0.522676532161923 | epot = -15.445315577297 | etot = -14.6175140351482 -785000 ekin = 0.316868262923434 | erot = 0.549859353707342 | epot = -15.4842416518064 | etot = -14.6175140351756 -786000 ekin = 0.324828845889255 | erot = 0.576983310023016 | epot = -15.5193261910972 | etot = -14.6175140351849 -787000 ekin = 0.32919323387939 | erot = 0.603636505801527 | epot = -15.550343774859 | etot = -14.617514035178 -788000 ekin = 0.330371864852151 | erot = 0.629413875563716 | epot = -15.5772997755747 | etot = -14.6175140351588 -789000 ekin = 0.328934711355495 | erot = 0.653926193132344 | epot = -15.6003749396201 | etot = -14.6175140351322 -790000 ekin = 0.32553731947378 | erot = 0.676802790006292 | epot = -15.6198541445837 | etot = -14.6175140351036 -791000 ekin = 0.320847267933459 | erot = 0.697689943211487 | epot = -15.6360512462227 | etot = -14.6175140350777 -792000 ekin = 0.315479253539392 | erot = 0.716247584423973 | epot = -15.6492408730215 | etot = -14.6175140350582 -793000 ekin = 0.309944490982107 | erot = 0.732146955922051 | epot = -15.6596054819516 | etot = -14.6175140350474 -794000 ekin = 0.304617480925239 | erot = 0.745071299199412 | epot = -15.6672028151708 | etot = -14.6175140350461 -795000 ekin = 0.299720880976423 | erot = 0.754720862084592 | epot = -15.6719557781148 | etot = -14.6175140350538 -796000 ekin = 0.295327396180162 | erot = 0.760822658787278 | epot = -15.6736640900359 | etot = -14.6175140350685 -797000 ekin = 0.291376296851675 | erot = 0.763144639344914 | epot = -15.6720349712838 | etot = -14.6175140350872 -798000 ekin = 0.287701294703707 | erot = 0.761513269131401 | epot = -15.6667285989415 | etot = -14.6175140351064 -799000 ekin = 0.284065979572222 | erot = 0.755832991336602 | epot = -15.6574130060307 | etot = -14.6175140351219 -800000 ekin = 0.280202790631652 | erot = 0.746105645863969 | epot = -15.643822471626 | etot = -14.6175140351304 -801000 ekin = 0.275851560112653 | erot = 0.732447665813264 | epot = -15.6258132610543 | etot = -14.6175140351284 -802000 ekin = 0.270794034433592 | erot = 0.715102809072576 | epot = -15.6034108786199 | etot = -14.6175140351138 -803000 ekin = 0.264881442636465 | erot = 0.694448356025832 | epot = -15.5768438337476 | etot = -14.6175140350853 -804000 ekin = 0.258053167891105 | erot = 0.670993199746629 | epot = -15.5465604026808 | etot = -14.6175140350431 -805000 ekin = 0.250345604728483 | erot = 0.645366941436678 | epot = -15.5132265811537 | etot = -14.6175140349885 -806000 ekin = 0.241890533712104 | erot = 0.618299214644422 | epot = -15.4777037832803 | etot = -14.6175140349238 -807000 ekin = 0.232905655207387 | erot = 0.590591287736433 | epot = -15.4410109777962 | etot = -14.6175140348524 -808000 ekin = 0.223678061733381 | erot = 0.563080896688429 | epot = -15.4042729931999 | etot = -14.6175140347781 -809000 ekin = 0.21454303523099 | erot = 0.536602758842029 | epot = -15.3686598287782 | etot = -14.6175140347052 -810000 ekin = 0.205860488313568 | erot = 0.511947500023896 | epot = -15.3353220229752 | etot = -14.6175140346377 -811000 ekin = 0.197991117806005 | erot = 0.489821758278081 | epot = -15.3053269106636 | etot = -14.6175140345795 -812000 ekin = 0.191273941671524 | erot = 0.470812030934271 | epot = -15.2796000071394 | etot = -14.6175140345336 -813000 ekin = 0.186006404369985 | erot = 0.455354451062655 | epot = -15.2588748899354 | etot = -14.6175140345028 -814000 ekin = 0.18242775371236 | erot = 0.443712201374096 | epot = -15.243653989575 | etot = -14.6175140344885 -815000 ekin = 0.18070598633541 | erot = 0.435961774091635 | epot = -15.234181794919 | etot = -14.617514034492 -816000 ekin = 0.180928373605491 | erot = 0.431988814113314 | epot = -15.2304312222317 | etot = -14.6175140345129 -817000 ekin = 0.183095431234183 | erot = 0.431493858263631 | epot = -15.2321033240486 | etot = -14.6175140345508 -818000 ekin = 0.187118173911464 | erot = 0.434007895069526 | epot = -15.2386401035849 | etot = -14.6175140346039 -819000 ekin = 0.192818568053382 | erot = 0.43891728680681 | epot = -15.2492498895299 | etot = -14.6175140346697 -820000 ekin = 0.199933211814771 | erot = 0.445497181488374 | epot = -15.2629444280486 | etot = -14.6175140347454 -821000 ekin = 0.208120374081953 | erot = 0.452952069483821 | epot = -15.2785864783931 | etot = -14.6175140348273 -822000 ekin = 0.216970558498266 | erot = 0.460461605795678 | epot = -15.2949461992054 | etot = -14.6175140349114 -823000 ekin = 0.226020685629111 | erot = 0.467229260922827 | epot = -15.3107639815452 | etot = -14.6175140349933 -824000 ekin = 0.234771793851546 | erot = 0.47253085821668 | epot = -15.3248166871369 | etot = -14.6175140350687 -825000 ekin = 0.242709867661982 | erot = 0.475759712130438 | epot = -15.3359836149259 | etot = -14.6175140351335 -826000 ekin = 0.249329060857897 | erot = 0.476465014357233 | epot = -15.3433081103994 | etot = -14.6175140351843 -827000 ekin = 0.254156259485738 | erot = 0.474380409602743 | epot = -15.3460507043067 | etot = -14.6175140352182 -828000 ekin = 0.256775693170762 | erot = 0.46944038334452 | epot = -15.3437301117489 | etot = -14.6175140352336 -829000 ekin = 0.256852201216661 | erot = 0.461783092102077 | epot = -15.3361493285486 | etot = -14.6175140352298 -830000 ekin = 0.254151805816721 | erot = 0.451739467041208 | epot = -15.3234053080651 | etot = -14.6175140352072 -831000 ekin = 0.248558416433736 | erot = 0.439809632306583 | epot = -15.3058820839077 | etot = -14.6175140351674 -832000 ekin = 0.240085737091052 | erot = 0.426628719076076 | epot = -15.2842284912797 | etot = -14.6175140351126 -833000 ekin = 0.228883712687689 | erot = 0.412924890624274 | epot = -15.2593226383577 | etot = -14.6175140350458 -834000 ekin = 0.215239082681844 | erot = 0.399472764056086 | epot = -15.2322258817084 | etot = -14.6175140349705 -835000 ekin = 0.199569787294665 | erot = 0.387045440519586 | epot = -15.2041292627046 | etot = -14.6175140348904 -836000 ekin = 0.182413100763772 | erot = 0.376368114580803 | epot = -15.1762952501539 | etot = -14.6175140348093 -837000 ekin = 0.164407483062706 | erot = 0.36807582593139 | epot = -15.1499973437255 | etot = -14.6175140347314 -838000 ekin = 0.146268295773454 | erot = 0.362677435797712 | epot = -15.1264597662312 | etot = -14.61751403466 -839000 ekin = 0.128757768426402 | erot = 0.360527421580405 | epot = -15.1067992246056 | etot = -14.6175140345988 -840000 ekin = 0.112649960717984 | erot = 0.361806618656283 | epot = -15.091970613925 | etot = -14.6175140345507 -841000 ekin = 0.0986919456677054 | erot = 0.366512603929069 | epot = -15.0827185841153 | etot = -14.6175140345185 -842000 ekin = 0.0875630029234395 | erot = 0.374460003555771 | epot = -15.0795370409833 | etot = -14.6175140345041 -843000 ekin = 0.0798341847686366 | erot = 0.385290606532762 | epot = -15.08263882581 | etot = -14.6175140345086 -844000 ekin = 0.0759310929907395 | erot = 0.3984927697296 | epot = -15.0919378972525 | etot = -14.6175140345322 -845000 ekin = 0.076102961020352 | erot = 0.413429207168617 | epot = -15.107046202763 | etot = -14.617514034574 -846000 ekin = 0.0804010613290235 | erot = 0.429371869322532 | epot = -15.1272869652841 | etot = -14.6175140346325 -847000 ekin = 0.0886689809240873 | erot = 0.445542241998021 | epot = -15.1517252576265 | etot = -14.6175140347044 -848000 ekin = 0.100546421459775 | erot = 0.461155038711605 | epot = -15.179215494957 | etot = -14.6175140347856 -849000 ekin = 0.115486960010826 | erot = 0.475462945351677 | epot = -15.208463940234 | etot = -14.6175140348715 -850000 ekin = 0.132788806695669 | erot = 0.487799837752774 | epot = -15.2381026794056 | etot = -14.6175140349571 -851000 ekin = 0.15163622778631 | erot = 0.49761978557658 | epot = -15.2667700483999 | etot = -14.617514035037 -852000 ekin = 0.171148194576093 | erot = 0.5045292426275 | epot = -15.2931914723102 | etot = -14.6175140351066 -853000 ekin = 0.19043015939564 | erot = 0.508310157461229 | epot = -15.3162543520185 | etot = -14.6175140351617 -854000 ekin = 0.208624756899512 | erot = 0.508932337650922 | epot = -15.3350711297497 | etot = -14.6175140351993 -855000 ekin = 0.224957674812131 | erot = 0.506554231539335 | epot = -15.3490259415692 | etot = -14.6175140352178 -856000 ekin = 0.238775816538934 | erot = 0.501512259960027 | epot = -15.3578021117156 | etot = -14.6175140352166 -857000 ekin = 0.249575992233887 | erot = 0.494299801981668 | epot = -15.3613898294122 | etot = -14.6175140351967 -858000 ekin = 0.257023502073677 | erot = 0.485537766821904 | epot = -15.3600753040553 | etot = -14.6175140351598 -859000 ekin = 0.260960921285557 | erot = 0.47593924761589 | epot = -15.3544142040099 | etot = -14.6175140351084 -860000 ekin = 0.261408037072254 | erot = 0.466270984604724 | epot = -15.3451930567227 | etot = -14.6175140350457 -861000 ekin = 0.258554187538227 | erot = 0.457314264403266 | epot = -15.3333824869164 | etot = -14.6175140349749 -862000 ekin = 0.252744258033032 | erot = 0.449827506886351 | epot = -15.3200857998187 | etot = -14.6175140348993 -863000 ekin = 0.24445941779656 | erot = 0.444512141834286 | epot = -15.3064855944532 | etot = -14.6175140348224 -864000 ekin = 0.234293368840191 | erot = 0.441983030939893 | epot = -15.2937904345275 | etot = -14.6175140347474 -865000 ekin = 0.222924696624028 | erot = 0.442744308395087 | epot = -15.2831830396966 | etot = -14.6175140346775 -866000 ekin = 0.211086026109153 | erot = 0.447169652381141 | epot = -15.275769713106 | etot = -14.6175140346157 -867000 ekin = 0.199530465892741 | erot = 0.455487658924214 | epot = -15.2725321593816 | etot = -14.6175140345647 -868000 ekin = 0.188996288427104 | erot = 0.467771811643747 | epot = -15.2742821345979 | etot = -14.6175140345271 -869000 ekin = 0.180171161859106 | erot = 0.483934855626885 | epot = -15.2816200519912 | etot = -14.6175140345052 -870000 ekin = 0.17365741386822 | erot = 0.503727420429673 | epot = -15.2948988687985 | etot = -14.6175140345006 -871000 ekin = 0.169940429081846 | erot = 0.52674119313203 | epot = -15.3141956567285 | etot = -14.6175140345146 -872000 ekin = 0.169362274178155 | erot = 0.552417088945952 | epot = -15.3392933976716 | etot = -14.6175140345475 -873000 ekin = 0.172102391201285 | erot = 0.580058846014358 | epot = -15.3696752718142 | etot = -14.6175140345986 -874000 ekin = 0.17816700290151 | erot = 0.608852557307893 | epot = -15.4045335948759 | etot = -14.6175140346665 -875000 ekin = 0.187388233890407 | erot = 0.637892396630087 | epot = -15.4427946652692 | etot = -14.6175140347487 -876000 ekin = 0.19943318136702 | erot = 0.666212376945529 | epot = -15.4831595931541 | etot = -14.6175140348415 -877000 ekin = 0.213822249050307 | erot = 0.692823325238237 | epot = -15.5241596092293 | etot = -14.6175140349407 -878000 ekin = 0.229955728385699 | erot = 0.71675421264508 | epot = -15.5642239760723 | etot = -14.6175140350415 -879000 ekin = 0.24714610464469 | erot = 0.737095186135096 | epot = -15.6017553259188 | etot = -14.617514035139 -880000 ekin = 0.264653797001986 | erot = 0.753040153406107 | epot = -15.6352079856364 | etot = -14.6175140352283 -881000 ekin = 0.281723784261025 | erot = 0.763926241591362 | epot = -15.6631640611574 | etot = -14.617514035305 -882000 ekin = 0.297620641606497 | erot = 0.769267373447878 | epot = -15.6844020504201 | etot = -14.6175140353657 -883000 ekin = 0.31165996716591 | erot = 0.768779581882635 | epot = -15.6979535844562 | etot = -14.6175140354077 -884000 ekin = 0.32323477376766 | erot = 0.762396270684418 | epot = -15.7031450798815 | etot = -14.6175140354294 -885000 ekin = 0.331836099624976 | erot = 0.750272396067649 | epot = -15.6996225311232 | etot = -14.6175140354305 -886000 ekin = 0.33706775156376 | erot = 0.73277738526586 | epot = -15.6873591722413 | etot = -14.6175140354116 -887000 ekin = 0.33865564976609 | erot = 0.710477420750346 | epot = -15.6666471058906 | etot = -14.6175140353742 -888000 ekin = 0.336452632420724 | erot = 0.684108417156207 | epot = -15.6380750848973 | etot = -14.6175140353203 -889000 ekin = 0.330439768515565 | erot = 0.654541548240145 | epot = -15.6024953520085 | etot = -14.6175140352528 -890000 ekin = 0.320725208484774 | erot = 0.622743520027188 | epot = -15.5609827636863 | etot = -14.6175140351743 -891000 ekin = 0.30754138620901 | erot = 0.589733936087593 | epot = -15.5147893573847 | etot = -14.6175140350881 -892000 ekin = 0.291240998129824 | erot = 0.55654208039805 | epot = -15.4652971135248 | etot = -14.6175140349969 -893000 ekin = 0.272291667891339 | erot = 0.524165278720875 | epot = -15.413970981516 | etot = -14.6175140349038 -894000 ekin = 0.251268620703469 | erot = 0.493530718297772 | epot = -15.3623133738123 | etot = -14.617514034811 -895000 ekin = 0.228844131843647 | erot = 0.465462234286628 | epot = -15.3118204008517 | etot = -14.6175140347214 -896000 ekin = 0.205772103521931 | erot = 0.44065313730724 | epot = -15.2639392754666 | etot = -14.6175140346374 -897000 ekin = 0.182866017803037 | erot = 0.419645693758354 | epot = -15.2200257461231 | etot = -14.6175140345617 -898000 ekin = 0.160968870008541 | erot = 0.402817425242934 | epot = -15.1813003297485 | etot = -14.617514034497 -899000 ekin = 0.140914625128407 | erot = 0.390374024162942 | epot = -15.1488026837377 | etot = -14.6175140344464 -900000 ekin = 0.123482269337592 | erot = 0.382348451689143 | epot = -15.1233447554393 | etot = -14.6175140344126 -901000 ekin = 0.109345484385137 | erot = 0.3786057375543 | epot = -15.1054652563377 | etot = -14.6175140343982 -902000 ekin = 0.0990229789068443 | erot = 0.378853140166087 | epot = -15.0953901534781 | etot = -14.6175140344052 -903000 ekin = 0.0928360184564003 | erot = 0.382655585825594 | epot = -15.0930056387161 | etot = -14.6175140344341 -904000 ekin = 0.0908801123879861 | erot = 0.389456554773426 | epot = -15.0978507016452 | etot = -14.6175140344838 -905000 ekin = 0.0930167096525759 | erot = 0.398604648849945 | epot = -15.109135393054 | etot = -14.6175140345515 -906000 ekin = 0.0988880708462299 | erot = 0.409385812369135 | epot = -15.1257879178477 | etot = -14.6175140346323 -907000 ekin = 0.107954659147321 | erot = 0.421060528764021 | epot = -15.1465292226317 | etot = -14.6175140347203 -908000 ekin = 0.119550305154264 | erot = 0.432904367174404 | epot = -15.1699687071371 | etot = -14.6175140348085 -909000 ekin = 0.132947118364171 | erot = 0.44424923215812 | epot = -15.1947103854124 | etot = -14.6175140348901 -910000 ekin = 0.147420543333256 | erot = 0.454521879656354 | epot = -15.2194564579492 | etot = -14.6175140349595 -911000 ekin = 0.162305506309105 | erot = 0.463275978359162 | epot = -15.243095519681 | etot = -14.6175140350127 -912000 ekin = 0.177037050912775 | erot = 0.470214361754759 | epot = -15.264765447715 | etot = -14.6175140350475 -913000 ekin = 0.191172462463145 | erot = 0.47519909256641 | epot = -15.2838855900937 | etot = -14.6175140350641 -914000 ekin = 0.204395616840717 | erot = 0.478248345048037 | epot = -15.3001579969529 | etot = -14.6175140350642 -915000 ekin = 0.216507238695372 | erot = 0.479520616572283 | epot = -15.3135418903184 | etot = -14.6175140350507 -916000 ekin = 0.227406352399354 | erot = 0.479288139236181 | epot = -15.324208526663 | etot = -14.6175140350275 -917000 ekin = 0.237068358848421 | erot = 0.47790239272317 | epot = -15.3324847865699 | etot = -14.6175140349983 -918000 ekin = 0.245524170399261 | erot = 0.475755244752224 | epot = -15.3387934501184 | etot = -14.6175140349669 -919000 ekin = 0.252843202023974 | erot = 0.473239468155706 | epot = -15.343596705116 | etot = -14.6175140349363 -920000 ekin = 0.259121284815254 | erot = 0.470712244290015 | epot = -15.3473475640143 | etot = -14.617514034909 -921000 ekin = 0.264473144076574 | erot = 0.468464808092157 | epot = -15.3504519870554 | etot = -14.6175140348867 -922000 ekin = 0.269028180853983 | erot = 0.466700668341734 | epot = -15.3532428840659 | etot = -14.6175140348701 -923000 ekin = 0.272927944745736 | erot = 0.465523908452108 | epot = -15.3559658880573 | etot = -14.6175140348595 -924000 ekin = 0.276323793829006 | erot = 0.464938026324777 | epot = -15.3587758550082 | etot = -14.6175140348544 -925000 ekin = 0.279373649323259 | erot = 0.46485472138072 | epot = -15.361742405558 | etot = -14.617514034854 -926000 ekin = 0.282237300897742 | erot = 0.465111106681027 | epot = -15.3648624424358 | etot = -14.617514034857 -927000 ekin = 0.285070250341507 | erot = 0.465493135293317 | epot = -15.368077420497 | etot = -14.6175140348622 -928000 ekin = 0.288016501944515 | erot = 0.465762600718122 | epot = -15.3712931375312 | etot = -14.6175140348685 -929000 ekin = 0.291201026098165 | erot = 0.465684740678949 | epot = -15.3743998016517 | etot = -14.6175140348746 -930000 ekin = 0.294722459178849 | erot = 0.465054261989122 | epot = -15.3772907560474 | etot = -14.6175140348794 -931000 ekin = 0.298646764015069 | erot = 0.463717248452617 | epot = -15.37987804735 | etot = -14.6175140348823 -932000 ekin = 0.303002304639518 | erot = 0.461587311532337 | epot = -15.3821036510548 | etot = -14.6175140348829 -933000 ekin = 0.307776651094703 | erot = 0.458654945590446 | epot = -15.3839456315665 | etot = -14.6175140348813 -934000 ekin = 0.312915338271949 | erot = 0.454989722654232 | epot = -15.3854190958038 | etot = -14.6175140348776 -935000 ekin = 0.318322768321298 | erot = 0.450735625549576 | epot = -15.3865724287433 | etot = -14.6175140348724 -936000 ekin = 0.323865441581078 | erot = 0.4461003856938 | epot = -15.3874798621412 | etot = -14.6175140348663 -937000 ekin = 0.329377658420705 | erot = 0.441340069469478 | epot = -15.3882317627502 | etot = -14.61751403486 -938000 ekin = 0.334669609401419 | erot = 0.43674015463711 | epot = -15.3889237988925 | etot = -14.617514034854 -939000 ekin = 0.339538182698638 | erot = 0.43259572362611 | epot = -15.3896479411737 | etot = -14.6175140348489 -940000 ekin = 0.343779460435286 | erot = 0.429190561371808 | epot = -15.3904840566521 | etot = -14.617514034845 -941000 ekin = 0.347202304174038 | erot = 0.426777065358206 | epot = -15.3914934043749 | etot = -14.6175140348427 -942000 ekin = 0.349642062607923 | erot = 0.425558062624919 | epot = -15.3927141600748 | etot = -14.617514034842 -943000 ekin = 0.350973206935894 | erot = 0.425671371650785 | epot = -15.3941586134297 | etot = -14.617514034843 -944000 ekin = 0.351119786154916 | erot = 0.427178062459289 | epot = -15.3958118834598 | etot = -14.6175140348456 -945000 ekin = 0.350062816508881 | erot = 0.430055404933721 | epot = -15.3976322562924 | etot = -14.6175140348498 -946000 ekin = 0.347844068536826 | erot = 0.43419544779 | epot = -15.399553551182 | etot = -14.6175140348552 -947000 ekin = 0.344566017441624 | erot = 0.439410327984555 | epot = -15.4014903802875 | etot = -14.6175140348614 -948000 ekin = 0.340388212507466 | erot = 0.445444378277408 | epot = -15.4033466256523 | etot = -14.6175140348674 -949000 ekin = 0.335520427168573 | erot = 0.451992965714934 | epot = -15.405027427756 | etot = -14.6175140348725 -950000 ekin = 0.330213181196302 | erot = 0.458727107975965 | epot = -15.4064543240477 | etot = -14.6175140348755 -951000 ekin = 0.32474581655651 | erot = 0.465321341197607 | epot = -15.4075811926297 | etot = -14.6175140348755 -952000 ekin = 0.319412679962215 | erot = 0.471482169177628 | epot = -15.4084088840117 | etot = -14.6175140348718 -953000 ekin = 0.314508037100187 | erot = 0.476974139327395 | epot = -15.4089962112918 | etot = -14.6175140348642 -954000 ekin = 0.310309685024338 | erot = 0.48163943141798 | epot = -15.4094631512954 | etot = -14.6175140348531 -955000 ekin = 0.307061947765172 | erot = 0.485408201613879 | epot = -15.4099841842186 | etot = -14.6175140348396 -956000 ekin = 0.304958921288845 | erot = 0.488297803841432 | epot = -15.4107707599557 | etot = -14.6175140348254 -957000 ekin = 0.304129209168544 | erot = 0.490400499132465 | epot = -15.412043743114 | etot = -14.617514034813 -958000 ekin = 0.30462371461979 | erot = 0.491860923621405 | epot = -15.4139986730458 | etot = -14.6175140348046 -959000 ekin = 0.306408207891338 | erot = 0.492846142548894 | epot = -15.4167683852429 | etot = -14.6175140348027 -960000 ekin = 0.309362278812989 | erot = 0.493512316198202 | epot = -15.4203886298201 | etot = -14.6175140348089 -961000 ekin = 0.313285873784586 | erot = 0.493972653387296 | epot = -15.4247725619958 | etot = -14.6175140348239 -962000 ekin = 0.31791392478401 | erot = 0.494271324762717 | epot = -15.429699284394 | etot = -14.6175140348473 -963000 ekin = 0.322938673952677 | erot = 0.49436733773729 | epot = -15.4348200465674 | etot = -14.6175140348775 -964000 ekin = 0.328038281530642 | erot = 0.494131108238433 | epot = -15.4396834246807 | etot = -14.6175140349116 -965000 ekin = 0.332909295682699 | erot = 0.493354750676295 | epot = -15.4437780813051 | etot = -14.6175140349461 -966000 ekin = 0.33729968976251 | erot = 0.491775167781853 | epot = -15.4465888925212 | etot = -14.6175140349768 -967000 ekin = 0.341038574326505 | erot = 0.489107134739274 | epot = -15.4476597440655 | etot = -14.6175140349998 -968000 ekin = 0.344058508086205 | erot = 0.485082040988283 | epot = -15.446654584086 | etot = -14.6175140350116 -969000 ekin = 0.346406687226292 | erot = 0.479487053292162 | epot = -15.4434077755287 | etot = -14.6175140350102 -970000 ekin = 0.348242259950603 | erot = 0.472199376075359 | epot = -15.4379556710211 | etot = -14.6175140349951 -971000 ekin = 0.34981857790832 | erot = 0.46321104020783 | epot = -15.4305436530838 | etot = -14.6175140349677 -972000 ekin = 0.351451221504254 | erot = 0.452641107454446 | epot = -15.4216063638894 | etot = -14.6175140349307 -973000 ekin = 0.353474851841754 | erot = 0.440734047140903 | epot = -15.4117229338711 | etot = -14.6175140348884 -974000 ekin = 0.356193968986792 | erot = 0.42784496232361 | epot = -15.4015529661561 | etot = -14.6175140348457 -975000 ekin = 0.359834072253393 | erot = 0.414413971021987 | epot = -15.3917620780828 | etot = -14.6175140348074 -976000 ekin = 0.364500158165202 | erot = 0.400933139115816 | epot = -15.3829473320587 | etot = -14.6175140347777 -977000 ekin = 0.370148756532482 | erot = 0.387909813697021 | epot = -15.3755726049891 | etot = -14.6175140347596 -978000 ekin = 0.376577842833215 | erot = 0.375830059083025 | epot = -15.3699219366707 | etot = -14.6175140347545 -979000 ekin = 0.38343628910019 | erot = 0.365125297246779 | epot = -15.3660756211092 | etot = -14.6175140347622 -980000 ekin = 0.390251542223294 | erot = 0.35614439745949 | epot = -15.3639099744643 | etot = -14.6175140347816 -981000 ekin = 0.396471539317082 | erot = 0.349132547197932 | epot = -15.3631181213249 | etot = -14.6175140348099 -982000 ekin = 0.401514997593021 | erot = 0.344217435799683 | epot = -15.3632464682369 | etot = -14.6175140348442 -983000 ekin = 0.40482345877132 | erot = 0.341402706416172 | epot = -15.3637402000689 | etot = -14.6175140348814 -984000 ekin = 0.40590886668651 | erot = 0.340568324597744 | epot = -15.3639912262029 | etot = -14.6175140349187 -985000 ekin = 0.40439180306127 | erot = 0.341477444720355 | epot = -15.3633832827352 | etot = -14.6175140349536 -986000 ekin = 0.400027422801574 | erot = 0.34378943446128 | epot = -15.361330892247 | etot = -14.6175140349842 -987000 ekin = 0.392718180745197 | erot = 0.347078806738211 | epot = -15.3573110224925 | etot = -14.617514035009 -988000 ekin = 0.38251423921461 | erot = 0.35085976914659 | epot = -15.3508880433883 | etot = -14.6175140350271 -989000 ekin = 0.369603726654237 | erot = 0.354615837188711 | epot = -15.3417335988804 | etot = -14.6175140350375 -990000 ekin = 0.354295674461643 | erot = 0.357833454087933 | epot = -15.3296431635888 | etot = -14.6175140350392 -991000 ekin = 0.336998529351755 | erot = 0.360037895318059 | epot = -15.3145504597015 | etot = -14.6175140350317 -992000 ekin = 0.318196763890793 | erot = 0.360829065190808 | epot = -15.2965398640958 | etot = -14.6175140350142 -993000 ekin = 0.298427479538949 | erot = 0.359914303089432 | epot = -15.275855817615 | etot = -14.6175140349866 -994000 ekin = 0.278258203580391 | erot = 0.357135170965373 | epot = -15.2529074094948 | etot = -14.617514034949 -995000 ekin = 0.258266471895345 | erot = 0.352485480212691 | epot = -15.2282659870101 | etot = -14.617514034902 -996000 ekin = 0.239021351636229 | erot = 0.346118523027927 | epot = -15.2026539095112 | etot = -14.617514034847 -997000 ekin = 0.221066818081289 | erot = 0.338342492442898 | epot = -15.1769233453102 | etot = -14.617514034786 -998000 ekin = 0.204906835818331 | erot = 0.329604233509071 | epot = -15.1520251040488 | etot = -14.6175140347214 -999000 ekin = 0.190992053959174 | erot = 0.320462575795008 | epot = -15.1289686644104 | etot = -14.6175140346562 -1000000 ekin = 0.179708146665509 | erot = 0.311553394429298 | epot = -15.1087755756885 | etot = -14.6175140345937 - 1000000 0.013311715 -1.5443684 0.033490821 -1.4929067 -3.7544839e-05 -Loop time of 17.0535 on 1 procs for 1000000 steps with 10 atoms - -Performance: 50663.947 tau/day, 58638.827 timesteps/s -99.5% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 13.135 | 13.135 | 13.135 | 0.0 | 77.02 -Bond | 0.6362 | 0.6362 | 0.6362 | 0.0 | 3.73 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 0.18919 | 0.18919 | 0.18919 | 0.0 | 1.11 -Output | 8e-06 | 8e-06 | 8e-06 | 0.0 | 0.00 -Modify | 2.8399 | 2.8399 | 2.8399 | 0.0 | 16.65 -Other | | 0.2536 | | | 1.49 - -Nlocal: 10.0 ave 10.0 max 10.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 37.0 ave 37.0 max 37.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 37 -Ave neighs/atom = 3.7 -Ave special neighs/atom = 3.6 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:17 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.4 deleted file mode 100644 index 134ef62d8f..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.30Jun20.duplex1.g++.4 +++ /dev/null @@ -1,1182 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex1 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 10 atoms - reading velocities ... - 10 velocities - 10 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 8 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.004 seconds - -set atom * mass 3.1575 - 10 settings made for mass - -group all type 1 4 -10 atoms in group all - -# oxDNA2 bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA2 pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 -pair_coeff * * oxdna2/dh 0.1 1.0 0.815 - -# NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 2.6274048 - ghost atom cutoff = 2.6274048 - binsize = 1.3137024, bins = 31 31 31 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 2.627404783947349 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -14.6175140343334 | etot = -14.6175140343334 -Per MPI rank memory allocation (min/avg/max) = 7.903 | 7.96 | 8.018 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.4712768 0.009525411 -1.4617514 4.663076e-06 -1000 ekin = 0.00113086229080478 | erot = 0.00431010160406708 | epot = -14.6229549982368 | etot = -14.617514034342 -2000 ekin = 0.00448533224342286 | erot = 0.0171407706505013 | epot = -14.6391401372615 | etot = -14.6175140343675 -3000 ekin = 0.0099503525964896 | erot = 0.0381961780846439 | epot = -14.6656605650904 | etot = -14.6175140344093 -4000 ekin = 0.0173418024861991 | erot = 0.0669935184860482 | epot = -14.7018493554381 | etot = -14.6175140344659 -5000 ekin = 0.0264109356285965 | erot = 0.102878288094483 | epot = -14.7468032582586 | etot = -14.6175140345355 -6000 ekin = 0.0368533113591267 | erot = 0.14504542056981 | epot = -14.7994127665446 | etot = -14.6175140346157 -7000 ekin = 0.0483200640564583 | erot = 0.192565862515414 | epot = -14.8583999612755 | etot = -14.6175140347036 -8000 ekin = 0.0604312317605635 | erot = 0.244417870131371 | epot = -14.9223631366881 | etot = -14.6175140347962 -9000 ekin = 0.072790711967127 | erot = 0.299521949931656 | epot = -14.9898266967887 | etot = -14.6175140348899 -10000 ekin = 0.0850022498874609 | erot = 0.356777997217668 | epot = -15.0592942820866 | etot = -14.6175140349815 -11000 ekin = 0.0966857134040954 | erot = 0.415102860829322 | epot = -15.1293026093009 | etot = -14.6175140350675 -12000 ekin = 0.107492790688356 | erot = 0.473466334177699 | epot = -15.1984731600111 | etot = -14.617514035145 -13000 ekin = 0.117121180381612 | erot = 0.530923485009329 | epot = -15.2655587006024 | etot = -14.6175140352115 -14000 ekin = 0.125326348459051 | erot = 0.586641324447251 | epot = -15.3294817081714 | etot = -14.6175140352651 -15000 ekin = 0.131930017119328 | erot = 0.63991810423422 | epot = -15.3893621566583 | etot = -14.6175140353048 -16000 ekin = 0.136824741331405 | erot = 0.690194029500566 | epot = -15.4445328061626 | etot = -14.6175140353306 -17000 ekin = 0.139974218116171 | erot = 0.737052866147306 | epot = -15.4945411196066 | etot = -14.6175140353432 -18000 ekin = 0.141409342139797 | erot = 0.780214750583043 | epot = -15.5391381280668 | etot = -14.617514035344 -19000 ekin = 0.141220424903361 | erot = 0.819521373491177 | epot = -15.5782558337298 | etot = -14.6175140353352 -20000 ekin = 0.139546371890511 | erot = 0.854915474127585 | epot = -15.6119758813374 | etot = -14.6175140353193 -21000 ekin = 0.136561897558541 | erot = 0.886417110947522 | epot = -15.6404930438047 | etot = -14.6175140352986 -22000 ekin = 0.132464002543684 | erot = 0.914099368829796 | epot = -15.6640774066492 | etot = -14.6175140352758 -23000 ekin = 0.127458921012898 | erot = 0.938065991541741 | epot = -15.6830389478072 | etot = -14.6175140352525 -24000 ekin = 0.121750582423396 | erot = 0.958432936326346 | epot = -15.6976975539803 | etot = -14.6175140352306 -25000 ekin = 0.115531361419039 | erot = 0.975315142931434 | epot = -15.7083605395612 | etot = -14.6175140352107 -26000 ekin = 0.108975565586195 | erot = 0.988819027952452 | epot = -15.715308628732 | etot = -14.6175140351934 -27000 ekin = 0.102235785319183 | erot = 0.999040485514706 | epot = -15.7187903060122 | etot = -14.6175140351783 -28000 ekin = 0.0954419434320554 | erot = 1.00606759141037 | epot = -15.7190235700075 | etot = -14.6175140351651 -29000 ekin = 0.0887026587346012 | erot = 1.00998681843686 | epot = -15.7162035123244 | etot = -14.6175140351529 -30000 ekin = 0.0821083868016836 | erot = 1.01089138149989 | epot = -15.7105138034423 | etot = -14.6175140351407 -31000 ekin = 0.0757357206090521 | erot = 1.00889031641421 | epot = -15.702140072151 | etot = -14.6175140351278 -32000 ekin = 0.0696522149391935 | erot = 1.00411701390103 | epot = -15.6912832639534 | etot = -14.6175140351132 -33000 ekin = 0.0639211300031737 | erot = 0.996736133736263 | epot = -15.6781712988358 | etot = -14.6175140350964 -34000 ekin = 0.0586055597942697 | erot = 0.986948071944207 | epot = -15.6630676668155 | etot = -14.617514035077 -35000 ekin = 0.0537715085522448 | erot = 0.974990414618501 | epot = -15.6462759582258 | etot = -14.617514035055 -36000 ekin = 0.0494895953267295 | erot = 0.961136064968264 | epot = -15.6281396953257 | etot = -14.6175140350307 -37000 ekin = 0.0458351949408502 | erot = 0.945687966087874 | epot = -15.6090371960337 | etot = -14.617514035005 -38000 ekin = 0.0428869588018996 | erot = 0.928970560853581 | epot = -15.5893715546342 | etot = -14.6175140349787 -39000 ekin = 0.0407237982125063 | erot = 0.911318339680438 | epot = -15.5695561728459 | etot = -14.617514034953 -40000 ekin = 0.0394205547756063 | erot = 0.893062038098217 | epot = -15.5499966278032 | etot = -14.6175140349294 -41000 ekin = 0.0390427256108178 | erot = 0.874513269991183 | epot = -15.5310700305113 | etot = -14.6175140349092 -42000 ekin = 0.0396407506458889 | erot = 0.855948622306388 | epot = -15.5131034078463 | etot = -14.617514034894 -43000 ekin = 0.0412444930542012 | erot = 0.837594480923648 | epot = -15.4963530088627 | etot = -14.6175140348848 -44000 ekin = 0.0438586280729573 | erot = 0.819614069272763 | epot = -15.4809867322283 | etot = -14.6175140348826 -45000 ekin = 0.0474596621514809 | erot = 0.802098297010425 | epot = -15.4670719940496 | etot = -14.6175140348876 -46000 ekin = 0.0519951857190001 | erot = 0.785061947877089 | epot = -15.4545711684958 | etot = -14.6175140348997 -47000 ekin = 0.0573856747188828 | erot = 0.768446392385995 | epot = -15.4433461020223 | etot = -14.6175140349174 -48000 ekin = 0.0635286843628562 | erot = 0.752129335015535 | epot = -15.433172054318 | etot = -14.6175140349396 -49000 ekin = 0.0703046735384702 | erot = 0.735941123250163 | epot = -15.4237598317528 | etot = -14.6175140349642 -50000 ekin = 0.0775831019852491 | erot = 0.719686007780774 | epot = -15.4147831447551 | etot = -14.6175140349891 -51000 ekin = 0.0852270843840623 | erot = 0.703165726694424 | epot = -15.4059068460916 | etot = -14.6175140350132 -52000 ekin = 0.0930950223446157 | erot = 0.686202231165621 | epot = -15.3968112885448 | etot = -14.6175140350346 -53000 ekin = 0.101038429252411 | erot = 0.668656546988554 | epot = -15.3872090112944 | etot = -14.6175140350534 -54000 ekin = 0.108896540979999 | erot = 0.65044172617409 | epot = -15.3768523022237 | etot = -14.6175140350696 -55000 ekin = 0.116489881625605 | erot = 0.631529329347953 | epot = -15.3655332460571 | etot = -14.6175140350836 -56000 ekin = 0.12361610349128 | erot = 0.611950383382754 | epot = -15.3530805219694 | etot = -14.6175140350954 -57000 ekin = 0.130051530400511 | erot = 0.591792721317636 | epot = -15.3393582868229 | etot = -14.6175140351047 -58000 ekin = 0.135560625192868 | erot = 0.571196690673809 | epot = -15.3242713509772 | etot = -14.6175140351105 -59000 ekin = 0.13991335082652 | erot = 0.550350463180971 | epot = -15.307777849119 | etot = -14.6175140351115 -60000 ekin = 0.142907875045205 | erot = 0.529485019663366 | epot = -15.2899069298149 | etot = -14.6175140351063 -61000 ekin = 0.144394224776987 | erot = 0.508867904999859 | epot = -15.2707761648709 | etot = -14.6175140350941 -62000 ekin = 0.14429400378525 | erot = 0.488794507593493 | epot = -15.2506025464535 | etot = -14.6175140350748 -63000 ekin = 0.142612256997681 | erot = 0.469576039422599 | epot = -15.2297023314693 | etot = -14.617514035049 -64000 ekin = 0.139439544726489 | erot = 0.451524344955609 | epot = -15.2084779247008 | etot = -14.6175140350187 -65000 ekin = 0.134944526553205 | erot = 0.434934714914789 | epot = -15.1873932764541 | etot = -14.6175140349861 -66000 ekin = 0.129359146357915 | erot = 0.42006860776795 | epot = -15.1669417890793 | etot = -14.6175140349534 -67000 ekin = 0.122959458763979 | erot = 0.407138362060406 | epot = -15.1476118557473 | etot = -14.6175140349229 -68000 ekin = 0.116045210525348 | erot = 0.396295631876791 | epot = -15.1298548772989 | etot = -14.6175140348967 -69000 ekin = 0.108920722072196 | erot = 0.387624589972286 | epot = -15.1140593469203 | etot = -14.6175140348758 -70000 ekin = 0.10187874072944 | erot = 0.381140173640969 | epot = -15.1005329492312 | etot = -14.6175140348608 -71000 ekin = 0.0951880561483024 | erot = 0.376791007701474 | epot = -15.0894930987017 | etot = -14.6175140348519 -72000 ekin = 0.0890849677261225 | erot = 0.374466237250124 | epot = -15.0810652398251 | etot = -14.6175140348489 -73000 ekin = 0.0837682427021172 | erot = 0.37400534759948 | epot = -15.0752876251526 | etot = -14.617514034851 -74000 ekin = 0.0793969849743902 | erot = 0.375210076750066 | epot = -15.0721210965819 | etot = -14.6175140348574 -75000 ekin = 0.0760907865069309 | erot = 0.377857644571635 | epot = -15.0714624659456 | etot = -14.617514034867 -76000 ekin = 0.073931583490861 | erot = 0.381714646754472 | epot = -15.073160265124 | etot = -14.6175140348787 -77000 ekin = 0.0729667273608691 | erot = 0.386551032955436 | epot = -15.0770317952076 | etot = -14.6175140348913 -78000 ekin = 0.0732128655080132 | erot = 0.392153586682573 | epot = -15.0828804870945 | etot = -14.6175140349039 -79000 ekin = 0.0746602878351816 | erot = 0.398338263928879 | epot = -15.0905125866795 | etot = -14.6175140349154 -80000 ekin = 0.0772774298946258 | erot = 0.404960669862598 | epot = -15.0997521346822 | etot = -14.617514034925 -81000 ekin = 0.0810152396747851 | erot = 0.411923913358685 | epot = -15.1104531879654 | etot = -14.617514034932 -82000 ekin = 0.0858111278281503 | erot = 0.419183131304765 | epot = -15.122508294069 | etot = -14.6175140349361 -83000 ekin = 0.0915922459207823 | erot = 0.426746154030485 | epot = -15.1358524348888 | etot = -14.6175140349375 -84000 ekin = 0.0982778862655832 | erot = 0.434670094582864 | epot = -15.1504620157849 | etot = -14.6175140349364 -85000 ekin = 0.105780875252437 | erot = 0.443054055542249 | epot = -15.1663489657283 | etot = -14.6175140349336 -86000 ekin = 0.114007936320836 | erot = 0.452028591870875 | epot = -15.1835505631216 | etot = -14.6175140349299 -87000 ekin = 0.122859117093393 | erot = 0.461742961599463 | epot = -15.2021161136192 | etot = -14.6175140349264 -88000 ekin = 0.132226490250757 | erot = 0.472351454261397 | epot = -15.2220919794359 | etot = -14.6175140349237 -89000 ekin = 0.141992430435586 | erot = 0.48400015022936 | epot = -15.243506615588 | etot = -14.6175140349231 -90000 ekin = 0.152027823849156 | erot = 0.496815313840275 | epot = -15.2663571726144 | etot = -14.617514034925 -91000 ekin = 0.162190574344531 | erot = 0.510894287760946 | epot = -15.2905988970356 | etot = -14.6175140349301 -92000 ekin = 0.172324730223634 | erot = 0.526299304076921 | epot = -15.3161380692392 | etot = -14.6175140349387 -93000 ekin = 0.182260479602882 | erot = 0.543054150884053 | epot = -15.3428286654374 | etot = -14.6175140349505 -94000 ekin = 0.19181516642483 | erot = 0.561143224560411 | epot = -15.3704724259507 | etot = -14.6175140349654 -95000 ekin = 0.200795384590157 | erot = 0.580512230413436 | epot = -15.398821649987 | etot = -14.6175140349834 -96000 ekin = 0.209000133284529 | erot = 0.601069706845066 | epot = -15.4275838751334 | etot = -14.6175140350038 -97000 ekin = 0.216224974983237 | erot = 0.62268863993255 | epot = -15.4564276499423 | etot = -14.6175140350265 -98000 ekin = 0.222267131485539 | erot = 0.6452076702458 | epot = -15.4849888367823 | etot = -14.617514035051 -99000 ekin = 0.226931474008825 | erot = 0.668431711039527 | epot = -15.5128772201251 | etot = -14.6175140350767 -100000 ekin = 0.230037392185109 | erot = 0.692132125756159 | epot = -15.5396835530446 | etot = -14.6175140351033 -101000 ekin = 0.231426538774162 | erot = 0.716046886548711 | epot = -15.5649874604531 | etot = -14.6175140351302 -102000 ekin = 0.230971416185847 | erot = 0.739881303910146 | epot = -15.5883667552525 | etot = -14.6175140351565 -103000 ekin = 0.228584676860608 | erot = 0.763309953364731 | epot = -15.6094086654068 | etot = -14.6175140351814 -104000 ekin = 0.224228843046253 | erot = 0.78598032692129 | epot = -15.6277232051714 | etot = -14.6175140352039 -105000 ekin = 0.217925953180068 | erot = 0.807518535459536 | epot = -15.6429585238624 | etot = -14.6175140352228 -106000 ekin = 0.209766205881383 | erot = 0.827537066837229 | epot = -15.6548173079557 | etot = -14.6175140352371 -107000 ekin = 0.199914663118832 | erot = 0.845644346598305 | epot = -15.6630730449629 | etot = -14.6175140352458 -108000 ekin = 0.188614735690438 | erot = 0.86145556230374 | epot = -15.6675843332424 | etot = -14.6175140352482 -109000 ekin = 0.176187061060969 | erot = 0.874603999194657 | epot = -15.6683050954996 | etot = -14.617514035244 -110000 ekin = 0.163022626611269 | erot = 0.884752084634178 | epot = -15.6652887464788 | etot = -14.6175140352334 -111000 ekin = 0.149569382110055 | erot = 0.891601400936344 | epot = -15.6586848182636 | etot = -14.6175140352172 -112000 ekin = 0.136312261124298 | erot = 0.894901120601569 | epot = -15.6487274169225 | etot = -14.6175140351967 -113000 ekin = 0.123747404857111 | erot = 0.894454602034433 | epot = -15.635716042065 | etot = -14.6175140351735 -114000 ekin = 0.112352324429236 | erot = 0.89012419645392 | epot = -15.6199905560327 | etot = -14.6175140351496 -115000 ekin = 0.102554569787019 | erot = 0.881834585428133 | epot = -15.601903190342 | etot = -14.6175140351268 -116000 ekin = 0.094702004709198 | erot = 0.869575126615747 | epot = -15.5817911664316 | etot = -14.6175140351067 -117000 ekin = 0.0890378681933156 | erot = 0.853401690495617 | epot = -15.5599535937792 | etot = -14.6175140350902 -118000 ekin = 0.0856833736304911 | erot = 0.833438318820653 | epot = -15.536635727529 | etot = -14.6175140350778 -119000 ekin = 0.0846297171115028 | erot = 0.809878764033866 | epot = -15.5120225162146 | etot = -14.6175140350693 -120000 ekin = 0.0857402026933537 | erot = 0.782987649503194 | epot = -15.4862418872603 | etot = -14.6175140350638 -121000 ekin = 0.0887619781646647 | erot = 0.753100709617513 | epot = -15.4593767228421 | etot = -14.61751403506 -122000 ekin = 0.0933458418333701 | erot = 0.720623403983765 | epot = -15.4314832808735 | etot = -14.6175140350564 -123000 ekin = 0.0990718975136712 | erot = 0.686027198351099 | epot = -15.4026131309163 | etot = -14.6175140350515 -124000 ekin = 0.10547856753477 | erot = 0.649842971568616 | epot = -15.3728355741476 | etot = -14.6175140350442 -125000 ekin = 0.112092583657157 | erot = 0.612651306911466 | epot = -15.3422579256018 | etot = -14.6175140350331 -126000 ekin = 0.118457948669929 | erot = 0.575069793126885 | epot = -15.3110417768148 | etot = -14.6175140350179 -127000 ekin = 0.12416235209736 | erot = 0.537737821904032 | epot = -15.2794142089994 | etot = -14.617514034998 -128000 ekin = 0.12886000047466 | erot = 0.50129966007338 | epot = -15.2476736955216 | etot = -14.6175140349735 -129000 ekin = 0.132290197680968 | erot = 0.466386755141928 | epot = -15.2161909877676 | etot = -14.6175140349447 -130000 ekin = 0.134291248322799 | erot = 0.433600287194598 | epot = -15.1854055704295 | etot = -14.6175140349121 -131000 ekin = 0.134809368078731 | erot = 0.403494917850824 | epot = -15.1558183208059 | etot = -14.6175140348763 -132000 ekin = 0.133902311412609 | erot = 0.376564532721137 | epot = -15.1279808789722 | etot = -14.6175140348384 -133000 ekin = 0.131737425949523 | erot = 0.35323055944927 | epot = -15.102482020198 | etot = -14.6175140347992 -134000 ekin = 0.128583872249503 | erot = 0.333833200744645 | epot = -15.0799311077543 | etot = -14.6175140347601 -135000 ekin = 0.124798858318881 | erot = 0.318625678761018 | epot = -15.0609385718023 | etot = -14.6175140347224 -136000 ekin = 0.120807966950657 | erot = 0.307771366705204 | epot = -15.0460933683435 | etot = -14.6175140346876 -137000 ekin = 0.117080018573046 | erot = 0.301343503849178 | epot = -15.0359375570798 | etot = -14.6175140346576 -138000 ekin = 0.11409740445119 | erot = 0.299327064918184 | epot = -15.0309385040035 | etot = -14.6175140346342 -139000 ekin = 0.112323403877017 | erot = 0.30162229304682 | epot = -15.0314597315429 | etot = -14.6175140346191 -140000 ekin = 0.112168587316825 | erot = 0.308049410073269 | epot = -15.0377320320041 | etot = -14.617514034614 -141000 ekin = 0.113958896787242 | erot = 0.318354084563179 | epot = -15.0498270159708 | etot = -14.6175140346204 -142000 ekin = 0.117908250109871 | erot = 0.332213334114279 | epot = -15.0676356188632 | etot = -14.6175140346391 -143000 ekin = 0.124098500240005 | erot = 0.349241744869171 | epot = -15.0908542797795 | etot = -14.6175140346704 -144000 ekin = 0.132469049162189 | erot = 0.368998042344344 | epot = -15.1189811262203 | etot = -14.6175140347138 -145000 ekin = 0.142817534773286 | erot = 0.390992018433719 | epot = -15.1513235879751 | etot = -14.6175140347681 -146000 ekin = 0.154812002594074 | erot = 0.414692148539669 | epot = -15.1870181859652 | etot = -14.6175140348314 -147000 ekin = 0.168013608208222 | erot = 0.439534147564146 | epot = -15.2250617906734 | etot = -14.617514034901 -148000 ekin = 0.181907755044263 | erot = 0.464930715993231 | epot = -15.2643525060114 | etot = -14.617514034974 -149000 ekin = 0.195940689918476 | erot = 0.490282644231627 | epot = -15.303737369197 | etot = -14.6175140350469 -150000 ekin = 0.209558115498224 | erot = 0.514991307803342 | epot = -15.3420634584183 | etot = -14.6175140351167 -151000 ekin = 0.222242375358764 | erot = 0.538472447670959 | epot = -15.37822885821 | etot = -14.6175140351803 -152000 ekin = 0.233545181100908 | erot = 0.560170967505261 | epot = -15.4112301838413 | etot = -14.6175140352351 -153000 ekin = 0.243113638171877 | erot = 0.579575715964384 | epot = -15.4402033894153 | etot = -14.6175140352791 -154000 ekin = 0.250708030719506 | erot = 0.596234520730852 | epot = -15.4644565867613 | etot = -14.617514035311 -155000 ekin = 0.256210874594867 | erot = 0.60976818504912 | epot = -15.4834930949737 | etot = -14.6175140353297 -156000 ekin = 0.259627463842678 | erot = 0.619882772314523 | epot = -15.4970242714926 | etot = -14.6175140353354 -157000 ekin = 0.261078756733762 | erot = 0.626379517381851 | epot = -15.5049723094439 | etot = -14.6175140353283 -158000 ekin = 0.260787877594799 | erot = 0.629161788909728 | epot = -15.5074637018138 | etot = -14.6175140353093 -159000 ekin = 0.259061752299363 | erot = 0.628238692725143 | epot = -15.5048144803044 | etot = -14.6175140352799 -160000 ekin = 0.256269476947947 | erot = 0.623725097357694 | epot = -15.4975086095473 | etot = -14.6175140352416 -161000 ekin = 0.252818974262676 | erot = 0.615838055764808 | epot = -15.486171065224 | etot = -14.6175140351965 -162000 ekin = 0.249133354780831 | erot = 0.604889772113657 | epot = -15.471537162041 | etot = -14.6175140351465 -163000 ekin = 0.245628201594069 | erot = 0.591277407065719 | epot = -15.4544196437535 | etot = -14.6175140350937 -164000 ekin = 0.242690765770497 | erot = 0.575470125399849 | epot = -15.4356749262106 | etot = -14.6175140350402 -165000 ekin = 0.240661818237638 | erot = 0.557993868663582 | epot = -15.4161697218892 | etot = -14.617514034988 -166000 ekin = 0.239820672159809 | erot = 0.53941438884916 | epot = -15.3967490959478 | etot = -14.6175140349388 -167000 ekin = 0.240373682616981 | erot = 0.520319112884548 | epot = -15.3782068303959 | etot = -14.6175140348944 -168000 ekin = 0.24244635767337 | erot = 0.501298426047094 | epot = -15.3612588185766 | etot = -14.6175140348562 -169000 ekin = 0.246079081489486 | erot = 0.482926967022081 | epot = -15.3465200833369 | etot = -14.6175140348253 -170000 ekin = 0.251226355670601 | erot = 0.465745518941346 | epot = -15.3344859094148 | etot = -14.6175140348028 -171000 ekin = 0.257759407502439 | erot = 0.450244072412675 | epot = -15.3255175147044 | etot = -14.6175140347893 -172000 ekin = 0.265471962314995 | erot = 0.43684655757276 | epot = -15.3198325546728 | etot = -14.617514034785 -173000 ekin = 0.274088992052566 | erot = 0.425897760802307 | epot = -15.317500787645 | etot = -14.6175140347901 -174000 ekin = 0.283278228107989 | erot = 0.417652965987653 | epot = -15.3184452288998 | etot = -14.6175140348041 -175000 ekin = 0.292664164217049 | erot = 0.41227065206718 | epot = -15.3224488511106 | etot = -14.6175140348264 -176000 ekin = 0.301844276743974 | erot = 0.409808663993543 | epot = -15.3291669755933 | etot = -14.6175140348558 -177000 ekin = 0.310407103277722 | erot = 0.410224178773613 | epot = -15.338145316942 | etot = -14.6175140348907 -178000 ekin = 0.317951707448459 | erot = 0.413377690533319 | epot = -15.3488434329112 | etot = -14.6175140349295 -179000 ekin = 0.324107901131331 | erot = 0.419041092199345 | epot = -15.3606630283007 | etot = -14.61751403497 -180000 ekin = 0.328556397748226 | erot = 0.426909726007329 | epot = -15.3729801587658 | etot = -14.6175140350103 -181000 ekin = 0.331047834153872 | erot = 0.436618006902467 | epot = -15.3851798761041 | etot = -14.6175140350478 -182000 ekin = 0.331419420114469 | erot = 0.447757936314679 | epot = -15.3966913915095 | etot = -14.6175140350803 -183000 ekin = 0.32960779233749 | erot = 0.459899520065503 | epot = -15.4070213475091 | etot = -14.6175140351061 -184000 ekin = 0.325656516855028 | erot = 0.472611792133139 | epot = -15.4157823441118 | etot = -14.6175140351236 -185000 ekin = 0.319716934487211 | erot = 0.485483030927449 | epot = -15.4227140005469 | etot = -14.6175140351322 -186000 ekin = 0.312041347782212 | erot = 0.498138700398001 | epot = -15.4276940833121 | etot = -14.6175140351319 -187000 ekin = 0.302968200961153 | erot = 0.510255791848845 | epot = -15.4307380279334 | etot = -14.6175140351234 -188000 ekin = 0.292899787356355 | erot = 0.5215725520513 | epot = -15.4319863745157 | etot = -14.6175140351081 -189000 ekin = 0.282274048055605 | erot = 0.531893031493143 | epot = -15.4316811146372 | etot = -14.6175140350884 -190000 ekin = 0.271533034588949 | erot = 0.541086413296656 | epot = -15.4301334829521 | etot = -14.6175140350665 -191000 ekin = 0.261091384545176 | erot = 0.549081610185661 | epot = -15.4276870297757 | etot = -14.6175140350448 -192000 ekin = 0.251308489707993 | erot = 0.555858063434326 | epot = -15.4246805881679 | etot = -14.6175140350256 -193000 ekin = 0.242467771119499 | erot = 0.561433978654792 | epot = -15.4214157847846 | etot = -14.6175140350103 -194000 ekin = 0.234765581624083 | erot = 0.565853352187983 | epot = -15.4181329688119 | etot = -14.6175140349998 -195000 ekin = 0.228310848060933 | erot = 0.569173077812972 | epot = -15.414997960868 | etot = -14.6175140349941 -196000 ekin = 0.223134890549791 | erot = 0.571451208607789 | epot = -15.4121001341501 | etot = -14.6175140349925 -197000 ekin = 0.219209242155479 | erot = 0.572737138234515 | epot = -15.4094604153842 | etot = -14.6175140349942 -198000 ekin = 0.216468062808567 | erot = 0.573064123809139 | epot = -15.4070462216157 | etot = -14.6175140349979 -199000 ekin = 0.214831137522102 | erot = 0.572444258405115 | epot = -15.4047894309295 | etot = -14.6175140350023 -200000 ekin = 0.214223573901692 | erot = 0.570865760664587 | epot = -15.402603369573 | etot = -14.6175140350067 -201000 ekin = 0.214589119166338 | erot = 0.568292309388425 | epot = -15.4003954635655 | etot = -14.6175140350107 -202000 ekin = 0.215895325601886 | erot = 0.564664121435212 | epot = -15.3980734820515 | etot = -14.6175140350144 -203000 ekin = 0.218130347569574 | erot = 0.559900543320399 | epot = -15.3955449259083 | etot = -14.6175140350184 -204000 ekin = 0.221292667473328 | erot = 0.553904074219812 | epot = -15.3927107767163 | etot = -14.6175140350232 -205000 ekin = 0.225376258610291 | erot = 0.546565915590092 | epot = -15.3894562092301 | etot = -14.6175140350297 -206000 ekin = 0.230354397528691 | erot = 0.537773288685112 | epot = -15.3856417212522 | etot = -14.6175140350384 -207000 ekin = 0.236165428414371 | erot = 0.527418806931585 | epot = -15.3810982703949 | etot = -14.617514035049 -208000 ekin = 0.242703261860097 | erot = 0.515412077176746 | epot = -15.3756293740978 | etot = -14.617514035061 -209000 ekin = 0.249814382549771 | erot = 0.501693407692903 | epot = -15.3690218253159 | etot = -14.6175140350732 -210000 ekin = 0.257301864855487 | erot = 0.486249049966596 | epot = -15.3610649499059 | etot = -14.6175140350838 -211000 ekin = 0.264935635394204 | erot = 0.469126912721243 | epot = -15.3515765832063 | etot = -14.6175140350909 -212000 ekin = 0.272467183646431 | erot = 0.450451153648371 | epot = -15.3404323723875 | etot = -14.6175140350927 -213000 ekin = 0.279646306736912 | erot = 0.430433702677772 | epot = -15.3275940445023 | etot = -14.6175140350876 -214000 ekin = 0.286237611276899 | erot = 0.409381288017331 | epot = -15.3131329343688 | etot = -14.6175140350746 -215000 ekin = 0.29203464387293 | erot = 0.387696263733711 | epot = -15.29724494266 | etot = -14.6175140350534 -216000 ekin = 0.296870258153004 | erot = 0.365870567410591 | epot = -15.2802548605881 | etot = -14.6175140350245 -217000 ekin = 0.300622666325324 | erot = 0.344472695101547 | epot = -15.2626093964159 | etot = -14.617514034989 -218000 ekin = 0.303217269541564 | erot = 0.324128407396835 | epot = -15.244859711887 | etot = -14.6175140349486 -219000 ekin = 0.30462484391226 | erot = 0.305496496150474 | epot = -15.2276353749682 | etot = -14.6175140349055 -220000 ekin = 0.304856982074418 | erot = 0.289241221674229 | epot = -15.2116122386105 | etot = -14.6175140348619 -221000 ekin = 0.303959749544728 | erot = 0.276003133760616 | epot = -15.1974769181253 | etot = -14.61751403482 -222000 ekin = 0.302006434071345 | erot = 0.266369862263779 | epot = -15.1858903311172 | etot = -14.6175140347821 -223000 ekin = 0.299090105491099 | erot = 0.260848208952979 | epot = -15.1774523491944 | etot = -14.6175140347503 -224000 ekin = 0.295316503745815 | erot = 0.259838588555865 | epot = -15.172669127028 | etot = -14.6175140347263 -225000 ekin = 0.29079760031813 | erot = 0.263612591734547 | epot = -15.1719242267643 | etot = -14.6175140347116 -226000 ekin = 0.28564610323333 | erot = 0.272294318079248 | epot = -15.1754544560199 | etot = -14.6175140347074 -227000 ekin = 0.279971018689722 | erot = 0.285846075010758 | epot = -15.1833311284149 | etot = -14.6175140347144 -228000 ekin = 0.27387437472819 | erot = 0.304059069119049 | epot = -15.1954474785804 | etot = -14.6175140347332 -229000 ekin = 0.2674491741605 | erot = 0.326549807965654 | epot = -15.2115130168897 | etot = -14.6175140347636 -230000 ekin = 0.260778614119455 | erot = 0.352763004039831 | epot = -15.2310556529641 | etot = -14.6175140348048 -231000 ekin = 0.253936564977397 | erot = 0.381981763344761 | epot = -15.2534323631777 | etot = -14.6175140348555 -232000 ekin = 0.246989230842658 | erot = 0.413345683736738 | epot = -15.2778489494936 | etot = -14.6175140349142 -233000 ekin = 0.239997814735998 | erot = 0.445877135783837 | epot = -15.3033889854983 | etot = -14.6175140349784 -234000 ekin = 0.233021891669953 | erot = 0.478515439398998 | epot = -15.3290513661143 | etot = -14.6175140350454 -235000 ekin = 0.226123071286445 | erot = 0.510157919201484 | epot = -15.3537950255997 | etot = -14.6175140351118 -236000 ekin = 0.21936843695277 | erot = 0.539706010633891 | epot = -15.3765884827611 | etot = -14.6175140351745 -237000 ekin = 0.212833212708602 | erot = 0.566113832023262 | epot = -15.3964610799619 | etot = -14.61751403523 -238000 ekin = 0.206602165162865 | erot = 0.588436180449287 | epot = -15.4125523808878 | etot = -14.6175140352757 -239000 ekin = 0.200769360307748 | erot = 0.605872583258365 | epot = -15.4241559788754 | etot = -14.6175140353093 -240000 ekin = 0.195436190928625 | erot = 0.61780345837781 | epot = -15.4307536846357 | etot = -14.6175140353293 -241000 ekin = 0.190707920284743 | erot = 0.623817360380854 | epot = -15.4320393160006 | etot = -14.617514035335 -242000 ekin = 0.186689132524135 | erot = 0.623726737659666 | epot = -15.4279299055104 | etot = -14.6175140353266 -243000 ekin = 0.183478880874969 | erot = 0.617571857376273 | epot = -15.4185647735561 | etot = -14.6175140353049 -244000 ekin = 0.181166166760206 | erot = 0.605612923712308 | epot = -15.4042931257437 | etot = -14.6175140352712 -245000 ekin = 0.179826690516145 | erot = 0.588311983397642 | epot = -15.3856527091413 | etot = -14.6175140352275 -246000 ekin = 0.179521473345086 | erot = 0.566306329739288 | epot = -15.3633418382601 | etot = -14.6175140351758 -247000 ekin = 0.180297726609514 | erot = 0.540375528723551 | epot = -15.3381872904514 | etot = -14.6175140351183 -248000 ekin = 0.182192022181392 | erot = 0.511404282991666 | epot = -15.3111103402302 | etot = -14.6175140350572 -249000 ekin = 0.185235475059313 | erot = 0.480343275337858 | epot = -15.2830927853916 | etot = -14.6175140349945 -250000 ekin = 0.189460324578832 | erot = 0.448169956262064 | epot = -15.255144315773 | etot = -14.6175140349321 -251000 ekin = 0.19490702001237 | erot = 0.415851007132868 | epot = -15.228272062017 | etot = -14.6175140348717 -252000 ekin = 0.201630699423836 | erot = 0.384307951122289 | epot = -15.2034526853611 | etot = -14.617514034815 -253000 ekin = 0.209705815256177 | erot = 0.354387113740113 | epot = -15.1816069637594 | etot = -14.6175140347631 -254000 ekin = 0.219227629547432 | erot = 0.326834860919775 | epot = -15.1635765251848 | etot = -14.6175140347176 -255000 ekin = 0.230309407957432 | erot = 0.302278768995733 | epot = -15.1501022116327 | etot = -14.6175140346795 -256000 ekin = 0.243074422922267 | erot = 0.281215109558701 | epot = -15.141803567131 | etot = -14.61751403465 -257000 ekin = 0.257642364630153 | erot = 0.264002762946067 | epot = -15.1391591622066 | etot = -14.6175140346304 -258000 ekin = 0.274110461104108 | erot = 0.250863404057697 | epot = -15.1424878997833 | etot = -14.6175140346215 -259000 ekin = 0.292530483429775 | erot = 0.241887528333024 | epot = -15.1519320463872 | etot = -14.6175140346244 -260000 ekin = 0.312883750215128 | erot = 0.237045600991386 | epot = -15.1674433858462 | etot = -14.6175140346397 -261000 ekin = 0.335057071666333 | erot = 0.236203324625284 | epot = -15.1887744309592 | etot = -14.6175140346676 -262000 ekin = 0.358823075933473 | erot = 0.239139750884213 | epot = -15.2154768615253 | etot = -14.6175140347076 -263000 ekin = 0.383828346058996 | erot = 0.245566753569572 | epot = -15.2469091343872 | etot = -14.6175140347587 -264000 ekin = 0.409592161639947 | erot = 0.255148290958814 | epot = -15.2822544874178 | etot = -14.6175140348191 -265000 ekin = 0.435517425640964 | erot = 0.267517972446782 | epot = -15.3205494329741 | etot = -14.6175140348864 -266000 ekin = 0.460913759434661 | erot = 0.282293742227942 | epot = -15.3607215366204 | etot = -14.6175140349578 -267000 ekin = 0.485031075313793 | erot = 0.299088986461059 | epot = -15.4016340968052 | etot = -14.6175140350303 -268000 ekin = 0.50710051747368 | erot = 0.317519986656956 | epot = -15.4421345392314 | etot = -14.6175140351007 -269000 ekin = 0.526378761163555 | erot = 0.33721025800327 | epot = -15.4811030543329 | etot = -14.6175140351661 -270000 ekin = 0.542191399557166 | erot = 0.357792786170323 | epot = -15.5174982209515 | etot = -14.617514035224 -271000 ekin = 0.553971501275297 | erot = 0.378911394713051 | epot = -15.5503969312606 | etot = -14.6175140352722 -272000 ekin = 0.561290243476884 | erot = 0.400222387433604 | epot = -15.5790266662199 | etot = -14.6175140353094 -273000 ekin = 0.563877614617889 | erot = 0.421397250043755 | epot = -15.6027888999963 | etot = -14.6175140353346 -274000 ekin = 0.561632338447609 | erot = 0.442126671655328 | epot = -15.6212730454506 | etot = -14.6175140353477 -275000 ekin = 0.554621238224436 | erot = 0.462125606775396 | epot = -15.6342608803486 | etot = -14.6175140353487 -276000 ekin = 0.543069132887187 | erot = 0.481138682331962 | epot = -15.6417218505579 | etot = -14.6175140353387 -277000 ekin = 0.527340979965694 | erot = 0.498945052082853 | epot = -15.6438000673675 | etot = -14.6175140353189 -278000 ekin = 0.507918337217276 | erot = 0.515361832413196 | epot = -15.6407942049214 | etot = -14.617514035291 -279000 ekin = 0.485372319601914 | erot = 0.530245473601771 | epot = -15.6331318284601 | etot = -14.6175140352564 -280000 ekin = 0.46033511650651 | erot = 0.543490744711146 | epot = -15.6213398964351 | etot = -14.6175140352175 -281000 ekin = 0.433471859960453 | erot = 0.555027349456868 | epot = -15.6060132445935 | etot = -14.6175140351761 -282000 ekin = 0.405454262480505 | erot = 0.564814480007104 | epot = -15.5877827776223 | etot = -14.6175140351347 -283000 ekin = 0.376937038993415 | erot = 0.572833827993335 | epot = -15.5672849020813 | etot = -14.6175140350945 -284000 ekin = 0.348537747962441 | erot = 0.579081711931139 | epot = -15.5451334949501 | etot = -14.6175140350565 -285000 ekin = 0.320820372083179 | erot = 0.583561068647143 | epot = -15.5218954757531 | etot = -14.6175140350227 -286000 ekin = 0.294282726921465 | erot = 0.586274110946605 | epot = -15.4980708728619 | etot = -14.6175140349939 -287000 ekin = 0.269347634013372 | erot = 0.587216475910704 | epot = -15.4740781448946 | etot = -14.6175140349706 -288000 ekin = 0.246357704467567 | erot = 0.586373659773396 | epot = -15.4502453991941 | etot = -14.6175140349531 -289000 ekin = 0.225573522145737 | erot = 0.583720426232575 | epot = -15.4268079833199 | etot = -14.6175140349416 -290000 ekin = 0.207174962818498 | erot = 0.579223657449698 | epot = -15.4039126552032 | etot = -14.617514034935 -291000 ekin = 0.191265313940317 | erot = 0.57284878086397 | epot = -15.3816281297368 | etot = -14.6175140349325 -292000 ekin = 0.177877757396561 | erot = 0.564569470033103 | epot = -15.3599612623625 | etot = -14.6175140349328 -293000 ekin = 0.166983649288562 | erot = 0.55437983768204 | epot = -15.3388775219052 | etot = -14.6175140349346 -294000 ekin = 0.158501898150816 | erot = 0.542307895558416 | epot = -15.3183238286456 | etot = -14.6175140349363 -295000 ekin = 0.152308641379775 | erot = 0.528428741575564 | epot = -15.2982514178919 | etot = -14.6175140349366 -296000 ekin = 0.14824639013426 | erot = 0.512875830575376 | epot = -15.2786362556441 | etot = -14.6175140349344 -297000 ekin = 0.146131889948848 | erot = 0.49584883363365 | epot = -15.2594947585117 | etot = -14.6175140349292 -298000 ekin = 0.145762142540934 | erot = 0.47761697934363 | epot = -15.2408931568053 | etot = -14.6175140349207 -299000 ekin = 0.146918339842692 | erot = 0.458517327974144 | epot = -15.2229497027261 | etot = -14.6175140349093 -300000 ekin = 0.149367830718069 | erot = 0.438948042711649 | epot = -15.2058299083254 | etot = -14.6175140348957 -301000 ekin = 0.152864610234033 | erot = 0.419357266833102 | epot = -15.1897359119478 | etot = -14.6175140348807 -302000 ekin = 0.157149122640169 | erot = 0.400228590597444 | epot = -15.1748917481033 | etot = -14.6175140348656 -303000 ekin = 0.161948347719032 | erot = 0.382064246006851 | epot = -15.1615266285773 | etot = -14.6175140348514 -304000 ekin = 0.166977167327436 | erot = 0.365367110078575 | epot = -15.1498583122451 | etot = -14.6175140348391 -305000 ekin = 0.171941885875871 | erot = 0.350622387001196 | epot = -15.1400783077067 | etot = -14.6175140348296 -306000 ekin = 0.176546522696863 | erot = 0.338279561363742 | epot = -15.1323401188838 | etot = -14.6175140348232 -307000 ekin = 0.180502080572192 | erot = 0.32873493509135 | epot = -15.126751050484 | etot = -14.6175140348205 -308000 ekin = 0.183539117579248 | erot = 0.322315068517915 | epot = -15.1233682209185 | etot = -14.6175140348213 -309000 ekin = 0.18542258916881 | erot = 0.31926113518031 | epot = -15.1221977591748 | etot = -14.6175140348257 -310000 ekin = 0.185968382525478 | erot = 0.319714556777655 | epot = -15.1231969741364 | etot = -14.6175140348332 -311000 ekin = 0.185060444471749 | erot = 0.323704474532897 | epot = -15.1262789538482 | etot = -14.6175140348435 -312000 ekin = 0.182667055699898 | erot = 0.331137883754702 | epot = -15.1313189743107 | etot = -14.6175140348561 -313000 ekin = 0.178854671448117 | erot = 0.341793554574368 | epot = -15.1381622608928 | etot = -14.6175140348703 -314000 ekin = 0.173797674113305 | erot = 0.355321045101964 | epot = -15.1466327541009 | etot = -14.6175140348857 -315000 ekin = 0.167782440685989 | erot = 0.371246117950244 | epot = -15.1565425935376 | etot = -14.6175140349013 -316000 ekin = 0.161204347699333 | erot = 0.388983636698412 | epot = -15.1677020193144 | etot = -14.6175140349166 -317000 ekin = 0.154556738722997 | erot = 0.407858516721222 | epot = -15.179929290375 | etot = -14.6175140349308 -318000 ekin = 0.148411457828014 | erot = 0.427134549771526 | epot = -15.1930600425429 | etot = -14.6175140349434 -319000 ekin = 0.143391260343274 | erot = 0.446049980956587 | epot = -15.2069552762535 | etot = -14.6175140349536 -320000 ekin = 0.140135163879389 | erot = 0.463857713006731 | epot = -15.2215069118477 | etot = -14.6175140349616 -321000 ekin = 0.13925849683082 | erot = 0.47986711734359 | epot = -15.2366396491416 | etot = -14.6175140349672 -322000 ekin = 0.141309963686786 | erot = 0.493483840953745 | epot = -15.2523078396115 | etot = -14.617514034971 -323000 ekin = 0.146728465402049 | erot = 0.504243890594766 | epot = -15.2684863909708 | etot = -14.617514034974 -324000 ekin = 0.155802740978474 | erot = 0.511838753068047 | epot = -15.2851555290241 | etot = -14.6175140349776 -325000 ekin = 0.168637192339758 | erot = 0.516129344219392 | epot = -15.3022805715425 | etot = -14.6175140349833 -326000 ekin = 0.185127492740937 | erot = 0.517147991936341 | epot = -15.3197895196698 | etot = -14.6175140349925 -327000 ekin = 0.204949583925474 | erot = 0.515089155111526 | epot = -15.3375527740431 | etot = -14.6175140350061 -328000 ekin = 0.227565145376632 | erot = 0.510290835144293 | epot = -15.3553700155453 | etot = -14.6175140350243 -329000 ekin = 0.252245305622037 | erot = 0.503209396460715 | epot = -15.372968737129 | etot = -14.6175140350463 -330000 ekin = 0.278112223739082 | erot = 0.494390678506977 | epot = -15.3900169373163 | etot = -14.6175140350702 -331000 ekin = 0.304195517645115 | erot = 0.484439927614521 | epot = -15.4061494803532 | etot = -14.6175140350935 -332000 ekin = 0.329497983392802 | erot = 0.473992405219011 | epot = -15.4210044237255 | etot = -14.6175140351136 -333000 ekin = 0.353063353198636 | erot = 0.463685785195801 | epot = -15.4342631735224 | etot = -14.617514035128 -334000 ekin = 0.374038491016654 | erot = 0.454134842083192 | epot = -15.4456873682344 | etot = -14.6175140351345 -335000 ekin = 0.391723520500355 | erot = 0.445908562625392 | epot = -15.4551461182584 | etot = -14.6175140351326 -336000 ekin = 0.405605581598612 | erot = 0.439509690040415 | epot = -15.4626293067615 | etot = -14.6175140351225 -337000 ekin = 0.415374601838216 | erot = 0.435356764652285 | epot = -15.4682454015957 | etot = -14.6175140351052 -338000 ekin = 0.42092199701013 | erot = 0.433768862195237 | epot = -15.4722048942883 | etot = -14.6175140350829 -339000 ekin = 0.422325110447523 | erot = 0.434953376211998 | epot = -15.4747925217174 | etot = -14.6175140350579 -340000 ekin = 0.419821259880453 | erot = 0.438997304560007 | epot = -15.4763325994732 | etot = -14.6175140350327 -341000 ekin = 0.413775534581149 | erot = 0.445862573585633 | epot = -15.4771521431765 | etot = -14.6175140350097 -342000 ekin = 0.404646174020848 | erot = 0.455385967573857 | epot = -15.4775461765857 | etot = -14.617514034991 -343000 ekin = 0.39295070583281 | erot = 0.467284215126884 | epot = -15.4777489559374 | etot = -14.6175140349777 -344000 ekin = 0.379235231728883 | erot = 0.481164689425934 | epot = -15.4779139561254 | etot = -14.6175140349706 -345000 ekin = 0.364048459933153 | erot = 0.496541967294177 | epot = -15.4781044621969 | etot = -14.6175140349695 -346000 ekin = 0.347921358320316 | erot = 0.512860132815006 | epot = -15.478295526109 | etot = -14.6175140349737 -347000 ekin = 0.331352665808126 | erot = 0.529520204053122 | epot = -15.4783869048429 | etot = -14.6175140349817 -348000 ekin = 0.314799955036566 | erot = 0.545911447469168 | epot = -15.4782254374972 | etot = -14.6175140349915 -349000 ekin = 0.298675493175281 | erot = 0.561444708834092 | epot = -15.4776342370104 | etot = -14.6175140350011 -350000 ekin = 0.283345815520869 | erot = 0.575585348315993 | epot = -15.4764451988451 | etot = -14.6175140350083 -351000 ekin = 0.269133730327523 | erot = 0.587883045339117 | epot = -15.474530810678 | etot = -14.6175140350114 -352000 ekin = 0.256321431305203 | erot = 0.597995738138039 | epot = -15.4718312044524 | etot = -14.6175140350092 -353000 ekin = 0.24515350965437 | erot = 0.605705335206206 | epot = -15.4683728798616 | etot = -14.617514035001 -354000 ekin = 0.235838910986168 | erot = 0.610923562934476 | epot = -15.4642765089078 | etot = -14.6175140349872 -355000 ekin = 0.228551231300269 | erot = 0.613687305425456 | epot = -15.4597525716945 | etot = -14.6175140349688 -356000 ekin = 0.223427131306842 | erot = 0.61414390282459 | epot = -15.4550850690789 | etot = -14.6175140349475 -357000 ekin = 0.220563006917694 | erot = 0.612527933401747 | epot = -15.4506049752447 | etot = -14.6175140349253 -358000 ekin = 0.22001033319751 | erot = 0.60913185554411 | epot = -15.4466562236463 | etot = -14.6175140349046 -359000 ekin = 0.221770268739896 | erot = 0.604273418957587 | epot = -15.4435577225855 | etot = -14.617514034888 -360000 ekin = 0.225788163653238 | erot = 0.598262925571301 | epot = -15.4415651241022 | etot = -14.6175140348777 -361000 ekin = 0.231948578437327 | erot = 0.591373251984918 | epot = -15.4408358652977 | etot = -14.6175140348754 -362000 ekin = 0.240071331017989 | erot = 0.583815109039703 | epot = -15.4414004749403 | etot = -14.6175140348826 -363000 ekin = 0.249908988057725 | erot = 0.5757194066129 | epot = -15.4431424295705 | etot = -14.6175140348999 -364000 ekin = 0.261146140581906 | erot = 0.567127906486804 | epot = -15.445788081996 | etot = -14.6175140349273 -365000 ekin = 0.273400773645715 | erot = 0.55799265360587 | epot = -15.4489074622158 | etot = -14.6175140349642 -366000 ekin = 0.286228056503678 | erot = 0.548184015759183 | epot = -15.4519261072721 | etot = -14.6175140350092 -367000 ekin = 0.299126926925909 | erot = 0.537506547612528 | epot = -15.454147509599 | etot = -14.6175140350606 -368000 ekin = 0.311549892638302 | erot = 0.525721330953642 | epot = -15.4547852587076 | etot = -14.6175140351156 -369000 ekin = 0.32291649334207 | erot = 0.512572942756027 | epot = -15.4530034712696 | etot = -14.6175140351715 -370000 ekin = 0.332630833323927 | erot = 0.497818805483382 | epot = -15.4479636740324 | etot = -14.6175140352251 -371000 ekin = 0.340103492446064 | erot = 0.481258447418256 | epot = -15.4388759751374 | etot = -14.617514035273 -372000 ekin = 0.344777943663672 | erot = 0.462760223985855 | epot = -15.4250522029614 | etot = -14.6175140353119 -373000 ekin = 0.346161332161602 | erot = 0.442283380419715 | epot = -15.4059587479198 | etot = -14.6175140353385 -374000 ekin = 0.343859062980226 | erot = 0.419893962768359 | epot = -15.3812670610984 | etot = -14.6175140353498 -375000 ekin = 0.337612023151089 | erot = 0.395773904237503 | epot = -15.3508999627316 | etot = -14.617514035343 -376000 ekin = 0.327334336193297 | erot = 0.370223433837585 | epot = -15.3150718053467 | etot = -14.6175140353159 -377000 ekin = 0.31314826371265 | erot = 0.343657545338067 | epot = -15.2743198443178 | etot = -14.6175140352671 -378000 ekin = 0.295411338277465 | erot = 0.316597454538877 | epot = -15.2295228280127 | etot = -14.6175140351964 -379000 ekin = 0.274729408510311 | erot = 0.289657740940239 | epot = -15.1819011845556 | etot = -14.6175140351051 -380000 ekin = 0.251948675267255 | erot = 0.263529414055484 | epot = -15.1329921243191 | etot = -14.6175140349963 -381000 ekin = 0.228120837035106 | erot = 0.238958749468258 | epot = -15.0845936213795 | etot = -14.6175140348762 -382000 ekin = 0.204438854506711 | erot = 0.21672127051921 | epot = -15.0386741597778 | etot = -14.6175140347519 -383000 ekin = 0.182146263755408 | erot = 0.197591880984099 | epot = -14.9972521793719 | etot = -14.6175140346324 -384000 ekin = 0.162429780679591 | erot = 0.182311896923862 | epot = -14.9622557121303 | etot = -14.6175140345269 -385000 ekin = 0.14631062212392 | erot = 0.171555128910903 | epot = -14.9353797854787 | etot = -14.6175140344438 -386000 ekin = 0.134552389652504 | erot = 0.165895597224072 | epot = -14.9179620212652 | etot = -14.6175140343886 -387000 ekin = 0.127600986328474 | erot = 0.165779213533691 | epot = -14.9108942342261 | etot = -14.6175140343639 -388000 ekin = 0.125565151523057 | erot = 0.171500950984465 | epot = -14.9145801368767 | etot = -14.6175140343691 -389000 ekin = 0.128237001096924 | erot = 0.183188026636153 | epot = -14.9289390621345 | etot = -14.6175140344014 -390000 ekin = 0.135143637923019 | erot = 0.200788930663243 | epot = -14.953446603043 | etot = -14.6175140344567 -391000 ekin = 0.145616156499687 | erot = 0.224068074688667 | epot = -14.9871982657189 | etot = -14.6175140345306 -392000 ekin = 0.158862235246419 | erot = 0.252606362172197 | epot = -15.028982632037 | etot = -14.6175140346184 -393000 ekin = 0.174032087603182 | erot = 0.285808726840173 | epot = -15.0773548491589 | etot = -14.6175140347155 -394000 ekin = 0.190272707003279 | erot = 0.32292010751355 | epot = -15.130706849335 | etot = -14.6175140348181 -395000 ekin = 0.206769905101682 | erot = 0.363051013228993 | epot = -15.1873349532528 | etot = -14.6175140349222 -396000 ekin = 0.222780272469837 | erot = 0.405212687948367 | epot = -15.2455069954416 | etot = -14.6175140350234 -397000 ekin = 0.237655698718666 | erot = 0.448360183483368 | epot = -15.3035299173201 | etot = -14.6175140351181 -398000 ekin = 0.250862154069819 | erot = 0.491439914330298 | epot = -15.3598161036023 | etot = -14.6175140352022 -399000 ekin = 0.261993055953367 | erot = 0.533437059171161 | epot = -15.4129441503973 | etot = -14.6175140352727 -400000 ekin = 0.27077655050685 | erot = 0.573417887950022 | epot = -15.4617084737844 | etot = -14.6175140353276 -401000 ekin = 0.277075831015552 | erot = 0.610562842824378 | epot = -15.505152709206 | etot = -14.6175140353661 -402000 ekin = 0.280882158891387 | erot = 0.644187798759806 | epot = -15.5425839930396 | etot = -14.6175140353885 -403000 ekin = 0.282301228578668 | erot = 0.673752968642337 | epot = -15.5735682326172 | etot = -14.6175140353962 -404000 ekin = 0.281534519811851 | erot = 0.698860907482421 | epot = -15.5979094626856 | etot = -14.6175140353913 -405000 ekin = 0.278857975736577 | erot = 0.719246574878491 | epot = -15.6156185859914 | etot = -14.6175140353763 -406000 ekin = 0.27460055575904 | erot = 0.734763157396981 | epot = -15.6268777485092 | etot = -14.6175140353531 -407000 ekin = 0.269124923358191 | erot = 0.745367259285135 | epot = -15.632006217967 | etot = -14.6175140353237 -408000 ekin = 0.262811853165513 | erot = 0.75110627666519 | epot = -15.6314321651198 | etot = -14.6175140352891 -409000 ekin = 0.256049112192014 | erot = 0.752109968276038 | epot = -15.6256731157183 | etot = -14.6175140352503 -410000 ekin = 0.249224269809724 | erot = 0.748584332259421 | epot = -15.6153226372766 | etot = -14.6175140352074 -411000 ekin = 0.242720888553515 | erot = 0.74080910391814 | epot = -15.6010440276324 | etot = -14.6175140351607 -412000 ekin = 0.236916379506249 | erot = 0.729136085380527 | epot = -15.5835664999973 | etot = -14.6175140351105 -413000 ekin = 0.232179735243875 | erot = 0.713985498456682 | epot = -15.5636792687578 | etot = -14.6175140350572 -414000 ekin = 0.228867632642529 | erot = 0.695838652585608 | epot = -15.5422203202303 | etot = -14.6175140350022 -415000 ekin = 0.227317772308198 | erot = 0.675225695396014 | epot = -15.5200575026511 | etot = -14.6175140349469 -416000 ekin = 0.227838940778005 | erot = 0.65270826110506 | epot = -15.4980612367768 | etot = -14.6175140348937 -417000 ekin = 0.23069797086734 | erot = 0.628857925336074 | epot = -15.4770699310485 | etot = -14.6175140348451 -418000 ekin = 0.236104416121177 | erot = 0.604232291329939 | epot = -15.4578507422545 | etot = -14.6175140348034 -419000 ekin = 0.244194252200936 | erot = 0.579351108945467 | epot = -15.4410593959176 | etot = -14.6175140347712 -420000 ekin = 0.255014214169025 | erot = 0.554674986841681 | epot = -15.427203235761 | etot = -14.6175140347503 -421000 ekin = 0.268508458340867 | erot = 0.530589008737006 | epot = -15.4166115018197 | etot = -14.6175140347419 -422000 ekin = 0.284509119561056 | erot = 0.507392982381358 | epot = -15.4094161366888 | etot = -14.6175140347464 -423000 ekin = 0.302732060427453 | erot = 0.485299248119848 | epot = -15.4055453433108 | etot = -14.6175140347635 -424000 ekin = 0.322778728051846 | erot = 0.464438075671392 | epot = -15.4047308385151 | etot = -14.6175140347918 -425000 ekin = 0.344144594922978 | erot = 0.444869796713037 | epot = -15.4065284264654 | etot = -14.6175140348294 -426000 ekin = 0.366234204300236 | erot = 0.426602052984558 | epot = -15.4103502921584 | etot = -14.6175140348736 -427000 ekin = 0.388382398339839 | erot = 0.409609962240785 | epot = -15.4155063955021 | etot = -14.6175140349215 -428000 ekin = 0.409880900047347 | erot = 0.393856678092514 | epot = -15.4212516131098 | etot = -14.61751403497 -429000 ekin = 0.430009061106081 | erot = 0.379311788382045 | epot = -15.4268348845042 | etot = -14.617514035016 -430000 ekin = 0.448067283635938 | erot = 0.365965282400769 | epot = -15.4315466010937 | etot = -14.617514035057 -431000 ekin = 0.463411378722709 | erot = 0.353835411175237 | epot = -15.4347608249887 | etot = -14.6175140350907 -432000 ekin = 0.47548594153415 | erot = 0.342969616703567 | epot = -15.4359695933534 | etot = -14.6175140351157 -433000 ekin = 0.483854704019995 | erot = 0.333438714396017 | epot = -15.4348074535468 | etot = -14.6175140351308 -434000 ekin = 0.488225698517989 | erot = 0.325325491781988 | epot = -15.4310652254358 | etot = -14.6175140351358 -435000 ekin = 0.488469615216989 | erot = 0.318709988965469 | epot = -15.4246936393136 | etot = -14.6175140351312 -436000 ekin = 0.48462910079659 | erot = 0.313653867974335 | epot = -15.4157970038886 | etot = -14.6175140351176 -437000 ekin = 0.476917712283315 | erot = 0.310186654190433 | epot = -15.4046184015705 | etot = -14.6175140350967 -438000 ekin = 0.465707830234525 | erot = 0.308296241622533 | epot = -15.3915181069269 | etot = -14.6175140350699 -439000 ekin = 0.451507536799582 | erot = 0.307925153770196 | epot = -15.376946725609 | etot = -14.6175140350392 -440000 ekin = 0.434927659012326 | erot = 0.308973010492473 | epot = -15.3614147045113 | etot = -14.6175140350065 -441000 ekin = 0.416641657348227 | erot = 0.311304747383323 | epot = -15.3454604397054 | etot = -14.6175140349739 -442000 ekin = 0.397341542599983 | erot = 0.3147626187362 | epot = -15.3296181962795 | etot = -14.6175140349433 -443000 ekin = 0.377694362714098 | erot = 0.319179725729427 | epot = -15.3143881233596 | etot = -14.6175140349161 -444000 ekin = 0.358304425135514 | erot = 0.324393298190365 | epot = -15.3002117582193 | etot = -14.6175140348935 -445000 ekin = 0.339684383333994 | erot = 0.330254911560057 | epot = -15.2874533297702 | etot = -14.6175140348761 -446000 ekin = 0.322237701350787 | erot = 0.336636009508874 | epot = -15.276387745724 | etot = -14.6175140348643 -447000 ekin = 0.306253086582787 | erot = 0.343428242758822 | epot = -15.2671953641996 | etot = -14.617514034858 -448000 ekin = 0.291909091343146 | erot = 0.350538602021414 | epot = -15.2599617282214 | etot = -14.6175140348569 -449000 ekin = 0.279285717663623 | erot = 0.35788026308961 | epot = -15.2546800156141 | etot = -14.6175140348608 -450000 ekin = 0.268379332693062 | erot = 0.365360767817965 | epot = -15.2512541353807 | etot = -14.6175140348697 -451000 ekin = 0.259117719162389 | erot = 0.372869677561009 | epot = -15.2495014316067 | etot = -14.6175140348833 -452000 ekin = 0.251373384973236 | erot = 0.380268095671436 | epot = -15.2491555155464 | etot = -14.6175140349017 -453000 ekin = 0.244974824127414 | erot = 0.387382402365197 | epot = -15.249871261417 | etot = -14.6175140349243 -454000 ekin = 0.239716691076083 | erot = 0.39400413186188 | epot = -15.2512348578882 | etot = -14.6175140349502 -455000 ekin = 0.235370413814051 | erot = 0.399897145642462 | epot = -15.2527815944342 | etot = -14.6175140349777 -456000 ekin = 0.231696513790449 | erot = 0.40481218842498 | epot = -15.2540227372201 | etot = -14.6175140350047 -457000 ekin = 0.228459014431981 | erot = 0.40850770951526 | epot = -15.2544807589758 | etot = -14.6175140350286 -458000 ekin = 0.225441196082345 | erot = 0.410774705624049 | epot = -15.2537299367533 | etot = -14.6175140350469 -459000 ekin = 0.222461018940529 | erot = 0.411462514811891 | epot = -15.2514375688097 | etot = -14.6175140350572 -460000 ekin = 0.219384094438522 | erot = 0.410502136529 | epot = -15.2474002660254 | etot = -14.6175140350579 -461000 ekin = 0.216132245240083 | erot = 0.40792384413244 | epot = -15.2415701244207 | etot = -14.6175140350482 -462000 ekin = 0.212686361973293 | erot = 0.403866554423589 | epot = -15.2340669514251 | etot = -14.6175140350283 -463000 ekin = 0.209083218482802 | erot = 0.398577486489706 | epot = -15.2251747399718 | etot = -14.6175140349993 -464000 ekin = 0.205406888263705 | erot = 0.392401883856904 | epot = -15.2153228070839 | etot = -14.6175140349633 -465000 ekin = 0.201776197881055 | erot = 0.385763783461981 | epot = -15.205054016266 | etot = -14.617514034923 -466000 ekin = 0.198330130961163 | erot = 0.379139817336875 | epot = -15.1949839831792 | etot = -14.6175140348812 -467000 ekin = 0.195213224017084 | erot = 0.373028711257248 | epot = -15.1857559701149 | etot = -14.6175140348406 -468000 ekin = 0.192562810062079 | erot = 0.367919448414624 | epot = -15.1779962932805 | etot = -14.6175140348038 -469000 ekin = 0.190499545154634 | erot = 0.364261004085315 | epot = -15.1722745840127 | etot = -14.6175140347728 -470000 ekin = 0.189122086032537 | erot = 0.362436180586744 | epot = -15.1690723013681 | etot = -14.6175140347488 -471000 ekin = 0.188506156938585 | erot = 0.362741456207124 | epot = -15.1687616478783 | etot = -14.6175140347325 -472000 ekin = 0.188707621222025 | erot = 0.365373993438314 | epot = -15.1715956493842 | etot = -14.6175140347239 -473000 ekin = 0.189768618621823 | erot = 0.370426120543997 | epot = -15.1777087738881 | etot = -14.6175140347222 -474000 ekin = 0.191725397341228 | erot = 0.377886798112909 | epot = -15.1871262301805 | etot = -14.6175140347264 -475000 ekin = 0.194616213070748 | erot = 0.387648901412907 | epot = -15.1997791492191 | etot = -14.6175140347355 -476000 ekin = 0.19848763616064 | erot = 0.39952067815615 | epot = -15.2155223490651 | etot = -14.6175140347483 -477000 ekin = 0.203397790429832 | erot = 0.413239540255182 | epot = -15.2341513654491 | etot = -14.6175140347641 -478000 ekin = 0.209415519783212 | erot = 0.428486466927375 | epot = -15.2554160214929 | etot = -14.6175140347823 -479000 ekin = 0.216615156594683 | erot = 0.444899686772466 | epot = -15.2790288781699 | etot = -14.6175140348028 -480000 ekin = 0.225067223157677 | erot = 0.462086880018489 | epot = -15.3046681380017 | etot = -14.6175140348255 -481000 ekin = 0.234826185147703 | erot = 0.479635803739713 | epot = -15.3319760237384 | etot = -14.617514034851 -482000 ekin = 0.245916939355107 | erot = 0.497123799838186 | epot = -15.3605547740726 | etot = -14.6175140348793 -483000 ekin = 0.258322039580648 | erot = 0.514126984881418 | epot = -15.3899630593725 | etot = -14.6175140349104 -484000 ekin = 0.27197166705463 | erot = 0.530229960568927 | epot = -15.4197156625676 | etot = -14.6175140349441 -485000 ekin = 0.286738030809397 | erot = 0.545036619609846 | epot = -15.4492886853987 | etot = -14.6175140349795 -486000 ekin = 0.302435294441744 | erot = 0.55818212519067 | epot = -15.4781314546478 | etot = -14.6175140350154 -487000 ekin = 0.31882536985775 | erot = 0.569345540302742 | epot = -15.5056849452109 | etot = -14.6175140350504 -488000 ekin = 0.33562912085568 | erot = 0.578262027782569 | epot = -15.531405183721 | etot = -14.6175140350828 -489000 ekin = 0.352541803824768 | erot = 0.584733173542191 | epot = -15.5547890124778 | etot = -14.6175140351108 -490000 ekin = 0.369251041132819 | erot = 0.588633902375943 | epot = -15.575398978642 | etot = -14.6175140351332 -491000 ekin = 0.38545533994301 | erot = 0.589914693969638 | epot = -15.5928840690618 | etot = -14.6175140351491 -492000 ekin = 0.400881156477994 | erot = 0.588598334680196 | epot = -15.6069935263164 | etot = -14.6175140351582 -493000 ekin = 0.41529674637658 | erot = 0.584771169136983 | epot = -15.6175819506742 | etot = -14.6175140351607 -494000 ekin = 0.42852150310201 | erot = 0.578569614095072 | epot = -15.6246051523544 | etot = -14.6175140351573 -495000 ekin = 0.440430011857935 | erot = 0.570163426567811 | epot = -15.6281074735753 | etot = -14.6175140351496 -496000 ekin = 0.45095070631601 | erot = 0.559737766476832 | epot = -15.6282025079316 | etot = -14.6175140351387 -497000 ekin = 0.460059581797609 | erot = 0.547476355485017 | epot = -15.6250499724091 | etot = -14.6175140351264 -498000 ekin = 0.467769906491902 | erot = 0.533547985554597 | epot = -15.6188319271606 | etot = -14.6175140351141 -499000 ekin = 0.474119221072851 | erot = 0.51809827733209 | epot = -15.6097315335077 | etot = -14.6175140351027 -500000 ekin = 0.47915510663515 | erot = 0.501247978936972 | epot = -15.5979171206651 | etot = -14.617514035093 -501000 ekin = 0.482921233339145 | erot = 0.48309830408219 | epot = -15.5835335725062 | etot = -14.6175140350848 -502000 ekin = 0.485445093649468 | erot = 0.463742920559152 | epot = -15.5667020492864 | etot = -14.6175140350778 -503000 ekin = 0.486728599210218 | erot = 0.443285305605287 | epot = -15.5475279398865 | etot = -14.617514035071 -504000 ekin = 0.486742408088666 | erot = 0.421859374631512 | epot = -15.5261158177833 | etot = -14.6175140350632 -505000 ekin = 0.485424480828576 | erot = 0.399650657767878 | epot = -15.5025891736495 | etot = -14.617514035053 -506000 ekin = 0.482682973412862 | erot = 0.376914939267073 | epot = -15.4771119477192 | etot = -14.6175140350392 -507000 ekin = 0.478403198155678 | erot = 0.353991273960951 | epot = -15.4499085071374 | etot = -14.6175140350208 -508000 ekin = 0.472458052936543 | erot = 0.331306710133899 | epot = -15.4212787980677 | etot = -14.6175140349973 -509000 ekin = 0.464721062856492 | erot = 0.309370883447797 | epot = -15.3916059812731 | etot = -14.6175140349688 -510000 ekin = 0.455081004105159 | erot = 0.288759823578861 | epot = -15.3613548626198 | etot = -14.6175140349358 -511000 ekin = 0.443456979181393 | erot = 0.270089690707588 | epot = -15.3310607047887 | etot = -14.6175140348997 -512000 ekin = 0.42981284822046 | erot = 0.253982534898902 | epot = -15.3013094179813 | etot = -14.6175140348619 -513000 ekin = 0.414169942619743 | erot = 0.241027258547542 | epot = -15.2727112359918 | etot = -14.6175140348246 -514000 ekin = 0.396617122320061 | erot = 0.231739657368506 | epot = -15.2458708144779 | etot = -14.6175140347893 -515000 ekin = 0.377317407139222 | erot = 0.226525548757325 | epot = -15.2213569906545 | etot = -14.6175140347579 -516000 ekin = 0.356510629533878 | erot = 0.225650587239722 | epot = -15.1996752515054 | etot = -14.6175140347318 -517000 ekin = 0.334511811731657 | erot = 0.2292195098864 | epot = -15.1812453563299 | etot = -14.6175140347119 -518000 ekin = 0.311705249159968 | erot = 0.237166415926506 | epot = -15.1663856997852 | etot = -14.6175140346987 -519000 ekin = 0.288534562405324 | erot = 0.249256456193412 | epot = -15.1553050532911 | etot = -14.6175140346924 -520000 ekin = 0.265489234982117 | erot = 0.265098165450665 | epot = -15.1481014351253 | etot = -14.6175140346926 -521000 ekin = 0.243088358087376 | erot = 0.28416474515935 | epot = -15.1447671379453 | etot = -14.6175140346986 -522000 ekin = 0.221862437060409 | erot = 0.305821970139557 | epot = -15.1451984419098 | etot = -14.6175140347099 -523000 ekin = 0.202334169775844 | erot = 0.329360070796281 | epot = -15.1492082752976 | etot = -14.6175140347255 -524000 ekin = 0.18499909107587 | erot = 0.354026911469942 | epot = -15.1565400372904 | etot = -14.6175140347446 -525000 ekin = 0.170306912739125 | erot = 0.379059948770509 | epot = -15.1668808962761 | etot = -14.6175140347665 -526000 ekin = 0.158644243148338 | erot = 0.403715126924459 | epot = -15.1798734048633 | etot = -14.6175140347905 -527000 ekin = 0.150319367666652 | erot = 0.427291025811595 | epot = -15.1951244282948 | etot = -14.6175140348166 -528000 ekin = 0.145549592055536 | erot = 0.449147424932796 | epot = -15.2122110518326 | etot = -14.6175140348442 -529000 ekin = 0.144451603985221 | erot = 0.468718121850073 | epot = -15.2306837607087 | etot = -14.6175140348734 -530000 ekin = 0.14703526713895 | erot = 0.485518371010905 | epot = -15.2500676730542 | etot = -14.6175140349043 -531000 ekin = 0.153201203685084 | erot = 0.499147835496798 | epot = -15.2698630741185 | etot = -14.6175140349366 -532000 ekin = 0.162742448480689 | erot = 0.509290301682419 | epot = -15.2895467851334 | etot = -14.6175140349703 -533000 ekin = 0.175350354883052 | erot = 0.515711587206659 | epot = -15.3085759770945 | etot = -14.6175140350048 -534000 ekin = 0.190624856014791 | erot = 0.518257146630773 | epot = -15.3263960376849 | etot = -14.6175140350393 -535000 ekin = 0.2080884935382 | erot = 0.516850140105121 | epot = -15.342452668716 | etot = -14.6175140350727 -536000 ekin = 0.227204325844129 | erot = 0.511491240066285 | epot = -15.356209601014 | etot = -14.6175140351035 -537000 ekin = 0.247396768814447 | erot = 0.502260311074919 | epot = -15.3671711150196 | etot = -14.6175140351302 -538000 ekin = 0.268074342414832 | erot = 0.489319600962367 | epot = -15.374907978528 | etot = -14.6175140351508 -539000 ekin = 0.288653182934819 | erot = 0.472917679673217 | epot = -15.3790848977717 | etot = -14.6175140351637 -540000 ekin = 0.308579985827036 | erot = 0.453392904740712 | epot = -15.3794869257353 | etot = -14.6175140351676 -541000 ekin = 0.32735300819234 | erot = 0.431174973012169 | epot = -15.3760420163656 | etot = -14.6175140351611 -542000 ekin = 0.344539853507862 | erot = 0.406783142890278 | epot = -15.368837031542 | etot = -14.6175140351439 -543000 ekin = 0.359790986514659 | erot = 0.380819988065077 | epot = -15.3581250096959 | etot = -14.6175140351161 -544000 ekin = 0.372848263091261 | erot = 0.353960030673725 | epot = -15.3443223288437 | etot = -14.6175140350787 -545000 ekin = 0.383548167009949 | erot = 0.326933212483018 | epot = -15.3279954145262 | etot = -14.6175140350332 -546000 ekin = 0.391819867385597 | erot = 0.30050378423916 | epot = -15.3098376866063 | etot = -14.6175140349815 -547000 ekin = 0.397678590181961 | erot = 0.275445713888184 | epot = -15.2906383389964 | etot = -14.6175140349263 -548000 ekin = 0.401215088504123 | erot = 0.252516050367 | epot = -15.2712451737411 | etot = -14.6175140348699 -549000 ekin = 0.402582175511822 | erot = 0.232427794768509 | epot = -15.2525240050958 | etot = -14.6175140348155 -550000 ekin = 0.401979352686767 | erot = 0.215823740833757 | epot = -15.2353171282858 | etot = -14.6175140347652 -551000 ekin = 0.399636550192594 | erot = 0.203252510910356 | epot = -15.2204030958242 | etot = -14.6175140347213 -552000 ekin = 0.39579793483933 | erot = 0.19514771457426 | epot = -15.2084596840996 | etot = -14.617514034686 -553000 ekin = 0.390706676474511 | erot = 0.191810879117678 | epot = -15.2000315902533 | etot = -14.6175140346611 -554000 ekin = 0.384591526956334 | erot = 0.193398609454572 | epot = -15.1955041710586 | etot = -14.6175140346477 -555000 ekin = 0.37765606833088 | erot = 0.19991436289407 | epot = -15.1950844658717 | etot = -14.6175140346467 -556000 ekin = 0.370071512613894 | erot = 0.211205266307038 | epot = -15.1987908135787 | etot = -14.6175140346578 -557000 ekin = 0.361973939271072 | erot = 0.22696451510277 | epot = -15.2064524890543 | etot = -14.6175140346805 -558000 ekin = 0.353466765019157 | erot = 0.246739996101886 | epot = -15.2177207958342 | etot = -14.6175140347132 -559000 ekin = 0.344628961763677 | erot = 0.269949765670226 | epot = -15.2320927621875 | etot = -14.6175140347536 -560000 ekin = 0.335528980566657 | erot = 0.295904778795777 | epot = -15.2489477941611 | etot = -14.6175140347987 -561000 ekin = 0.326243446080443 | erot = 0.323838714908469 | epot = -15.2675961958334 | etot = -14.6175140348445 -562000 ekin = 0.31687848681263 | erot = 0.35294385755285 | epot = -15.2873363792525 | etot = -14.617514034887 -563000 ekin = 0.307590234581101 | erot = 0.382410843957197 | epot = -15.3075151134611 | etot = -14.6175140349228 -564000 ekin = 0.298599911427017 | erot = 0.411468934029061 | epot = -15.3275828804049 | etot = -14.6175140349488 -565000 ekin = 0.290198521501092 | erot = 0.439422606477171 | epot = -15.3471351629423 | etot = -14.617514034964 -566000 ekin = 0.282736992095573 | erot = 0.46568015891933 | epot = -15.365931185984 | etot = -14.6175140349691 -567000 ekin = 0.276599956454062 | erot = 0.489770841522339 | epot = -15.3838848329429 | etot = -14.6175140349665 -568000 ekin = 0.272165052790826 | erot = 0.511348887820125 | epot = -15.4010279755712 | etot = -14.6175140349602 -569000 ekin = 0.269753809413461 | erot = 0.530185258476706 | epot = -15.4174531028449 | etot = -14.6175140349547 -570000 ekin = 0.269583567607582 | erot = 0.546150320474166 | epot = -15.4332479230358 | etot = -14.617514034954 -571000 ekin = 0.271731068578169 | erot = 0.559192265325146 | epot = -15.4484373688639 | etot = -14.6175140349606 -572000 ekin = 0.27611649568743 | erot = 0.569316321633573 | epot = -15.4629468522957 | etot = -14.6175140349747 -573000 ekin = 0.282512256444883 | erot = 0.576569321997748 | epot = -15.4765956134373 | etot = -14.6175140349947 -574000 ekin = 0.290574483947772 | erot = 0.581030490761115 | epot = -15.4891190097262 | etot = -14.6175140350173 -575000 ekin = 0.299890113326873 | erot = 0.582808418137228 | epot = -15.5002125665028 | etot = -14.6175140350387 -576000 ekin = 0.310029076131071 | erot = 0.582041678954515 | epot = -15.5095847901411 | etot = -14.6175140350555 -577000 ekin = 0.320591144135804 | erot = 0.578899817193121 | epot = -15.5170049963945 | etot = -14.6175140350656 -578000 ekin = 0.331239680817777 | erot = 0.573581904321184 | epot = -15.5223356202071 | etot = -14.6175140350681 -579000 ekin = 0.341718767395671 | erot = 0.566311213814667 | epot = -15.5255440162741 | etot = -14.6175140350637 -580000 ekin = 0.351854361646072 | erot = 0.557326170820678 | epot = -15.5266945675208 | etot = -14.6175140350541 -581000 ekin = 0.361543170719775 | erot = 0.54686904311153 | epot = -15.5259262488726 | etot = -14.6175140350413 -582000 ekin = 0.370734291431498 | erot = 0.535174473618245 | epot = -15.5234228000773 | etot = -14.6175140350275 -583000 ekin = 0.37940854514609 | erot = 0.522459863754552 | epot = -15.5193824439152 | etot = -14.6175140350145 -584000 ekin = 0.38755933833177 | erot = 0.50891899994006 | epot = -15.5139923732754 | etot = -14.6175140350036 -585000 ekin = 0.395177418309126 | erot = 0.494719483695348 | epot = -15.5074109369997 | etot = -14.6175140349952 -586000 ekin = 0.402240533516271 | erot = 0.480003760425467 | epot = -15.4997583289313 | etot = -14.6175140349896 -587000 ekin = 0.408707997144929 | erot = 0.464893014295021 | epot = -15.4911150464262 | etot = -14.6175140349863 -588000 ekin = 0.414519545772604 | erot = 0.449492951761529 | epot = -15.4815265325189 | etot = -14.6175140349848 -589000 ekin = 0.419597612554971 | erot = 0.433900487906506 | epot = -15.4710121354457 | etot = -14.6175140349842 -590000 ekin = 0.423852083806182 | erot = 0.418210489544302 | epot = -15.4595766083342 | etot = -14.6175140349837 -591000 ekin = 0.42718667151707 | erot = 0.402521929659384 | epot = -15.4472226361591 | etot = -14.6175140349827 -592000 ekin = 0.429506137373247 | erot = 0.386943005730352 | epot = -15.4339631780839 | etot = -14.6175140349803 -593000 ekin = 0.430723706116147 | erot = 0.371594936610811 | epot = -15.4198326777029 | etot = -14.617514034976 -594000 ekin = 0.430768094953345 | erot = 0.356614269838259 | epot = -15.4048963997609 | etot = -14.6175140349693 -595000 ekin = 0.429589664829847 | erot = 0.342153609171636 | epot = -15.3892573089616 | etot = -14.6175140349601 -596000 ekin = 0.427165296133148 | erot = 0.328380718542492 | epot = -15.3730600496239 | etot = -14.6175140349483 -597000 ekin = 0.42350165849966 | erot = 0.315475989403582 | epot = -15.3564916828373 | etot = -14.6175140349341 -598000 ekin = 0.418636501255305 | erot = 0.303628359581859 | epot = -15.339778895755 | etot = -14.6175140349179 -599000 ekin = 0.412638207582272 | erot = 0.293029673723798 | epot = -15.3231819162063 | etot = -14.6175140349002 -600000 ekin = 0.405603414753522 | erot = 0.28386763722636 | epot = -15.3069850868619 | etot = -14.617514034882 -601000 ekin = 0.397652939448492 | erot = 0.276317573361084 | epot = -15.2914845476736 | etot = -14.617514034864 -602000 ekin = 0.388926339151588 | erot = 0.270533300128844 | epot = -15.2769736741277 | etot = -14.6175140348473 -603000 ekin = 0.379575547710976 | erot = 0.266637582798786 | epot = -15.2637271653425 | etot = -14.6175140348328 -604000 ekin = 0.369758112224373 | erot = 0.264712769809576 | epot = -15.2519849168554 | etot = -14.6175140348215 -605000 ekin = 0.35963061496451 | erot = 0.264792359550224 | epot = -15.2419370093288 | etot = -14.6175140348141 -606000 ekin = 0.349342882571248 | erot = 0.266854337886836 | epot = -15.2337112552692 | etot = -14.6175140348112 -607000 ekin = 0.339033558751512 | erot = 0.270817131627415 | epot = -15.2273647251918 | etot = -14.6175140348128 -608000 ekin = 0.32882753825937 | erot = 0.276538908097057 | epot = -15.2228804811754 | etot = -14.617514034819 -609000 ekin = 0.318835621087622 | erot = 0.283820700144174 | epot = -15.2201703560608 | etot = -14.617514034829 -610000 ekin = 0.309156542568317 | erot = 0.292413461055651 | epot = -15.219084038466 | etot = -14.617514034842 -611000 ekin = 0.299881272108214 | erot = 0.302028697869802 | epot = -15.2194240048347 | etot = -14.6175140348566 -612000 ekin = 0.291099167856268 | erot = 0.312351863789569 | epot = -15.2209650665173 | etot = -14.6175140348715 -613000 ekin = 0.282905257831642 | erot = 0.323057294042038 | epot = -15.2234765867589 | etot = -14.6175140348852 -614000 ekin = 0.275407632339941 | erot = 0.333823223652897 | epot = -15.2267448908892 | etot = -14.6175140348963 -615000 ekin = 0.26873372556727 | erot = 0.344345386320857 | epot = -15.2305931467922 | etot = -14.6175140349041 -616000 ekin = 0.263034181136603 | erot = 0.354347879927045 | epot = -15.2348960959716 | etot = -14.617514034908 -617000 ekin = 0.258483071857928 | erot = 0.363590372787296 | epot = -15.2395874795532 | etot = -14.617514034908 -618000 ekin = 0.255273496413749 | erot = 0.371871254538884 | epot = -15.2446587858574 | etot = -14.6175140349047 -619000 ekin = 0.253608004174875 | erot = 0.379026921287401 | epot = -15.2501489603618 | etot = -14.6175140348996 -620000 ekin = 0.253683881422301 | erot = 0.384927934514049 | epot = -15.2561258508302 | etot = -14.6175140348939 -621000 ekin = 0.255674023710173 | erot = 0.389473226072584 | epot = -15.2626612846724 | etot = -14.6175140348896 -622000 ekin = 0.25970485336799 | erot = 0.392583779640473 | epot = -15.269802667897 | etot = -14.6175140348886 -623000 ekin = 0.265833429999859 | erot = 0.394197274406549 | epot = -15.2775447392987 | etot = -14.6175140348923 -624000 ekin = 0.274026439188702 | erot = 0.394265031625425 | epot = -15.2858055057161 | etot = -14.6175140349019 -625000 ekin = 0.28414401573885 | erot = 0.392752285177019 | epot = -15.2944103358336 | etot = -14.6175140349177 -626000 ekin = 0.295931256226573 | erot = 0.389642344381245 | epot = -15.303087635547 | etot = -14.6175140349392 -627000 ekin = 0.309019727830035 | erot = 0.384944676505037 | epot = -15.3114784393 | etot = -14.6175140349649 -628000 ekin = 0.322940275279346 | erot = 0.378706350960174 | epot = -15.3191606612318 | etot = -14.6175140349923 -629000 ekin = 0.337147043698441 | erot = 0.371025698974895 | epot = -15.3256867776918 | etot = -14.6175140350184 -630000 ekin = 0.351051052995002 | erot = 0.362066500827022 | epot = -15.330631588862 | etot = -14.61751403504 -631000 ekin = 0.364060148818953 | erot = 0.352070586246035 | epot = -15.3336447701185 | etot = -14.6175140350535 -632000 ekin = 0.375621025661416 | erot = 0.341366514681189 | epot = -15.334501575399 | etot = -14.6175140350563 -633000 ekin = 0.385258541224309 | erot = 0.330372092305621 | epot = -15.3331446685767 | etot = -14.6175140350468 -634000 ekin = 0.392607865616072 | erot = 0.319588956493667 | epot = -15.329710857134 | etot = -14.6175140350243 -635000 ekin = 0.397436097277817 | erot = 0.309588318033289 | epot = -15.3245384503008 | etot = -14.6175140349897 -636000 ekin = 0.399651602684335 | erot = 0.300988094378234 | epot = -15.3181537320079 | etot = -14.6175140349453 -637000 ekin = 0.399301141331978 | erot = 0.294422893568735 | epot = -15.3112380697947 | etot = -14.617514034894 -638000 ekin = 0.396556439146157 | erot = 0.290509369489293 | epot = -15.3045798434752 | etot = -14.6175140348397 -639000 ekin = 0.391692975512685 | erot = 0.289810143796979 | epot = -15.2990171540957 | etot = -14.6175140347861 -640000 ekin = 0.385064212932825 | erot = 0.29279965311316 | epot = -15.2953779007829 | etot = -14.6175140347369 -641000 ekin = 0.377074355549984 | erot = 0.299834934662478 | epot = -15.2944233249076 | etot = -14.6175140346951 -642000 ekin = 0.368152133960252 | erot = 0.311133625025682 | epot = -15.2967997936491 | etot = -14.6175140346632 -643000 ekin = 0.35872729827394 | erot = 0.326760494743215 | epot = -15.3030018276596 | etot = -14.6175140346425 -644000 ekin = 0.349210670242454 | erot = 0.346622862553666 | epot = -15.3133475674301 | etot = -14.6175140346339 -645000 ekin = 0.339977915473995 | erot = 0.370474376279531 | epot = -15.3279663263912 | etot = -14.6175140346376 -646000 ekin = 0.331356734048571 | erot = 0.397926004728945 | epot = -15.3467967734306 | etot = -14.6175140346531 -647000 ekin = 0.323616951061498 | erot = 0.428462692621698 | epot = -15.3695936783626 | etot = -14.6175140346794 -648000 ekin = 0.316962984679426 | erot = 0.461463981263885 | epot = -15.395941000659 | etot = -14.6175140347157 -649000 ekin = 0.311528303721651 | erot = 0.496226945505972 | epot = -15.4252692839882 | etot = -14.6175140347606 -650000 ekin = 0.307371814502134 | erot = 0.531990113311391 | epot = -15.4568759626263 | etot = -14.6175140348127 -651000 ekin = 0.304476169211803 | erot = 0.567957247022998 | epot = -15.4899474511054 | etot = -14.6175140348706 -652000 ekin = 0.302748327843514 | erot = 0.603320352538697 | epot = -15.5235827153148 | etot = -14.6175140349326 -653000 ekin = 0.302022769690169 | erot = 0.637281675063339 | epot = -15.5568184797505 | etot = -14.617514034997 -654000 ekin = 0.302067723594894 | erot = 0.669074745115614 | epot = -15.5886565037725 | etot = -14.617514035062 -655000 ekin = 0.30259467177562 | erot = 0.697984728109731 | epot = -15.6180934350106 | etot = -14.6175140351253 -656000 ekin = 0.30327116127458 | erot = 0.723368330431443 | epot = -15.6441535268905 | etot = -14.6175140351845 -657000 ekin = 0.303736663271753 | erot = 0.744673311811842 | epot = -15.665924010321 | etot = -14.6175140352374 -658000 ekin = 0.303620889263354 | erot = 0.761457272709825 | epot = -15.6825921972547 | etot = -14.6175140352815 -659000 ekin = 0.302563666908929 | erot = 0.773404945480537 | epot = -15.6934826477038 | etot = -14.6175140353143 -660000 ekin = 0.300235395695977 | erot = 0.780343280385416 | epot = -15.6980927114156 | etot = -14.6175140353342 -661000 ekin = 0.2963557105327 | erot = 0.782250083092817 | epot = -15.6961198289653 | etot = -14.6175140353398 -662000 ekin = 0.290710478297869 | erot = 0.779257959177475 | epot = -15.6874824728057 | etot = -14.6175140353303 -663000 ekin = 0.283165147464189 | erot = 0.771650651991606 | epot = -15.672329834762 | etot = -14.6175140353062 -664000 ekin = 0.27367342717685 | erot = 0.75985056245593 | epot = -15.6510380249012 | etot = -14.6175140352684 -665000 ekin = 0.262280913452633 | erot = 0.744397727319261 | epot = -15.6241926759909 | etot = -14.617514035219 -666000 ekin = 0.249123647022576 | erot = 0.725921231745041 | epot = -15.5925589139283 | etot = -14.6175140351607 -667000 ekin = 0.234422061210095 | erot = 0.705104954965518 | epot = -15.5570410512721 | etot = -14.6175140350965 -668000 ekin = 0.218471158369142 | erot = 0.682650243125394 | epot = -15.5186354365242 | etot = -14.6175140350297 -669000 ekin = 0.201627981911554 | erot = 0.659238455807285 | epot = -15.4783804726821 | etot = -14.6175140349633 -670000 ekin = 0.184297501938695 | erot = 0.635496303881749 | epot = -15.4373078407206 | etot = -14.6175140349002 -671000 ekin = 0.166917915804586 | erot = 0.611966525748987 | epot = -15.3963984763963 | etot = -14.6175140348427 -672000 ekin = 0.149946120673763 | erot = 0.589085832362546 | epot = -15.3565459878289 | etot = -14.6175140347926 -673000 ekin = 0.133843801904168 | erot = 0.567171306813735 | epot = -15.3185291434688 | etot = -14.6175140347509 -674000 ekin = 0.119064262674211 | erot = 0.546415679822031 | epot = -15.2829939772145 | etot = -14.6175140347182 -675000 ekin = 0.106039855016797 | erot = 0.526891195483695 | epot = -15.250445085195 | etot = -14.6175140346945 -676000 ekin = 0.0951697078771964 | erot = 0.508561175679673 | epot = -15.2212449182363 | etot = -14.6175140346794 -677000 ekin = 0.0868074519861108 | erot = 0.491297978911151 | epot = -15.1956194655695 | etot = -14.6175140346723 -678000 ekin = 0.0812485969713162 | erot = 0.47490530110032 | epot = -15.173667932744 | etot = -14.6175140346723 -679000 ekin = 0.0787177619801643 | erot = 0.459143233465844 | epot = -15.1553750301248 | etot = -14.6175140346788 -680000 ekin = 0.079356202465094 | erot = 0.443753980650321 | epot = -15.1406242178063 | etot = -14.6175140346909 -681000 ekin = 0.0832104900793129 | erot = 0.428486254342671 | epot = -15.1292107791298 | etot = -14.6175140347078 -682000 ekin = 0.0902236865228784 | erot = 0.41311688093406 | epot = -15.1208546021859 | etot = -14.617514034729 -683000 ekin = 0.100230543462783 | erot = 0.397468585264983 | epot = -15.1152131634811 | etot = -14.6175140347533 -684000 ekin = 0.112958164259223 | erot = 0.38142345901904 | epot = -15.1118956580582 | etot = -14.61751403478 -685000 ekin = 0.128033094046448 | erot = 0.364932120277571 | epot = -15.1104792491317 | etot = -14.6175140348077 -686000 ekin = 0.144995008361815 | erot = 0.348018922992721 | epot = -15.1105279661897 | etot = -14.6175140348351 -687000 ekin = 0.163316207854869 | erot = 0.330783730220898 | epot = -15.1116139729366 | etot = -14.6175140348608 -688000 ekin = 0.18242523421552 | erot = 0.313400732953528 | epot = -15.1133400020522 | etot = -14.6175140348832 -689000 ekin = 0.201732335852404 | erot = 0.296114640200911 | epot = -15.1153610109544 | etot = -14.6175140349011 -690000 ekin = 0.220654383890837 | erot = 0.2792343742397 | epot = -15.1174027930443 | etot = -14.6175140349138 -691000 ekin = 0.238637189924079 | erot = 0.263124260135935 | epot = -15.1192754849806 | etot = -14.6175140349206 -692000 ekin = 0.255173895595862 | erot = 0.248192653896372 | epot = -15.120880584414 | etot = -14.6175140349217 -693000 ekin = 0.269818995117389 | erot = 0.23487802400786 | epot = -15.1222110540428 | etot = -14.6175140349175 -694000 ekin = 0.282198402188406 | erot = 0.223632668705058 | epot = -15.1233451058024 | etot = -14.6175140349089 -695000 ekin = 0.292016609392508 | erot = 0.214904477347547 | epot = -15.1244351216369 | etot = -14.6175140348968 -696000 ekin = 0.299062308190414 | erot = 0.209117382946464 | epot = -15.125693726019 | etot = -14.6175140348821 -697000 ekin = 0.303213809971508 | erot = 0.20665136156702 | epot = -15.1273792064044 | etot = -14.6175140348658 -698000 ekin = 0.304445256191661 | erot = 0.207822979228463 | epot = -15.1297822702686 | etot = -14.6175140348484 -699000 ekin = 0.302833983904557 | erot = 0.212867544423975 | epot = -15.133215563159 | etot = -14.6175140348305 -700000 ekin = 0.298568596343091 | erot = 0.221923881122192 | epot = -15.1380065122771 | etot = -14.6175140348118 -701000 ekin = 0.291956369738192 | erot = 0.235022588975887 | epot = -15.1444929935065 | etot = -14.6175140347924 -702000 ekin = 0.283427734153971 | erot = 0.252078414120766 | epot = -15.1530201830474 | etot = -14.6175140347727 -703000 ekin = 0.273534855577063 | erot = 0.272887068860917 | epot = -15.1639359591908 | etot = -14.6175140347528 -704000 ekin = 0.262941046164718 | erot = 0.297126498876258 | epot = -15.1775815797747 | etot = -14.6175140347337 -705000 ekin = 0.252398060444993 | erot = 0.324362359960494 | epot = -15.1942744551228 | etot = -14.6175140347173 -706000 ekin = 0.242709489752809 | erot = 0.35405734989386 | epot = -15.2142808743525 | etot = -14.6175140347058 -707000 ekin = 0.23468046525944 | erot = 0.385584073394854 | epot = -15.2377785733566 | etot = -14.6175140347023 -708000 ekin = 0.229056562326985 | erot = 0.418241319395694 | epot = -15.2648119164327 | etot = -14.61751403471 -709000 ekin = 0.226457657534062 | erot = 0.451273895784643 | epot = -15.2952455880503 | etot = -14.6175140347316 -710000 ekin = 0.227314828596047 | erot = 0.483896330832059 | epot = -15.3287251941968 | etot = -14.6175140347687 -711000 ekin = 0.231819479497758 | erot = 0.51532074217238 | epot = -15.3646542564917 | etot = -14.6175140348216 -712000 ekin = 0.239893150549453 | erot = 0.544788749313893 | epot = -15.4021959347515 | etot = -14.6175140348881 -713000 ekin = 0.251183758823612 | erot = 0.571606341189966 | epot = -15.4403041349782 | etot = -14.6175140349646 -714000 ekin = 0.265090036185669 | erot = 0.595179886373849 | epot = -15.4777839576048 | etot = -14.6175140350453 -715000 ekin = 0.280811306968513 | erot = 0.615050345045216 | epot = -15.5133756871376 | etot = -14.6175140351238 -716000 ekin = 0.297415784950172 | erot = 0.63092216570443 | epot = -15.5458519858484 | etot = -14.6175140351938 -717000 ekin = 0.313918116237496 | erot = 0.642683345317361 | epot = -15.5741154968044 | etot = -14.6175140352495 -718000 ekin = 0.329356373326515 | erot = 0.650413757300699 | epot = -15.597284165914 | etot = -14.6175140352868 -719000 ekin = 0.342860093483698 | erot = 0.654380316354833 | epot = -15.6147544451418 | etot = -14.6175140353033 -720000 ekin = 0.353703497402146 | erot = 0.655019233384794 | epot = -15.6262367660857 | etot = -14.6175140352987 -721000 ekin = 0.361340844904821 | erot = 0.652906431496425 | epot = -15.6317613116759 | etot = -14.6175140352746 -722000 ekin = 0.365423978940444 | erot = 0.648719378780955 | epot = -15.6316573929551 | etot = -14.6175140352337 -723000 ekin = 0.365803989071099 | erot = 0.643193727890457 | epot = -15.6265117521414 | etot = -14.6175140351799 -724000 ekin = 0.362520178744054 | erot = 0.637078359572984 | epot = -15.6171125734343 | etot = -14.6175140351172 -725000 ekin = 0.355779938479084 | erot = 0.631092082280464 | epot = -15.6043860558097 | etot = -14.6175140350502 -726000 ekin = 0.345932952940548 | erot = 0.625884613514222 | epot = -15.5893316014373 | etot = -14.6175140349826 -727000 ekin = 0.333442641404433 | erot = 0.622003743386452 | epot = -15.572960419709 | etot = -14.6175140349181 -728000 ekin = 0.31885705049608 | erot = 0.619869891937983 | epot = -15.5562409772938 | etot = -14.6175140348597 -729000 ekin = 0.30278072495631 | erot = 0.61975869169039 | epot = -15.5400534514564 | etot = -14.6175140348097 -730000 ekin = 0.285848455040377 | erot = 0.621791770571061 | epot = -15.5251542603808 | etot = -14.6175140347694 -731000 ekin = 0.26870127220438 | erot = 0.625935552811994 | epot = -15.5121508597562 | etot = -14.6175140347399 -732000 ekin = 0.251964649663544 | erot = 0.632007594592584 | epot = -15.5014862789777 | etot = -14.6175140347215 -733000 ekin = 0.236228569496369 | erot = 0.639689689353592 | epot = -15.4934322935641 | etot = -14.6175140347141 -734000 ekin = 0.2220289607466 | erot = 0.64854669871573 | epot = -15.4880896941798 | etot = -14.6175140347175 -735000 ekin = 0.209830023527896 | erot = 0.658049804518268 | epot = -15.4853938627768 | etot = -14.6175140347306 -736000 ekin = 0.20000716676131 | erot = 0.667602683400117 | epot = -15.4851238849144 | etot = -14.6175140347529 -737000 ekin = 0.192830719625365 | erot = 0.676569044421737 | epot = -15.4869137988309 | etot = -14.6175140347838 -738000 ekin = 0.188451200585985 | erot = 0.684300102138329 | epot = -15.4902653375465 | etot = -14.6175140348222 -739000 ekin = 0.186887639937117 | erot = 0.6901609006521 | epot = -15.4945625754563 | etot = -14.6175140348671 -740000 ekin = 0.18802106841102 | erot = 0.693554915035337 | epot = -15.4990900183636 | etot = -14.6175140349173 -741000 ekin = 0.191595568995591 | erot = 0.693946922730827 | epot = -15.5030565266968 | etot = -14.6175140349704 -742000 ekin = 0.197228843628703 | erot = 0.690884208638806 | epot = -15.5056270872919 | etot = -14.6175140350244 -743000 ekin = 0.204433503637974 | erot = 0.684016821527692 | epot = -15.5059643602413 | etot = -14.6175140350756 -744000 ekin = 0.212648433381792 | erot = 0.673116668202608 | epot = -15.503279136705 | etot = -14.6175140351206 -745000 ekin = 0.221277722248228 | erot = 0.658094727364962 | epot = -15.4968864847688 | etot = -14.6175140351556 -746000 ekin = 0.229733012317398 | erot = 0.639014583780834 | epot = -15.4862616312757 | etot = -14.6175140351775 -747000 ekin = 0.23747404414407 | erot = 0.616100096672176 | epot = -15.4710881760002 | etot = -14.6175140351839 -748000 ekin = 0.244042266762415 | erot = 0.589734872786552 | epot = -15.4512911747231 | etot = -14.6175140351741 -749000 ekin = 0.249083597952522 | erot = 0.560451518402465 | epot = -15.4270491515038 | etot = -14.6175140351488 -750000 ekin = 0.25235833014632 | erot = 0.528910066810374 | epot = -15.3987824320668 | etot = -14.6175140351102 -751000 ekin = 0.253738423480709 | erot = 0.495866496253692 | epot = -15.3671189547962 | etot = -14.6175140350618 -752000 ekin = 0.253194394014668 | erot = 0.462133785332355 | epot = -15.3328422143545 | etot = -14.6175140350075 -753000 ekin = 0.250775308154698 | erot = 0.428539072349797 | epot = -15.2968284154564 | etot = -14.6175140349519 -754000 ekin = 0.246585878545855 | erot = 0.395880964578259 | epot = -15.2599808780229 | etot = -14.6175140348988 -755000 ekin = 0.240764398112151 | erot = 0.364890850085332 | epot = -15.2231692830489 | etot = -14.6175140348514 -756000 ekin = 0.233464471042371 | erot = 0.33620133003052 | epot = -15.1871798358848 | etot = -14.6175140348119 -757000 ekin = 0.224842467157428 | erot = 0.310323830730607 | epot = -15.1526803326694 | etot = -14.6175140347814 -758000 ekin = 0.215051562420606 | erot = 0.287636293953365 | epot = -15.1202018911339 | etot = -14.61751403476 -759000 ekin = 0.204242275875609 | erot = 0.268380753510832 | epot = -15.090137064133 | etot = -14.6175140347465 -760000 ekin = 0.192568636064991 | erot = 0.252669695564108 | epot = -15.0627523663688 | etot = -14.6175140347397 -761000 ekin = 0.180198520175589 | erot = 0.240499428913179 | epot = -15.038211983826 | etot = -14.6175140347373 -762000 ekin = 0.167326299029085 | erot = 0.231768292969539 | epot = -15.0166086267357 | etot = -14.617514034737 -763000 ekin = 0.15418568590204 | erot = 0.226297425418118 | epot = -14.997997146057 | etot = -14.6175140347368 -764000 ekin = 0.141060632749147 | erot = 0.223852003350697 | epot = -14.9824266708347 | etot = -14.6175140347349 -765000 ekin = 0.128292252297103 | erot = 0.224161332820243 | epot = -14.9699676198474 | etot = -14.61751403473 -766000 ekin = 0.116280064488639 | erot = 0.226936813025351 | epot = -14.9607309122354 | etot = -14.6175140347214 -767000 ekin = 0.105476340627594 | erot = 0.231887507272404 | epot = -14.9548778826094 | etot = -14.6175140347094 -768000 ekin = 0.0963728909465988 | erot = 0.23873364134698 | epot = -14.952620566988 | etot = -14.6175140346944 -769000 ekin = 0.0894802427438104 | erot = 0.247218655410706 | epot = -14.9542129328319 | etot = -14.6175140346774 -770000 ekin = 0.0852997361098734 | erot = 0.257120353609604 | epot = -14.9599341243794 | etot = -14.6175140346599 -771000 ekin = 0.0842896183574806 | erot = 0.268261228609983 | epot = -14.9700648816113 | etot = -14.6175140346438 -772000 ekin = 0.0868267987479503 | erot = 0.280517313420827 | epot = -14.9848581468001 | etot = -14.6175140346313 -773000 ekin = 0.0931666172479738 | erot = 0.29382416266062 | epot = -15.0045048145334 | etot = -14.6175140346248 -774000 ekin = 0.103403843826315 | erot = 0.308178073397328 | epot = -15.0290959518505 | etot = -14.6175140346269 -775000 ekin = 0.117439110045059 | erot = 0.323630675217718 | epot = -15.0585838199028 | etot = -14.61751403464 -776000 ekin = 0.134955835364923 | erot = 0.340275613675133 | epot = -15.0927454837062 | etot = -14.6175140346661 -777000 ekin = 0.155413263634583 | erot = 0.3582278427454 | epot = -15.1311551410863 | etot = -14.6175140347063 -778000 ekin = 0.178060391220183 | erot = 0.377596905888865 | epot = -15.1731713318691 | etot = -14.6175140347601 -779000 ekin = 0.201973803863677 | erot = 0.398457850157374 | epot = -15.2179456888463 | etot = -14.6175140348253 -780000 ekin = 0.226119091212116 | erot = 0.420824480237598 | epot = -15.2644576063476 | etot = -14.6175140348979 -781000 ekin = 0.249431156624362 | erot = 0.444629585314245 | epot = -15.3115747769111 | etot = -14.6175140349725 -782000 ekin = 0.27090447026737 | erot = 0.469715692367108 | epot = -15.3581341976774 | etot = -14.617514035043 -783000 ekin = 0.289681273781371 | erot = 0.495837747641005 | epot = -15.4030330565255 | etot = -14.6175140351031 -784000 ekin = 0.305125009984925 | erot = 0.522676532161846 | epot = -15.4453155772951 | etot = -14.6175140351483 -785000 ekin = 0.316868262921689 | erot = 0.549859353707494 | epot = -15.4842416518049 | etot = -14.6175140351757 -786000 ekin = 0.324828845887827 | erot = 0.57698331002341 | epot = -15.5193261910962 | etot = -14.617514035185 -787000 ekin = 0.32919323387832 | erot = 0.60363650580216 | epot = -15.5503437748586 | etot = -14.6175140351781 -788000 ekin = 0.33037186485146 | erot = 0.629413875564563 | epot = -15.5772997755749 | etot = -14.6175140351589 -789000 ekin = 0.328934711355184 | erot = 0.653926193133396 | epot = -15.6003749396209 | etot = -14.6175140351323 -790000 ekin = 0.325537319473833 | erot = 0.676802790007515 | epot = -15.619854144585 | etot = -14.6175140351037 -791000 ekin = 0.320847267933844 | erot = 0.697689943212853 | epot = -15.6360512462245 | etot = -14.6175140350778 -792000 ekin = 0.315479253540059 | erot = 0.716247584425432 | epot = -15.6492408730237 | etot = -14.6175140350582 -793000 ekin = 0.309944490982995 | erot = 0.732146955923568 | epot = -15.659605481954 | etot = -14.6175140350475 -794000 ekin = 0.304617480926279 | erot = 0.745071299200936 | epot = -15.6672028151733 | etot = -14.6175140350461 -795000 ekin = 0.299720880977542 | erot = 0.754720862086076 | epot = -15.6719557781174 | etot = -14.6175140350538 -796000 ekin = 0.295327396181288 | erot = 0.760822658788699 | epot = -15.6736640900385 | etot = -14.6175140350685 -797000 ekin = 0.291376296852734 | erot = 0.763144639346229 | epot = -15.6720349712862 | etot = -14.6175140350872 -798000 ekin = 0.287701294704638 | erot = 0.761513269132583 | epot = -15.6667285989436 | etot = -14.6175140351064 -799000 ekin = 0.284065979572969 | erot = 0.755832991337638 | epot = -15.6574130060325 | etot = -14.6175140351219 -800000 ekin = 0.280202790632173 | erot = 0.746105645864818 | epot = -15.6438224716274 | etot = -14.6175140351304 -801000 ekin = 0.275851560112921 | erot = 0.732447665813908 | epot = -15.6258132610552 | etot = -14.6175140351284 -802000 ekin = 0.270794034433598 | erot = 0.715102809072986 | epot = -15.6034108786203 | etot = -14.6175140351137 -803000 ekin = 0.264881442636211 | erot = 0.694448356025999 | epot = -15.5768438337475 | etot = -14.6175140350853 -804000 ekin = 0.258053167890611 | erot = 0.670993199746564 | epot = -15.5465604026803 | etot = -14.6175140350431 -805000 ekin = 0.250345604727777 | erot = 0.645366941436383 | epot = -15.5132265811527 | etot = -14.6175140349885 -806000 ekin = 0.241890533711227 | erot = 0.618299214643911 | epot = -15.4777037832789 | etot = -14.6175140349238 -807000 ekin = 0.232905655206386 | erot = 0.59059128773573 | epot = -15.4410109777945 | etot = -14.6175140348524 -808000 ekin = 0.223678061732307 | erot = 0.563080896687569 | epot = -15.404272993198 | etot = -14.6175140347781 -809000 ekin = 0.21454303522989 | erot = 0.536602758841035 | epot = -15.3686598287761 | etot = -14.6175140347052 -810000 ekin = 0.205860488312487 | erot = 0.511947500022813 | epot = -15.335322022973 | etot = -14.6175140346377 -811000 ekin = 0.197991117804985 | erot = 0.489821758276953 | epot = -15.3053269106614 | etot = -14.6175140345795 -812000 ekin = 0.191273941670598 | erot = 0.470812030933133 | epot = -15.2796000071373 | etot = -14.6175140345336 -813000 ekin = 0.18600640436918 | erot = 0.455354451061547 | epot = -15.2588748899335 | etot = -14.6175140345028 -814000 ekin = 0.182427753711695 | erot = 0.443712201373049 | epot = -15.2436539895733 | etot = -14.6175140344886 -815000 ekin = 0.180705986334899 | erot = 0.435961774090678 | epot = -15.2341817949176 | etot = -14.617514034492 -816000 ekin = 0.180928373605138 | erot = 0.431988814112469 | epot = -15.2304312222306 | etot = -14.617514034513 -817000 ekin = 0.183095431233989 | erot = 0.431493858262917 | epot = -15.2321033240477 | etot = -14.6175140345508 -818000 ekin = 0.187118173911423 | erot = 0.43400789506895 | epot = -15.2386401035843 | etot = -14.6175140346039 -819000 ekin = 0.192818568053485 | erot = 0.438917286806367 | epot = -15.2492498895297 | etot = -14.6175140346698 -820000 ekin = 0.199933211815007 | erot = 0.445497181488063 | epot = -15.2629444280486 | etot = -14.6175140347455 -821000 ekin = 0.208120374082307 | erot = 0.452952069483619 | epot = -15.2785864783934 | etot = -14.6175140348274 -822000 ekin = 0.216970558498724 | erot = 0.460461605795572 | epot = -15.2949461992058 | etot = -14.6175140349115 -823000 ekin = 0.226020685629653 | erot = 0.467229260922794 | epot = -15.3107639815457 | etot = -14.6175140349933 -824000 ekin = 0.234771793852154 | erot = 0.472530858216694 | epot = -15.3248166871376 | etot = -14.6175140350687 -825000 ekin = 0.242709867662635 | erot = 0.475759712130466 | epot = -15.3359836149267 | etot = -14.6175140351336 -826000 ekin = 0.249329060858575 | erot = 0.476465014357238 | epot = -15.3433081104001 | etot = -14.6175140351843 -827000 ekin = 0.25415625948642 | erot = 0.474380409602698 | epot = -15.3460507043074 | etot = -14.6175140352183 -828000 ekin = 0.256775693171424 | erot = 0.469440383344404 | epot = -15.3437301117495 | etot = -14.6175140352337 -829000 ekin = 0.256852201217284 | erot = 0.46178309210187 | epot = -15.336149328549 | etot = -14.6175140352299 -830000 ekin = 0.254151805817283 | erot = 0.451739467040903 | epot = -15.3234053080654 | etot = -14.6175140352073 -831000 ekin = 0.248558416434218 | erot = 0.439809632306185 | epot = -15.3058820839079 | etot = -14.6175140351675 -832000 ekin = 0.240085737091441 | erot = 0.426628719075599 | epot = -15.2842284912797 | etot = -14.6175140351126 -833000 ekin = 0.228883712687973 | erot = 0.412924890623741 | epot = -15.2593226383575 | etot = -14.6175140350458 -834000 ekin = 0.215239082682017 | erot = 0.399472764055522 | epot = -15.2322258817081 | etot = -14.6175140349705 -835000 ekin = 0.199569787294727 | erot = 0.387045440519038 | epot = -15.2041292627042 | etot = -14.6175140348904 -836000 ekin = 0.182413100763729 | erot = 0.376368114580306 | epot = -15.1762952501535 | etot = -14.6175140348094 -837000 ekin = 0.164407483062571 | erot = 0.368075825930997 | epot = -15.149997343725 | etot = -14.6175140347315 -838000 ekin = 0.146268295773245 | erot = 0.362677435797452 | epot = -15.1264597662308 | etot = -14.6175140346601 -839000 ekin = 0.128757768426142 | erot = 0.360527421580312 | epot = -15.1067992246053 | etot = -14.6175140345989 -840000 ekin = 0.112649960717701 | erot = 0.36180661865639 | epot = -15.0919706139249 | etot = -14.6175140345508 -841000 ekin = 0.0986919456674289 | erot = 0.36651260392939 | epot = -15.0827185841154 | etot = -14.6175140345186 -842000 ekin = 0.0875630029231973 | erot = 0.374460003556307 | epot = -15.0795370409836 | etot = -14.6175140345041 -843000 ekin = 0.0798341847684568 | erot = 0.385290606533499 | epot = -15.0826388258105 | etot = -14.6175140345086 -844000 ekin = 0.0759310929906455 | erot = 0.398492769730518 | epot = -15.0919378972534 | etot = -14.6175140345322 -845000 ekin = 0.0761029610203614 | erot = 0.413429207169692 | epot = -15.1070462027642 | etot = -14.6175140345741 -846000 ekin = 0.0804010613291467 | erot = 0.429371869323724 | epot = -15.1272869652855 | etot = -14.6175140346326 -847000 ekin = 0.0886689809243283 | erot = 0.445542241999283 | epot = -15.151725257628 | etot = -14.6175140347044 -848000 ekin = 0.100546421460129 | erot = 0.46115503871289 | epot = -15.1792154949586 | etot = -14.6175140347856 -849000 ekin = 0.115486960011282 | erot = 0.475462945352927 | epot = -15.2084639402358 | etot = -14.6175140348716 -850000 ekin = 0.132788806696208 | erot = 0.487799837753942 | epot = -15.2381026794073 | etot = -14.6175140349572 -851000 ekin = 0.151636227786906 | erot = 0.497619785577632 | epot = -15.2667700484016 | etot = -14.6175140350371 -852000 ekin = 0.171148194576718 | erot = 0.504529242628412 | epot = -15.2931914723118 | etot = -14.6175140351066 -853000 ekin = 0.190430159396265 | erot = 0.50831015746196 | epot = -15.31625435202 | etot = -14.6175140351617 -854000 ekin = 0.208624756900111 | erot = 0.508932337651449 | epot = -15.3350711297509 | etot = -14.6175140351993 -855000 ekin = 0.224957674812678 | erot = 0.506554231539646 | epot = -15.3490259415702 | etot = -14.6175140352179 -856000 ekin = 0.238775816539412 | erot = 0.501512259960127 | epot = -15.3578021117162 | etot = -14.6175140352167 -857000 ekin = 0.249575992234284 | erot = 0.494299801981541 | epot = -15.3613898294126 | etot = -14.6175140351967 -858000 ekin = 0.257023502073991 | erot = 0.485537766821542 | epot = -15.3600753040553 | etot = -14.6175140351598 -859000 ekin = 0.260960921285794 | erot = 0.475939247615297 | epot = -15.3544142040096 | etot = -14.6175140351085 -860000 ekin = 0.261408037072425 | erot = 0.466270984603931 | epot = -15.3451930567221 | etot = -14.6175140350458 -861000 ekin = 0.258554187538353 | erot = 0.457314264402295 | epot = -15.3333824869156 | etot = -14.6175140349749 -862000 ekin = 0.252744258033141 | erot = 0.449827506885222 | epot = -15.3200857998177 | etot = -14.6175140348993 -863000 ekin = 0.244459417796683 | erot = 0.444512141833012 | epot = -15.3064855944521 | etot = -14.6175140348224 -864000 ekin = 0.23429336884036 | erot = 0.441983030938511 | epot = -15.2937904345263 | etot = -14.6175140347475 -865000 ekin = 0.222924696624272 | erot = 0.442744308393629 | epot = -15.2831830396954 | etot = -14.6175140346775 -866000 ekin = 0.211086026109497 | erot = 0.447169652379628 | epot = -15.2757697131049 | etot = -14.6175140346158 -867000 ekin = 0.199530465893205 | erot = 0.455487658922675 | epot = -15.2725321593806 | etot = -14.6175140345647 -868000 ekin = 0.188996288427701 | erot = 0.467771811642206 | epot = -15.274282134597 | etot = -14.6175140345271 -869000 ekin = 0.180171161859839 | erot = 0.483934855625384 | epot = -15.2816200519904 | etot = -14.6175140345052 -870000 ekin = 0.173657413869083 | erot = 0.503727420428225 | epot = -15.2948988687979 | etot = -14.6175140345006 -871000 ekin = 0.169940429082826 | erot = 0.526741193130643 | epot = -15.3141956567281 | etot = -14.6175140345146 -872000 ekin = 0.169362274179231 | erot = 0.55241708894464 | epot = -15.3392933976713 | etot = -14.6175140345475 -873000 ekin = 0.172102391202432 | erot = 0.580058846013128 | epot = -15.3696752718142 | etot = -14.6175140345986 -874000 ekin = 0.178167002902699 | erot = 0.608852557306752 | epot = -15.404533594876 | etot = -14.6175140346666 -875000 ekin = 0.187388233891608 | erot = 0.637892396629037 | epot = -15.4427946652693 | etot = -14.6175140347487 -876000 ekin = 0.199433181368205 | erot = 0.666212376944565 | epot = -15.4831595931543 | etot = -14.6175140348416 -877000 ekin = 0.213822249051452 | erot = 0.69282332523737 | epot = -15.5241596092296 | etot = -14.6175140349407 -878000 ekin = 0.229955728386783 | erot = 0.716754212644293 | epot = -15.5642239760726 | etot = -14.6175140350415 -879000 ekin = 0.247146104645698 | erot = 0.737095186134375 | epot = -15.6017553259191 | etot = -14.617514035139 -880000 ekin = 0.264653797002906 | erot = 0.753040153405454 | epot = -15.6352079856366 | etot = -14.6175140352283 -881000 ekin = 0.28172378426185 | erot = 0.763926241590771 | epot = -15.6631640611577 | etot = -14.617514035305 -882000 ekin = 0.297620641607227 | erot = 0.769267373447333 | epot = -15.6844020504203 | etot = -14.6175140353657 -883000 ekin = 0.311659967166543 | erot = 0.768779581882131 | epot = -15.6979535844564 | etot = -14.6175140354077 -884000 ekin = 0.323234773768197 | erot = 0.762396270683944 | epot = -15.7031450798816 | etot = -14.6175140354294 -885000 ekin = 0.331836099625417 | erot = 0.750272396067174 | epot = -15.6996225311231 | etot = -14.6175140354305 -886000 ekin = 0.337067751564103 | erot = 0.732777385265373 | epot = -15.6873591722411 | etot = -14.6175140354117 -887000 ekin = 0.338655649766336 | erot = 0.710477420749848 | epot = -15.6666471058904 | etot = -14.6175140353742 -888000 ekin = 0.336452632420875 | erot = 0.684108417155686 | epot = -15.6380750848969 | etot = -14.6175140353203 -889000 ekin = 0.330439768515621 | erot = 0.654541548239603 | epot = -15.602495352008 | etot = -14.6175140352528 -890000 ekin = 0.320725208484741 | erot = 0.62274352002662 | epot = -15.5609827636857 | etot = -14.6175140351743 -891000 ekin = 0.307541386208895 | erot = 0.589733936087021 | epot = -15.514789357384 | etot = -14.6175140350881 -892000 ekin = 0.291240998129636 | erot = 0.556542080397485 | epot = -15.465297113524 | etot = -14.6175140349969 -893000 ekin = 0.272291667891092 | erot = 0.524165278720341 | epot = -15.4139709815152 | etot = -14.6175140349038 -894000 ekin = 0.251268620703177 | erot = 0.493530718297282 | epot = -15.3623133738115 | etot = -14.6175140348111 -895000 ekin = 0.228844131843334 | erot = 0.465462234286213 | epot = -15.311820400851 | etot = -14.6175140347214 -896000 ekin = 0.205772103521623 | erot = 0.440653137306931 | epot = -15.263939275466 | etot = -14.6175140346374 -897000 ekin = 0.18286601780276 | erot = 0.419645693758162 | epot = -15.2200257461227 | etot = -14.6175140345617 -898000 ekin = 0.160968870008327 | erot = 0.40281742524286 | epot = -15.1813003297482 | etot = -14.617514034497 -899000 ekin = 0.140914625128286 | erot = 0.390374024162985 | epot = -15.1488026837377 | etot = -14.6175140344464 -900000 ekin = 0.123482269337591 | erot = 0.382348451689304 | epot = -15.1233447554395 | etot = -14.6175140344126 -901000 ekin = 0.109345484385278 | erot = 0.378605737554559 | epot = -15.1054652563381 | etot = -14.6175140343982 -902000 ekin = 0.0990229789071406 | erot = 0.37885314016642 | epot = -15.0953901534788 | etot = -14.6175140344052 -903000 ekin = 0.0928360184568559 | erot = 0.382655585825979 | epot = -15.093005638717 | etot = -14.6175140344341 -904000 ekin = 0.0908801123885926 | erot = 0.389456554773827 | epot = -15.0978507016463 | etot = -14.6175140344838 -905000 ekin = 0.0930167096533132 | erot = 0.398604648850322 | epot = -15.1091353930552 | etot = -14.6175140345515 -906000 ekin = 0.0988880708470662 | erot = 0.409385812369458 | epot = -15.1257879178489 | etot = -14.6175140346324 -907000 ekin = 0.107954659148216 | erot = 0.421060528764254 | epot = -15.1465292226329 | etot = -14.6175140347204 -908000 ekin = 0.119550305155171 | erot = 0.432904367174519 | epot = -15.1699687071382 | etot = -14.6175140348085 -909000 ekin = 0.132947118365042 | erot = 0.444249232158093 | epot = -15.1947103854133 | etot = -14.6175140348902 -910000 ekin = 0.14742054333404 | erot = 0.45452187965619 | epot = -15.2194564579498 | etot = -14.6175140349596 -911000 ekin = 0.162305506309761 | erot = 0.463275978358842 | epot = -15.2430955196813 | etot = -14.6175140350127 -912000 ekin = 0.177037050913266 | erot = 0.470214361754283 | epot = -15.2647654477151 | etot = -14.6175140350476 -913000 ekin = 0.191172462463443 | erot = 0.475199092565798 | epot = -15.2838855900934 | etot = -14.6175140350642 -914000 ekin = 0.204395616840806 | erot = 0.478248345047313 | epot = -15.3001579969523 | etot = -14.6175140350642 -915000 ekin = 0.21650723869525 | erot = 0.479520616571472 | epot = -15.3135418903175 | etot = -14.6175140350508 -916000 ekin = 0.22740635239903 | erot = 0.479288139235308 | epot = -15.3242085266619 | etot = -14.6175140350276 -917000 ekin = 0.237068358847916 | erot = 0.477902392722287 | epot = -15.3324847865686 | etot = -14.6175140349984 -918000 ekin = 0.245524170398606 | erot = 0.475755244751368 | epot = -15.338793450117 | etot = -14.617514034967 -919000 ekin = 0.252843202023207 | erot = 0.473239468154926 | epot = -15.3435967051145 | etot = -14.6175140349364 -920000 ekin = 0.259121284814418 | erot = 0.470712244289352 | epot = -15.3473475640129 | etot = -14.6175140349091 -921000 ekin = 0.264473144075716 | erot = 0.468464808091652 | epot = -15.3504519870541 | etot = -14.6175140348868 -922000 ekin = 0.269028180853147 | erot = 0.466700668341421 | epot = -15.3532428840648 | etot = -14.6175140348703 -923000 ekin = 0.272927944744965 | erot = 0.465523908452019 | epot = -15.3559658880565 | etot = -14.6175140348596 -924000 ekin = 0.276323793828338 | erot = 0.464938026324942 | epot = -15.3587758550077 | etot = -14.6175140348544 -925000 ekin = 0.279373649322719 | erot = 0.464854721381143 | epot = -15.3617424055579 | etot = -14.6175140348541 -926000 ekin = 0.282237300897349 | erot = 0.465111106681717 | epot = -15.3648624424361 | etot = -14.6175140348571 -927000 ekin = 0.285070250341268 | erot = 0.465493135294266 | epot = -15.3680774204978 | etot = -14.6175140348623 -928000 ekin = 0.288016501944426 | erot = 0.465762600719312 | epot = -15.3712931375323 | etot = -14.6175140348686 -929000 ekin = 0.291201026098215 | erot = 0.465684740680354 | epot = -15.3743998016532 | etot = -14.6175140348747 -930000 ekin = 0.294722459179014 | erot = 0.465054261990702 | epot = -15.3772907560492 | etot = -14.6175140348795 -931000 ekin = 0.29864676401532 | erot = 0.463717248454336 | epot = -15.3798780473521 | etot = -14.6175140348824 -932000 ekin = 0.30300230463982 | erot = 0.461587311534142 | epot = -15.382103651057 | etot = -14.617514034883 -933000 ekin = 0.307776651095021 | erot = 0.458654945592281 | epot = -15.3839456315687 | etot = -14.6175140348814 -934000 ekin = 0.312915338272243 | erot = 0.454989722656041 | epot = -15.385419095806 | etot = -14.6175140348777 -935000 ekin = 0.318322768321537 | erot = 0.4507356255513 | epot = -15.3865724287453 | etot = -14.6175140348725 -936000 ekin = 0.323865441581232 | erot = 0.446100385695392 | epot = -15.3874798621431 | etot = -14.6175140348664 -937000 ekin = 0.329377658420751 | erot = 0.441340069470884 | epot = -15.3882317627517 | etot = -14.6175140348601 -938000 ekin = 0.334669609401342 | erot = 0.436740154638299 | epot = -15.3889237988938 | etot = -14.6175140348541 -939000 ekin = 0.339538182698431 | erot = 0.432595723627041 | epot = -15.3896479411745 | etot = -14.617514034849 -940000 ekin = 0.343779460434951 | erot = 0.429190561372456 | epot = -15.3904840566526 | etot = -14.6175140348452 -941000 ekin = 0.347202304173587 | erot = 0.426777065358565 | epot = -15.391493404375 | etot = -14.6175140348428 -942000 ekin = 0.349642062607373 | erot = 0.425558062624985 | epot = -15.3927141600744 | etot = -14.6175140348421 -943000 ekin = 0.350973206935267 | erot = 0.425671371650545 | epot = -15.3941586134289 | etot = -14.6175140348431 -944000 ekin = 0.351119786154239 | erot = 0.427178062458757 | epot = -15.3958118834587 | etot = -14.6175140348457 -945000 ekin = 0.350062816508182 | erot = 0.430055404932911 | epot = -15.397632256291 | etot = -14.6175140348499 -946000 ekin = 0.347844068536133 | erot = 0.434195447788936 | epot = -15.3995535511804 | etot = -14.6175140348553 -947000 ekin = 0.344566017440968 | erot = 0.439410327983271 | epot = -15.4014903802857 | etot = -14.6175140348614 -948000 ekin = 0.340388212506876 | erot = 0.445444378275944 | epot = -15.4033466256503 | etot = -14.6175140348675 -949000 ekin = 0.335520427168076 | erot = 0.451992965713332 | epot = -15.405027427754 | etot = -14.6175140348726 -950000 ekin = 0.330213181195925 | erot = 0.458727107974287 | epot = -15.4064543240458 | etot = -14.6175140348756 -951000 ekin = 0.324745816556271 | erot = 0.465321341195901 | epot = -15.4075811926278 | etot = -14.6175140348756 -952000 ekin = 0.319412679962131 | erot = 0.471482169175953 | epot = -15.4084088840101 | etot = -14.617514034872 -953000 ekin = 0.314508037100271 | erot = 0.476974139325801 | epot = -15.4089962112904 | etot = -14.6175140348643 -954000 ekin = 0.310309685024597 | erot = 0.481639431416524 | epot = -15.4094631512943 | etot = -14.6175140348532 -955000 ekin = 0.30706194776561 | erot = 0.485408201612597 | epot = -15.4099841842179 | etot = -14.6175140348397 -956000 ekin = 0.304958921289462 | erot = 0.488297803840355 | epot = -15.4107707599554 | etot = -14.6175140348255 -957000 ekin = 0.304129209169334 | erot = 0.490400499131601 | epot = -15.4120437431141 | etot = -14.6175140348131 -958000 ekin = 0.304623714620741 | erot = 0.491860923620763 | epot = -15.4139986730463 | etot = -14.6175140348048 -959000 ekin = 0.306408207892433 | erot = 0.492846142548468 | epot = -15.4167683852438 | etot = -14.6175140348029 -960000 ekin = 0.309362278814204 | erot = 0.493512316197963 | epot = -15.4203886298212 | etot = -14.617514034809 -961000 ekin = 0.313285873785893 | erot = 0.493972653387203 | epot = -15.4247725619971 | etot = -14.617514034824 -962000 ekin = 0.317913924785377 | erot = 0.494271324762721 | epot = -15.4296992843955 | etot = -14.6175140348474 -963000 ekin = 0.322938673954067 | erot = 0.494367337737335 | epot = -15.434820046569 | etot = -14.6175140348776 -964000 ekin = 0.32803828153202 | erot = 0.494131108238476 | epot = -15.4396834246822 | etot = -14.6175140349118 -965000 ekin = 0.332909295684033 | erot = 0.493354750676285 | epot = -15.4437780813066 | etot = -14.6175140349462 -966000 ekin = 0.337299689763766 | erot = 0.491775167781745 | epot = -15.4465888925225 | etot = -14.617514034977 -967000 ekin = 0.341038574327655 | erot = 0.489107134739062 | epot = -15.4476597440666 | etot = -14.6175140349999 -968000 ekin = 0.344058508087222 | erot = 0.485082040987952 | epot = -15.4466545840868 | etot = -14.6175140350117 -969000 ekin = 0.346406687227151 | erot = 0.479487053291702 | epot = -15.4434077755292 | etot = -14.6175140350103 -970000 ekin = 0.348242259951282 | erot = 0.472199376074787 | epot = -15.4379556710213 | etot = -14.6175140349953 -971000 ekin = 0.349818577908804 | erot = 0.463211040207177 | epot = -15.4305436530837 | etot = -14.6175140349678 -972000 ekin = 0.351451221504524 | erot = 0.452641107453752 | epot = -15.4216063638891 | etot = -14.6175140349308 -973000 ekin = 0.3534748518418 | erot = 0.440734047140215 | epot = -15.4117229338706 | etot = -14.6175140348885 -974000 ekin = 0.356193968986606 | erot = 0.427844962322964 | epot = -15.4015529661554 | etot = -14.6175140348458 -975000 ekin = 0.359834072252968 | erot = 0.414413971021433 | epot = -15.3917620780819 | etot = -14.6175140348075 -976000 ekin = 0.364500158164541 | erot = 0.400933139115399 | epot = -15.3829473320578 | etot = -14.6175140347778 -977000 ekin = 0.370148756531594 | erot = 0.387909813696784 | epot = -15.3755726049881 | etot = -14.6175140347597 -978000 ekin = 0.376577842832112 | erot = 0.37583005908299 | epot = -15.3699219366697 | etot = -14.6175140347546 -979000 ekin = 0.383436289098897 | erot = 0.365125297246974 | epot = -15.3660756211082 | etot = -14.6175140347623 -980000 ekin = 0.390251542221838 | erot = 0.356144397459927 | epot = -15.3639099744635 | etot = -14.6175140347817 -981000 ekin = 0.396471539315499 | erot = 0.349132547198626 | epot = -15.3631181213241 | etot = -14.61751403481 -982000 ekin = 0.401514997591354 | erot = 0.344217435800631 | epot = -15.3632464682362 | etot = -14.6175140348443 -983000 ekin = 0.404823458769612 | erot = 0.341402706417366 | epot = -15.3637402000685 | etot = -14.6175140348815 -984000 ekin = 0.405908866684804 | erot = 0.34056832459917 | epot = -15.3639912262027 | etot = -14.6175140349188 -985000 ekin = 0.404391803059605 | erot = 0.341477444721989 | epot = -15.3633832827353 | etot = -14.6175140349537 -986000 ekin = 0.400027422799988 | erot = 0.343789434463081 | epot = -15.3613308922474 | etot = -14.6175140349843 -987000 ekin = 0.392718180743718 | erot = 0.347078806740141 | epot = -15.357311022493 | etot = -14.6175140350092 -988000 ekin = 0.382514239213264 | erot = 0.350859769148604 | epot = -15.3508880433891 | etot = -14.6175140350273 -989000 ekin = 0.36960372665304 | erot = 0.354615837190747 | epot = -15.3417335988814 | etot = -14.6175140350376 -990000 ekin = 0.354295674460603 | erot = 0.357833454089941 | epot = -15.3296431635899 | etot = -14.6175140350393 -991000 ekin = 0.336998529350877 | erot = 0.360037895319979 | epot = -15.3145504597026 | etot = -14.6175140350318 -992000 ekin = 0.318196763890073 | erot = 0.360829065192576 | epot = -15.296539864097 | etot = -14.6175140350143 -993000 ekin = 0.298427479538382 | erot = 0.359914303090994 | epot = -15.2758558176161 | etot = -14.6175140349867 -994000 ekin = 0.278258203579966 | erot = 0.357135170966681 | epot = -15.2529074094957 | etot = -14.6175140349491 -995000 ekin = 0.258266471895044 | erot = 0.352485480213702 | epot = -15.2282659870109 | etot = -14.6175140349022 -996000 ekin = 0.239021351636038 | erot = 0.346118523028621 | epot = -15.2026539095118 | etot = -14.6175140348471 -997000 ekin = 0.221066818081191 | erot = 0.338342492443265 | epot = -15.1769233453106 | etot = -14.6175140347861 -998000 ekin = 0.204906835818307 | erot = 0.329604233509113 | epot = -15.152025104049 | etot = -14.6175140347215 -999000 ekin = 0.190992053959209 | erot = 0.320462575794744 | epot = -15.1289686644103 | etot = -14.6175140346563 -1000000 ekin = 0.179708146665587 | erot = 0.311553394428757 | epot = -15.1087755756882 | etot = -14.6175140345938 - 1000000 0.013311715 -1.5443684 0.033490821 -1.4929067 -3.7544839e-05 -Loop time of 17.7119 on 4 procs for 1000000 steps with 10 atoms - -Performance: 48780.802 tau/day, 56459.261 timesteps/s -99.5% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 0.59564 | 6.28 | 11.307 | 181.3 | 35.46 -Bond | 0.083757 | 0.28777 | 0.47668 | 30.6 | 1.62 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 1.8539 | 2.1875 | 2.4877 | 17.3 | 12.35 -Output | 2.1e-05 | 3.85e-05 | 4.5e-05 | 0.0 | 0.00 -Modify | 0.18254 | 0.92719 | 1.638 | 61.5 | 5.23 -Other | | 8.029 | | | 45.33 - -Nlocal: 2.5 ave 5.0 max 0.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 -Nghost: 7.5 ave 10.0 max 5.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 -Neighs: 16.0 ave 30.0 max 0.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 - -Total # of neighbors = 64 -Ave neighs/atom = 6.4 -Ave special neighs/atom = 3.6 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:17 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/data.duplex2 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/data.duplex2 index 72872d431a..8c985708ca 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/data.duplex2 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/data.duplex2 @@ -1,15 +1,14 @@ -# LAMMPS data file +LAMMPS data file via write_data, version 27 May 2021 + 16 atoms -16 ellipsoids -13 bonds - 4 atom types +13 bonds 1 bond types +16 ellipsoids -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi Masses @@ -18,79 +17,75 @@ Masses 3 3.1575 4 3.1575 -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms +Atoms # hybrid -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.860249842674776e-01 -3.518234140414736e-01 3.897628551303122e-01 1 1 1 -3 3 -1.874009511073395e-01 -5.699832309147915e-01 7.795257102606244e-01 1 1 1 -4 4 1.824198365552941e-01 -5.715968887521518e-01 1.169288565390937e+00 1 1 1 -5 1 4.829362784135484e-01 -3.560513319622209e-01 1.559051420521249e+00 1 1 1 -6 2 5.999771538385027e-01 -5.235921299024461e-03 1.948814275651561e+00 1 1 1 -7 3 4.890766774371325e-01 3.475687034056071e-01 2.338577130781873e+00 1 1 1 -8 4 1.923677943514057e-01 5.683261666476170e-01 2.728339985912185e+00 1 1 1 -9 1 -1.923677943514057e-01 -5.683261666476170e-01 2.728339985912185e+00 2 1 1 -10 2 -4.890766774371324e-01 -3.475687034056071e-01 2.338577130781873e+00 2 1 1 -11 3 -5.999771538385025e-01 5.235921299024461e-03 1.948814275651561e+00 2 1 1 -12 4 -4.829362784135481e-01 3.560513319622207e-01 1.559051420521249e+00 2 1 1 -13 1 -1.824198365552940e-01 5.715968887521514e-01 1.169288565390936e+00 2 1 1 -14 2 1.874009511073395e-01 5.699832309147912e-01 7.795257102606241e-01 2 1 1 -15 3 4.860249842674773e-01 3.518234140414733e-01 3.897628551303119e-01 2 1 1 -16 4 5.999999999999995e-01 -3.330669073875470e-17 -3.330669073875470e-16 2 1 1 +1 1 -0.6133472972454725 -0.657478171669766 0.36065226351201896 1 1 3.7269849963023267 0 0 0 +2 2 -0.45262764247356363 -1.0030650534345913 0.7258693379233347 1 1 3.7269849963023267 0 0 0 +3 3 -0.0988342108522641 -1.239775807128057 1.069462285786363 1 1 3.7269849963023267 0 0 0 +4 4 0.2937771854299732 -1.2579750924899842 1.4258916086606965 1 1 3.7269849963023267 0 0 0 +5 1 0.6286896795685137 -1.0183343395119744 1.7689346339672825 1 1 3.7269849963023267 0 0 0 +6 2 0.7901522619067926 -0.6766341805565266 2.1540160705495754 1 1 3.7269849963023267 0 0 0 +7 3 0.7115777184886863 -0.40195579325143455 2.569568683291525 1 1 3.7269849963023267 0 0 0 +8 4 0.46973310377005234 -0.30251697967107033 3.0668007117519216 1 1 3.7269849963023267 0 0 0 +9 1 0.4056113349449848 -1.443775499211898 3.0590726503341124 2 1 3.7269849963023267 0 0 0 +10 2 -0.032028429059287516 -1.2947520971164723 2.7201071151392187 2 1 3.7269849963023267 0 0 0 +11 3 -0.31613855112314065 -0.908414175906161 2.4125207871782006 2 1 3.7269849963023267 0 0 0 +12 4 -0.38939391251821 -0.4866605488242819 2.006177777000426 2 1 3.7269849963023267 0 0 0 +13 1 -0.06232643040853296 -0.07155965522127403 1.5593206052730733 3 1 3.7269849963023267 0 0 0 +14 2 0.17884090390913376 -0.05516721349427172 1.021273149730912 3 1 3.7269849963023267 0 0 0 +15 3 0.4513439961906 -0.23795607383274572 0.5957328539615993 3 1 3.7269849963023267 0 0 0 +16 4 0.5077649359807965 -0.5565625134533538 0.1655875784458841 3 1 3.7269849963023267 0 0 0 -# Atom-ID, translational velocity, angular momentum Velocities -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -11 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -12 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -13 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -14 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -15 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -16 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 +1 0.05386890022865587 0.02262922525602673 0.24882291144736746 0.1772010258006941 -0.29588531700001014 -0.2624137503614725 +2 -0.03995003075629463 0.26969511063701984 -0.18986454548195664 -0.030614539375968176 -0.11769518931480599 0.040074702426473215 +3 -0.20784535295201376 -0.13628722357673043 -0.06062477950201746 -0.03676034584820381 -0.06308707793373186 -0.14798601576087625 +4 -0.23969824181316998 -0.5624721730878831 0.032474422905036715 -0.16523645965016515 0.2860623077030974 0.33543519753105877 +5 -0.16114897356828353 -0.22889697470760145 -0.13553324962649563 0.07151030852881342 -0.09415592891043179 0.13422881539312292 +6 -0.04701706588477693 0.19216715585110036 0.14588242791297215 0.09218622989776322 -0.5640128930702024 0.09287105657777776 +7 0.05098438305112513 -0.038459555522009595 -0.14244196285749675 0.3479046835475834 0.4244922695910593 -0.13582882604358357 +8 0.37827971348411926 -0.04953992506010833 0.1626392045834847 0.0442887659636129 0.07868414126013584 -0.12713600444325032 +9 0.04912038408665491 0.041260647318716696 0.012223856334495234 0.03282916621721876 -0.00012670547095256 0.155978785417696 +10 0.1939216183073483 0.11075235485381942 -0.0405050516019971 -0.17008135001813812 -0.4563093565840761 -0.30318513627039506 +11 -0.351360733920646 -0.18822419067535692 0.36147938199051305 -0.3708221604627426 -0.49108381825941216 0.09435948331955418 +12 -0.1188642917357977 0.22355282456551884 0.009265586122144348 -0.28230100188858365 0.10276485660828892 0.10175233476780697 +13 -0.1446616296238799 -0.11552059909787235 0.1331477187595642 -0.25498721890374343 0.2754663721641154 0.05806416868630132 +14 0.051547120035862544 -0.36611026510775635 -0.06630782880801242 -0.11999847173316518 0.0684476892288605 0.2161595932308759 +15 -0.20214244962091388 0.23341226933559608 0.008133374252278069 -0.17013911124135248 0.01870292260510287 -0.2682954134361106 +16 -0.19202131162868008 -0.08105295741355378 -0.0469350810885074 0.017332107652647588 -0.32876588862807693 0.1085334141225924 -# Atom-ID, shape, quaternion -Ellipsoids - -1 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.513258223252946e-01 0.000000000000000e+00 0.000000000000000e+00 3.081869234362515e-01 -3 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 8.100416404457962e-01 0.000000000000000e+00 0.000000000000000e+00 5.863723567357894e-01 -4 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.899012371043606e-01 0.000000000000000e+00 0.000000000000000e+00 8.074754054847398e-01 -5 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 3.123349185122326e-01 0.000000000000000e+00 0.000000000000000e+00 9.499720515246527e-01 -6 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 4.363309284746654e-03 0.000000000000000e+00 0.000000000000000e+00 9.999904807207346e-01 -7 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -3.040330609254902e-01 0.000000000000000e+00 0.000000000000000e+00 9.526614812535865e-01 -8 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.828323126827837e-01 0.000000000000000e+00 0.000000000000000e+00 -8.125924533816677e-01 -9 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.125924533816681e-01 5.828323126827832e-01 -0.000000000000000e+00 -10 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.526614812535864e-01 3.040330609254902e-01 0.000000000000000e+00 -11 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.999904807207346e-01 -4.363309284746654e-03 0.000000000000000e+00 -12 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.499720515246526e-01 -3.123349185122325e-01 0.000000000000000e+00 -13 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.074754054847402e-01 -5.899012371043603e-01 0.000000000000000e+00 -14 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 5.863723567357898e-01 -8.100416404457959e-01 0.000000000000000e+00 -15 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -3.081869234362514e-01 9.513258223252948e-01 0.000000000000000e+00 -16 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 2.775557561562893e-17 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology Bonds -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 5 6 -6 1 6 7 -7 1 7 8 -8 1 9 10 -9 1 10 11 -10 1 11 12 -11 1 13 14 -12 1 14 15 -13 1 15 16 +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 5 6 +6 1 6 7 +7 1 7 8 +8 1 9 10 +9 1 10 11 +10 1 11 12 +11 1 13 14 +12 1 14 15 +13 1 15 16 + +Ellipsoids + +1 1.173984503142341 1.173984503142341 1.173984503142341 0.9964752158482045 -0.053253555733239796 0.011391163807102514 -0.06380787090289707 +2 1.173984503142341 1.173984503142341 1.173984503142341 0.9369923833143513 0.11220716044648564 0.06732538499716349 0.3239168400846305 +3 1.173984503142341 1.173984503142341 1.173984503142341 0.797964932091827 0.14473096354527873 0.18374142699366386 0.5554673737937029 +4 1.173984503142341 1.173984503142341 1.173984503142341 0.5660864821344559 0.14688275499481052 0.09873742533340191 0.8051226439917721 +5 1.173984503142341 1.173984503142341 1.173984503142341 0.2533023785125306 0.12062313161679827 0.08583012223905846 0.9559922359911086 +6 1.173984503142341 1.173984503142341 1.173984503142341 -0.03855807343534716 0.08405913137017908 0.02236505169306371 0.9954632800204194 +7 1.173984503142341 1.173984503142341 1.173984503142341 -0.45592844330248017 0.1004550065061007 -0.052524745294758785 0.8827679181910482 +8 1.173984503142341 1.173984503142341 1.173984503142341 0.768021221540491 -0.009582139884533599 0.03658677589040892 -0.63930665074644 +9 1.173984503142341 1.173984503142341 1.173984503142341 -0.23299975754512345 0.688686395231341 0.6747873944883376 -0.12682324016841584 +10 1.173984503142341 1.173984503142341 1.173984503142341 -0.24662061871907232 0.8744456399178389 0.39370836087823996 -0.13970261209395163 +11 1.173984503142341 1.173984503142341 1.173984503142341 -0.087475900850909 0.977367602388229 0.14493549113095577 -0.12686307572668784 +12 1.173984503142341 1.173984503142341 1.173984503142341 -0.03181169300779214 0.9634374984140112 -0.2442360692534371 -0.10547485630879185 +13 1.173984503142341 1.173984503142341 1.173984503142341 -0.032786070696572266 0.7922941528811777 -0.6084214170523915 -0.03191282109962717 +14 1.173984503142341 1.173984503142341 1.173984503142341 0.047188686288341455 0.6316396208287698 -0.7737349519945348 0.011783095844627799 +15 1.173984503142341 1.173984503142341 1.173984503142341 -0.05869980642620335 -0.34229358203414423 0.9376740835056508 0.012519965878508689 +16 1.173984503142341 1.173984503142341 1.173984503142341 -0.08582818143150042 0.0008707732197394232 0.9939540921464659 -0.0684691735853161 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/in.duplex2 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/in.duplex2 index 50c1dd3379..b43ce6fd15 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/in.duplex2 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/in.duplex2 @@ -2,6 +2,7 @@ variable number equal 2 variable ofreq equal 1000 variable efreq equal 1000 variable T equal 0.1 +variable rhos equal 0.2 units lj @@ -11,11 +12,11 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 1 delay 0 check yes read_data data.duplex2 @@ -38,30 +39,19 @@ pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 # NVE ensemble -#fix 1 all nve/dot -fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" +compute quat all property/atom quatw quati quatj quatk compute erot all erotate/asphere compute ekin all ke @@ -72,10 +62,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" run 1000000 -#write_restart config.${number}.* +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 new file mode 100644 index 0000000000..6379401f02 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 @@ -0,0 +1,1183 @@ +LAMMPS (27 May 2021) +variable number equal 2 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex2 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 16 atoms + reading velocities ... + 16 velocities + scanning bonds ... + 2 = max bonds/atom + 16 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 13 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.003 seconds + +set atom * mass 3.1575 +Setting atom values ... + 16 settings made for mass + +group all type 1 4 +16 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA2 pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# NVE ensemble +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.2.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 2.70475393009871 | erot = 2.80172072918779 | epot = -21.0482852787267 | etot = -15.5418106194402 +Per MPI rank memory allocation (min/avg/max) = 9.575 | 9.575 | 9.575 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.12021129 -1.3610384 0.045520537 -1.1464707 5.9660461e-05 64000 +1000 ekin = 2.70391570439002 | erot = 2.60396138194761 | epot = -20.892587006041 | etot = -15.5847099197034 +2000 ekin = 2.64635320949975 | erot = 2.53579824187029 | epot = -20.7791695875995 | etot = -15.5970181362294 +3000 ekin = 2.69752120400807 | erot = 2.55180306746824 | epot = -20.7137659040141 | etot = -15.4644416325378 +4000 ekin = 2.65388214447351 | erot = 2.47641299322464 | epot = -20.6794119976431 | etot = -15.5491168599449 +5000 ekin = 2.60025466050757 | erot = 2.2039059393524 | epot = -20.6560408696723 | etot = -15.8518802698123 +6000 ekin = 2.46901398821907 | erot = 2.47310200487733 | epot = -20.6350989412901 | etot = -15.6929829481937 +7000 ekin = 2.51574664182367 | erot = 2.31213437386206 | epot = -20.6631357493118 | etot = -15.8352547336261 +8000 ekin = 2.59690047628267 | erot = 2.32317845363663 | epot = -20.7152959922884 | etot = -15.7952170623691 +9000 ekin = 2.48618631858408 | erot = 2.08285633125494 | epot = -20.7950725844518 | etot = -16.2260299346128 +10000 ekin = 2.52115116499233 | erot = 2.20106084795614 | epot = -20.8992442032707 | etot = -16.1770321903222 +11000 ekin = 2.43147539619194 | erot = 2.4292761978595 | epot = -21.0249867006789 | etot = -16.1642351066275 +12000 ekin = 2.45333761568576 | erot = 2.52560307161098 | epot = -21.1588492672088 | etot = -16.179908579912 +13000 ekin = 2.53951720462344 | erot = 2.7465487700648 | epot = -21.2655112796489 | etot = -15.9794453049607 +14000 ekin = 2.5287482301222 | erot = 3.01239544645659 | epot = -21.3374765197331 | etot = -15.7963328431543 +15000 ekin = 2.63126849733546 | erot = 2.75804260501315 | epot = -21.3622375137172 | etot = -15.9729264113686 +16000 ekin = 2.53351081020597 | erot = 2.9515240146865 | epot = -21.3358982910483 | etot = -15.8508634661558 +17000 ekin = 2.57894891181708 | erot = 3.20567182477319 | epot = -21.2708322188655 | etot = -15.4862114822752 +18000 ekin = 2.48912656009911 | erot = 3.30514421758695 | epot = -21.1854964687721 | etot = -15.391225691086 +19000 ekin = 2.54963746369468 | erot = 3.12775559702552 | epot = -21.0796045258341 | etot = -15.4022114651139 +20000 ekin = 2.70343028147054 | erot = 3.48245634539085 | epot = -20.9620878080506 | etot = -14.7762011811892 +21000 ekin = 2.74008375980767 | erot = 3.49340976649893 | epot = -20.8605728519254 | etot = -14.6270793256188 +22000 ekin = 2.70619491966173 | erot = 3.39094503970526 | epot = -20.7832212738353 | etot = -14.6860813144683 +23000 ekin = 2.76977571935376 | erot = 2.96919161110174 | epot = -20.7244407619743 | etot = -14.9854734315188 +24000 ekin = 2.70661582607977 | erot = 2.7368811231863 | epot = -20.7053645378039 | etot = -15.2618675885378 +25000 ekin = 2.68754636497152 | erot = 2.61416599169544 | epot = -20.7064779461664 | etot = -15.4047655894994 +26000 ekin = 2.73235500408335 | erot = 2.73313459064972 | epot = -20.7277379348113 | etot = -15.2622483400782 +27000 ekin = 2.80776243953875 | erot = 2.57060961199333 | epot = -20.7536767854922 | etot = -15.3753047339601 +28000 ekin = 2.72026602469303 | erot = 2.48773762184112 | epot = -20.7972439765033 | etot = -15.5892403299692 +29000 ekin = 2.74993250614267 | erot = 2.43620019541717 | epot = -20.8845224755542 | etot = -15.6983897739944 +30000 ekin = 2.84727011110436 | erot = 2.55872515142542 | epot = -21.0029391367955 | etot = -15.5969438742657 +31000 ekin = 2.9373105145775 | erot = 2.68538653493624 | epot = -21.1441658724037 | etot = -15.52146882289 +32000 ekin = 3.11483472271262 | erot = 2.71833221771893 | epot = -21.3009630690853 | etot = -15.4677961286538 +33000 ekin = 3.420156896237 | erot = 3.01186958829685 | epot = -21.4445354747606 | etot = -15.0125089902268 +34000 ekin = 3.45714970534467 | erot = 3.34699175671057 | epot = -21.5750227937594 | etot = -14.7708813317042 +35000 ekin = 3.49497749393847 | erot = 3.14001434352622 | epot = -21.6604994386104 | etot = -15.0255076011457 +36000 ekin = 3.47204675153368 | erot = 2.84774400732499 | epot = -21.6891867301233 | etot = -15.3693959712647 +37000 ekin = 3.44180301616541 | erot = 2.56259280720522 | epot = -21.6709924941778 | etot = -15.6665966708072 +38000 ekin = 3.54821034228961 | erot = 2.44212751582542 | epot = -21.6265094810359 | etot = -15.6361716229209 +39000 ekin = 3.46871818671425 | erot = 2.3996020823067 | epot = -21.5379795382886 | etot = -15.6696592692677 +40000 ekin = 3.39697091933587 | erot = 2.06928828303179 | epot = -21.4180869184494 | etot = -15.9518277160818 +41000 ekin = 3.34648089211933 | erot = 2.10977053447765 | epot = -21.3088504303423 | etot = -15.8525990037453 +42000 ekin = 3.14017175730779 | erot = 2.61712762297441 | epot = -21.2075302208962 | etot = -15.450230840614 +43000 ekin = 3.05412713054855 | erot = 2.16422672116185 | epot = -21.1026514185808 | etot = -15.8842975668704 +44000 ekin = 2.8563652549228 | erot = 2.23456154398499 | epot = -21.0187138708968 | etot = -15.9277870719891 +45000 ekin = 2.71017763793129 | erot = 2.20442798009884 | epot = -20.9688571562277 | etot = -16.0542515381976 +46000 ekin = 2.80228666966602 | erot = 2.36912065742281 | epot = -20.9221917036258 | etot = -15.750784376537 +47000 ekin = 2.68398029783771 | erot = 2.30787382180577 | epot = -20.9147956898556 | etot = -15.9229415702121 +48000 ekin = 2.60361639221637 | erot = 2.16759706121354 | epot = -20.9378819526189 | etot = -16.166668499189 +49000 ekin = 2.6987952733265 | erot = 1.95331370371641 | epot = -20.9793801292351 | etot = -16.3272711521922 +50000 ekin = 2.78297818082632 | erot = 1.73866705563713 | epot = -21.0239873291857 | etot = -16.5023420927222 +51000 ekin = 2.79226298145989 | erot = 1.75750015205397 | epot = -21.0591817365135 | etot = -16.5094186029997 +52000 ekin = 2.93778678358835 | erot = 2.05248025310421 | epot = -21.1000263829064 | etot = -16.1097593462138 +53000 ekin = 2.93047021956224 | erot = 2.21318598351598 | epot = -21.1408129057595 | etot = -15.9971567026813 +54000 ekin = 2.95313738597265 | erot = 2.20797346738785 | epot = -21.1830307851602 | etot = -16.0219199317997 +55000 ekin = 2.98703149924487 | erot = 2.36965734625004 | epot = -21.2448833674046 | etot = -15.8881945219097 +56000 ekin = 2.9918847626884 | erot = 2.35374933057426 | epot = -21.3017374555429 | etot = -15.9561033622802 +57000 ekin = 3.04248410594257 | erot = 2.10923890188225 | epot = -21.3362725295755 | etot = -16.1845495217507 +58000 ekin = 2.98235297495945 | erot = 2.13409247728306 | epot = -21.3593231655096 | etot = -16.2428777132671 +59000 ekin = 2.91016949839304 | erot = 2.36822905479349 | epot = -21.3622398255745 | etot = -16.083841272388 +60000 ekin = 2.9725077920235 | erot = 2.54263250726515 | epot = -21.3342690818058 | etot = -15.8191287825172 +61000 ekin = 2.96790668494255 | erot = 2.48996902731659 | epot = -21.2724803895844 | etot = -15.8146046773253 +62000 ekin = 2.94610606099054 | erot = 2.18201665175963 | epot = -21.1879194614352 | etot = -16.059796748685 +63000 ekin = 3.02712147052615 | erot = 2.16093889178585 | epot = -21.0966584891443 | etot = -15.9085981268323 +64000 ekin = 3.20886369209217 | erot = 2.0693144064006 | epot = -21.0569971647534 | etot = -15.7788190662607 +65000 ekin = 3.22349334555756 | erot = 1.93510092297445 | epot = -21.0349289183421 | etot = -15.8763346498101 +66000 ekin = 3.10418207507132 | erot = 1.94339370515854 | epot = -21.0517453882432 | etot = -16.0041696080134 +67000 ekin = 3.12595764700021 | erot = 2.29857726165626 | epot = -21.1076206585503 | etot = -15.6830857498938 +68000 ekin = 2.99981867339099 | erot = 2.04147368191608 | epot = -21.1811986978272 | etot = -16.1399063425201 +69000 ekin = 2.93860333642774 | erot = 2.09583398354874 | epot = -21.2548061558297 | etot = -16.2203688358532 +70000 ekin = 2.94862796959938 | erot = 2.02427035214619 | epot = -21.3225756079774 | etot = -16.3496772862319 +71000 ekin = 2.95485075626802 | erot = 1.9804675253528 | epot = -21.3931478839353 | etot = -16.4578296023144 +72000 ekin = 3.03083521870645 | erot = 1.64033628981966 | epot = -21.4680680893692 | etot = -16.7968965808431 +73000 ekin = 3.20193349232362 | erot = 1.82676041495793 | epot = -21.5301957695024 | etot = -16.5015018622209 +74000 ekin = 3.22662444253097 | erot = 1.89227240506012 | epot = -21.5643738418553 | etot = -16.4454769942643 +75000 ekin = 3.28911018830876 | erot = 1.89872323449654 | epot = -21.5810306648804 | etot = -16.3931972420751 +76000 ekin = 3.29558374515735 | erot = 1.87444557500023 | epot = -21.5642338211322 | etot = -16.3942045009746 +77000 ekin = 3.54018909072077 | erot = 1.7572907653699 | epot = -21.5044360245146 | etot = -16.2069561684239 +78000 ekin = 3.54291076978584 | erot = 1.76974361090017 | epot = -21.4006101697986 | etot = -16.0879557891126 +79000 ekin = 3.54987455874813 | erot = 1.91515152695035 | epot = -21.2526696681999 | etot = -15.7876435825014 +80000 ekin = 3.44554692397026 | erot = 1.55785077520353 | epot = -21.1041761178578 | etot = -16.1007784186841 +81000 ekin = 3.39041332539999 | erot = 1.45777024027671 | epot = -20.9764951390215 | etot = -16.1283115733448 +82000 ekin = 3.28164787796649 | erot = 1.38380348431298 | epot = -20.899509162344 | etot = -16.2340578000645 +83000 ekin = 3.2711994674637 | erot = 1.61635220758894 | epot = -20.8682969771062 | etot = -15.9807453020535 +84000 ekin = 3.23767018514766 | erot = 1.58136727778769 | epot = -20.8558733748386 | etot = -16.0368359119032 +85000 ekin = 3.19513864200051 | erot = 1.64319108858878 | epot = -20.8419968518708 | etot = -16.0036671212815 +86000 ekin = 3.24896357270191 | erot = 1.89522046055132 | epot = -20.8328066333251 | etot = -15.6886226000718 +87000 ekin = 3.13174021654818 | erot = 1.94306423894154 | epot = -20.8481262288119 | etot = -15.7733217733222 +88000 ekin = 3.11122085279112 | erot = 1.78724048339194 | epot = -20.9059531901009 | etot = -16.0074918539178 +89000 ekin = 3.08381661724967 | erot = 1.63584870500638 | epot = -20.9715808309548 | etot = -16.2519155086988 +90000 ekin = 3.20313125753904 | erot = 1.94895881894576 | epot = -21.0671915523153 | etot = -15.9151014758305 +91000 ekin = 3.14651785772315 | erot = 2.26271277860543 | epot = -21.1780568094307 | etot = -15.7688261731021 +92000 ekin = 3.23402739820378 | erot = 2.38502646372715 | epot = -21.3058699018425 | etot = -15.6868160399115 +93000 ekin = 3.27864277718343 | erot = 2.22426372598659 | epot = -21.4112218809903 | etot = -15.9083153778203 +94000 ekin = 3.31438607736517 | erot = 2.13604324487189 | epot = -21.5023579935935 | etot = -16.0519286713564 +95000 ekin = 3.27323012344957 | erot = 2.3817868438853 | epot = -21.6160955797712 | etot = -15.9610786124363 +96000 ekin = 3.22326707535027 | erot = 2.54544679505643 | epot = -21.7318191046089 | etot = -15.9631052342022 +97000 ekin = 3.23424306839053 | erot = 2.64153427684313 | epot = -21.8458536800777 | etot = -15.9700763348441 +98000 ekin = 3.20883333988361 | erot = 2.67043755850074 | epot = -21.9495446261424 | etot = -16.070273727758 +99000 ekin = 3.11663851643537 | erot = 2.90733596256654 | epot = -22.0486791427266 | etot = -16.0247046637247 +100000 ekin = 3.03264321501926 | erot = 2.96946233520272 | epot = -22.1457931713674 | etot = -16.1436876211454 +101000 ekin = 2.95046281913221 | erot = 2.88464070608065 | epot = -22.2018281755497 | etot = -16.3667246503368 +102000 ekin = 2.85487641720317 | erot = 3.18352311497666 | epot = -22.1945156997858 | etot = -16.1561161676059 +103000 ekin = 2.83556367487544 | erot = 3.10626911100562 | epot = -22.1286684506118 | etot = -16.1868356647308 +104000 ekin = 2.74206313561189 | erot = 2.76469534508288 | epot = -22.0370967342097 | etot = -16.5303382535149 +105000 ekin = 2.68691210569757 | erot = 2.43510424243724 | epot = -21.9227484953522 | etot = -16.8007321472174 +106000 ekin = 2.5632306571111 | erot = 2.04976251036801 | epot = -21.8252352950753 | etot = -17.2122421275962 +107000 ekin = 2.45282193090847 | erot = 2.35578840258498 | epot = -21.7394205256345 | etot = -16.930810192141 +108000 ekin = 2.53861743899996 | erot = 2.41441398228762 | epot = -21.6772620188417 | etot = -16.7242305975541 +109000 ekin = 2.47502081207099 | erot = 2.24593310938323 | epot = -21.6325689491035 | etot = -16.9116150276492 +110000 ekin = 2.50321333342891 | erot = 1.86407174946136 | epot = -21.6221361025482 | etot = -17.2548510196579 +111000 ekin = 2.55274947911868 | erot = 1.93351998444029 | epot = -21.642435954763 | etot = -17.156166491204 +112000 ekin = 2.57554816024182 | erot = 1.85965001180021 | epot = -21.6646307305488 | etot = -17.2294325585067 +113000 ekin = 2.58422184546739 | erot = 1.6661260659466 | epot = -21.6825320885557 | etot = -17.4321841771417 +114000 ekin = 2.63767451071981 | erot = 1.86651684228484 | epot = -21.6875711888382 | etot = -17.1833798358336 +115000 ekin = 2.5585086928899 | erot = 1.95479352013927 | epot = -21.7088690741548 | etot = -17.1955668611256 +116000 ekin = 2.59960484914044 | erot = 1.98515359639084 | epot = -21.7399246709688 | etot = -17.1551662254375 +117000 ekin = 2.6364636182488 | erot = 2.15859263253909 | epot = -21.7790865447413 | etot = -16.9840302939534 +118000 ekin = 2.6722112411998 | erot = 2.07625368130402 | epot = -21.8132075002145 | etot = -17.0647425777106 +119000 ekin = 2.91085167645328 | erot = 1.98818490836518 | epot = -21.8375717289924 | etot = -16.9385351441739 +120000 ekin = 2.93975077154823 | erot = 1.99854094901667 | epot = -21.8494362428875 | etot = -16.9111445223226 +121000 ekin = 3.04700503953787 | erot = 2.15191677123412 | epot = -21.85263610441 | etot = -16.653714293638 +122000 ekin = 3.0197006563079 | erot = 2.09092735340922 | epot = -21.8688746811129 | etot = -16.7582466713958 +123000 ekin = 2.99309396144643 | erot = 1.76972828030718 | epot = -21.9045561644835 | etot = -17.1417339227298 +124000 ekin = 2.96321679602905 | erot = 1.96464026140175 | epot = -21.9325819137335 | etot = -17.0047248563027 +125000 ekin = 2.98312575423872 | erot = 1.64592593754597 | epot = -21.9608904634475 | etot = -17.3318387716628 +126000 ekin = 2.99097949215567 | erot = 1.75618745760138 | epot = -22.0097583194279 | etot = -17.2625913696708 +127000 ekin = 3.04267424627591 | erot = 1.84781956231799 | epot = -22.0474977427292 | etot = -17.1570039341353 +128000 ekin = 3.16299477926054 | erot = 1.98570527937052 | epot = -22.1060844986598 | etot = -16.9573844400288 +129000 ekin = 3.16426696344662 | erot = 1.97746137640529 | epot = -22.1606468653278 | etot = -17.0189185254759 +130000 ekin = 3.09082575381663 | erot = 2.52059065203424 | epot = -22.1892702662504 | etot = -16.5778538603996 +131000 ekin = 3.04363359740035 | erot = 2.76905383223607 | epot = -22.1941284862536 | etot = -16.3814410566171 +132000 ekin = 2.97799249868517 | erot = 2.58737442779091 | epot = -22.1487985926417 | etot = -16.5834316661656 +133000 ekin = 3.03410219436437 | erot = 2.49151216637022 | epot = -22.0390476094716 | etot = -16.513433248737 +134000 ekin = 2.97290518441653 | erot = 2.27955980622729 | epot = -21.9043568760918 | etot = -16.651891885448 +135000 ekin = 2.97882125899841 | erot = 2.36516672946397 | epot = -21.7588924186335 | etot = -16.4149044301711 +136000 ekin = 3.06225054874153 | erot = 1.85004987442537 | epot = -21.6100365266532 | etot = -16.6977361034863 +137000 ekin = 3.03515949013354 | erot = 1.79133727158631 | epot = -21.4833056014438 | etot = -16.656808839724 +138000 ekin = 2.98359986843838 | erot = 1.95427111240585 | epot = -21.3692118882269 | etot = -16.4313409073826 +139000 ekin = 3.00638756764291 | erot = 1.75390651791807 | epot = -21.2771971161583 | etot = -16.5169030305973 +140000 ekin = 2.9830152029022 | erot = 1.55293456918097 | epot = -21.208258242256 | etot = -16.6723084701728 +141000 ekin = 2.87341969180383 | erot = 1.62004287774022 | epot = -21.1593315472343 | etot = -16.6658689776903 +142000 ekin = 2.77198594269117 | erot = 1.82883994332524 | epot = -21.1253786225535 | etot = -16.5245527365371 +143000 ekin = 2.66544385214397 | erot = 1.70763016025297 | epot = -21.1194742186356 | etot = -16.7464002062387 +144000 ekin = 2.64364564452786 | erot = 2.02089778883362 | epot = -21.1558312252309 | etot = -16.4912877918694 +145000 ekin = 2.58320561695141 | erot = 2.33928617610571 | epot = -21.1972194246108 | etot = -16.2747276315537 +146000 ekin = 2.59582465617015 | erot = 2.39139100798266 | epot = -21.2181779484861 | etot = -16.2309622843333 +147000 ekin = 2.57433616776254 | erot = 2.62068830532513 | epot = -21.2035776919779 | etot = -16.0085532188902 +148000 ekin = 2.66661322554079 | erot = 2.64858494989764 | epot = -21.1567312792461 | etot = -15.8415331038077 +149000 ekin = 2.60767807433569 | erot = 2.2443534552845 | epot = -21.1005834026185 | etot = -16.2485518729983 +150000 ekin = 2.54139526377891 | erot = 2.28883985685592 | epot = -21.0349331020296 | etot = -16.2046979813948 +151000 ekin = 2.54322194136655 | erot = 2.35864839828535 | epot = -20.9724639116438 | etot = -16.0705935719919 +152000 ekin = 2.56796491103015 | erot = 2.43023333349196 | epot = -20.9157846601099 | etot = -15.9175864155878 +153000 ekin = 2.51372807626571 | erot = 2.39277188889786 | epot = -20.8708281017582 | etot = -15.9643281365947 +154000 ekin = 2.56425050300777 | erot = 2.55681269376796 | epot = -20.820806189713 | etot = -15.6997429929373 +155000 ekin = 2.54836883214872 | erot = 2.77382882086449 | epot = -20.7512322840952 | etot = -15.4290346310819 +156000 ekin = 2.5043034111557 | erot = 2.84536424459339 | epot = -20.6831823234817 | etot = -15.3335146677326 +157000 ekin = 2.50400336317658 | erot = 2.74300988092659 | epot = -20.6024983277711 | etot = -15.3554850836679 +158000 ekin = 2.46635677816755 | erot = 2.72725266952939 | epot = -20.3927742179106 | etot = -15.1991647702137 +159000 ekin = 2.41243392896904 | erot = 2.89017327284231 | epot = -20.3716899613966 | etot = -15.0690827595852 +160000 ekin = 2.44543789794343 | erot = 2.94805496717105 | epot = -20.5757394278764 | etot = -15.182246562762 +161000 ekin = 2.48584882392462 | erot = 3.0855000004303 | epot = -20.7243276115621 | etot = -15.1529787872072 +162000 ekin = 2.63092470794179 | erot = 2.84912777185641 | epot = -20.8061639431944 | etot = -15.3261114633962 +163000 ekin = 2.72019716465019 | erot = 2.95674331723606 | epot = -20.9203905101816 | etot = -15.2434500282953 +164000 ekin = 2.85144745755518 | erot = 2.79837544407189 | epot = -21.059920844175 | etot = -15.4100979425479 +165000 ekin = 3.01926698163447 | erot = 2.57598017599233 | epot = -21.2160748663888 | etot = -15.620827708762 +166000 ekin = 3.1597503290263 | erot = 2.53424140536847 | epot = -21.3722197077627 | etot = -15.6782279733679 +167000 ekin = 3.28010263683416 | erot = 2.66118639042397 | epot = -21.5168932797697 | etot = -15.5756042525116 +168000 ekin = 3.30088936113466 | erot = 2.65708015641673 | epot = -21.6596207437233 | etot = -15.7016512261719 +169000 ekin = 3.47029246215385 | erot = 2.25395751697306 | epot = -21.7742578136394 | etot = -16.0500078345125 +170000 ekin = 3.70050747267222 | erot = 2.16365167905449 | epot = -21.874839145911 | etot = -16.0106799941843 +171000 ekin = 3.84839140735084 | erot = 1.87628165448692 | epot = -21.9555399182122 | etot = -16.2308668563745 +172000 ekin = 3.95026415662096 | erot = 1.96481352720162 | epot = -21.9987319268215 | etot = -16.083654242999 +173000 ekin = 3.92397418949733 | erot = 2.14024865545683 | epot = -21.9962461659819 | etot = -15.9320233210278 +174000 ekin = 3.91787773957974 | erot = 2.15382550531679 | epot = -21.9649412516534 | etot = -15.8932380067568 +175000 ekin = 3.92478898493237 | erot = 1.81413864863455 | epot = -21.8860588210322 | etot = -16.1471311874653 +176000 ekin = 3.61843418337274 | erot = 1.68410090365154 | epot = -21.786103239384 | etot = -16.4835681523598 +177000 ekin = 3.4377743722168 | erot = 1.50869914434537 | epot = -21.6530103766415 | etot = -16.7065368600793 +178000 ekin = 3.29404805426692 | erot = 1.54702143204467 | epot = -21.5151124491373 | etot = -16.6740429628257 +179000 ekin = 3.15559273998204 | erot = 1.8346142003624 | epot = -21.384626452117 | etot = -16.3944195117726 +180000 ekin = 3.11144262168977 | erot = 1.96187195470704 | epot = -21.2631791815958 | etot = -16.1898646051989 +181000 ekin = 2.86058839708627 | erot = 1.9791666278232 | epot = -21.1736204719048 | etot = -16.3338654469954 +182000 ekin = 2.73358163055365 | erot = 2.08235166110568 | epot = -21.1163854347032 | etot = -16.3004521430439 +183000 ekin = 2.78667823921493 | erot = 2.14955927554272 | epot = -21.0704997912635 | etot = -16.1342622765058 +184000 ekin = 2.74700284417942 | erot = 2.17568363892107 | epot = -21.0417241927554 | etot = -16.1190377096549 +185000 ekin = 2.712067005484 | erot = 2.43154766133345 | epot = -21.0534073134643 | etot = -15.9097926466468 +186000 ekin = 2.70473969876207 | erot = 2.54763882184431 | epot = -21.0771037789773 | etot = -15.824725258371 +187000 ekin = 2.69011328843059 | erot = 2.42677059090821 | epot = -21.1334063747327 | etot = -16.0165224953939 +188000 ekin = 2.63139574425883 | erot = 2.47663409366879 | epot = -21.2056416357497 | etot = -16.0976117978221 +189000 ekin = 2.52625691649438 | erot = 2.3681103054878 | epot = -21.2763445168884 | etot = -16.3819772949062 +190000 ekin = 2.55070314102265 | erot = 2.46381370096641 | epot = -21.3751397733681 | etot = -16.3606229313791 +191000 ekin = 2.62917079754897 | erot = 2.67833301813009 | epot = -21.4532628428639 | etot = -16.1457590271848 +192000 ekin = 2.58870583923174 | erot = 3.04288815538934 | epot = -21.5216329873862 | etot = -15.8900389927651 +193000 ekin = 2.57473296407416 | erot = 2.98273386984072 | epot = -21.5752070232355 | etot = -16.0177401893206 +194000 ekin = 2.55188197567089 | erot = 3.53664565918029 | epot = -21.6029115846235 | etot = -15.5143839497724 +195000 ekin = 2.37005947654562 | erot = 3.88569194357622 | epot = -21.5199791042825 | etot = -15.2642276841606 +196000 ekin = 2.24643312652479 | erot = 3.89236383309536 | epot = -21.4290282307872 | etot = -15.2902312711671 +197000 ekin = 2.08212744149216 | erot = 3.73392747991452 | epot = -21.3909391389937 | etot = -15.574884217587 +198000 ekin = 1.99546802101167 | erot = 3.31869767813097 | epot = -21.3106385880562 | etot = -15.9964728889136 +199000 ekin = 1.88808259694768 | erot = 3.05651027418434 | epot = -21.1932358978994 | etot = -16.2486430267674 +200000 ekin = 1.86182600189617 | erot = 3.12152068869519 | epot = -21.1112046099847 | etot = -16.1278579193933 +201000 ekin = 1.97052135402485 | erot = 2.56337970690564 | epot = -21.081815037023 | etot = -16.5479139760925 +202000 ekin = 1.96444489641647 | erot = 2.52188298721408 | epot = -21.0909969362213 | etot = -16.6046690525908 +203000 ekin = 2.02727163636658 | erot = 2.40435818767024 | epot = -21.1422876293972 | etot = -16.7106578053604 +204000 ekin = 2.08583315864169 | erot = 2.40223613667985 | epot = -21.2224635405408 | etot = -16.7343942452193 +205000 ekin = 2.20775264966635 | erot = 2.45569503503489 | epot = -21.3216506287514 | etot = -16.6582029440502 +206000 ekin = 2.3252558114439 | erot = 2.44338569524396 | epot = -21.4263895154157 | etot = -16.6577480087279 +207000 ekin = 2.39884741653078 | erot = 2.19219588140548 | epot = -21.5586341308419 | etot = -16.9675908329056 +208000 ekin = 2.5417416133168 | erot = 2.02043086482636 | epot = -21.7018700931409 | etot = -17.1396976149977 +209000 ekin = 2.6346029520279 | erot = 2.00847282239021 | epot = -21.8765502984946 | etot = -17.2334745240765 +210000 ekin = 2.81803535020483 | erot = 2.15132327942401 | epot = -22.0655129469125 | etot = -17.0961543172836 +211000 ekin = 2.8544966933983 | erot = 2.00032723609073 | epot = -22.2569212397587 | etot = -17.4020973102697 +212000 ekin = 2.93298840099946 | erot = 2.18896574432203 | epot = -22.4295331026806 | etot = -17.3075789573591 +213000 ekin = 3.04393339596819 | erot = 2.16674803090435 | epot = -22.5865045861155 | etot = -17.3758231592429 +214000 ekin = 3.17687786434383 | erot = 1.9320460445079 | epot = -22.7049386266082 | etot = -17.5960147177564 +215000 ekin = 3.23140803215869 | erot = 1.91093387521923 | epot = -22.7702150399471 | etot = -17.6278731325691 +216000 ekin = 3.23213410508674 | erot = 1.8676094366755 | epot = -22.8077327389954 | etot = -17.7079891972331 +217000 ekin = 3.29951241617981 | erot = 1.99642477225938 | epot = -22.8230103446112 | etot = -17.527073156172 +218000 ekin = 3.29737584458636 | erot = 1.96274603890197 | epot = -22.8136249789525 | etot = -17.5535030954641 +219000 ekin = 3.23565881897553 | erot = 1.94555976805409 | epot = -22.8103460409254 | etot = -17.6291274538957 +220000 ekin = 3.19248478951652 | erot = 2.1454971546158 | epot = -22.8135403395689 | etot = -17.4755583954366 +221000 ekin = 3.08489658572221 | erot = 2.35182511982451 | epot = -22.7936924594888 | etot = -17.356970753942 +222000 ekin = 2.98911659742777 | erot = 2.24286093437231 | epot = -22.7593104849619 | etot = -17.5273329531618 +223000 ekin = 2.94028114747171 | erot = 2.45179850593564 | epot = -22.7094689680864 | etot = -17.3173893146791 +224000 ekin = 2.86327223103166 | erot = 2.45496570504129 | epot = -22.6840408073417 | etot = -17.3658028712688 +225000 ekin = 2.86217589447829 | erot = 2.64576978314411 | epot = -22.7094594459947 | etot = -17.2015137683723 +226000 ekin = 2.81421750908743 | erot = 2.65054275980961 | epot = -22.7920788909684 | etot = -17.3273186220714 +227000 ekin = 2.76125022534676 | erot = 2.53291854231086 | epot = -22.8714022097527 | etot = -17.577233442095 +228000 ekin = 2.78877138535049 | erot = 2.36581554391 | epot = -22.9403431333365 | etot = -17.785756204076 +229000 ekin = 2.72891406599667 | erot = 2.3676118984917 | epot = -22.9752057147158 | etot = -17.8786797502274 +230000 ekin = 2.73218055588349 | erot = 2.27179336612923 | epot = -22.9619591335888 | etot = -17.957985211576 +231000 ekin = 2.78238304060714 | erot = 2.56004300399624 | epot = -22.9015540669898 | etot = -17.5591280223865 +232000 ekin = 2.70574670734534 | erot = 2.20917728909302 | epot = -22.8024125768836 | etot = -17.8874885804452 +233000 ekin = 2.64840920464742 | erot = 2.10191715204331 | epot = -22.6817951010109 | etot = -17.9314687443202 +234000 ekin = 2.61941879874168 | erot = 1.89218225093232 | epot = -22.5506641543627 | etot = -18.0390631046887 +235000 ekin = 2.59340202709224 | erot = 1.81296941612975 | epot = -22.4559841307523 | etot = -18.0496126875303 +236000 ekin = 2.51387645324668 | erot = 1.87601834806579 | epot = -22.36020773658 | etot = -17.9703129352675 +237000 ekin = 2.4869760697627 | erot = 1.8872559853993 | epot = -22.2423219253942 | etot = -17.8680898702322 +238000 ekin = 2.4616064489039 | erot = 1.69677740799995 | epot = -22.1532316635744 | etot = -17.9948478066705 +239000 ekin = 2.42201063037747 | erot = 1.70150164392287 | epot = -22.1281108141978 | etot = -18.0045985398974 +240000 ekin = 2.37084323379687 | erot = 1.98736224075235 | epot = -22.1423976045622 | etot = -17.784192130013 +241000 ekin = 2.37738836540319 | erot = 2.31585984211781 | epot = -22.1830534944815 | etot = -17.4898052869605 +242000 ekin = 2.41676243464678 | erot = 2.5528014206363 | epot = -22.1811996624362 | etot = -17.2116358071531 +243000 ekin = 2.33148792530051 | erot = 2.76551405431946 | epot = -22.1959816056367 | etot = -17.0989796260167 +244000 ekin = 2.38360456402087 | erot = 2.74375775378546 | epot = -22.353019513755 | etot = -17.2256571959487 +245000 ekin = 2.33752620010189 | erot = 2.63541001293064 | epot = -22.5037249285206 | etot = -17.5307887154881 +246000 ekin = 2.25775984192156 | erot = 2.49145900746122 | epot = -22.6039669429677 | etot = -17.8547480935849 +247000 ekin = 2.20328096321354 | erot = 2.51295988229199 | epot = -22.6897860502885 | etot = -17.9735452047829 +248000 ekin = 2.112151354048 | erot = 2.38179652938581 | epot = -22.7654961945531 | etot = -18.2715483111193 +249000 ekin = 2.18103243553702 | erot = 2.12199506651665 | epot = -22.8086866218617 | etot = -18.5056591198081 +250000 ekin = 2.00642865007494 | erot = 2.13785268765967 | epot = -22.7981127674597 | etot = -18.6538314297251 +251000 ekin = 2.0081090206784 | erot = 2.15377771615681 | epot = -22.7541924896506 | etot = -18.5923057528154 +252000 ekin = 2.04967696381093 | erot = 2.10564030292912 | epot = -22.7175683002137 | etot = -18.5622510334737 +253000 ekin = 1.97178429049464 | erot = 2.56395759404191 | epot = -22.6833423138514 | etot = -18.1476004293148 +254000 ekin = 1.89998560000744 | erot = 2.7644634625402 | epot = -22.652550739486 | etot = -17.9881016769384 +255000 ekin = 1.92358808504085 | erot = 2.82321806552328 | epot = -22.6339519254389 | etot = -17.8871457748748 +256000 ekin = 1.8853792482747 | erot = 2.39478935532051 | epot = -22.6063238269834 | etot = -18.3261552233881 +257000 ekin = 1.89017314858323 | erot = 2.47354789341061 | epot = -22.5844642699129 | etot = -18.2207432279191 +258000 ekin = 2.03347535796375 | erot = 2.0639166704276 | epot = -22.5636266221106 | etot = -18.4662345937192 +259000 ekin = 2.08170419875297 | erot = 1.98311262235166 | epot = -22.5595893965745 | etot = -18.4947725754699 +260000 ekin = 2.15465691022489 | erot = 1.92890944309583 | epot = -22.5702550804875 | etot = -18.4866887271667 +261000 ekin = 2.1852590897665 | erot = 1.8066804326572 | epot = -22.5996038556691 | etot = -18.6076643332454 +262000 ekin = 2.39558735865994 | erot = 1.7710110990717 | epot = -22.6433503794796 | etot = -18.476751921748 +263000 ekin = 2.51566381481672 | erot = 1.74502710268517 | epot = -22.7083481578159 | etot = -18.4476572403141 +264000 ekin = 2.61294097754958 | erot = 1.72004349105586 | epot = -22.787072777371 | etot = -18.4540883087656 +265000 ekin = 2.69751103648208 | erot = 1.73596878524942 | epot = -22.876113825704 | etot = -18.4426340039725 +266000 ekin = 2.73317595749248 | erot = 2.00190945895265 | epot = -22.9815854287863 | etot = -18.2465000123412 +267000 ekin = 2.88777944401859 | erot = 2.03601396733327 | epot = -23.0741467375983 | etot = -18.1503533262464 +268000 ekin = 2.88428212564758 | erot = 2.3921025045242 | epot = -23.1701763705664 | etot = -17.8937917403946 +269000 ekin = 2.94011387527547 | erot = 2.47436168171159 | epot = -23.2463195301015 | etot = -17.8318439731145 +270000 ekin = 3.16907204765191 | erot = 2.44558507843772 | epot = -23.2623613561913 | etot = -17.6477042301017 +271000 ekin = 3.2333039510143 | erot = 2.22964844922974 | epot = -23.2347949376338 | etot = -17.7718425373897 +272000 ekin = 3.25903447141499 | erot = 2.27670268800702 | epot = -23.1776976604854 | etot = -17.6419605010634 +273000 ekin = 3.33084558602097 | erot = 2.3473050651847 | epot = -23.0897292017611 | etot = -17.4115785505554 +274000 ekin = 3.13365175221761 | erot = 2.28906991347369 | epot = -22.970791629232 | etot = -17.5480699635407 +275000 ekin = 3.06411601298027 | erot = 2.05657284383682 | epot = -22.8411592683854 | etot = -17.7204704115683 +276000 ekin = 3.00284299412667 | erot = 2.41503398631213 | epot = -22.700654835852 | etot = -17.2827778554132 +277000 ekin = 2.88988536066512 | erot = 2.56679455786094 | epot = -22.5600288715065 | etot = -17.1033489529804 +278000 ekin = 2.79983988341306 | erot = 2.44718365696948 | epot = -22.4337020220078 | etot = -17.1866784816253 +279000 ekin = 2.62025699943799 | erot = 2.34403355986971 | epot = -22.3217153271847 | etot = -17.357424767877 +280000 ekin = 2.65113378626865 | erot = 2.38211104337876 | epot = -22.213634072387 | etot = -17.1803892427396 +281000 ekin = 2.56011045257063 | erot = 2.14040765533489 | epot = -22.1467069298696 | etot = -17.446188821964 +282000 ekin = 2.46937295979428 | erot = 2.08425434958577 | epot = -22.1062066499082 | etot = -17.5525793405281 +283000 ekin = 2.44420819687498 | erot = 1.8804700883888 | epot = -22.0682236162877 | etot = -17.7435453310239 +284000 ekin = 2.39435456980274 | erot = 2.14903249361609 | epot = -22.0569027581283 | etot = -17.5135156947095 +285000 ekin = 2.3970352250904 | erot = 2.56964603915915 | epot = -22.0888499478263 | etot = -17.1221686835767 +286000 ekin = 2.43717149651532 | erot = 2.84247600307286 | epot = -22.1412346796126 | etot = -16.8615871800244 +287000 ekin = 2.31664233692346 | erot = 2.84674819551605 | epot = -22.1861386782241 | etot = -17.0227481457846 +288000 ekin = 2.26607109317387 | erot = 3.21299363478899 | epot = -22.2378784042867 | etot = -16.7588136763238 +289000 ekin = 2.29584076229561 | erot = 3.11249259323246 | epot = -22.2883115241199 | etot = -16.8799781685918 +290000 ekin = 2.2304990206166 | erot = 2.87013105088144 | epot = -22.31434015915 | etot = -17.213710087652 +291000 ekin = 2.21755828984435 | erot = 2.71274244030915 | epot = -22.3410646593233 | etot = -17.4107639291698 +292000 ekin = 2.21317296232834 | erot = 2.69582872791191 | epot = -22.3827626255974 | etot = -17.4737609353572 +293000 ekin = 2.23081262903896 | erot = 2.60204748252234 | epot = -22.4352222519782 | etot = -17.6023621404169 +294000 ekin = 2.26311425147052 | erot = 3.03410577179159 | epot = -22.4683441344049 | etot = -17.1711241111428 +295000 ekin = 2.28122075778682 | erot = 2.86887170599451 | epot = -22.4906039301706 | etot = -17.3405114663893 +296000 ekin = 2.26383415546926 | erot = 2.78467774936793 | epot = -22.512972044678 | etot = -17.4644601398408 +297000 ekin = 2.33825045335869 | erot = 2.98513561564364 | epot = -22.5191664894368 | etot = -17.1957804204345 +298000 ekin = 2.37786827340735 | erot = 2.85984647447046 | epot = -22.5058515980851 | etot = -17.2681368502073 +299000 ekin = 2.32052037098622 | erot = 2.69480633982959 | epot = -22.4889248916846 | etot = -17.4735981808687 +300000 ekin = 2.30322327761376 | erot = 2.72939848613209 | epot = -22.4591258064481 | etot = -17.4265040427023 +301000 ekin = 2.29995331731943 | erot = 2.60777958693866 | epot = -22.4102468930605 | etot = -17.5025139888024 +302000 ekin = 2.31454372799491 | erot = 2.67298740529848 | epot = -22.3501115787882 | etot = -17.3625804454948 +303000 ekin = 2.4057635722635 | erot = 2.41520690493577 | epot = -22.2832063980303 | etot = -17.462235920831 +304000 ekin = 2.35524162584705 | erot = 2.05432603043707 | epot = -22.2112103404667 | etot = -17.8016426841826 +305000 ekin = 2.30537591124517 | erot = 1.98023337779149 | epot = -22.1649123466498 | etot = -17.8793030576131 +306000 ekin = 2.32478727778818 | erot = 1.89519445956124 | epot = -22.1442852026109 | etot = -17.9243034652615 +307000 ekin = 2.41423624130649 | erot = 1.91431870573664 | epot = -22.1548620004649 | etot = -17.8263070534218 +308000 ekin = 2.44675290257478 | erot = 2.31210197406256 | epot = -22.2055558309842 | etot = -17.4467009543468 +309000 ekin = 2.45673374131202 | erot = 2.16129470434173 | epot = -22.2742892000821 | etot = -17.6562607544283 +310000 ekin = 2.5816765776324 | erot = 2.43846943017109 | epot = -22.3327423848022 | etot = -17.3125963769987 +311000 ekin = 2.52939449011354 | erot = 2.76106281819526 | epot = -22.3705094869032 | etot = -17.0800521785944 +312000 ekin = 2.52610661112941 | erot = 2.98071467503416 | epot = -22.3866205343173 | etot = -16.8797992481538 +313000 ekin = 2.5240567165484 | erot = 2.80377255965813 | epot = -22.4049055192049 | etot = -17.0770762429984 +314000 ekin = 2.65040443727043 | erot = 2.69900889453188 | epot = -22.3876700619111 | etot = -17.0382567301088 +315000 ekin = 2.74472815623847 | erot = 2.66340996418727 | epot = -22.3592685134388 | etot = -16.951130393013 +316000 ekin = 2.83270806183616 | erot = 2.68346240186182 | epot = -22.3041387808832 | etot = -16.7879683171853 +317000 ekin = 2.98267354986778 | erot = 2.49998910531225 | epot = -22.2250773416349 | etot = -16.7424146864549 +318000 ekin = 2.95159865011169 | erot = 2.46437525131283 | epot = -22.1605195993974 | etot = -16.7445456979729 +319000 ekin = 2.99544196834471 | erot = 2.37119170515196 | epot = -22.0922506560637 | etot = -16.725616982567 +320000 ekin = 3.12952415968031 | erot = 2.25302267428102 | epot = -22.019340284027 | etot = -16.6367934500656 +321000 ekin = 3.21184303812898 | erot = 2.03139593747186 | epot = -21.9793920725112 | etot = -16.7361530969103 +322000 ekin = 3.32994096856484 | erot = 2.34110893676891 | epot = -21.976319235169 | etot = -16.3052693298352 +323000 ekin = 3.41272790799865 | erot = 2.43631206380514 | epot = -22.0140123354235 | etot = -16.1649723636197 +324000 ekin = 3.63714885281349 | erot = 1.9465124176185 | epot = -22.088735892451 | etot = -16.505074622019 +325000 ekin = 3.64965023300834 | erot = 1.83594979903828 | epot = -22.1597106232423 | etot = -16.6741105911957 +326000 ekin = 3.7993132385246 | erot = 1.60564512903883 | epot = -22.2163199739485 | etot = -16.8113616063851 +327000 ekin = 3.85106864316211 | erot = 1.8544923321543 | epot = -22.2856422481554 | etot = -16.580081272839 +328000 ekin = 3.95505458701141 | erot = 2.12895030409338 | epot = -22.341235179965 | etot = -16.2572302888602 +329000 ekin = 3.96560356728828 | erot = 2.06124066393336 | epot = -22.375273676819 | etot = -16.3484294455974 +330000 ekin = 4.00004269284724 | erot = 2.01808790805426 | epot = -22.3671090028812 | etot = -16.3489784019797 +331000 ekin = 3.84205146855943 | erot = 1.89603876125699 | epot = -22.3128837484492 | etot = -16.5747935186328 +332000 ekin = 3.66184063362548 | erot = 2.39349988256136 | epot = -22.2576238736144 | etot = -16.2022833574276 +333000 ekin = 3.52628969259455 | erot = 2.20415103930269 | epot = -22.1847867511304 | etot = -16.4543460192331 +334000 ekin = 3.34377798013965 | erot = 2.36266544381965 | epot = -22.1376045131508 | etot = -16.4311610891915 +335000 ekin = 3.23745330446362 | erot = 2.56905504387933 | epot = -22.1187474004991 | etot = -16.3122390521561 +336000 ekin = 3.15020041660115 | erot = 2.76447823600581 | epot = -22.1164491906302 | etot = -16.2017705380232 +337000 ekin = 2.95647753165982 | erot = 3.39203265805591 | epot = -22.1578850568604 | etot = -15.8093748671446 +338000 ekin = 2.77494351817588 | erot = 3.38702940437079 | epot = -22.202861556972 | etot = -16.0408886344253 +339000 ekin = 2.56974792274944 | erot = 3.36393768621199 | epot = -22.2430377961408 | etot = -16.3093521871794 +340000 ekin = 2.54624997134431 | erot = 3.18838906080724 | epot = -22.2696997292611 | etot = -16.5350606971095 +341000 ekin = 2.46680453333096 | erot = 3.23666697035712 | epot = -22.271405486473 | etot = -16.5679339827849 +342000 ekin = 2.41970796988162 | erot = 3.10075257077717 | epot = -22.2625825508722 | etot = -16.7421220102134 +343000 ekin = 2.39134830962091 | erot = 2.99983011061325 | epot = -22.2626100438684 | etot = -16.8714316236342 +344000 ekin = 2.40072375544811 | erot = 3.07461576439211 | epot = -22.2332671874545 | etot = -16.7579276676142 +345000 ekin = 2.47818664391048 | erot = 3.0187860642563 | epot = -22.1765310886862 | etot = -16.6795583805194 +346000 ekin = 2.42322520039712 | erot = 2.49312120205076 | epot = -22.1072756725382 | etot = -17.1909292700903 +347000 ekin = 2.50705041682171 | erot = 2.52533205787059 | epot = -22.0719334103213 | etot = -17.039550935629 +348000 ekin = 2.50030685159476 | erot = 2.73825503551145 | epot = -22.0270671882385 | etot = -16.7885053011322 +349000 ekin = 2.60963103698133 | erot = 2.79443949989289 | epot = -21.9800449664782 | etot = -16.5759744296039 +350000 ekin = 2.57407872164997 | erot = 2.87849433187397 | epot = -21.9210551857959 | etot = -16.468482132272 +351000 ekin = 2.60900955228816 | erot = 2.47335254246402 | epot = -21.9029016387205 | etot = -16.8205395439683 +352000 ekin = 2.68632626573676 | erot = 2.16861659144726 | epot = -21.8932933758344 | etot = -17.0383505186504 +353000 ekin = 2.72806527094876 | erot = 2.21631476958766 | epot = -21.8949965382939 | etot = -16.9506164977575 +354000 ekin = 2.80926057411823 | erot = 2.29356292718614 | epot = -21.9255698630403 | etot = -16.8227463617359 +355000 ekin = 2.82955370341647 | erot = 2.23886374167674 | epot = -21.9739881370165 | etot = -16.9055706919233 +356000 ekin = 2.95318161283299 | erot = 2.20593846887508 | epot = -22.0378541396093 | etot = -16.8787340579012 +357000 ekin = 3.00516452100415 | erot = 2.39489434202976 | epot = -22.1045635884317 | etot = -16.7045047253978 +358000 ekin = 3.14013674094321 | erot = 2.81648025756423 | epot = -22.1940030034415 | etot = -16.237386004934 +359000 ekin = 3.24895307320306 | erot = 2.89756918684587 | epot = -22.2894356246554 | etot = -16.1429133646064 +360000 ekin = 3.29499898808933 | erot = 2.69446962924553 | epot = -22.3827935430047 | etot = -16.3933249256699 +361000 ekin = 3.31826252960456 | erot = 3.08121996997187 | epot = -22.3855376265962 | etot = -15.9860551270198 +362000 ekin = 3.22507380499808 | erot = 2.94494755594777 | epot = -22.1939077776813 | etot = -16.0238864167354 +363000 ekin = 3.31998300083524 | erot = 2.84571871387882 | epot = -22.1418339144076 | etot = -15.9761321996935 +364000 ekin = 3.46138826026378 | erot = 3.17267347021667 | epot = -22.2920001905049 | etot = -15.6579384600244 +365000 ekin = 3.41685157685527 | erot = 2.95127990795427 | epot = -22.240326005598 | etot = -15.8721945207884 +366000 ekin = 3.28889153330098 | erot = 2.68298751094302 | epot = -22.0917647614673 | etot = -16.1198857172233 +367000 ekin = 3.13188043782657 | erot = 2.32272362557592 | epot = -21.9624425815386 | etot = -16.5078385181361 +368000 ekin = 3.05635233611774 | erot = 2.49179825174051 | epot = -21.8924084965111 | etot = -16.3442579086529 +369000 ekin = 2.97979500179328 | erot = 2.09677594955095 | epot = -21.8535972953631 | etot = -16.7770263440189 +370000 ekin = 2.86265256457595 | erot = 2.27837964431441 | epot = -21.8636474872574 | etot = -16.722615278367 +371000 ekin = 2.81676366518709 | erot = 2.51005420363845 | epot = -21.8612307947661 | etot = -16.5344129259405 +372000 ekin = 2.89056214524116 | erot = 2.17924443857032 | epot = -21.8465926809761 | etot = -16.7767860971646 +373000 ekin = 2.8570298581495 | erot = 2.22607119851538 | epot = -21.8235708010655 | etot = -16.7404697444006 +374000 ekin = 2.69116258554315 | erot = 2.54595039875577 | epot = -21.8020300439681 | etot = -16.5649170596691 +375000 ekin = 2.65367735566843 | erot = 2.84882366948601 | epot = -21.7972775666776 | etot = -16.2947765415232 +376000 ekin = 2.56541501683978 | erot = 3.15381436306351 | epot = -21.8007765642059 | etot = -16.0815471843026 +377000 ekin = 2.51617117441618 | erot = 3.3450646638395 | epot = -21.7780898056687 | etot = -15.916853967413 +378000 ekin = 2.39886036582813 | erot = 3.14706842402749 | epot = -21.7384304892538 | etot = -16.1925016993981 +379000 ekin = 2.3253462058556 | erot = 2.94670382278376 | epot = -21.6782824657577 | etot = -16.4062324371184 +380000 ekin = 2.15266052745908 | erot = 3.4385709524693 | epot = -21.603829406221 | etot = -16.0125979262926 +381000 ekin = 2.13714114193707 | erot = 3.11249169114188 | epot = -21.5367992698036 | etot = -16.2871664367247 +382000 ekin = 2.05496339747556 | erot = 3.44869747601523 | epot = -21.4764708985237 | etot = -15.972810025033 +383000 ekin = 2.03169806552601 | erot = 3.38753191033151 | epot = -21.41731912066 | etot = -15.9980891448025 +384000 ekin = 1.95364649921204 | erot = 3.35746983585197 | epot = -21.3597667304036 | etot = -16.0486503953396 +385000 ekin = 1.95295295831859 | erot = 3.20059142565729 | epot = -21.3242192311683 | etot = -16.1706748471924 +386000 ekin = 2.03545459887455 | erot = 2.63337254678625 | epot = -21.3197581171679 | etot = -16.6509309715071 +387000 ekin = 2.08744315207298 | erot = 2.67515413940826 | epot = -21.3219783057837 | etot = -16.5593810143025 +388000 ekin = 2.10460844408253 | erot = 2.63750027619805 | epot = -21.3534873824529 | etot = -16.6113786621724 +389000 ekin = 2.13617356385001 | erot = 2.49874264909327 | epot = -21.4010667143315 | etot = -16.7661505013883 +390000 ekin = 2.21418863130718 | erot = 2.61354129728496 | epot = -21.4597800849526 | etot = -16.6320501563605 +391000 ekin = 2.30830767897515 | erot = 2.4215513814523 | epot = -21.5215483863442 | etot = -16.7916893259168 +392000 ekin = 2.30978428581522 | erot = 2.27021166226852 | epot = -21.5693953401794 | etot = -16.9893993920957 +393000 ekin = 2.43507049787362 | erot = 2.19525621528512 | epot = -21.6165022301659 | etot = -16.9861755170072 +394000 ekin = 2.48175272100126 | erot = 1.97403757750059 | epot = -21.643553588929 | etot = -17.1877632904271 +395000 ekin = 2.57078024352592 | erot = 1.94477022107788 | epot = -21.7032003447496 | etot = -17.1876498801457 +396000 ekin = 2.63856854694597 | erot = 2.15467094485357 | epot = -21.7518329108742 | etot = -16.9585934190747 +397000 ekin = 2.67333204158365 | erot = 2.1041553022136 | epot = -21.787492252614 | etot = -17.0100049088167 +398000 ekin = 2.7165721744556 | erot = 2.27260876442706 | epot = -21.7955669580493 | etot = -16.8063860191666 +399000 ekin = 2.74052903416011 | erot = 1.98188508417864 | epot = -21.7850112801672 | etot = -17.0625971618285 +400000 ekin = 2.72461700644124 | erot = 1.79309630627408 | epot = -21.7479203148977 | etot = -17.2302070021823 +401000 ekin = 2.67821010319074 | erot = 1.80652566016293 | epot = -21.698608702759 | etot = -17.2138729394054 +402000 ekin = 2.66678843641966 | erot = 1.99143851830836 | epot = -21.6166886330482 | etot = -16.9584616783202 +403000 ekin = 2.71498615143731 | erot = 2.00496282624765 | epot = -21.5303765730254 | etot = -16.8104275953404 +404000 ekin = 2.72798047530906 | erot = 1.97802766069345 | epot = -21.4249267789287 | etot = -16.7189186429262 +405000 ekin = 2.65655813266529 | erot = 1.93167942695887 | epot = -21.3111486584607 | etot = -16.7229110988365 +406000 ekin = 2.60702986991693 | erot = 1.76285472093939 | epot = -21.1926812354134 | etot = -16.8227966445571 +407000 ekin = 2.48234362601344 | erot = 1.89687727619143 | epot = -21.0701942151536 | etot = -16.6909733129487 +408000 ekin = 2.49227529739275 | erot = 2.21804348518165 | epot = -20.9209091795071 | etot = -16.2105903969327 +409000 ekin = 2.2814751296365 | erot = 2.33822783370113 | epot = -20.7906871723623 | etot = -16.1709842090246 +410000 ekin = 2.17062635902599 | erot = 2.33410289107624 | epot = -20.7498754299763 | etot = -16.245146179874 +411000 ekin = 2.17272870653954 | erot = 2.21566346266576 | epot = -20.7111946304982 | etot = -16.3228024612929 +412000 ekin = 2.18233973422082 | erot = 1.9503355575729 | epot = -20.6834214582715 | etot = -16.5507461664778 +413000 ekin = 2.30890718881929 | erot = 2.07021554036486 | epot = -20.6873588522823 | etot = -16.3082361230982 +414000 ekin = 2.33564543866434 | erot = 1.99840226970561 | epot = -20.7252533334275 | etot = -16.3912056250575 +415000 ekin = 2.3828428990009 | erot = 2.11597172640877 | epot = -20.8097694536975 | etot = -16.3109548282878 +416000 ekin = 2.4891981967793 | erot = 2.33259772891839 | epot = -20.9508447049435 | etot = -16.1290487792458 +417000 ekin = 2.54526036986856 | erot = 2.55910512686826 | epot = -21.1274289862993 | etot = -16.0230634895625 +418000 ekin = 2.51632809206367 | erot = 2.72037030682998 | epot = -21.2997759305309 | etot = -16.0630775316373 +419000 ekin = 2.67295573593454 | erot = 2.77715355803624 | epot = -21.4556263294562 | etot = -16.0055170354854 +420000 ekin = 2.85018483582368 | erot = 2.31598006691992 | epot = -21.5980960673048 | etot = -16.4319311645612 +421000 ekin = 2.96837524337248 | erot = 2.6268245252954 | epot = -21.7546670845076 | etot = -16.1594673158397 +422000 ekin = 3.19012922154569 | erot = 2.84396098635293 | epot = -21.9215374215569 | etot = -15.8874472136583 +423000 ekin = 3.36893935507836 | erot = 2.63026872290732 | epot = -22.0572951448102 | etot = -16.0580870668246 +424000 ekin = 3.56949208720939 | erot = 2.47035354176304 | epot = -22.1637806318815 | etot = -16.1239350029091 +425000 ekin = 3.74058915148745 | erot = 2.35112257121758 | epot = -22.2380669505815 | etot = -16.1463552278764 +426000 ekin = 3.80317641902157 | erot = 2.35606913247661 | epot = -22.2959429720034 | etot = -16.1366974205052 +427000 ekin = 3.84305942013392 | erot = 2.33548874740528 | epot = -22.3376365509403 | etot = -16.1590883834011 +428000 ekin = 3.83870631322379 | erot = 2.23506863760186 | epot = -22.3684501057751 | etot = -16.2946751549495 +429000 ekin = 3.88817033525596 | erot = 2.49183581120231 | epot = -22.3756888085914 | etot = -15.9956826621331 +430000 ekin = 3.80889051818661 | erot = 2.40484189761628 | epot = -22.3570018637867 | etot = -16.1432694479838 +431000 ekin = 3.77310947248878 | erot = 2.27913524660278 | epot = -22.3205980214877 | etot = -16.2683533023961 +432000 ekin = 3.52274921334608 | erot = 2.24573259199209 | epot = -22.2753655924894 | etot = -16.5068837871512 +433000 ekin = 3.46705236442823 | erot = 2.20376216835521 | epot = -22.2487474226526 | etot = -16.5779328898691 +434000 ekin = 3.3190237946751 | erot = 2.11029295350201 | epot = -22.2098823317896 | etot = -16.7805655836125 +435000 ekin = 3.17487375029747 | erot = 2.50022517053558 | epot = -22.1671631710258 | etot = -16.4920642501928 +436000 ekin = 3.02349956092836 | erot = 2.40764251188797 | epot = -22.1302532198703 | etot = -16.699111147054 +437000 ekin = 2.8274843272161 | erot = 2.14344362630262 | epot = -22.1006119384222 | etot = -17.1296839849035 +438000 ekin = 2.76339787793449 | erot = 2.419050805213 | epot = -22.0957010825607 | etot = -16.9132523994132 +439000 ekin = 2.6719888655247 | erot = 2.59491616836517 | epot = -22.1135007428951 | etot = -16.8465957090052 +440000 ekin = 2.51284986257035 | erot = 2.91174228785256 | epot = -22.1427877988881 | etot = -16.7181956484652 +441000 ekin = 2.50780828634487 | erot = 2.72902768068024 | epot = -22.1697146510927 | etot = -16.9328786840676 +442000 ekin = 2.44873015400876 | erot = 2.74922432089642 | epot = -22.2054533182394 | etot = -17.0074988433342 +443000 ekin = 2.38093647463546 | erot = 2.64154199429497 | epot = -22.2472480992723 | etot = -17.2247696303419 +444000 ekin = 2.3836651928718 | erot = 2.67137923733314 | epot = -22.2750222251913 | etot = -17.2199777949864 +445000 ekin = 2.40684373898638 | erot = 2.59567738953056 | epot = -22.2857281482667 | etot = -17.2832070197498 +446000 ekin = 2.36082009501178 | erot = 2.73001014061349 | epot = -22.2789998471501 | etot = -17.1881696115248 +447000 ekin = 2.36605795906985 | erot = 2.58257112673036 | epot = -22.296084006631 | etot = -17.3474549208308 +448000 ekin = 2.32165762068431 | erot = 2.36145535918737 | epot = -22.3211882050734 | etot = -17.6380752252017 +449000 ekin = 2.44203969267613 | erot = 2.62540304636683 | epot = -22.3026387988317 | etot = -17.2351960597888 +450000 ekin = 2.51099258071366 | erot = 2.64840657329928 | epot = -22.267592439271 | etot = -17.1081932852581 +451000 ekin = 2.50793019457285 | erot = 2.96188202684451 | epot = -22.2417686447217 | etot = -16.7719564233044 +452000 ekin = 2.51543909198851 | erot = 2.97645802250506 | epot = -22.1947639118422 | etot = -16.7028667973486 +453000 ekin = 2.48027617072946 | erot = 2.57675545715338 | epot = -22.1151189784502 | etot = -17.0580873505673 +454000 ekin = 2.53738257378355 | erot = 2.32076068281048 | epot = -22.0114335109913 | etot = -17.1532902543973 +455000 ekin = 2.40824460563841 | erot = 2.52466300048405 | epot = -21.9140685033281 | etot = -16.9811608972056 +456000 ekin = 2.48089669783941 | erot = 2.44995767624609 | epot = -21.8323732399429 | etot = -16.9015188658574 +457000 ekin = 2.41775201722807 | erot = 2.40996718790043 | epot = -21.7728619497125 | etot = -16.945142744584 +458000 ekin = 2.47981300263281 | erot = 2.17375208123342 | epot = -21.7127229794164 | etot = -17.0591578955502 +459000 ekin = 2.50098429139872 | erot = 2.13049458828883 | epot = -21.6581010444978 | etot = -17.0266221648102 +460000 ekin = 2.38145892905012 | erot = 1.94162891941082 | epot = -21.6082620378702 | etot = -17.2851741894092 +461000 ekin = 2.33337517008614 | erot = 1.98667402531269 | epot = -21.5649964210082 | etot = -17.2449472256094 +462000 ekin = 2.28227781413454 | erot = 1.78636859811698 | epot = -21.553299713963 | etot = -17.4846533017115 +463000 ekin = 2.31407904587662 | erot = 1.75082487007379 | epot = -21.5758125934728 | etot = -17.5109086775224 +464000 ekin = 2.33760733880305 | erot = 1.97752071149097 | epot = -21.6288036107042 | etot = -17.3136755604102 +465000 ekin = 2.35344133595334 | erot = 1.91505497900085 | epot = -21.7041801943282 | etot = -17.435683879374 +466000 ekin = 2.42854776892495 | erot = 1.75072628953255 | epot = -21.7819960540267 | etot = -17.6027219955692 +467000 ekin = 2.46288459947455 | erot = 1.78816598264993 | epot = -21.8507036001171 | etot = -17.5996530179926 +468000 ekin = 2.43969802378134 | erot = 1.72898452339381 | epot = -21.9015694636234 | etot = -17.7328869164483 +469000 ekin = 2.54376807882612 | erot = 1.93023555616042 | epot = -21.9541799518686 | etot = -17.4801763168821 +470000 ekin = 2.63326744382507 | erot = 1.50609058500135 | epot = -21.9819116677654 | etot = -17.842553638939 +471000 ekin = 2.65978116714121 | erot = 1.70311641290859 | epot = -21.9987201136985 | etot = -17.6358225336487 +472000 ekin = 2.69971587804205 | erot = 1.8009932352239 | epot = -22.0027803172691 | etot = -17.5020712040031 +473000 ekin = 2.72512699348222 | erot = 2.02324872686538 | epot = -22.0030224491709 | etot = -17.2546467288233 +474000 ekin = 2.8407241273446 | erot = 2.21383290314944 | epot = -21.9941738614503 | etot = -16.9396168309562 +475000 ekin = 2.80675445958342 | erot = 1.9022077441246 | epot = -21.9850696381233 | etot = -17.2761074344153 +476000 ekin = 2.72360114140089 | erot = 2.00284464538934 | epot = -21.9892397336858 | etot = -17.2627939468956 +477000 ekin = 2.84056500761867 | erot = 1.91820766145655 | epot = -22.0039582079798 | etot = -17.2451855389045 +478000 ekin = 2.79479136762923 | erot = 2.33508343932096 | epot = -22.00732044934 | etot = -16.8774456423898 +479000 ekin = 2.68385324315871 | erot = 2.16409914969161 | epot = -21.9972664623617 | etot = -17.1493140695114 +480000 ekin = 2.70919062871922 | erot = 2.22019074837664 | epot = -21.9751418417902 | etot = -17.0457604646944 +481000 ekin = 2.63307386350591 | erot = 1.99280181185976 | epot = -21.930382642354 | etot = -17.3045069669883 +482000 ekin = 2.59315858027254 | erot = 2.21899648577216 | epot = -21.8738249715991 | etot = -17.0616699055543 +483000 ekin = 2.47046920651423 | erot = 2.31431109078702 | epot = -21.8097795572383 | etot = -17.0249992599371 +484000 ekin = 2.53508822055565 | erot = 2.47424748553162 | epot = -21.717582839324 | etot = -16.7082471332367 +485000 ekin = 2.50485650643252 | erot = 2.32403296584736 | epot = -21.6361062693713 | etot = -16.8072167970914 +486000 ekin = 2.47721144858919 | erot = 2.13567134935204 | epot = -21.5220454766263 | etot = -16.909162678685 +487000 ekin = 2.37724853790766 | erot = 2.18943698926619 | epot = -21.3143250794171 | etot = -16.7476395522432 +488000 ekin = 2.48818613181585 | erot = 1.88306237250916 | epot = -21.3116084588705 | etot = -16.9403599545454 +489000 ekin = 2.74982657944148 | erot = 1.89187656286088 | epot = -21.4756253900909 | etot = -16.8339222477885 +490000 ekin = 2.8446680042418 | erot = 1.71237058668201 | epot = -21.5263774576819 | etot = -16.9693388667581 +491000 ekin = 2.85737105202647 | erot = 1.55281245576843 | epot = -21.5086751027881 | etot = -17.0984915949932 +492000 ekin = 2.90983632457446 | erot = 1.91497206116271 | epot = -21.5279430025224 | etot = -16.7031346167852 +493000 ekin = 2.89079796015651 | erot = 2.10766085424332 | epot = -21.5508401314459 | etot = -16.5523813170461 +494000 ekin = 2.90235816901155 | erot = 1.94029226116637 | epot = -21.5811303529853 | etot = -16.7384799228073 +495000 ekin = 2.87250026921941 | erot = 1.80307251979098 | epot = -21.6111333229181 | etot = -16.9355605339077 +496000 ekin = 2.90478694209773 | erot = 1.72383486079645 | epot = -21.6487754892898 | etot = -17.0201536863956 +497000 ekin = 2.79889384992189 | erot = 1.75660961047807 | epot = -21.6748215786368 | etot = -17.1193181182368 +498000 ekin = 2.74060640404878 | erot = 1.89888258825447 | epot = -21.7102647961437 | etot = -17.0707758038405 +499000 ekin = 2.80294847124273 | erot = 2.31213970127628 | epot = -21.7484718969958 | etot = -16.6333837244768 +500000 ekin = 2.83514351912433 | erot = 2.19332479656724 | epot = -21.7847476520866 | etot = -16.756279336395 +501000 ekin = 2.85410564762384 | erot = 2.42583012042736 | epot = -21.8174128447107 | etot = -16.5374770766595 +502000 ekin = 2.87283408161156 | erot = 2.50841092791887 | epot = -21.8423925146404 | etot = -16.46114750511 +503000 ekin = 2.94443013466719 | erot = 2.36313582629975 | epot = -21.8519587007927 | etot = -16.5443927398257 +504000 ekin = 2.98534964558865 | erot = 2.41275211835278 | epot = -21.8136647277169 | etot = -16.4155629637754 +505000 ekin = 3.10846911992712 | erot = 2.13573452517232 | epot = -21.7537837267859 | etot = -16.5095800816865 +506000 ekin = 3.09786641402203 | erot = 2.01700572313853 | epot = -21.704980465629 | etot = -16.5901083284684 +507000 ekin = 3.16348616847776 | erot = 1.94949346287655 | epot = -21.6672353473606 | etot = -16.5542557160063 +508000 ekin = 3.07061633092943 | erot = 2.13446212006009 | epot = -21.6350846399512 | etot = -16.4300061889617 +509000 ekin = 3.1290746647534 | erot = 2.35272620108262 | epot = -21.6205801924064 | etot = -16.1387793265704 +510000 ekin = 3.02451400178539 | erot = 2.25242701385277 | epot = -21.6251089836147 | etot = -16.3481679679765 +511000 ekin = 2.94040580941463 | erot = 2.31948438934906 | epot = -21.6216965431392 | etot = -16.3618063443755 +512000 ekin = 2.94467119608427 | erot = 2.24306810877191 | epot = -21.5962799069271 | etot = -16.408540602071 +513000 ekin = 2.877517425685 | erot = 2.415414442973 | epot = -21.5773819493338 | etot = -16.2844500806758 +514000 ekin = 2.87859810419301 | erot = 2.53612885093571 | epot = -21.5886910612355 | etot = -16.1739641061068 +515000 ekin = 2.65152076844877 | erot = 2.70952186913731 | epot = -21.612623025511 | etot = -16.2515803879249 +516000 ekin = 2.77253963034854 | erot = 3.11116882765854 | epot = -21.6107374310222 | etot = -15.7270289730151 +517000 ekin = 2.76572402179399 | erot = 2.98569828005596 | epot = -21.5945323230581 | etot = -15.8431100212081 +518000 ekin = 2.7008206456695 | erot = 2.94453329815972 | epot = -21.5767297354897 | etot = -15.9313757916605 +519000 ekin = 2.54482845466835 | erot = 2.66065301480809 | epot = -21.550873009667 | etot = -16.3453915401906 +520000 ekin = 2.45944414333513 | erot = 2.60592783176574 | epot = -21.5130137565189 | etot = -16.4476417814181 +521000 ekin = 2.40695980994532 | erot = 2.63220992355656 | epot = -21.4828393267846 | etot = -16.4436695932827 +522000 ekin = 2.52378769907082 | erot = 2.5606649708313 | epot = -21.4628073945547 | etot = -16.3783547246526 +523000 ekin = 2.47704387064711 | erot = 2.27847516566856 | epot = -21.3936943383584 | etot = -16.6381753020428 +524000 ekin = 2.45003418957973 | erot = 2.35140218073637 | epot = -21.2843636599242 | etot = -16.4829272896081 +525000 ekin = 2.36142621667685 | erot = 2.56683372922449 | epot = -21.3738770732935 | etot = -16.4456171273921 +526000 ekin = 2.41274041153279 | erot = 2.62143474643711 | epot = -21.5186087776708 | etot = -16.4844336197009 +527000 ekin = 2.51690607418079 | erot = 2.50693092291703 | epot = -21.5243590814524 | etot = -16.5005220843546 +528000 ekin = 2.54770211426177 | erot = 2.53999552090169 | epot = -21.5164154929441 | etot = -16.4287178577806 +529000 ekin = 2.47536749790361 | erot = 2.56875642748168 | epot = -21.5117161086094 | etot = -16.4675921832241 +530000 ekin = 2.58038897425517 | erot = 3.01233807443761 | epot = -21.51906057773 | etot = -15.9263335290372 +531000 ekin = 2.65054894724649 | erot = 2.80448099540854 | epot = -21.5589351824931 | etot = -16.1039052398381 +532000 ekin = 2.66965242144118 | erot = 2.74119638755984 | epot = -21.6464179501738 | etot = -16.2355691411728 +533000 ekin = 2.72770786142518 | erot = 2.77844536173269 | epot = -21.7626441239341 | etot = -16.2564909007762 +534000 ekin = 2.64182362572789 | erot = 3.16792870118696 | epot = -21.9259934897415 | etot = -16.1162411628266 +535000 ekin = 2.66520124770253 | erot = 3.2879171249754 | epot = -22.0889762146499 | etot = -16.1358578419719 +536000 ekin = 2.62601876922159 | erot = 3.30261897461137 | epot = -22.2457512656683 | etot = -16.3171135218353 +537000 ekin = 2.69839345537236 | erot = 3.42813769244414 | epot = -22.4210021127572 | etot = -16.2944709649407 +538000 ekin = 2.66760385526424 | erot = 3.62303132590558 | epot = -22.591355025516 | etot = -16.3007198443462 +539000 ekin = 2.67321194398888 | erot = 3.60397197005577 | epot = -22.7197786083617 | etot = -16.442594694317 +540000 ekin = 2.61847962179691 | erot = 3.5981459306722 | epot = -22.8058567264861 | etot = -16.589231174017 +541000 ekin = 2.6718641974379 | erot = 3.32667413558402 | epot = -22.8335693145219 | etot = -16.8350309815 +542000 ekin = 2.70747491915389 | erot = 3.0111564589795 | epot = -22.8115452943438 | etot = -17.0929139162104 +543000 ekin = 2.54644874759658 | erot = 2.82723025266225 | epot = -22.7664572430856 | etot = -17.3927782428268 +544000 ekin = 2.5463938428872 | erot = 2.51742249196045 | epot = -22.7350779454406 | etot = -17.6712616105929 +545000 ekin = 2.56168013748318 | erot = 2.65611713884647 | epot = -22.7023384195507 | etot = -17.484541143221 +546000 ekin = 2.5816053409223 | erot = 2.38787600628575 | epot = -22.6704542470139 | etot = -17.7009728998058 +547000 ekin = 2.61211462803719 | erot = 2.34648461296472 | epot = -22.6334663710585 | etot = -17.6748671300566 +548000 ekin = 2.61848748301373 | erot = 2.55163104207081 | epot = -22.609768517203 | etot = -17.4396499921185 +549000 ekin = 2.67184047302148 | erot = 2.60680496690166 | epot = -22.6113862974879 | etot = -17.3327408575648 +550000 ekin = 2.72277931598591 | erot = 2.65040849078669 | epot = -22.6203600824213 | etot = -17.2471722756487 +551000 ekin = 2.74305353489299 | erot = 2.80075659039574 | epot = -22.6177232617524 | etot = -17.0739131364637 +552000 ekin = 2.81751360269261 | erot = 2.75287635518208 | epot = -22.6023118767284 | etot = -17.0319219188537 +553000 ekin = 2.79227730256403 | erot = 2.56192872740986 | epot = -22.5537272638583 | etot = -17.1995212338845 +554000 ekin = 2.73534601404039 | erot = 2.65053323061235 | epot = -22.4791077870362 | etot = -17.0932285423835 +555000 ekin = 2.63887069330074 | erot = 2.60099744506886 | epot = -22.3836014529606 | etot = -17.143733314591 +556000 ekin = 2.58795922731594 | erot = 2.83939231122779 | epot = -22.324279926465 | etot = -16.8969283879212 +557000 ekin = 2.47840947592902 | erot = 2.83134609082774 | epot = -22.3241590735317 | etot = -17.0144035067749 +558000 ekin = 2.40468725505321 | erot = 2.93322561456053 | epot = -22.2772491751351 | etot = -16.9393363055213 +559000 ekin = 2.41820823948273 | erot = 2.86089187346752 | epot = -22.2036329910433 | etot = -16.9245328780931 +560000 ekin = 2.39662020313128 | erot = 2.57730341735948 | epot = -22.1373821619364 | etot = -17.1634585414457 +561000 ekin = 2.41616568173907 | erot = 2.43139941603541 | epot = -22.060651028694 | etot = -17.2130859309196 +562000 ekin = 2.32711122790885 | erot = 2.68540878415341 | epot = -22.0362236088757 | etot = -17.0237035968134 +563000 ekin = 2.40105509630151 | erot = 2.62423602861762 | epot = -22.0398518714974 | etot = -17.0145607465783 +564000 ekin = 2.5062266422146 | erot = 2.4928348217893 | epot = -22.0598046960841 | etot = -17.0607432320802 +565000 ekin = 2.51273313956208 | erot = 2.47207361692511 | epot = -22.0899214253432 | etot = -17.1051146688561 +566000 ekin = 2.45555537786091 | erot = 2.30821557149137 | epot = -22.1147098672023 | etot = -17.35093891785 +567000 ekin = 2.48507699437162 | erot = 2.03226369059631 | epot = -22.1483465792775 | etot = -17.6310058943096 +568000 ekin = 2.44600711349195 | erot = 2.1681878009117 | epot = -22.171561314542 | etot = -17.5573664001384 +569000 ekin = 2.41496567776287 | erot = 2.08307839560009 | epot = -22.1893617136992 | etot = -17.6913176403362 +570000 ekin = 2.31032400356049 | erot = 1.94654984481964 | epot = -22.1972672153826 | etot = -17.9403933670025 +571000 ekin = 2.3417438804697 | erot = 1.90380560996236 | epot = -22.2024778466837 | etot = -17.9569283562516 +572000 ekin = 2.31612242672595 | erot = 2.32477215739624 | epot = -22.1972617700701 | etot = -17.556367185948 +573000 ekin = 2.33747992651649 | erot = 2.05308190482666 | epot = -22.1742687527255 | etot = -17.7837069213823 +574000 ekin = 2.25296248727416 | erot = 2.15192604028201 | epot = -22.1539412991559 | etot = -17.7490527715998 +575000 ekin = 2.39237411767914 | erot = 2.08020391847459 | epot = -22.1262092875428 | etot = -17.6536312513891 +576000 ekin = 2.399208847935 | erot = 2.19930885642811 | epot = -22.0840646582175 | etot = -17.4855469538544 +577000 ekin = 2.32808205752418 | erot = 1.94197958979002 | epot = -22.0344723562019 | etot = -17.7644107088876 +578000 ekin = 2.1746858706361 | erot = 1.9246103716916 | epot = -21.974741428263 | etot = -17.8754451859353 +579000 ekin = 2.11583896079266 | erot = 1.92936420584519 | epot = -21.9045494517261 | etot = -17.8593462850882 +580000 ekin = 1.98384148142164 | erot = 1.90081955947752 | epot = -21.8148954466256 | etot = -17.9302344057265 +581000 ekin = 1.94016412525874 | erot = 1.93233669573757 | epot = -21.7165439683888 | etot = -17.8440431473925 +582000 ekin = 1.8610251889665 | erot = 1.79341078671836 | epot = -21.6380365856683 | etot = -17.9836006099834 +583000 ekin = 1.68386990762823 | erot = 1.83679042288102 | epot = -21.5992064668106 | etot = -18.0785461363014 +584000 ekin = 1.67261412505281 | erot = 1.65634612158735 | epot = -21.5952053447537 | etot = -18.2662450981136 +585000 ekin = 1.73992925735474 | erot = 1.83366430721889 | epot = -21.6327697441752 | etot = -18.0591761796016 +586000 ekin = 1.74661255409199 | erot = 1.71213201580435 | epot = -21.7000609183774 | etot = -18.2413163484811 +587000 ekin = 1.71710189718426 | erot = 1.97098182988229 | epot = -21.7683574543182 | etot = -18.0802737272516 +588000 ekin = 1.86544089524901 | erot = 1.85386980490137 | epot = -21.8425683848031 | etot = -18.1232576846527 +589000 ekin = 1.85071717322245 | erot = 1.97068115142838 | epot = -21.9095983694565 | etot = -18.0882000448057 +590000 ekin = 1.83374905828411 | erot = 1.81484654719552 | epot = -21.9582171568539 | etot = -18.3096215513743 +591000 ekin = 1.81469352641367 | erot = 1.99878899767044 | epot = -21.9200659973671 | etot = -18.106583473283 +592000 ekin = 1.71363100839097 | erot = 2.12573581395021 | epot = -21.9592135376051 | etot = -18.1198467152639 +593000 ekin = 1.72614766500717 | erot = 2.17937588775971 | epot = -22.0664089208097 | etot = -18.1608853680429 +594000 ekin = 1.75427689765194 | erot = 1.98826780368116 | epot = -22.0976975488655 | etot = -18.3551528475324 +595000 ekin = 1.85406358952679 | erot = 2.20206199980458 | epot = -22.1226176690415 | etot = -18.0664920797102 +596000 ekin = 1.84670119316264 | erot = 2.33908153853203 | epot = -22.1559831226416 | etot = -17.9702003909469 +597000 ekin = 1.81732138775584 | erot = 2.40005576098716 | epot = -22.1594075236561 | etot = -17.9420303749132 +598000 ekin = 1.8677543970775 | erot = 2.55301581891932 | epot = -22.1595993961162 | etot = -17.7388291801194 +599000 ekin = 1.91773913278424 | erot = 2.67167362163678 | epot = -22.1710888467289 | etot = -17.5816760923079 +600000 ekin = 1.98736665658494 | erot = 2.80063355631912 | epot = -22.2102053911852 | etot = -17.4222051782811 +601000 ekin = 1.90702337725175 | erot = 2.8344671118145 | epot = -22.2420925338082 | etot = -17.500602044742 +602000 ekin = 1.94976963379167 | erot = 2.90342633891973 | epot = -22.2734691619211 | etot = -17.4202731892097 +603000 ekin = 1.96641425291164 | erot = 2.66529933433923 | epot = -22.2825393460705 | etot = -17.6508257588197 +604000 ekin = 1.91858852447213 | erot = 2.76080776072352 | epot = -22.2678256349417 | etot = -17.588429349746 +605000 ekin = 1.97193019282287 | erot = 2.5472794862884 | epot = -22.2112173532513 | etot = -17.6920076741401 +606000 ekin = 2.03197193648821 | erot = 2.19902614177724 | epot = -22.1164544376306 | etot = -17.8854563593652 +607000 ekin = 2.0510528043558 | erot = 2.16675765880382 | epot = -21.977405385855 | etot = -17.7595949226954 +608000 ekin = 2.17944443921817 | erot = 2.13131743184037 | epot = -21.81532099036 | etot = -17.5045591193014 +609000 ekin = 2.16101479212554 | erot = 2.06129841109631 | epot = -21.6707988831018 | etot = -17.44848567988 +610000 ekin = 2.19385705617071 | erot = 2.02131249667483 | epot = -21.5477012163134 | etot = -17.3325316634679 +611000 ekin = 2.19942394637387 | erot = 2.20280786133682 | epot = -21.4384008683102 | etot = -17.0361690605995 +612000 ekin = 2.23163662761403 | erot = 2.17565235563963 | epot = -21.349788353045 | etot = -16.9424993697913 +613000 ekin = 2.34183365033965 | erot = 1.89422502415553 | epot = -21.3091832789097 | etot = -17.0731246044145 +614000 ekin = 2.41074949980695 | erot = 1.66581051947232 | epot = -21.3121685225909 | etot = -17.2356085033117 +615000 ekin = 2.45538962657556 | erot = 1.67175711569392 | epot = -21.3797539205093 | etot = -17.2526071782398 +616000 ekin = 2.54665272757605 | erot = 1.63332091588076 | epot = -21.4744887763228 | etot = -17.294515132866 +617000 ekin = 2.69386292022006 | erot = 1.67560230924526 | epot = -21.5884179595115 | etot = -17.2189527300462 +618000 ekin = 2.87435666564076 | erot = 1.80165459029546 | epot = -21.7048752429654 | etot = -17.0288639870292 +619000 ekin = 3.06032720665858 | erot = 1.65093186491283 | epot = -21.8125402008936 | etot = -17.1012811293222 +620000 ekin = 3.05516944552948 | erot = 1.78567665314232 | epot = -21.9362157730247 | etot = -17.0953696743529 +621000 ekin = 3.19482877288248 | erot = 1.85444292415898 | epot = -22.0590109842176 | etot = -17.0097392871761 +622000 ekin = 3.19833270893106 | erot = 1.64252462622214 | epot = -22.1304552689738 | etot = -17.2895979338206 +623000 ekin = 3.29734758995184 | erot = 1.6970718936091 | epot = -22.1701112545649 | etot = -17.175691771004 +624000 ekin = 3.37713404636418 | erot = 1.61937249977472 | epot = -22.190132986186 | etot = -17.1936264400471 +625000 ekin = 3.38380934462731 | erot = 1.54917206280412 | epot = -22.18904166071 | etot = -17.2560602532785 +626000 ekin = 3.32638739446822 | erot = 1.5672214829387 | epot = -22.1785220524127 | etot = -17.2849131750058 +627000 ekin = 3.31569249720242 | erot = 1.71066467192316 | epot = -22.142364077785 | etot = -17.1160069086594 +628000 ekin = 3.16697776454389 | erot = 1.85806977204807 | epot = -22.0112520476558 | etot = -16.9862045110638 +629000 ekin = 2.99094278818954 | erot = 1.86346544111366 | epot = -21.9346731409829 | etot = -17.0802649116797 +630000 ekin = 2.90556071918765 | erot = 2.06931303104692 | epot = -21.93509085158 | etot = -16.9602171013454 +631000 ekin = 2.79969582944963 | erot = 2.05621242567385 | epot = -21.848604572972 | etot = -16.9926963178485 +632000 ekin = 2.67147709831704 | erot = 2.03262561422009 | epot = -21.7549691244764 | etot = -17.0508664119392 +633000 ekin = 2.65536759972781 | erot = 2.03400136625199 | epot = -21.6799332000585 | etot = -16.9905642340787 +634000 ekin = 2.60619207671931 | erot = 2.13546718822713 | epot = -21.6154557479591 | etot = -16.8737964830127 +635000 ekin = 2.50701558019089 | erot = 1.74758901075321 | epot = -21.5543249117148 | etot = -17.2997203207707 +636000 ekin = 2.39745600323038 | erot = 1.85247540266676 | epot = -21.525559430038 | etot = -17.2756280241409 +637000 ekin = 2.41790008828878 | erot = 1.89421557823705 | epot = -21.5250233017194 | etot = -17.2129076351935 +638000 ekin = 2.47578971863419 | erot = 2.36571418053423 | epot = -21.5337545659553 | etot = -16.6922506667868 +639000 ekin = 2.35660046082987 | erot = 2.51353605838012 | epot = -21.5410972420903 | etot = -16.6709607228803 +640000 ekin = 2.45486082803939 | erot = 2.67800600845168 | epot = -21.5528145208901 | etot = -16.419947684399 +641000 ekin = 2.56928913237021 | erot = 2.42818013926169 | epot = -21.5744429168227 | etot = -16.5769736451908 +642000 ekin = 2.56519022418627 | erot = 2.50858602525848 | epot = -21.5829619563601 | etot = -16.5091857069153 +643000 ekin = 2.61438251477725 | erot = 2.14546404075467 | epot = -21.6040625493721 | etot = -16.8442159938402 +644000 ekin = 2.62186764966518 | erot = 2.14191076230766 | epot = -21.6253516870774 | etot = -16.8615732751046 +645000 ekin = 2.73445879103536 | erot = 2.35765807621281 | epot = -21.6468161631206 | etot = -16.5546992958724 +646000 ekin = 2.74844139127275 | erot = 2.17611353686106 | epot = -21.6394622686008 | etot = -16.7149073404669 +647000 ekin = 2.81459539064456 | erot = 2.08632073152474 | epot = -21.6308966078165 | etot = -16.7299804856472 +648000 ekin = 2.85700926870993 | erot = 1.929464333082 | epot = -21.6388376034704 | etot = -16.8523640016785 +649000 ekin = 2.83442652810361 | erot = 1.81043301746374 | epot = -21.6816093302455 | etot = -17.0367497846781 +650000 ekin = 2.82385635198136 | erot = 1.98060013201534 | epot = -21.7368430060001 | etot = -16.9323865220034 +651000 ekin = 2.92885602891552 | erot = 2.12442721936496 | epot = -21.8172866774946 | etot = -16.7640034292141 +652000 ekin = 2.93013307398413 | erot = 2.27578127027685 | epot = -21.8890408405115 | etot = -16.6831264962505 +653000 ekin = 3.04736898125529 | erot = 2.16776847613793 | epot = -21.9486345968613 | etot = -16.7334971394681 +654000 ekin = 2.9579573037244 | erot = 2.21678381714574 | epot = -22.0001869032537 | etot = -16.8254457823835 +655000 ekin = 3.02540562074026 | erot = 2.13692279145231 | epot = -22.0213788097191 | etot = -16.8590503975265 +656000 ekin = 2.93581362686808 | erot = 2.18988187130916 | epot = -22.0109757197437 | etot = -16.8852802215665 +657000 ekin = 2.76805340651528 | erot = 2.32463835532626 | epot = -21.9890816986899 | etot = -16.8963899368483 +658000 ekin = 2.72010078264234 | erot = 2.42170769009701 | epot = -21.9346454326191 | etot = -16.7928369598798 +659000 ekin = 2.56993867397745 | erot = 2.56748186419765 | epot = -21.8575737943239 | etot = -16.7201532561488 +660000 ekin = 2.47973868672844 | erot = 2.40259679627682 | epot = -21.7795672371149 | etot = -16.8972317541096 +661000 ekin = 2.4537354259568 | erot = 2.39904349056703 | epot = -21.7176497643057 | etot = -16.8648708477819 +662000 ekin = 2.31664057269244 | erot = 2.35054704143559 | epot = -21.6537121043311 | etot = -16.9865244902031 +663000 ekin = 2.2406453295341 | erot = 2.17910127912748 | epot = -21.6391536375417 | etot = -17.2194070288801 +664000 ekin = 2.20916362864349 | erot = 2.06262569311488 | epot = -21.6851863902027 | etot = -17.4133970684443 +665000 ekin = 2.13954972476586 | erot = 2.25756057575123 | epot = -21.7455075936907 | etot = -17.3483972931736 +666000 ekin = 2.08532103984047 | erot = 2.53235015645644 | epot = -21.8306488165158 | etot = -17.2129776202189 +667000 ekin = 2.07434468635446 | erot = 2.5831602433618 | epot = -21.9388099470219 | etot = -17.2813050173056 +668000 ekin = 2.14972707351062 | erot = 2.44036539013545 | epot = -22.0333424314715 | etot = -17.4432499678254 +669000 ekin = 2.14867112158583 | erot = 2.43281409131061 | epot = -22.1304448026368 | etot = -17.5489595897403 +670000 ekin = 2.23890403189165 | erot = 2.58648249214524 | epot = -22.2056814205456 | etot = -17.3802948965087 +671000 ekin = 2.31625622499946 | erot = 2.69333851171567 | epot = -22.279662062181 | etot = -17.2700673254659 +672000 ekin = 2.44586153940214 | erot = 2.56646280616739 | epot = -22.358695214431 | etot = -17.3463708688615 +673000 ekin = 2.54481735055823 | erot = 2.75556593856414 | epot = -22.4593396425686 | etot = -17.1589563534462 +674000 ekin = 2.71391625159941 | erot = 2.6554308425355 | epot = -22.5584890476563 | etot = -17.1891419535214 +675000 ekin = 2.90764129270492 | erot = 2.23819775094513 | epot = -22.6180177016502 | etot = -17.4721786580001 +676000 ekin = 2.92265152567894 | erot = 2.01907422039395 | epot = -22.6419153633299 | etot = -17.700189617257 +677000 ekin = 2.98331588051219 | erot = 1.94365767388436 | epot = -22.6354363273705 | etot = -17.7084627729739 +678000 ekin = 3.09770353325547 | erot = 1.78984747588624 | epot = -22.5937189533551 | etot = -17.7061679442134 +679000 ekin = 3.25432444248411 | erot = 1.88443631033161 | epot = -22.53178413596 | etot = -17.3930233831443 +680000 ekin = 3.22961887078865 | erot = 1.69909805719967 | epot = -22.463070825024 | etot = -17.5343538970357 +681000 ekin = 3.29793543712228 | erot = 1.73422658308543 | epot = -22.3946434176705 | etot = -17.3624813974628 +682000 ekin = 3.24199079106594 | erot = 1.5969219856144 | epot = -22.3029193266293 | etot = -17.464006549949 +683000 ekin = 3.25371946999921 | erot = 1.72202050023417 | epot = -22.199148999364 | etot = -17.2234090291306 +684000 ekin = 3.19052733109178 | erot = 1.66622681172431 | epot = -22.0655070121616 | etot = -17.2087528693455 +685000 ekin = 3.12351779825689 | erot = 1.51735754830883 | epot = -21.914824245787 | etot = -17.2739488992213 +686000 ekin = 3.07326489888731 | erot = 1.46555591350498 | epot = -21.7573475582043 | etot = -17.218526745812 +687000 ekin = 3.0692678194322 | erot = 1.15712044634882 | epot = -21.5962819403328 | etot = -17.3698936745518 +688000 ekin = 2.87390652866056 | erot = 1.4033120365228 | epot = -21.4336822001954 | etot = -17.156463635012 +689000 ekin = 2.69554492827624 | erot = 1.45829074533076 | epot = -21.2672855389621 | etot = -17.1134498653551 +690000 ekin = 2.61061423011971 | erot = 1.36248966419064 | epot = -21.1045284460301 | etot = -17.1314245517197 +691000 ekin = 2.5384895571243 | erot = 1.51295281726462 | epot = -20.9662406736519 | etot = -16.914798299263 +692000 ekin = 2.46230747660143 | erot = 1.79517490024282 | epot = -20.8267179895335 | etot = -16.5692356126893 +693000 ekin = 2.33092902932419 | erot = 1.956932557055 | epot = -20.7214634762705 | etot = -16.4336018898913 +694000 ekin = 2.20499278049238 | erot = 2.26852927145225 | epot = -20.6632308881527 | etot = -16.189708836208 +695000 ekin = 2.03014457111504 | erot = 2.21386820279686 | epot = -20.6164786812691 | etot = -16.3724659073572 +696000 ekin = 1.90099616141403 | erot = 2.5103465105869 | epot = -20.5979238575923 | etot = -16.1865811855913 +697000 ekin = 1.85444991610566 | erot = 2.53777912909066 | epot = -20.6115349149648 | etot = -16.2193058697685 +698000 ekin = 1.7451785995618 | erot = 2.7223822414534 | epot = -20.6303436251994 | etot = -16.1627827841842 +699000 ekin = 1.7516813089068 | erot = 2.85503588879926 | epot = -20.6320585257903 | etot = -16.0253413280842 +700000 ekin = 1.64369199910929 | erot = 2.34560591480479 | epot = -20.647513946931 | etot = -16.6582160330169 +701000 ekin = 1.68132533789918 | erot = 2.43909304651561 | epot = -20.685910928294 | etot = -16.5654925438792 +702000 ekin = 1.70386840970035 | erot = 2.35102704448869 | epot = -20.7376959872533 | etot = -16.6828005330643 +703000 ekin = 1.80305935509192 | erot = 2.30693909538442 | epot = -20.8251011762137 | etot = -16.7151027257374 +704000 ekin = 1.85427679013225 | erot = 2.26509125077371 | epot = -20.9059280513971 | etot = -16.7865600104912 +705000 ekin = 1.88335846983262 | erot = 2.19214658824562 | epot = -20.9954367870654 | etot = -16.9199317289872 +706000 ekin = 1.876702340526 | erot = 2.28719516538887 | epot = -21.0193227576574 | etot = -16.8554252517425 +707000 ekin = 1.93293497142214 | erot = 2.38330202769163 | epot = -21.0638890738323 | etot = -16.7476520747185 +708000 ekin = 2.09065153727884 | erot = 2.35104864418889 | epot = -21.2227908262374 | etot = -16.7810906447697 +709000 ekin = 2.20425730862929 | erot = 2.60124565008879 | epot = -21.3749368892937 | etot = -16.5694339305757 +710000 ekin = 2.15847586521867 | erot = 2.78837422905336 | epot = -21.45375589322 | etot = -16.506905798948 +711000 ekin = 2.1473856761086 | erot = 2.55565446850249 | epot = -21.4922752305126 | etot = -16.7892350859015 +712000 ekin = 2.21832534546642 | erot = 2.2837823329791 | epot = -21.5070148685007 | etot = -17.0049071900552 +713000 ekin = 2.23341186047371 | erot = 2.34500428198362 | epot = -21.5008699398634 | etot = -16.9224537974061 +714000 ekin = 2.33230836040244 | erot = 2.19479871425188 | epot = -21.4839019806539 | etot = -16.9567949059995 +715000 ekin = 2.33030820574014 | erot = 2.17965051754596 | epot = -21.4553142973931 | etot = -16.945355574107 +716000 ekin = 2.36748822470048 | erot = 2.35438142347193 | epot = -21.4335845554585 | etot = -16.7117149072861 +717000 ekin = 2.42589072361015 | erot = 2.26035712234886 | epot = -21.4376774007483 | etot = -16.7514295547893 +718000 ekin = 2.38255620505849 | erot = 2.62805972075967 | epot = -21.4709814331184 | etot = -16.4603655073003 +719000 ekin = 2.4316038044644 | erot = 2.63972746655449 | epot = -21.4971766168892 | etot = -16.4258453458703 +720000 ekin = 2.33769336712433 | erot = 2.55371461534658 | epot = -21.5394919555774 | etot = -16.6480839731065 +721000 ekin = 2.28846155322463 | erot = 2.63462733239722 | epot = -21.6184618151068 | etot = -16.695372929485 +722000 ekin = 2.2625799464171 | erot = 2.84783969674578 | epot = -21.6945502707626 | etot = -16.5841306275997 +723000 ekin = 2.23304720962205 | erot = 3.06611659822373 | epot = -21.7528202353841 | etot = -16.4536564275383 +724000 ekin = 2.12684507278506 | erot = 2.78432312637157 | epot = -21.7751025516938 | etot = -16.8639343525372 +725000 ekin = 2.06612304119179 | erot = 2.6657008722112 | epot = -21.7772349484646 | etot = -17.0454110350617 +726000 ekin = 2.06015720392149 | erot = 2.53002799423227 | epot = -21.7484309875606 | etot = -17.1582457894068 +727000 ekin = 1.94617710091939 | erot = 2.58809722642033 | epot = -21.698865942308 | etot = -17.1645916149683 +728000 ekin = 1.79988680762503 | erot = 2.59791601958482 | epot = -21.6244191329722 | etot = -17.2266163057624 +729000 ekin = 1.88959231946007 | erot = 2.45182775661247 | epot = -21.5334662312982 | etot = -17.1920461552256 +730000 ekin = 1.96867512295179 | erot = 2.41054767101764 | epot = -21.4871507299598 | etot = -17.1079279359904 +731000 ekin = 2.04007066021515 | erot = 2.10968471949812 | epot = -21.5107250767863 | etot = -17.360969697073 +732000 ekin = 2.15156634650352 | erot = 2.21445806294108 | epot = -21.565694539444 | etot = -17.1996701299994 +733000 ekin = 2.35654560078856 | erot = 2.0926020619831 | epot = -21.6365297457638 | etot = -17.1873820829921 +734000 ekin = 2.53299152923216 | erot = 2.37468932984106 | epot = -21.7439901596571 | etot = -16.8363093005839 +735000 ekin = 2.68562697475253 | erot = 2.64165595377503 | epot = -21.8172386752045 | etot = -16.4899557466769 +736000 ekin = 2.79874366040361 | erot = 2.35556726484813 | epot = -21.8745419467326 | etot = -16.7202310214809 +737000 ekin = 2.90595989296463 | erot = 2.41144452276433 | epot = -21.9257424852809 | etot = -16.6083380695519 +738000 ekin = 3.16854231512105 | erot = 2.16995374764071 | epot = -21.9707229821506 | etot = -16.6322269193889 +739000 ekin = 3.23623963268824 | erot = 2.03973592993996 | epot = -22.0157112429449 | etot = -16.7397356803167 +740000 ekin = 3.39353868555119 | erot = 2.32580669983873 | epot = -22.0571350158395 | etot = -16.3377896304496 +741000 ekin = 3.45553760108211 | erot = 2.27352146352834 | epot = -22.0707608655482 | etot = -16.3417018009378 +742000 ekin = 3.39019064344775 | erot = 2.25908088551195 | epot = -22.0670611146352 | etot = -16.4177895856755 +743000 ekin = 3.24233276383884 | erot = 2.18392506449989 | epot = -22.0666014745795 | etot = -16.6403436462408 +744000 ekin = 3.20002114728711 | erot = 2.23309952366348 | epot = -22.028539163169 | etot = -16.5954184922184 +745000 ekin = 3.14151943265607 | erot = 2.14368723244716 | epot = -21.9643868056962 | etot = -16.679180140593 +746000 ekin = 3.13633701521663 | erot = 2.23603593988693 | epot = -21.882872862873 | etot = -16.5104999077695 +747000 ekin = 3.07456220778637 | erot = 2.26587079383327 | epot = -21.7933333887767 | etot = -16.452900387157 +748000 ekin = 2.89245092613184 | erot = 2.40124088279734 | epot = -21.7426214163823 | etot = -16.4489296074532 +749000 ekin = 2.88984722840687 | erot = 2.04545464704715 | epot = -21.7486405812119 | etot = -16.8133387057579 +750000 ekin = 2.90690239667419 | erot = 2.16308193639859 | epot = -21.8037851942402 | etot = -16.7338008611674 +751000 ekin = 2.91748713435882 | erot = 2.28652646733658 | epot = -21.8965044368825 | etot = -16.6924908351871 +752000 ekin = 2.97329531437785 | erot = 2.21452942544206 | epot = -22.0108702587414 | etot = -16.8230455189215 +753000 ekin = 3.12120975435271 | erot = 2.07420726206866 | epot = -22.1751207133467 | etot = -16.9797036969253 +754000 ekin = 3.10943310281728 | erot = 2.24992106750504 | epot = -22.3612161837239 | etot = -17.0018620134016 +755000 ekin = 3.18094546468949 | erot = 2.11033610484495 | epot = -22.5317563093684 | etot = -17.2404747398339 +756000 ekin = 3.21064051440325 | erot = 2.2847912638149 | epot = -22.6718534245683 | etot = -17.1764216463502 +757000 ekin = 3.22246886754025 | erot = 2.44968123087621 | epot = -22.7886247543782 | etot = -17.1164746559617 +758000 ekin = 3.20698410892119 | erot = 2.50948468912354 | epot = -22.8454442004646 | etot = -17.1289754024199 +759000 ekin = 3.21234700687647 | erot = 3.12016624161199 | epot = -22.8201205205761 | etot = -16.4876072720877 +760000 ekin = 3.27823245967428 | erot = 2.84290665242051 | epot = -22.6783954091999 | etot = -16.5572562971051 +761000 ekin = 3.12453460408395 | erot = 2.62184906422512 | epot = -22.438200107225 | etot = -16.6918164389159 +762000 ekin = 3.00311895367918 | erot = 2.41644056781989 | epot = -22.1533696227388 | etot = -16.7338101012398 +763000 ekin = 2.78638584214101 | erot = 2.32781672447598 | epot = -21.8612278496142 | etot = -16.7470252829972 +764000 ekin = 2.62767890060543 | erot = 2.17189942716303 | epot = -21.5731775254861 | etot = -16.7735991977176 +765000 ekin = 2.51344272364432 | erot = 2.10908907015976 | epot = -21.3425441704342 | etot = -16.7200123766302 +766000 ekin = 2.44393199306567 | erot = 2.31186162861124 | epot = -21.1564464031704 | etot = -16.4006527814935 +767000 ekin = 2.31911160678287 | erot = 2.18314082130554 | epot = -20.9627169920091 | etot = -16.4604645639207 +768000 ekin = 2.13701069287306 | erot = 2.40318509200551 | epot = -20.8058909702391 | etot = -16.2656951853605 +769000 ekin = 2.10500025579103 | erot = 2.63894895440955 | epot = -20.8353130509833 | etot = -16.0913638407827 +770000 ekin = 2.12136471147998 | erot = 2.6554458784582 | epot = -20.9284031482484 | etot = -16.1515925583102 +771000 ekin = 2.13543144639345 | erot = 2.60537105377452 | epot = -21.0328875238191 | etot = -16.2920850236511 +772000 ekin = 2.24162906957588 | erot = 2.74417889300961 | epot = -21.1929928408463 | etot = -16.2071848782608 +773000 ekin = 2.33155635751896 | erot = 2.65445073231026 | epot = -21.3698964155417 | etot = -16.3838893257124 +774000 ekin = 2.48263962766567 | erot = 2.82209125579263 | epot = -21.5457273132847 | etot = -16.2409964298264 +775000 ekin = 2.54636977687724 | erot = 2.88053109255988 | epot = -21.7219905564985 | etot = -16.2950896870614 +776000 ekin = 2.69100265054475 | erot = 2.71778929652662 | epot = -21.8782095094697 | etot = -16.4694175623983 +777000 ekin = 2.78238726099168 | erot = 2.72823230982731 | epot = -21.9911064717638 | etot = -16.4804869009448 +778000 ekin = 2.78617187411511 | erot = 2.82815790459219 | epot = -22.0683537375448 | etot = -16.4540239588375 +779000 ekin = 2.84892593422022 | erot = 3.03438887674479 | epot = -22.1034747648793 | etot = -16.2201599539143 +780000 ekin = 2.88441601842049 | erot = 3.24511918269903 | epot = -22.0479241425091 | etot = -15.9183889413896 +781000 ekin = 2.79226579266676 | erot = 3.21548459938523 | epot = -21.8915863093246 | etot = -15.8838359172726 +782000 ekin = 2.68974173738614 | erot = 3.17926967087772 | epot = -21.6363560975167 | etot = -15.7673446892529 +783000 ekin = 2.79024932261644 | erot = 2.97774512627436 | epot = -21.2767108150424 | etot = -15.5087163661516 +784000 ekin = 2.86449981530865 | erot = 2.69172267166055 | epot = -21.0080507325922 | etot = -15.451828245623 +785000 ekin = 2.8095279662806 | erot = 2.46781875930815 | epot = -20.8778745868435 | etot = -15.6005278612548 +786000 ekin = 2.68208018816425 | erot = 2.29793991145912 | epot = -20.7982787985676 | etot = -15.8182586989442 +787000 ekin = 2.56813961256695 | erot = 2.41937763036887 | epot = -20.6982631250954 | etot = -15.7107458821596 +788000 ekin = 2.48851427869081 | erot = 2.49924394097201 | epot = -20.6407407229629 | etot = -15.6529825033001 +789000 ekin = 2.34982946717626 | erot = 2.56420624412215 | epot = -20.6454036959704 | etot = -15.731367984672 +790000 ekin = 2.27171119768142 | erot = 2.49951341291837 | epot = -20.6777685520533 | etot = -15.9065439414535 +791000 ekin = 2.21794673444052 | erot = 2.30373156167707 | epot = -20.733587944852 | etot = -16.2119096487344 +792000 ekin = 2.11119869207691 | erot = 2.39386074875515 | epot = -20.8097229220259 | etot = -16.3046634811938 +793000 ekin = 2.0914986232215 | erot = 2.33936906711867 | epot = -20.8989593305892 | etot = -16.4680916402491 +794000 ekin = 2.07514167964202 | erot = 2.18864817794238 | epot = -21.0024824072348 | etot = -16.7386925496504 +795000 ekin = 2.04599756417741 | erot = 1.93255592398139 | epot = -21.1171979822032 | etot = -17.1386444940444 +796000 ekin = 2.0560011436693 | erot = 2.03200387694587 | epot = -21.2502268612589 | etot = -17.1622218406437 +797000 ekin = 2.02544049585307 | erot = 2.05143967820681 | epot = -21.3783704821385 | etot = -17.3014903080786 +798000 ekin = 2.10531554228792 | erot = 1.92029368041654 | epot = -21.4968277215512 | etot = -17.4712184988467 +799000 ekin = 2.16064788774095 | erot = 1.68829576105933 | epot = -21.5739657591718 | etot = -17.7250221103715 +800000 ekin = 2.21578954821431 | erot = 1.79594742030858 | epot = -21.603956054732 | etot = -17.5922190862092 +801000 ekin = 2.22681551829209 | erot = 1.74309621460738 | epot = -21.6419326028295 | etot = -17.67202086993 +802000 ekin = 2.43626565180586 | erot = 1.85922368535807 | epot = -21.6656085836115 | etot = -17.3701192464476 +803000 ekin = 2.50783665003159 | erot = 1.58815243555041 | epot = -21.7145730788991 | etot = -17.6185839933171 +804000 ekin = 2.54745667479448 | erot = 1.78752251126577 | epot = -21.8111449940636 | etot = -17.4761658080033 +805000 ekin = 2.80080657856553 | erot = 2.23795086847267 | epot = -21.9683564899617 | etot = -16.9295990429235 +806000 ekin = 3.00571166515518 | erot = 2.567719998186 | epot = -22.162148095173 | etot = -16.5887164318318 +807000 ekin = 3.08052739942377 | erot = 2.70802004693296 | epot = -22.3817011009082 | etot = -16.5931536545515 +808000 ekin = 3.0935615091465 | erot = 2.92145006465344 | epot = -22.5983854951432 | etot = -16.5833739213433 +809000 ekin = 3.13660538877476 | erot = 2.76580118315174 | epot = -22.7898921423196 | etot = -16.8874855703931 +810000 ekin = 3.19670438612414 | erot = 3.0603328835606 | epot = -22.9235249464173 | etot = -16.6664876767325 +811000 ekin = 3.2435824870982 | erot = 2.75433145478958 | epot = -22.9913244588506 | etot = -16.9934105169628 +812000 ekin = 3.15387712947527 | erot = 2.67472079387966 | epot = -22.9958338237262 | etot = -17.1672359003712 +813000 ekin = 2.94730683854716 | erot = 2.78448217630032 | epot = -22.9500139539577 | etot = -17.2182249391102 +814000 ekin = 2.84152372531506 | erot = 2.94333861884916 | epot = -22.8861063328149 | etot = -17.1012439886507 +815000 ekin = 2.76239406868367 | erot = 3.2073823268363 | epot = -22.8152543629751 | etot = -16.8454779674551 +816000 ekin = 2.59996655001802 | erot = 2.9541571575398 | epot = -22.7323176380825 | etot = -17.1781939305247 +817000 ekin = 2.50568509693887 | erot = 2.56873279592996 | epot = -22.6565557161143 | etot = -17.5821378232455 +818000 ekin = 2.36879357413845 | erot = 2.62740710801411 | epot = -22.5771576372408 | etot = -17.5809569550882 +819000 ekin = 2.22137153555244 | erot = 2.20921666742025 | epot = -22.5063000643985 | etot = -18.0757118614258 +820000 ekin = 2.15352101503844 | erot = 2.22634472649615 | epot = -22.4644595926715 | etot = -18.0845938511369 +821000 ekin = 2.02682142409779 | erot = 2.27918504669084 | epot = -22.4285107655678 | etot = -18.1225042947792 +822000 ekin = 1.96590621976212 | erot = 2.1193358571147 | epot = -22.3893132044792 | etot = -18.3040711276024 +823000 ekin = 1.87390236474894 | erot = 2.43833928629823 | epot = -22.3766834300039 | etot = -18.0644417789567 +824000 ekin = 1.76511965451009 | erot = 2.08632973066864 | epot = -22.384695570879 | etot = -18.5332461857003 +825000 ekin = 1.72275906923453 | erot = 2.05491870775394 | epot = -22.4158544093933 | etot = -18.6381766324048 +826000 ekin = 1.654231730303 | erot = 1.90118083599813 | epot = -22.4865285736228 | etot = -18.9311160073217 +827000 ekin = 1.6220387740366 | erot = 2.11543908973767 | epot = -22.5672947980656 | etot = -18.8298169342914 +828000 ekin = 1.50840521352428 | erot = 1.94184045091945 | epot = -22.6360835928992 | etot = -19.1858379284554 +829000 ekin = 1.53133011832189 | erot = 2.23719923783634 | epot = -22.6642383844097 | etot = -18.8957090282514 +830000 ekin = 1.57674105330123 | erot = 2.32835034574904 | epot = -22.6990636526513 | etot = -18.793972253601 +831000 ekin = 1.66163281968432 | erot = 2.45366313848764 | epot = -22.728227092002 | etot = -18.6129311338301 +832000 ekin = 1.61575752897352 | erot = 2.36469513946935 | epot = -22.7314805576127 | etot = -18.7510278891698 +833000 ekin = 1.57484623731402 | erot = 2.43716147594987 | epot = -22.731026717864 | etot = -18.7190190046001 +834000 ekin = 1.61211592880252 | erot = 2.27369578074054 | epot = -22.7231073149633 | etot = -18.8372956054203 +835000 ekin = 1.71255063218106 | erot = 2.25145179686401 | epot = -22.7213723561492 | etot = -18.7573699271041 +836000 ekin = 1.66410080947891 | erot = 2.36287362113634 | epot = -22.7106963960556 | etot = -18.6837219654403 +837000 ekin = 1.55393537343306 | erot = 2.19682771055502 | epot = -22.7054421830578 | etot = -18.9546790990697 +838000 ekin = 1.55395449543536 | erot = 1.97831033842468 | epot = -22.6952408411522 | etot = -19.1629760072922 +839000 ekin = 1.56966734033286 | erot = 1.54356794703842 | epot = -22.6819663107275 | etot = -19.5687310233562 +840000 ekin = 1.67828545417797 | erot = 1.72274710399929 | epot = -22.6537987135626 | etot = -19.2527661553853 +841000 ekin = 1.70756024783819 | erot = 1.86878110712351 | epot = -22.6201854793038 | etot = -19.0438441243421 +842000 ekin = 1.65445531752371 | erot = 1.98969497305846 | epot = -22.5834458053272 | etot = -18.939295514745 +843000 ekin = 1.61813041031721 | erot = 1.94297358985358 | epot = -22.5343209800003 | etot = -18.9732169798295 +844000 ekin = 1.66559589059894 | erot = 2.07459583566883 | epot = -22.4909419629376 | etot = -18.7507502366698 +845000 ekin = 1.67372319184911 | erot = 2.01531047459158 | epot = -22.4486472588118 | etot = -18.7596135923711 +846000 ekin = 1.76456308419071 | erot = 2.04286196110294 | epot = -22.390765558653 | etot = -18.5833405133594 +847000 ekin = 1.68474528716571 | erot = 1.95062183544452 | epot = -22.3219698462515 | etot = -18.6866027236413 +848000 ekin = 1.77692080839843 | erot = 1.94903343886577 | epot = -22.2732219411799 | etot = -18.5472676939157 +849000 ekin = 1.80865478838294 | erot = 1.92750105953017 | epot = -22.254397724875 | etot = -18.5182418769619 +850000 ekin = 1.81902433574993 | erot = 1.83695743097569 | epot = -22.289579874299 | etot = -18.6335981075734 +851000 ekin = 1.8919092098265 | erot = 1.99438142785362 | epot = -22.370687738675 | etot = -18.4843971009949 +852000 ekin = 1.85572644981142 | erot = 2.08333690915233 | epot = -22.4954803882537 | etot = -18.55641702929 +853000 ekin = 1.96819950961986 | erot = 2.46522063934758 | epot = -22.6461768022044 | etot = -18.2127566532369 +854000 ekin = 1.99027367747409 | erot = 2.82405245762684 | epot = -22.8233134890086 | etot = -18.0089873539077 +855000 ekin = 2.02041206494495 | erot = 2.76127853932992 | epot = -22.9719213877705 | etot = -18.1902307834956 +856000 ekin = 1.98428835568952 | erot = 2.89398807391186 | epot = -23.0688189336862 | etot = -18.1905425040848 +857000 ekin = 1.94437625728389 | erot = 2.75841683958909 | epot = -23.1174862513516 | etot = -18.4146931544786 +858000 ekin = 1.77145748342923 | erot = 2.97613159794702 | epot = -23.09256410399 | etot = -18.3449750226137 +859000 ekin = 1.75449757825827 | erot = 2.94820975919279 | epot = -23.0174946494366 | etot = -18.3147873119855 +860000 ekin = 1.69824130830274 | erot = 2.56619342882397 | epot = -22.9138277520104 | etot = -18.6493930148837 +861000 ekin = 1.61723118355358 | erot = 2.60723394434931 | epot = -22.7817384645193 | etot = -18.5572733366164 +862000 ekin = 1.65016805241347 | erot = 2.58826826538693 | epot = -22.6306365080491 | etot = -18.3922001902487 +863000 ekin = 1.62167782719988 | erot = 2.32265511281206 | epot = -22.4833247924575 | etot = -18.5389918524456 +864000 ekin = 1.64443917202622 | erot = 2.41694169974078 | epot = -22.3437317075498 | etot = -18.2823508357828 +865000 ekin = 1.6232360705676 | erot = 2.42797649716492 | epot = -22.2339680949561 | etot = -18.1827555272236 +866000 ekin = 1.52330589261667 | erot = 2.43806006675287 | epot = -22.1297693882999 | etot = -18.1684034289304 +867000 ekin = 1.53921563766813 | erot = 2.56348629931229 | epot = -22.0395837686754 | etot = -17.936881831695 +868000 ekin = 1.51596999194589 | erot = 2.55716270739324 | epot = -21.9937420973958 | etot = -17.9206093980567 +869000 ekin = 1.59814692071406 | erot = 2.15771580624658 | epot = -21.9767818689194 | etot = -18.2209191419588 +870000 ekin = 1.62438751258778 | erot = 2.30366665730519 | epot = -22.0119463158222 | etot = -18.0838921459292 +871000 ekin = 1.64699232625249 | erot = 2.29504943910978 | epot = -22.0696451748748 | etot = -18.1276034095125 +872000 ekin = 1.7493610768973 | erot = 1.99655620180651 | epot = -22.1253859835088 | etot = -18.379468704805 +873000 ekin = 1.81958663574001 | erot = 2.15311518592939 | epot = -22.1932828259255 | etot = -18.2205810042561 +874000 ekin = 1.81429910948355 | erot = 2.15191422065537 | epot = -22.2521915372751 | etot = -18.2859782071362 +875000 ekin = 1.92774125136724 | erot = 2.09841769816155 | epot = -22.295019959013 | etot = -18.2688610094842 +876000 ekin = 2.05205383204242 | erot = 1.71112886964279 | epot = -22.3353847724689 | etot = -18.5722020707837 +877000 ekin = 2.00183605233821 | erot = 1.88466440539221 | epot = -22.3587375372267 | etot = -18.4722370794963 +878000 ekin = 1.96978247023496 | erot = 1.94492504421967 | epot = -22.3467650367967 | etot = -18.432057522342 +879000 ekin = 1.89978467383989 | erot = 2.08488575038216 | epot = -22.3245187946312 | etot = -18.3398483704092 +880000 ekin = 1.79316389454238 | erot = 2.0447265911779 | epot = -22.3022731632373 | etot = -18.464382677517 +881000 ekin = 1.84166442689778 | erot = 1.91254711303492 | epot = -22.2610385401995 | etot = -18.5068270002668 +882000 ekin = 1.84084232668587 | erot = 1.89291352333202 | epot = -22.2058993058503 | etot = -18.4721434558324 +883000 ekin = 1.85228381570649 | erot = 2.04568547305427 | epot = -22.1462287912802 | etot = -18.2482595025195 +884000 ekin = 1.74299718482353 | erot = 2.41541515350573 | epot = -22.0952302162142 | etot = -17.936817877885 +885000 ekin = 1.7011370112973 | erot = 2.12494075622072 | epot = -22.0624268043462 | etot = -18.2363490368282 +886000 ekin = 1.65197597472173 | erot = 2.40636683282474 | epot = -22.0395749533722 | etot = -17.9812321458257 +887000 ekin = 1.60780982779807 | erot = 2.52410870185878 | epot = -22.0426576240069 | etot = -17.9107390943501 +888000 ekin = 1.62736239763282 | erot = 2.54417200798801 | epot = -22.0837991546705 | etot = -17.9122647490497 +889000 ekin = 1.56260633742274 | erot = 2.93015784124647 | epot = -22.1644353768122 | etot = -17.671671198143 +890000 ekin = 1.59045576751439 | erot = 2.98817840519876 | epot = -22.2639211219189 | etot = -17.6852869492058 +891000 ekin = 1.56285966089655 | erot = 3.45684679212764 | epot = -22.3811052217716 | etot = -17.3613987687474 +892000 ekin = 1.5433042783868 | erot = 3.72585516837269 | epot = -22.4833521640554 | etot = -17.2141927172959 +893000 ekin = 1.59146757296863 | erot = 3.57834579864732 | epot = -22.5732593414809 | etot = -17.4034459698649 +894000 ekin = 1.62137337508144 | erot = 3.47314499517222 | epot = -22.6375279089989 | etot = -17.5430095387452 +895000 ekin = 1.66705900655095 | erot = 3.49716948137549 | epot = -22.6624975634756 | etot = -17.4982690755491 +896000 ekin = 1.55030206730747 | erot = 3.09080759429309 | epot = -22.6660259737724 | etot = -18.0249163121719 +897000 ekin = 1.59716300255375 | erot = 3.1884711459157 | epot = -22.6447094591909 | etot = -17.8590753107214 +898000 ekin = 1.63846223091607 | erot = 3.52423413884758 | epot = -22.5748070090784 | etot = -17.4121106393147 +899000 ekin = 1.76043242630826 | erot = 3.57817463535426 | epot = -22.5017519688476 | etot = -17.1631449071851 +900000 ekin = 1.79654660125886 | erot = 3.47500564829584 | epot = -22.435532158833 | etot = -17.1639799092783 +901000 ekin = 1.90036826124888 | erot = 3.08289582473293 | epot = -22.3778122198663 | etot = -17.3945481338845 +902000 ekin = 1.86184581507265 | erot = 3.53323519891635 | epot = -22.3343178451943 | etot = -16.9392368312053 +903000 ekin = 1.82612532908466 | erot = 2.94106563489456 | epot = -22.2753946825372 | etot = -17.508203718558 +904000 ekin = 1.83566294124427 | erot = 2.77276060855958 | epot = -22.2178118874605 | etot = -17.6093883376567 +905000 ekin = 1.98760022520356 | erot = 2.39033190744213 | epot = -22.1879073476946 | etot = -17.8099752150489 +906000 ekin = 2.03479331668359 | erot = 2.33442285317147 | epot = -22.1683021524559 | etot = -17.7990859826009 +907000 ekin = 2.13854534243923 | erot = 2.49897360264073 | epot = -22.1329919803474 | etot = -17.4954730352674 +908000 ekin = 2.29292980718743 | erot = 2.19971547335205 | epot = -22.0946544988759 | etot = -17.6020092183364 +909000 ekin = 2.26088767533079 | erot = 2.08032511955685 | epot = -22.0656471636866 | etot = -17.724434368799 +910000 ekin = 2.24374768453805 | erot = 2.05633395260619 | epot = -22.0263801495106 | etot = -17.7262985123664 +911000 ekin = 2.21169387792048 | erot = 2.07671300621213 | epot = -21.9687563877575 | etot = -17.6803495036249 +912000 ekin = 2.2634282786901 | erot = 2.19424965404288 | epot = -21.8985767358493 | etot = -17.4408988031163 +913000 ekin = 2.25810530261871 | erot = 2.15174616542683 | epot = -21.8202885495934 | etot = -17.4104370815479 +914000 ekin = 2.22041757979719 | erot = 2.112964313505 | epot = -21.7659012518198 | etot = -17.4325193585176 +915000 ekin = 2.3058538526313 | erot = 2.01195201885166 | epot = -21.710587261287 | etot = -17.3927813898041 +916000 ekin = 2.31746417556776 | erot = 2.26468835943419 | epot = -21.6446439231988 | etot = -17.0624913881969 +917000 ekin = 2.29083855377465 | erot = 2.35266040877195 | epot = -21.5981818981915 | etot = -16.9546829356449 +918000 ekin = 2.21948812241831 | erot = 2.67757709392787 | epot = -21.5768387043291 | etot = -16.6797734879829 +919000 ekin = 2.17502484144656 | erot = 2.50505023715203 | epot = -21.5962136980994 | etot = -16.9161386195008 +920000 ekin = 2.05225364762711 | erot = 2.28466235959408 | epot = -21.6248903594419 | etot = -17.2879743522207 +921000 ekin = 1.95826631853156 | erot = 2.44785811644725 | epot = -21.6449866661272 | etot = -17.2388622311484 +922000 ekin = 1.88713416312701 | erot = 2.20407498665963 | epot = -21.6433309330735 | etot = -17.5521217832869 +923000 ekin = 1.85499144920864 | erot = 2.47959433102065 | epot = -21.6219980061652 | etot = -17.2874122259359 +924000 ekin = 1.82449923254799 | erot = 2.43607326145712 | epot = -21.581122536388 | etot = -17.3205500423829 +925000 ekin = 1.75365416617991 | erot = 2.6704338213266 | epot = -21.5654424680514 | etot = -17.1413544805449 +926000 ekin = 1.82728938436568 | erot = 2.42568919454089 | epot = -21.5649010983331 | etot = -17.3119225194266 +927000 ekin = 1.71111907929799 | erot = 2.49634793929369 | epot = -21.5869585210632 | etot = -17.3794915024715 +928000 ekin = 1.64740049786963 | erot = 2.5378889624632 | epot = -21.6442370240019 | etot = -17.4589475636691 +929000 ekin = 1.68616483039163 | erot = 2.2627280589498 | epot = -21.7404415309175 | etot = -17.7915486415761 +930000 ekin = 1.8057977284219 | erot = 2.41185782526022 | epot = -21.8766034841546 | etot = -17.6589479304725 +931000 ekin = 1.84540351563189 | erot = 2.51429545094947 | epot = -22.0343594510998 | etot = -17.6746604845185 +932000 ekin = 1.91948716687413 | erot = 2.5078924614536 | epot = -22.210720099767 | etot = -17.7833404714392 +933000 ekin = 2.08806765097296 | erot = 2.54053118825007 | epot = -22.3857648909584 | etot = -17.7571660517354 +934000 ekin = 2.15790983140663 | erot = 2.35997810662255 | epot = -22.5303312795783 | etot = -18.0124433415491 +935000 ekin = 2.25791486608222 | erot = 2.61090003819346 | epot = -22.6566492074988 | etot = -17.7878343032231 +936000 ekin = 2.28694449910393 | erot = 2.88785018879364 | epot = -22.7387712915678 | etot = -17.5639766036702 +937000 ekin = 2.25985365977459 | erot = 2.68904834283785 | epot = -22.7546509524832 | etot = -17.8057489498707 +938000 ekin = 2.28814448880636 | erot = 2.54450017128454 | epot = -22.6975117726246 | etot = -17.8648671125337 +939000 ekin = 2.22181328678752 | erot = 2.40773891474717 | epot = -22.5724060300395 | etot = -17.9428538285048 +940000 ekin = 2.1904731805913 | erot = 2.24413418480596 | epot = -22.382599968865 | etot = -17.9479926034678 +941000 ekin = 1.97789684714955 | erot = 2.11351242298925 | epot = -22.1581596355121 | etot = -18.0667503653733 +942000 ekin = 1.82283426550965 | erot = 2.02814504753847 | epot = -21.9245079619175 | etot = -18.0735286488694 +943000 ekin = 1.77337816858732 | erot = 1.98390662003602 | epot = -21.7436762740877 | etot = -17.9863914854644 +944000 ekin = 1.74129354399816 | erot = 2.02570172818747 | epot = -21.6008012672883 | etot = -17.8338059951026 +945000 ekin = 1.72896560635122 | erot = 2.2099750803776 | epot = -21.5146553493564 | etot = -17.5757146626276 +946000 ekin = 1.90743436357407 | erot = 2.13705774217383 | epot = -21.4832307541172 | etot = -17.4387386483693 +947000 ekin = 2.028379866634 | erot = 2.29971426385207 | epot = -21.4794165970829 | etot = -17.1513224665968 +948000 ekin = 2.03783072879855 | erot = 2.11465543087289 | epot = -21.4989322229569 | etot = -17.3464460632855 +949000 ekin = 2.16990164234306 | erot = 1.99168801462696 | epot = -21.5364977263911 | etot = -17.3749080694211 +950000 ekin = 2.24527818418913 | erot = 2.12106218398704 | epot = -21.6200851503001 | etot = -17.253744782124 +951000 ekin = 2.35977794911024 | erot = 2.09437757436299 | epot = -21.718296700309 | etot = -17.2641411768358 +952000 ekin = 2.43036880893062 | erot = 2.60988991207355 | epot = -21.8098996400664 | etot = -16.7696409190622 +953000 ekin = 2.58164820045211 | erot = 2.62403788420625 | epot = -21.9145443047315 | etot = -16.7088582200731 +954000 ekin = 2.67569984167854 | erot = 2.49812470218295 | epot = -21.9760951843273 | etot = -16.8022706404658 +955000 ekin = 2.87107117644804 | erot = 2.70877614839034 | epot = -22.0056490566507 | etot = -16.4258017318124 +956000 ekin = 3.09772559508496 | erot = 2.62503444551481 | epot = -21.9996173766366 | etot = -16.2768573360369 +957000 ekin = 3.06387016720788 | erot = 2.83023563118165 | epot = -21.9356950338519 | etot = -16.0415892354624 +958000 ekin = 3.15191228692187 | erot = 2.56018473189795 | epot = -21.7995256048187 | etot = -16.0874285859989 +959000 ekin = 3.17671440939285 | erot = 2.4842151393073 | epot = -21.6207768556276 | etot = -15.9598473069274 +960000 ekin = 3.01275155896461 | erot = 2.431673793689 | epot = -21.4002125285923 | etot = -15.9557871759387 +961000 ekin = 2.94603084981591 | erot = 2.28503967365799 | epot = -21.1407696110433 | etot = -15.9096990875694 +962000 ekin = 2.87549986152203 | erot = 2.26764795390621 | epot = -20.8628900961283 | etot = -15.7197422807 +963000 ekin = 2.72736350188063 | erot = 2.02845193194806 | epot = -20.6025221949606 | etot = -15.8467067611319 +964000 ekin = 2.55766914747927 | erot = 1.90275324626263 | epot = -20.3671083669859 | etot = -15.906685973244 +965000 ekin = 2.42945571607322 | erot = 1.87896821137038 | epot = -20.1665878867516 | etot = -15.858163959308 +966000 ekin = 2.30432659917118 | erot = 2.05976948111884 | epot = -20.0345331150588 | etot = -15.6704370347688 +967000 ekin = 2.19239153699739 | erot = 2.23712663137927 | epot = -19.93047491381 | etot = -15.5009567454333 +968000 ekin = 2.12056467997116 | erot = 2.29258395928729 | epot = -19.8478936101842 | etot = -15.4347449709257 +969000 ekin = 2.03082359465821 | erot = 2.12561043987577 | epot = -19.8204193361086 | etot = -15.6639853015746 +970000 ekin = 2.06263818102141 | erot = 2.20772735706072 | epot = -19.8171007441947 | etot = -15.5467352061125 +971000 ekin = 2.07242738756087 | erot = 2.39359294752953 | epot = -19.8426078132312 | etot = -15.3765874781408 +972000 ekin = 2.13593664400655 | erot = 2.51621155234823 | epot = -19.8711039585032 | etot = -15.2189557621484 +973000 ekin = 2.19239588059432 | erot = 2.71817846233973 | epot = -19.8806125652158 | etot = -14.9700382222818 +974000 ekin = 2.08126353721536 | erot = 2.92742241693054 | epot = -19.8623774193927 | etot = -14.8536914652468 +975000 ekin = 2.0110783324585 | erot = 2.57768138393002 | epot = -19.8162471814878 | etot = -15.2274874650993 +976000 ekin = 1.90089112618523 | erot = 2.56071712862254 | epot = -19.7674234084161 | etot = -15.3058151536083 +977000 ekin = 1.82747564687015 | erot = 2.561175280289 | epot = -19.6916974381971 | etot = -15.303046511038 +978000 ekin = 1.81823178973058 | erot = 2.21507357951039 | epot = -19.6525909549454 | etot = -15.6192855857044 +979000 ekin = 1.8602091000828 | erot = 2.09761460514009 | epot = -19.6622349611945 | etot = -15.7044112559716 +980000 ekin = 1.8981306313303 | erot = 1.86971657434407 | epot = -19.6793196081168 | etot = -15.9114724024424 +981000 ekin = 1.96055767456421 | erot = 1.80588067180903 | epot = -19.7616283768435 | etot = -15.9951900304703 +982000 ekin = 2.04211859099661 | erot = 2.0065708647352 | epot = -19.8926418365965 | etot = -15.8439523808647 +983000 ekin = 2.08434248544488 | erot = 2.13281702823496 | epot = -20.0190963786397 | etot = -15.8019368649599 +984000 ekin = 2.28263945352163 | erot = 2.30206381624197 | epot = -20.1817376774969 | etot = -15.5970344077333 +985000 ekin = 2.33165973691051 | erot = 2.36792674462185 | epot = -20.3496337869023 | etot = -15.65004730537 +986000 ekin = 2.36845296330311 | erot = 2.40477790490572 | epot = -20.5172631957726 | etot = -15.7440323275638 +987000 ekin = 2.44660573334477 | erot = 2.60656597532256 | epot = -20.6827873919813 | etot = -15.629615683314 +988000 ekin = 2.48779340096477 | erot = 2.57507657271676 | epot = -20.8472563124179 | etot = -15.7843863387364 +989000 ekin = 2.62562775055009 | erot = 2.7875350688748 | epot = -20.9917314563749 | etot = -15.57856863695 +990000 ekin = 2.71356724748619 | erot = 3.06120975803976 | epot = -21.1004443459535 | etot = -15.3256673404276 +991000 ekin = 2.84485263344776 | erot = 3.42057995731802 | epot = -21.1508216928249 | etot = -14.8853891020592 +992000 ekin = 2.88616886570543 | erot = 3.47043505669747 | epot = -21.1491979980144 | etot = -14.7925940756115 +993000 ekin = 2.86101706987592 | erot = 3.40172740673593 | epot = -21.1075232078054 | etot = -14.8447787311935 +994000 ekin = 2.90016396739103 | erot = 3.68400469178538 | epot = -21.0544509503641 | etot = -14.4702822911876 +995000 ekin = 2.84836922582537 | erot = 3.86724891435329 | epot = -20.9907241498061 | etot = -14.2751060096275 +996000 ekin = 2.87268648345341 | erot = 3.37952872488001 | epot = -20.9186469222953 | etot = -14.6664317139619 +997000 ekin = 2.84260788754428 | erot = 3.24170863044316 | epot = -20.8185896660715 | etot = -14.7342731480841 +998000 ekin = 2.86644419268205 | erot = 3.30788437736625 | epot = -20.6892589093475 | etot = -14.5149303392992 +999000 ekin = 2.91762607564667 | erot = 3.19659159185214 | epot = -20.5404731143958 | etot = -14.426255446897 +1000000 ekin = 2.92466509156961 | erot = 2.67428308533433 | epot = -20.3978646538425 | etot = -14.7989164769385 + 1000000 0.12998512 -1.3075422 0.032675661 -1.092075 0.0002012331 64000 +Loop time of 37.6859 on 1 procs for 1000000 steps with 16 atoms + +Performance: 22926.360 tau/day, 26535.139 timesteps/s +99.2% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 31.712 | 31.712 | 31.712 | 0.0 | 84.15 +Bond | 1.0014 | 1.0014 | 1.0014 | 0.0 | 2.66 +Neigh | 0.014936 | 0.014936 | 0.014936 | 0.0 | 0.04 +Comm | 0.23328 | 0.23328 | 0.23328 | 0.0 | 0.62 +Output | 0.16016 | 0.16016 | 0.16016 | 0.0 | 0.42 +Modify | 4.2289 | 4.2289 | 4.2289 | 0.0 | 11.22 +Other | | 0.3355 | | | 0.89 + +Nlocal: 16.0000 ave 16 max 16 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 107.000 ave 107 max 107 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 107 +Ave neighs/atom = 6.6875000 +Ave special neighs/atom = 3.7500000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.2.* nocoeff +System init for write_data ... +Total wall time: 0:00:37 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 new file mode 100644 index 0000000000..5db1bd47b3 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 @@ -0,0 +1,1183 @@ +LAMMPS (27 May 2021) +variable number equal 2 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex2 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 16 atoms + reading velocities ... + 16 velocities + scanning bonds ... + 2 = max bonds/atom + 16 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 13 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +set atom * mass 3.1575 +Setting atom values ... + 16 settings made for mass + +group all type 1 4 +16 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA2 pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# NVE ensemble +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.2.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 2.70475393009871 | erot = 2.80172072918779 | epot = -21.0482852787267 | etot = -15.5418106194402 +Per MPI rank memory allocation (min/avg/max) = 9.570 | 9.599 | 9.684 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.12021129 -1.3610384 0.045520537 -1.1464707 5.9660461e-05 64000 +1000 ekin = 2.72013629959678 | erot = 3.04690178503881 | epot = -20.8790776967073 | etot = -15.1120396120718 +2000 ekin = 2.78009554567455 | erot = 2.50647079931992 | epot = -20.701004729611 | etot = -15.4144383846165 +3000 ekin = 2.76688166744693 | erot = 2.2821949377072 | epot = -20.5676929006559 | etot = -15.5186162955017 +4000 ekin = 2.70260128929367 | erot = 2.27403484282169 | epot = -20.4705557396832 | etot = -15.4939196075679 +5000 ekin = 2.64234178224169 | erot = 2.30733191000246 | epot = -20.423605764695 | etot = -15.4739320724509 +6000 ekin = 2.65801663486023 | erot = 2.39066626378173 | epot = -20.4246308066932 | etot = -15.3759479080512 +7000 ekin = 2.68316645880461 | erot = 2.33063300072945 | epot = -20.4749165048776 | etot = -15.4611170453436 +8000 ekin = 2.59120591314502 | erot = 2.0547790667844 | epot = -20.5631212612484 | etot = -15.917136281319 +9000 ekin = 2.65376648779414 | erot = 2.11575091090835 | epot = -20.6881173411843 | etot = -15.9185999424818 +10000 ekin = 2.77402134048095 | erot = 2.56538522546418 | epot = -20.812379085734 | etot = -15.4729725197888 +11000 ekin = 2.67401627862024 | erot = 2.8852684806639 | epot = -20.9238620704284 | etot = -15.3645773111443 +12000 ekin = 2.69364271301778 | erot = 2.66699911618312 | epot = -21.0407385357143 | etot = -15.6800967065134 +13000 ekin = 2.7835207626619 | erot = 2.62517780661367 | epot = -21.1720350247762 | etot = -15.7633364555007 +14000 ekin = 2.84595331390101 | erot = 2.43480334086399 | epot = -21.2963503704521 | etot = -16.0155937156871 +15000 ekin = 2.88907009700338 | erot = 2.41912745049441 | epot = -21.4150808543173 | etot = -16.1068833068195 +16000 ekin = 3.00758069356163 | erot = 2.63110801135323 | epot = -21.5261697271622 | etot = -15.8874810222474 +17000 ekin = 3.08749820661834 | erot = 2.5313798011721 | epot = -21.6092998996455 | etot = -15.990421891855 +18000 ekin = 2.97601119892236 | erot = 2.53805591696762 | epot = -21.6415056622546 | etot = -16.1274385463646 +19000 ekin = 2.8848844473712 | erot = 2.54441184479443 | epot = -21.6205491988714 | etot = -16.1912529067057 +20000 ekin = 2.65941914113234 | erot = 2.80243564233628 | epot = -21.5551870578305 | etot = -16.0933322743619 +21000 ekin = 2.57547433431649 | erot = 2.7496552753446 | epot = -21.4613716405082 | etot = -16.1362420308471 +22000 ekin = 2.53510807627333 | erot = 2.74029747587436 | epot = -21.3396334655202 | etot = -16.0642279133725 +23000 ekin = 2.40091416401757 | erot = 2.41245160665477 | epot = -21.2029723825425 | etot = -16.3896066118702 +24000 ekin = 2.35240654345191 | erot = 2.10101829600981 | epot = -21.0659817341104 | etot = -16.6125568946487 +25000 ekin = 2.24250544456842 | erot = 2.18590508799003 | epot = -20.9513445132091 | etot = -16.5229339806506 +26000 ekin = 2.15423649133114 | erot = 2.45727700237473 | epot = -20.866937908599 | etot = -16.2554244148931 +27000 ekin = 1.93524632585275 | erot = 2.34650303801409 | epot = -20.8326435236229 | etot = -16.5508941597561 +28000 ekin = 1.76943324443446 | erot = 2.41353675794598 | epot = -20.8217433644356 | etot = -16.6387733620552 +29000 ekin = 1.75176430946868 | erot = 2.21029128532645 | epot = -20.8529129923908 | etot = -16.8908573975956 +30000 ekin = 1.69211824889088 | erot = 2.43399158562873 | epot = -20.9103885167126 | etot = -16.784278682193 +31000 ekin = 1.72526028314479 | erot = 2.32450864670459 | epot = -21.0087646424163 | etot = -16.9589957125669 +32000 ekin = 1.85144315905103 | erot = 2.36996515630943 | epot = -21.1366890377948 | etot = -16.9152807224343 +33000 ekin = 1.92914135939677 | erot = 2.55157176589721 | epot = -21.2867811906613 | etot = -16.8060680653673 +34000 ekin = 1.86488201964575 | erot = 2.70400704788851 | epot = -21.4771748939503 | etot = -16.908285826416 +35000 ekin = 1.82452979540543 | erot = 2.88148899883832 | epot = -21.6928620054229 | etot = -16.9868432111792 +36000 ekin = 1.85882387630624 | erot = 2.79217577332803 | epot = -21.8984987105766 | etot = -17.2474990609424 +37000 ekin = 1.92831232163797 | erot = 2.92698521263713 | epot = -22.097948831493 | etot = -17.2426512972179 +38000 ekin = 1.935816304174 | erot = 2.90317027990001 | epot = -22.2686450915845 | etot = -17.4296585075105 +39000 ekin = 2.01059319335201 | erot = 2.94480429938125 | epot = -22.3778651261379 | etot = -17.4224676334047 +40000 ekin = 1.9707104121532 | erot = 2.93286391865189 | epot = -22.417858975573 | etot = -17.5142846447679 +41000 ekin = 2.05746434456946 | erot = 2.68242698010624 | epot = -22.3807196920657 | etot = -17.64082836739 +42000 ekin = 2.0911250992276 | erot = 2.6968518051769 | epot = -22.2906811943749 | etot = -17.5027042899704 +43000 ekin = 2.01814513009277 | erot = 2.85562815769075 | epot = -22.1601960046645 | etot = -17.2864227168809 +44000 ekin = 1.9217179974809 | erot = 2.74064501961459 | epot = -22.0236920121946 | etot = -17.3613289950991 +45000 ekin = 1.81213357146532 | erot = 2.33969637171489 | epot = -21.9013900155101 | etot = -17.7495600723299 +46000 ekin = 1.70431886268157 | erot = 2.39010616929271 | epot = -21.7951136139008 | etot = -17.7006885819265 +47000 ekin = 1.66181647983356 | erot = 2.43237478783467 | epot = -21.692979578058 | etot = -17.5987883103898 +48000 ekin = 1.6064085128736 | erot = 2.34869900597689 | epot = -21.5897329144351 | etot = -17.6346253955846 +49000 ekin = 1.52653989846239 | erot = 2.00084533105261 | epot = -21.5040522645286 | etot = -17.9766670350136 +50000 ekin = 1.44266718781295 | erot = 2.13453634177553 | epot = -21.4422830581905 | etot = -17.865079528602 +51000 ekin = 1.43550636726016 | erot = 2.23006562743143 | epot = -21.3792358932285 | etot = -17.713663898537 +52000 ekin = 1.41917583919533 | erot = 2.33479503366763 | epot = -21.3396501545003 | etot = -17.5856792816373 +53000 ekin = 1.50159149702876 | erot = 2.56353973620708 | epot = -21.3318420135024 | etot = -17.2667107802665 +54000 ekin = 1.53108046116779 | erot = 2.69431714698444 | epot = -21.3427130336452 | etot = -17.117315425493 +55000 ekin = 1.5720449679094 | erot = 2.27080332163902 | epot = -21.3613604522624 | etot = -17.518512162714 +56000 ekin = 1.49781857063065 | erot = 2.33086022046605 | epot = -21.3901677321077 | etot = -17.561488941011 +57000 ekin = 1.503261266716 | erot = 2.18728874275908 | epot = -21.4375848454808 | etot = -17.7470348360058 +58000 ekin = 1.56885163164476 | erot = 2.04781187994405 | epot = -21.4901198020452 | etot = -17.8734562904564 +59000 ekin = 1.6445687577087 | erot = 2.0921617030342 | epot = -21.5467238774716 | etot = -17.8099934167287 +60000 ekin = 1.6169192573205 | erot = 2.29542751813012 | epot = -21.6038795960773 | etot = -17.6915328206267 +61000 ekin = 1.65884539872101 | erot = 2.1084734948915 | epot = -21.6559771193387 | etot = -17.8886582257262 +62000 ekin = 1.72309094226646 | erot = 2.30407725612069 | epot = -21.7076104489971 | etot = -17.6804422506099 +63000 ekin = 1.68827086718387 | erot = 2.43329143180656 | epot = -21.7495751902361 | etot = -17.6280128912457 +64000 ekin = 1.77925986833289 | erot = 2.43931965882654 | epot = -21.7824788671426 | etot = -17.5638993399832 +65000 ekin = 1.71201207010361 | erot = 2.055652813486 | epot = -21.8004838491859 | etot = -18.0328189655963 +66000 ekin = 1.72258841195346 | erot = 1.8922111104938 | epot = -21.8042275382222 | etot = -18.1894280157749 +67000 ekin = 1.81093386427591 | erot = 1.9714982271847 | epot = -21.8237244535635 | etot = -18.0412923621029 +68000 ekin = 1.92086731218825 | erot = 2.04627775213356 | epot = -21.853856684096 | etot = -17.8867116197742 +69000 ekin = 1.95769420352299 | erot = 2.00695954556819 | epot = -21.8959292342322 | etot = -17.9312754851411 +70000 ekin = 2.04640812952272 | erot = 1.99675167399818 | epot = -21.9385347387981 | etot = -17.8953749352772 +71000 ekin = 2.09757818208408 | erot = 2.01099773767172 | epot = -21.9790979736474 | etot = -17.8705220538916 +72000 ekin = 2.17178409239839 | erot = 2.18113395841071 | epot = -22.015468769256 | etot = -17.6625507184469 +73000 ekin = 2.15190632785464 | erot = 2.45126940688759 | epot = -22.0387524357625 | etot = -17.4355767010203 +74000 ekin = 2.16265422451101 | erot = 2.15818555561656 | epot = -22.0321747353182 | etot = -17.7113349551906 +75000 ekin = 2.14414193832382 | erot = 1.98187999045799 | epot = -22.0167291804319 | etot = -17.8907072516501 +76000 ekin = 2.24692887257252 | erot = 1.89718749935303 | epot = -21.9954563023383 | etot = -17.8513399304128 +77000 ekin = 2.23929641773342 | erot = 1.79331586377881 | epot = -21.9651666845261 | etot = -17.9325544030139 +78000 ekin = 2.25131896609554 | erot = 1.81371170007279 | epot = -21.9326569846905 | etot = -17.8676263185222 +79000 ekin = 2.27306161178794 | erot = 1.71185434931883 | epot = -21.8897569865356 | etot = -17.9048410254288 +80000 ekin = 2.39399894443299 | erot = 1.35732464587517 | epot = -21.8616153060318 | etot = -18.1102917157236 +81000 ekin = 2.47373459732163 | erot = 1.54787737363677 | epot = -21.8542089705401 | etot = -17.8325969995817 +82000 ekin = 2.47280496509114 | erot = 1.57756404285384 | epot = -21.8821357876168 | etot = -17.8317667796718 +83000 ekin = 2.48717741782561 | erot = 1.71069094857345 | epot = -21.9195089096536 | etot = -17.7216405432545 +84000 ekin = 2.44796638425876 | erot = 2.01404972344718 | epot = -21.9668916260735 | etot = -17.5048755183675 +85000 ekin = 2.3957408319547 | erot = 2.32413660190234 | epot = -22.0180542299227 | etot = -17.2981767960657 +86000 ekin = 2.48782292320374 | erot = 1.96978488305034 | epot = -22.0725803391446 | etot = -17.6149725328905 +87000 ekin = 2.57930151405764 | erot = 2.2570902138915 | epot = -22.1348945159438 | etot = -17.2985027879947 +88000 ekin = 2.6956024897412 | erot = 2.13715554675378 | epot = -22.1930571194782 | etot = -17.3602990829832 +89000 ekin = 2.72380030029144 | erot = 2.11665976738326 | epot = -22.2588492472984 | etot = -17.4183891796237 +90000 ekin = 2.7775820443459 | erot = 2.3087167926615 | epot = -22.3316634662033 | etot = -17.2453646291959 +91000 ekin = 2.78121426761679 | erot = 2.06238861884245 | epot = -22.3950019314361 | etot = -17.5513990449768 +92000 ekin = 2.82075935404361 | erot = 2.27555189363852 | epot = -22.4458982217016 | etot = -17.3495869740194 +93000 ekin = 2.74234324408922 | erot = 2.73218737047999 | epot = -22.4777668035594 | etot = -17.0032361889902 +94000 ekin = 2.70595529611257 | erot = 2.8219193945842 | epot = -22.4719589759707 | etot = -16.9440842852739 +95000 ekin = 2.60066897821264 | erot = 2.87810504187081 | epot = -22.4346047957434 | etot = -16.9558307756599 +96000 ekin = 2.6262407611824 | erot = 3.14516589179064 | epot = -22.3619497140362 | etot = -16.5905430610632 +97000 ekin = 2.53528413246992 | erot = 2.79030318337089 | epot = -22.2496930254016 | etot = -16.9241057095608 +98000 ekin = 2.63666210187981 | erot = 2.76857448865096 | epot = -22.1491630400741 | etot = -16.7439264495434 +99000 ekin = 2.65483668512638 | erot = 2.78595031296347 | epot = -22.0460055113192 | etot = -16.6052185132294 +100000 ekin = 2.61516760613048 | erot = 2.20131962587002 | epot = -21.9508073892687 | etot = -17.1343201572682 +101000 ekin = 2.54624393295481 | erot = 2.36995664901277 | epot = -21.8740804698391 | etot = -16.9578798878716 +102000 ekin = 2.51242302732686 | erot = 2.61025478737428 | epot = -21.821356011813 | etot = -16.6986781971118 +103000 ekin = 2.47093986976496 | erot = 2.46981056153027 | epot = -21.7940331055599 | etot = -16.8532826742647 +104000 ekin = 2.46347963016611 | erot = 2.49008073758038 | epot = -21.7873646863928 | etot = -16.8338043186463 +105000 ekin = 2.38625333180197 | erot = 2.62338268192898 | epot = -21.7895340190363 | etot = -16.7798980053054 +106000 ekin = 2.31544255189987 | erot = 2.76529048503053 | epot = -21.7908248307259 | etot = -16.7100917937955 +107000 ekin = 2.35684717555652 | erot = 2.65933844478903 | epot = -21.7713781480754 | etot = -16.7551925277298 +108000 ekin = 2.29901143856397 | erot = 2.67802590245662 | epot = -21.7311454445308 | etot = -16.7541081035102 +109000 ekin = 2.32828462660076 | erot = 2.93774189015171 | epot = -21.6703154087736 | etot = -16.4042888920211 +110000 ekin = 2.27463751555897 | erot = 2.84342022670568 | epot = -21.5866031030149 | etot = -16.4685453607503 +111000 ekin = 2.17735794909434 | erot = 2.50678168266737 | epot = -21.4648745015602 | etot = -16.7807348697985 +112000 ekin = 2.185499595072 | erot = 2.55181336139714 | epot = -21.2989895507539 | etot = -16.5616765942847 +113000 ekin = 2.1730426325684 | erot = 2.34739205656817 | epot = -21.1119565159277 | etot = -16.5915218267911 +114000 ekin = 2.125108069316 | erot = 2.37674761233523 | epot = -20.9271632839068 | etot = -16.4253076022556 +115000 ekin = 2.06139325414478 | erot = 2.59024149702735 | epot = -20.7601756973169 | etot = -16.1085409461448 +116000 ekin = 2.00592136714115 | erot = 2.63732939337337 | epot = -20.6295174385162 | etot = -15.9862666780017 +117000 ekin = 2.00329160062531 | erot = 2.56870813228611 | epot = -20.5296446810243 | etot = -15.9576449481129 +118000 ekin = 2.0174280975583 | erot = 2.46944506284098 | epot = -20.4506063861926 | etot = -15.9637332257933 +119000 ekin = 1.98594704489191 | erot = 2.26746616716464 | epot = -20.4288828122731 | etot = -16.1754696002165 +120000 ekin = 1.94483011509478 | erot = 2.33696205000853 | epot = -20.442383394879 | etot = -16.1605912297756 +121000 ekin = 2.12792735290882 | erot = 2.36924962566049 | epot = -20.4991944142893 | etot = -16.00201743572 +122000 ekin = 2.10495427089355 | erot = 2.48776527931776 | epot = -20.574325415596 | etot = -15.9816058653847 +123000 ekin = 2.17541547749012 | erot = 2.84180455684321 | epot = -20.6672573168908 | etot = -15.6500372825575 +124000 ekin = 2.19585323570719 | erot = 2.81219539890926 | epot = -20.7617372386161 | etot = -15.7536886039996 +125000 ekin = 2.23956101001686 | erot = 2.84608901602504 | epot = -20.8364418009793 | etot = -15.7507917749374 +126000 ekin = 2.29874303635747 | erot = 3.12890547205359 | epot = -20.8639002292415 | etot = -15.4362517208305 +127000 ekin = 2.34552442074478 | erot = 2.96762996381649 | epot = -20.8482814122638 | etot = -15.5351270277026 +128000 ekin = 2.38042396339133 | erot = 2.39829809100068 | epot = -20.7821422786062 | etot = -16.0034202242142 +129000 ekin = 2.38818705381732 | erot = 2.14510497375872 | epot = -20.708044378118 | etot = -16.174752350542 +130000 ekin = 2.27293411796489 | erot = 2.06717107329867 | epot = -20.680722380144 | etot = -16.3406171888804 +131000 ekin = 2.28550173826512 | erot = 1.94055567970255 | epot = -20.6369898880998 | etot = -16.4109324701321 +132000 ekin = 2.26691955879914 | erot = 1.71853531657476 | epot = -20.577540507524 | etot = -16.5920856321501 +133000 ekin = 2.29137866879739 | erot = 1.62868472043517 | epot = -20.5420933212006 | etot = -16.622029931968 +134000 ekin = 2.25290206497431 | erot = 1.68278061233814 | epot = -20.5183097363761 | etot = -16.5826270590636 +135000 ekin = 2.14285941072835 | erot = 1.86118396103706 | epot = -20.5054969500188 | etot = -16.5014535782534 +136000 ekin = 2.12990199371918 | erot = 2.04359124600871 | epot = -20.5201047968038 | etot = -16.3466115570759 +137000 ekin = 2.07754853855295 | erot = 1.83088096227378 | epot = -20.5722472452261 | etot = -16.6638177443993 +138000 ekin = 2.15013934154965 | erot = 2.00941220949273 | epot = -20.667779560491 | etot = -16.5082280094487 +139000 ekin = 2.20517582266463 | erot = 1.94652682269834 | epot = -20.7931525252622 | etot = -16.6414498798992 +140000 ekin = 2.33731236767234 | erot = 1.96166026745082 | epot = -20.9310868774548 | etot = -16.6321142423316 +141000 ekin = 2.24448516285964 | erot = 2.27879036592832 | epot = -21.0648426319454 | etot = -16.5415671031575 +142000 ekin = 2.1931532375379 | erot = 2.32670116857754 | epot = -21.187774798334 | etot = -16.6679203922185 +143000 ekin = 2.151548283963 | erot = 2.38826183428083 | epot = -21.3137287268919 | etot = -16.7739186086481 +144000 ekin = 2.10225107667088 | erot = 2.40324709726068 | epot = -21.4354683955924 | etot = -16.9299702216609 +145000 ekin = 2.06221666396487 | erot = 2.32981540966414 | epot = -21.5580653796756 | etot = -17.1660333060466 +146000 ekin = 2.15268481715545 | erot = 2.24715096803345 | epot = -21.6452484907074 | etot = -17.2454127055185 +147000 ekin = 2.13045113501517 | erot = 2.24956262085626 | epot = -21.724100810277 | etot = -17.3440870544056 +148000 ekin = 2.14237927540729 | erot = 2.32388813542663 | epot = -21.8239853334792 | etot = -17.3577179226453 +149000 ekin = 2.13016451804401 | erot = 2.31003298264327 | epot = -21.9413859720018 | etot = -17.5011884713145 +150000 ekin = 2.1118941592917 | erot = 2.27040882248859 | epot = -22.0736176258281 | etot = -17.6913146440478 +151000 ekin = 2.08490791036346 | erot = 2.53796433942571 | epot = -22.1831326518407 | etot = -17.5602604020515 +152000 ekin = 2.05056796581086 | erot = 2.74378211496597 | epot = -22.2707370073162 | etot = -17.4763869265394 +153000 ekin = 2.01058950481926 | erot = 2.62970741316349 | epot = -22.3376436760766 | etot = -17.6973467580939 +154000 ekin = 2.01943769577487 | erot = 2.39009828792415 | epot = -22.4001638198039 | etot = -17.9906278361049 +155000 ekin = 2.05430763784564 | erot = 2.40978970203131 | epot = -22.4403746514595 | etot = -17.9762773115826 +156000 ekin = 2.10246203476605 | erot = 2.3162862509107 | epot = -22.3947496278242 | etot = -17.9760013421475 +157000 ekin = 2.20121785931622 | erot = 2.26047844907516 | epot = -22.3626746382073 | etot = -17.900978329816 +158000 ekin = 2.16806247020174 | erot = 2.01859116115299 | epot = -22.3794788142255 | etot = -18.1928251828708 +159000 ekin = 2.20647608921295 | erot = 2.03708981782408 | epot = -22.393340456396 | etot = -18.149774549359 +160000 ekin = 2.28482979303694 | erot = 2.06672295727712 | epot = -22.392971509361 | etot = -18.041418759047 +161000 ekin = 2.35408441526349 | erot = 2.11425691782657 | epot = -22.3845712470919 | etot = -17.9162299140018 +162000 ekin = 2.44383531112342 | erot = 2.051421726327 | epot = -22.3873594705055 | etot = -17.8921024330551 +163000 ekin = 2.38397054654208 | erot = 2.18088509829525 | epot = -22.4046928902402 | etot = -17.8398372454029 +164000 ekin = 2.36323785475495 | erot = 2.24099333696013 | epot = -22.4304254420051 | etot = -17.82619425029 +165000 ekin = 2.42861068657701 | erot = 2.32334175306822 | epot = -22.4693846686275 | etot = -17.7174322289823 +166000 ekin = 2.49646527013099 | erot = 2.76008268343011 | epot = -22.5024150074813 | etot = -17.2458670539202 +167000 ekin = 2.39742733231154 | erot = 2.66606455445541 | epot = -22.5059226951214 | etot = -17.4424308083544 +168000 ekin = 2.48222864422377 | erot = 2.12985047091143 | epot = -22.4839259607868 | etot = -17.8718468456516 +169000 ekin = 2.34389140284719 | erot = 2.23877784986582 | epot = -22.4355001459226 | etot = -17.8528308932096 +170000 ekin = 2.27819176115938 | erot = 2.38937348011876 | epot = -22.3963232925857 | etot = -17.7287580513075 +171000 ekin = 2.26183375697858 | erot = 2.6630881316761 | epot = -22.3493672389157 | etot = -17.424445350261 +172000 ekin = 2.27023963981113 | erot = 2.54732213285255 | epot = -22.2868682454192 | etot = -17.4693064727556 +173000 ekin = 2.19713801069004 | erot = 2.39492663110738 | epot = -22.206730666232 | etot = -17.6146660244346 +174000 ekin = 2.08128149693209 | erot = 2.65361881164586 | epot = -22.1239183165146 | etot = -17.3890180079366 +175000 ekin = 2.03179136441175 | erot = 2.6576915931798 | epot = -22.0831649919729 | etot = -17.3936820343813 +176000 ekin = 1.92235220335479 | erot = 2.46758244642911 | epot = -22.0704760764067 | etot = -17.6805414266228 +177000 ekin = 1.8767629533276 | erot = 2.76485058121241 | epot = -22.0943278887433 | etot = -17.4527143542032 +178000 ekin = 1.8196851112205 | erot = 3.06889049439786 | epot = -22.1713258315083 | etot = -17.28275022589 +179000 ekin = 1.83239453530745 | erot = 2.97256669493261 | epot = -22.3031073057822 | etot = -17.4981460755421 +180000 ekin = 1.78621083222566 | erot = 3.29401414659415 | epot = -22.470138760406 | etot = -17.3899137815862 +181000 ekin = 1.8851818529848 | erot = 3.13321574647615 | epot = -22.6327591209892 | etot = -17.6143615215283 +182000 ekin = 1.91900100882708 | erot = 2.86862183641649 | epot = -22.7815951170131 | etot = -17.9939722717695 +183000 ekin = 2.05132570727861 | erot = 3.08267197262641 | epot = -22.909220686437 | etot = -17.7752230065319 +184000 ekin = 2.06184088528539 | erot = 3.2007444069867 | epot = -23.0268740612164 | etot = -17.7642887689443 +185000 ekin = 2.09012289683705 | erot = 3.47009431072624 | epot = -23.1337090395161 | etot = -17.5734918319528 +186000 ekin = 2.23866301207462 | erot = 3.60859469886155 | epot = -23.1738137395751 | etot = -17.3265560286389 +187000 ekin = 2.42181473602224 | erot = 3.85086245359563 | epot = -23.1972395336004 | etot = -16.9245623439825 +188000 ekin = 2.41473791720882 | erot = 4.13943673363265 | epot = -23.313660149446 | etot = -16.7594854986045 +189000 ekin = 2.40456237424793 | erot = 4.00070701501225 | epot = -23.3710796524504 | etot = -16.9658102631902 +190000 ekin = 2.3927506641681 | erot = 3.65894410977791 | epot = -23.3540165218533 | etot = -17.3023217479073 +191000 ekin = 2.40766626916779 | erot = 4.27535474629197 | epot = -23.2939306874288 | etot = -16.610909671969 +192000 ekin = 2.38476057345244 | erot = 4.12521169410209 | epot = -23.1922092725541 | etot = -16.6822370049996 +193000 ekin = 2.26302104637807 | erot = 3.7779402618447 | epot = -23.0633113366603 | etot = -17.0223500284375 +194000 ekin = 2.10155057993347 | erot = 3.4992268119145 | epot = -22.9254751366501 | etot = -17.3246977448021 +195000 ekin = 2.03962481718054 | erot = 3.25259602899594 | epot = -22.769807353731 | etot = -17.4775865075545 +196000 ekin = 2.06049369787786 | erot = 2.84778946059528 | epot = -22.5997694102263 | etot = -17.6914862517532 +197000 ekin = 2.03160567713305 | erot = 2.37370828456973 | epot = -22.4368418077991 | etot = -18.0315278460963 +198000 ekin = 2.08676704026153 | erot = 2.19482531442788 | epot = -22.2622823748209 | etot = -17.9806900201315 +199000 ekin = 2.05269408710182 | erot = 2.16400413646367 | epot = -22.1035002649819 | etot = -17.8868020414165 +200000 ekin = 2.01411832170936 | erot = 2.38698541496883 | epot = -21.9546297375271 | etot = -17.5535260008489 +201000 ekin = 2.01209192808734 | erot = 2.38205260132373 | epot = -21.839087918056 | etot = -17.444943388645 +202000 ekin = 1.90781796628413 | erot = 2.36530018659051 | epot = -21.7246902929986 | etot = -17.4515721401239 +203000 ekin = 1.80024846565389 | erot = 2.34259351313096 | epot = -21.615977482744 | etot = -17.4731355039592 +204000 ekin = 1.68484818472322 | erot = 2.41487740212502 | epot = -21.5446736069975 | etot = -17.4449480201493 +205000 ekin = 1.6279281345828 | erot = 2.51982872964271 | epot = -21.5011323457791 | etot = -17.3533754815536 +206000 ekin = 1.55411064978348 | erot = 2.69683235574055 | epot = -21.4677288967242 | etot = -17.2167858912001 +207000 ekin = 1.51044177325198 | erot = 2.86067615909017 | epot = -21.4416223674891 | etot = -17.0705044351469 +208000 ekin = 1.46178623775162 | erot = 3.09687215817313 | epot = -21.3952301582476 | etot = -16.8365717623228 +209000 ekin = 1.49930719102405 | erot = 2.64986686100816 | epot = -21.3194384463854 | etot = -17.1702643943532 +210000 ekin = 1.48596643994187 | erot = 2.49507203528868 | epot = -21.2123168093858 | etot = -17.2312783341552 +211000 ekin = 1.51700235708605 | erot = 2.85982490581494 | epot = -21.0854390229479 | etot = -16.7086117600469 +212000 ekin = 1.47699871968623 | erot = 2.51260914037785 | epot = -20.9565961085739 | etot = -16.9669882485098 +213000 ekin = 1.58916579351334 | erot = 2.61661121884075 | epot = -20.8229216474679 | etot = -16.6171446351139 +214000 ekin = 1.62272322843393 | erot = 2.42273280311444 | epot = -20.7122766474859 | etot = -16.6668206159375 +215000 ekin = 1.66159030501777 | erot = 2.39943071607579 | epot = -20.6287014799337 | etot = -16.5676804588402 +216000 ekin = 1.74578478011215 | erot = 2.33284367785392 | epot = -20.5774611193674 | etot = -16.4988326614014 +217000 ekin = 1.86008672447786 | erot = 2.48365359198228 | epot = -20.5783803604762 | etot = -16.2346400440161 +218000 ekin = 1.88693206179544 | erot = 2.61817641260771 | epot = -20.6245681941586 | etot = -16.1194597197555 +219000 ekin = 1.9954584685533 | erot = 2.51280586705981 | epot = -20.672275526231 | etot = -16.1640111906179 +220000 ekin = 2.07891649227218 | erot = 2.43958393551872 | epot = -20.7460641755868 | etot = -16.2275637477959 +221000 ekin = 2.07405609075925 | erot = 2.36260767845184 | epot = -20.8472863845651 | etot = -16.410622615354 +222000 ekin = 2.10307745764232 | erot = 2.54950611704614 | epot = -20.9726401140739 | etot = -16.3200565393854 +223000 ekin = 2.029905607029 | erot = 2.36445779587677 | epot = -21.0835627182511 | etot = -16.6891993153454 +224000 ekin = 2.16888148730472 | erot = 2.48643165117694 | epot = -21.1978785829812 | etot = -16.5425654444995 +225000 ekin = 2.30521694661694 | erot = 2.40413284955319 | epot = -21.3143167094642 | etot = -16.6049669132941 +226000 ekin = 2.42660104949029 | erot = 2.10961133192969 | epot = -21.4003288303496 | etot = -16.8641164489296 +227000 ekin = 2.51989265457943 | erot = 2.19538124871698 | epot = -21.4710250786467 | etot = -16.7557511753503 +228000 ekin = 2.68551344341426 | erot = 2.30229521160067 | epot = -21.5296149017981 | etot = -16.5418062467832 +229000 ekin = 2.59976522820206 | erot = 2.51681087235227 | epot = -21.5666762700905 | etot = -16.4501001695361 +230000 ekin = 2.5850335929182 | erot = 2.17214995252271 | epot = -21.5872332974482 | etot = -16.8300497520073 +231000 ekin = 2.62353866357519 | erot = 2.17431567394796 | epot = -21.5820516856057 | etot = -16.7841973480826 +232000 ekin = 2.59120478967399 | erot = 2.34006912797248 | epot = -21.567210238379 | etot = -16.6359363207325 +233000 ekin = 2.51791287332682 | erot = 2.16488342987888 | epot = -21.5519147308628 | etot = -16.8691184276571 +234000 ekin = 2.48481380355974 | erot = 2.21816982784481 | epot = -21.5223665657165 | etot = -16.819382934312 +235000 ekin = 2.41086403910145 | erot = 2.10316509959354 | epot = -21.4789613614541 | etot = -16.9649322227591 +236000 ekin = 2.40928284749433 | erot = 1.88888489131681 | epot = -21.4361120637083 | etot = -17.1379443248971 +237000 ekin = 2.56301564001043 | erot = 1.7367156365967 | epot = -21.4280913003545 | etot = -17.1283600237474 +238000 ekin = 2.55765653830743 | erot = 1.90914079819508 | epot = -21.4255674324867 | etot = -16.9587700959842 +239000 ekin = 2.62181377631197 | erot = 2.06765286499137 | epot = -21.4529783008628 | etot = -16.7635116595594 +240000 ekin = 2.64076354676094 | erot = 2.31865643186807 | epot = -21.5224999667005 | etot = -16.5630799880715 +241000 ekin = 2.67609348690617 | erot = 2.52623661982354 | epot = -21.6079626104587 | etot = -16.405632503729 +242000 ekin = 2.63558109361467 | erot = 2.91329495494509 | epot = -21.6817125780998 | etot = -16.1328365295401 +243000 ekin = 2.76874739439914 | erot = 3.19547631893849 | epot = -21.72991854209 | etot = -15.7656948287524 +244000 ekin = 2.76082392607157 | erot = 2.9973885554399 | epot = -21.76547993096 | etot = -16.0072674494486 +245000 ekin = 2.84856552527554 | erot = 3.5561039977299 | epot = -21.7868813066433 | etot = -15.3822117836378 +246000 ekin = 2.74592112218097 | erot = 3.46897250198803 | epot = -21.7812302083596 | etot = -15.5663365841906 +247000 ekin = 2.62843885877447 | erot = 3.3915912792894 | epot = -21.7507462517775 | etot = -15.7307161137136 +248000 ekin = 2.6265799023713 | erot = 2.96254281821237 | epot = -21.6850863371033 | etot = -16.0959636165196 +249000 ekin = 2.64689987490188 | erot = 2.46750058971822 | epot = -21.6214034121611 | etot = -16.507002947541 +250000 ekin = 2.59258413901056 | erot = 1.95894591185221 | epot = -21.5523796219694 | etot = -17.0008495711067 +251000 ekin = 2.50508525922248 | erot = 1.94700044531511 | epot = -21.485640639306 | etot = -17.0335549347684 +252000 ekin = 2.362061411861 | erot = 2.03422118114505 | epot = -21.4223545940681 | etot = -17.0260720010621 +253000 ekin = 2.309350605284 | erot = 1.94736645762202 | epot = -21.3716222045374 | etot = -17.1149051416314 +254000 ekin = 2.2527459693501 | erot = 1.98706179687154 | epot = -21.3578828633465 | etot = -17.1180750971248 +255000 ekin = 2.24877704371088 | erot = 1.94793350141006 | epot = -21.3679438916479 | etot = -17.171233346527 +256000 ekin = 2.15038460246957 | erot = 2.1353664164586 | epot = -21.3873823966765 | etot = -17.1016313777483 +257000 ekin = 2.14820686493293 | erot = 1.95792063838272 | epot = -21.4016298030359 | etot = -17.2955022997202 +258000 ekin = 2.21551042205357 | erot = 2.08286212737995 | epot = -21.4265487793698 | etot = -17.1281762299363 +259000 ekin = 2.06173733154792 | erot = 1.93722502209168 | epot = -21.4284901665386 | etot = -17.429527812899 +260000 ekin = 1.95779184392074 | erot = 2.10071945094421 | epot = -21.4431554356543 | etot = -17.3846441407893 +261000 ekin = 1.89111873040642 | erot = 2.27491420373984 | epot = -21.4742539366704 | etot = -17.3082210025241 +262000 ekin = 1.81155628887094 | erot = 2.76845022524668 | epot = -21.5133565631458 | etot = -16.9333500490282 +263000 ekin = 1.78548461411774 | erot = 2.58995272844158 | epot = -21.5741933378567 | etot = -17.1987559952974 +264000 ekin = 1.70470903910482 | erot = 2.52740722130143 | epot = -21.6543975630333 | etot = -17.422281302627 +265000 ekin = 1.70456921180774 | erot = 2.91128169616601 | epot = -21.7314640373146 | etot = -17.1156131293409 +266000 ekin = 1.70108763348245 | erot = 3.15353043902165 | epot = -21.8059636436342 | etot = -16.9513455711301 +267000 ekin = 1.68792919988863 | erot = 2.90455900057175 | epot = -21.870732648304 | etot = -17.2782444478436 +268000 ekin = 1.72057453763242 | erot = 2.62604659087867 | epot = -21.9225381178383 | etot = -17.5759169893272 +269000 ekin = 1.78712640141424 | erot = 2.75599254857463 | epot = -21.9527991628362 | etot = -17.4096802128474 +270000 ekin = 1.72857790804084 | erot = 2.80083154386433 | epot = -21.9488059520795 | etot = -17.4193965001743 +271000 ekin = 1.64099428775304 | erot = 2.64687538276786 | epot = -21.9170243489263 | etot = -17.6291546784054 +272000 ekin = 1.58570258321571 | erot = 2.46968320121808 | epot = -21.8446210346508 | etot = -17.789235250217 +273000 ekin = 1.63767201216319 | erot = 2.19946786706664 | epot = -21.7638929876942 | etot = -17.9267531084643 +274000 ekin = 1.59847478128875 | erot = 2.30908990938638 | epot = -21.668243139743 | etot = -17.7606784490679 +275000 ekin = 1.48392569489385 | erot = 2.19949617068972 | epot = -21.5548162861332 | etot = -17.8713944205497 +276000 ekin = 1.39307584924635 | erot = 2.23039538438481 | epot = -21.4256702629286 | etot = -17.8021990292974 +277000 ekin = 1.32228191847669 | erot = 2.13983606829658 | epot = -21.3067538507252 | etot = -17.844635863952 +278000 ekin = 1.28711477346599 | erot = 2.14456329557357 | epot = -21.224078274628 | etot = -17.7924002055884 +279000 ekin = 1.28936005013437 | erot = 2.38491555516954 | epot = -21.173548547693 | etot = -17.4992729423891 +280000 ekin = 1.21003074239703 | erot = 2.42890760862482 | epot = -21.1457609661738 | etot = -17.5068226151519 +281000 ekin = 1.29885744861028 | erot = 2.42325573855922 | epot = -21.1507776171849 | etot = -17.4286644300154 +282000 ekin = 1.25436778972245 | erot = 2.81925761990964 | epot = -21.1898482264 | etot = -17.1162228167679 +283000 ekin = 1.21194774091223 | erot = 2.81987884081118 | epot = -21.2915251292642 | etot = -17.2596985475408 +284000 ekin = 1.18679083068176 | erot = 2.85260842120876 | epot = -21.4111056079338 | etot = -17.3717063560432 +285000 ekin = 1.15631267773667 | erot = 2.90112491489683 | epot = -21.5215297070962 | etot = -17.4640921144627 +286000 ekin = 1.1927926822259 | erot = 2.85809873900105 | epot = -21.6217291121405 | etot = -17.5708376909136 +287000 ekin = 1.26041360220417 | erot = 2.73020556183275 | epot = -21.6926219129291 | etot = -17.7020027488922 +288000 ekin = 1.28925684516283 | erot = 2.41344019790321 | epot = -21.7395791395394 | etot = -18.0368820964733 +289000 ekin = 1.32958093505212 | erot = 2.2719700407486 | epot = -21.7753244471437 | etot = -18.173773471343 +290000 ekin = 1.40642675848334 | erot = 1.95570600704145 | epot = -21.8122371335501 | etot = -18.4501043680253 +291000 ekin = 1.43917988615079 | erot = 1.90335102621715 | epot = -21.8672634472312 | etot = -18.5247325348633 +292000 ekin = 1.45457728536612 | erot = 1.91918018244104 | epot = -21.9211778027209 | etot = -18.5474203349137 +293000 ekin = 1.54025708206043 | erot = 1.76739883625603 | epot = -21.9892221465386 | etot = -18.6815662282221 +294000 ekin = 1.63446508682299 | erot = 1.86338835798862 | epot = -22.0608666741349 | etot = -18.5630132293233 +295000 ekin = 1.81613674682346 | erot = 1.9028469472332 | epot = -22.1395305108088 | etot = -18.4205468167521 +296000 ekin = 1.90988071285018 | erot = 2.10518814801487 | epot = -22.2099314509302 | etot = -18.1948625900651 +297000 ekin = 1.95608798955045 | erot = 2.52702443883807 | epot = -22.2985651779531 | etot = -17.8154527495646 +298000 ekin = 2.05852737833142 | erot = 2.38905675468749 | epot = -22.3766545803973 | etot = -17.9290704473783 +299000 ekin = 2.1864411137905 | erot = 2.43787113082697 | epot = -22.4274426042905 | etot = -17.8031303596731 +300000 ekin = 2.25246210387436 | erot = 2.26714642530523 | epot = -22.4460120088431 | etot = -17.9264034796635 +301000 ekin = 2.35563337457493 | erot = 1.81807021650493 | epot = -22.4572545711889 | etot = -18.2835509801091 +302000 ekin = 2.42168935052576 | erot = 2.12272372548235 | epot = -22.4773288548022 | etot = -17.9329157787941 +303000 ekin = 2.48491149619623 | erot = 1.80440720027866 | epot = -22.49978709942 | etot = -18.2104684029451 +304000 ekin = 2.57055300825417 | erot = 1.71612576378991 | epot = -22.5136290909673 | etot = -18.2269503189232 +305000 ekin = 2.60127252345969 | erot = 1.60228999221232 | epot = -22.5079813416075 | etot = -18.3044188259355 +306000 ekin = 2.65871790294493 | erot = 1.61152940110746 | epot = -22.4881104545321 | etot = -18.2178631504797 +307000 ekin = 2.67302778478971 | erot = 1.88303236420289 | epot = -22.4558851508275 | etot = -17.8998250018349 +308000 ekin = 2.66315429067354 | erot = 2.10086190187488 | epot = -22.4194774636684 | etot = -17.65546127112 +309000 ekin = 2.62361235711079 | erot = 2.06716291649094 | epot = -22.3854389472788 | etot = -17.694663673677 +310000 ekin = 2.65346557302746 | erot = 2.43388315560348 | epot = -22.3516578015447 | etot = -17.2643090729137 +311000 ekin = 2.62717610811387 | erot = 2.36697019339671 | epot = -22.3173746471545 | etot = -17.323228345644 +312000 ekin = 2.76485058199136 | erot = 2.29893166031318 | epot = -22.3073398967791 | etot = -17.2435576544746 +313000 ekin = 2.91401216196337 | erot = 2.42859802814641 | epot = -22.2874024124532 | etot = -16.9447922223434 +314000 ekin = 2.91385799167544 | erot = 1.91396248977988 | epot = -22.2694749773675 | etot = -17.4416544959122 +315000 ekin = 2.93036873457095 | erot = 1.99716548782002 | epot = -22.2742890679512 | etot = -17.3467548455602 +316000 ekin = 3.03268788685611 | erot = 1.92510083916592 | epot = -22.2577485073753 | etot = -17.2999597813533 +317000 ekin = 3.0878759484766 | erot = 1.92578200831355 | epot = -22.2266829567097 | etot = -17.2130249999196 +318000 ekin = 3.13577891188647 | erot = 1.80317853500181 | epot = -22.1919523893646 | etot = -17.2529949424764 +319000 ekin = 3.20520648794502 | erot = 1.70269113516979 | epot = -22.1746193500525 | etot = -17.2667217269377 +320000 ekin = 3.29702074479474 | erot = 1.5315778223532 | epot = -22.1625795722847 | etot = -17.3339810051367 +321000 ekin = 3.3450444842282 | erot = 1.62378232552177 | epot = -22.1868841736045 | etot = -17.2180573638545 +322000 ekin = 3.38460168822981 | erot = 1.76562508880759 | epot = -22.2499937572736 | etot = -17.0997669802362 +323000 ekin = 3.30048690012861 | erot = 1.78922162860215 | epot = -22.3245621231124 | etot = -17.2348535943816 +324000 ekin = 3.21996003388857 | erot = 2.07375779111671 | epot = -22.4074947135766 | etot = -17.1137768885713 +325000 ekin = 3.1932006584649 | erot = 2.34417123194124 | epot = -22.489592505192 | etot = -16.9522206147858 +326000 ekin = 3.13574523293136 | erot = 2.35602865246346 | epot = -22.5449076606476 | etot = -17.0531337752528 +327000 ekin = 3.06250064041744 | erot = 2.56089976464128 | epot = -22.5763641985364 | etot = -16.9529637934777 +328000 ekin = 2.98028960475491 | erot = 2.43252122765914 | epot = -22.5713698367082 | etot = -17.1585590042941 +329000 ekin = 3.00073413437889 | erot = 2.54697247273636 | epot = -22.5115486252432 | etot = -16.963842018128 +330000 ekin = 2.95148018624182 | erot = 2.24389127882677 | epot = -22.4149230401769 | etot = -17.2195515751083 +331000 ekin = 2.81139520816004 | erot = 2.33469163507243 | epot = -22.302381597186 | etot = -17.1562947539535 +332000 ekin = 2.70201927753231 | erot = 2.23446425932906 | epot = -22.1825698377621 | etot = -17.2460863009007 +333000 ekin = 2.67216560815672 | erot = 2.33828838842037 | epot = -22.1081794049503 | etot = -17.0977254083733 +334000 ekin = 2.63564129688352 | erot = 2.3844516220081 | epot = -22.0521006108914 | etot = -17.0320076919998 +335000 ekin = 2.49363748710296 | erot = 2.39927202409598 | epot = -21.999755390881 | etot = -17.1068458796821 +336000 ekin = 2.32703156354336 | erot = 2.49661552302095 | epot = -21.9570264750564 | etot = -17.1333793884921 +337000 ekin = 2.40437911185033 | erot = 2.34787944862516 | epot = -21.9196555873364 | etot = -17.167397026861 +338000 ekin = 2.41476505798858 | erot = 2.13162500253263 | epot = -21.8968278484035 | etot = -17.3504377878823 +339000 ekin = 2.43793058775621 | erot = 2.41901135922114 | epot = -21.903625267802 | etot = -17.0466833208247 +340000 ekin = 2.49068476405757 | erot = 2.44754202713574 | epot = -21.9103500540911 | etot = -16.9721232628978 +341000 ekin = 2.50472420190464 | erot = 2.67064038857613 | epot = -21.9332795205211 | etot = -16.7579149300404 +342000 ekin = 2.56647086804824 | erot = 2.61525528001605 | epot = -21.9674734299045 | etot = -16.7857472818402 +343000 ekin = 2.51904673868565 | erot = 2.55676588472587 | epot = -21.9948706708333 | etot = -16.9190580474217 +344000 ekin = 2.60508290174675 | erot = 2.48137560215985 | epot = -21.9825601130743 | etot = -16.8961016091677 +345000 ekin = 2.63784673980717 | erot = 2.00206586549288 | epot = -21.9580088648429 | etot = -17.3180962595428 +346000 ekin = 2.62397891911575 | erot = 2.06342882396961 | epot = -21.9497310194665 | etot = -17.2623232763812 +347000 ekin = 2.65803154655934 | erot = 2.1732091469081 | epot = -21.9288714180669 | etot = -17.0976307245995 +348000 ekin = 2.61080877072561 | erot = 2.24900638089749 | epot = -21.9064648355581 | etot = -17.046649683935 +349000 ekin = 2.56285615073655 | erot = 2.19373993711379 | epot = -21.9340203469075 | etot = -17.1774242590572 +350000 ekin = 2.52909341929274 | erot = 2.40459665484317 | epot = -21.9698973375558 | etot = -17.0362072634199 +351000 ekin = 2.49713504985993 | erot = 2.44402722640777 | epot = -22.0050349016586 | etot = -17.0638726253909 +352000 ekin = 2.4400081511828 | erot = 2.31901759386439 | epot = -22.0353401663223 | etot = -17.2763144212751 +353000 ekin = 2.43137304156583 | erot = 2.58293559904024 | epot = -22.0473314992667 | etot = -17.0330228586606 +354000 ekin = 2.42872461457131 | erot = 2.20097693718207 | epot = -22.0593257242364 | etot = -17.429624172483 +355000 ekin = 2.33110822210744 | erot = 2.4206307096628 | epot = -22.0716103668382 | etot = -17.3198714350679 +356000 ekin = 2.3039890517443 | erot = 2.62795866448668 | epot = -22.0804347592131 | etot = -17.1484870429821 +357000 ekin = 2.31942397069004 | erot = 2.59655320443807 | epot = -22.0821788434023 | etot = -17.1662016682742 +358000 ekin = 2.31430837414611 | erot = 2.83712652813159 | epot = -22.072502185868 | etot = -16.9210672835903 +359000 ekin = 2.31455342359158 | erot = 2.75771738371944 | epot = -22.0399086183635 | etot = -16.9676378110525 +360000 ekin = 2.33176210518086 | erot = 2.71178887834458 | epot = -22.0076297483562 | etot = -16.9640787648308 +361000 ekin = 2.27214122387383 | erot = 2.81145339858132 | epot = -21.9599421657393 | etot = -16.8763475432841 +362000 ekin = 2.29940723820851 | erot = 2.47979741361589 | epot = -21.9089639290965 | etot = -17.1297592772721 +363000 ekin = 2.53443578574928 | erot = 2.53169478867016 | epot = -21.8243312678077 | etot = -16.7582006933883 +364000 ekin = 2.62218089033857 | erot = 2.40320793892339 | epot = -21.7324712534029 | etot = -16.7070824241409 +365000 ekin = 2.7675580876352 | erot = 1.89475409755416 | epot = -21.6405111096152 | etot = -16.9781989244259 +366000 ekin = 2.83684484493777 | erot = 1.57102850121852 | epot = -21.5686856667024 | etot = -17.1608123205461 +367000 ekin = 2.93599158208377 | erot = 1.35687050095051 | epot = -21.4921061985772 | etot = -17.199244115543 +368000 ekin = 3.10052552420318 | erot = 1.34392548947238 | epot = -21.4550475057325 | etot = -17.0105964920569 +369000 ekin = 3.32282273578325 | erot = 1.444496693381 | epot = -21.469634605235 | etot = -16.7023151760708 +370000 ekin = 3.32440357214629 | erot = 1.32498034754162 | epot = -21.5235244672076 | etot = -16.8741405475197 +371000 ekin = 3.19604825174787 | erot = 1.32912305315194 | epot = -21.6063167417295 | etot = -17.0811454368297 +372000 ekin = 3.24806725016557 | erot = 1.57623327064951 | epot = -21.7023719429117 | etot = -16.8780714220966 +373000 ekin = 3.19541088772615 | erot = 1.59021472687934 | epot = -21.8029802274107 | etot = -17.0173546128052 +374000 ekin = 3.26135365290669 | erot = 1.85216595682046 | epot = -21.8950570456544 | etot = -16.7815374359273 +375000 ekin = 3.29383454867966 | erot = 2.06907009365906 | epot = -21.9845454700943 | etot = -16.6216408277556 +376000 ekin = 3.20015592859739 | erot = 2.07351416601095 | epot = -22.0952882395876 | etot = -16.8216181449793 +377000 ekin = 3.09004850922738 | erot = 2.18294615546873 | epot = -22.1887281106778 | etot = -16.9157334459817 +378000 ekin = 3.05043348195281 | erot = 2.51583225096577 | epot = -22.263666143955 | etot = -16.6974004110364 +379000 ekin = 3.10166908828999 | erot = 2.66676931647561 | epot = -22.3392187414395 | etot = -16.5707803366739 +380000 ekin = 3.11503780326003 | erot = 2.6084093126981 | epot = -22.3678930086929 | etot = -16.6444458927347 +381000 ekin = 3.11901255865583 | erot = 2.5131674520525 | epot = -22.3595089455393 | etot = -16.727328934831 +382000 ekin = 3.08198965968261 | erot = 2.54216489271882 | epot = -22.3171355116317 | etot = -16.6929809592303 +383000 ekin = 3.08529312773617 | erot = 2.60747953716485 | epot = -22.268125758685 | etot = -16.575353093784 +384000 ekin = 3.06435455473092 | erot = 2.59008305218086 | epot = -22.2008329018472 | etot = -16.5463952949354 +385000 ekin = 2.96902524929809 | erot = 2.39487400705568 | epot = -22.1308203226012 | etot = -16.7669210662474 +386000 ekin = 2.94398257253719 | erot = 2.3562498967375 | epot = -22.0974491806139 | etot = -16.7972167113393 +387000 ekin = 2.90022143016866 | erot = 2.26095116124118 | epot = -22.0819030869075 | etot = -16.9207304954977 +388000 ekin = 2.81389126988738 | erot = 2.13357533996891 | epot = -22.1104886391662 | etot = -17.1630220293099 +389000 ekin = 2.86348776127269 | erot = 2.05672668796337 | epot = -22.1951193908387 | etot = -17.2749049416026 +390000 ekin = 2.77165535979985 | erot = 2.1536573950014 | epot = -22.3132389416923 | etot = -17.387926186891 +391000 ekin = 2.77370479657934 | erot = 2.43647051356027 | epot = -22.4565212308196 | etot = -17.24634592068 +392000 ekin = 2.76583278927001 | erot = 2.40676865464339 | epot = -22.5818573009823 | etot = -17.4092558570689 +393000 ekin = 2.8090002415766 | erot = 2.37169277236098 | epot = -22.708659499688 | etot = -17.5279664857504 +394000 ekin = 2.87248081177523 | erot = 2.11617756482167 | epot = -22.8170775591549 | etot = -17.828419182558 +395000 ekin = 2.88095223032719 | erot = 2.05659355426901 | epot = -22.8808764228085 | etot = -17.9433306382123 +396000 ekin = 2.93418192071603 | erot = 2.30478582950589 | epot = -22.9097915865589 | etot = -17.670823836337 +397000 ekin = 2.98163695220519 | erot = 2.08558984982203 | epot = -22.9183417641045 | etot = -17.8511149620773 +398000 ekin = 2.98779262545462 | erot = 2.1519208232311 | epot = -22.9077750506591 | etot = -17.7680616019734 +399000 ekin = 2.91865693266167 | erot = 1.82887135319329 | epot = -22.8818662686362 | etot = -18.1343379827812 +400000 ekin = 2.90983153702377 | erot = 1.84033842076736 | epot = -22.8234620217338 | etot = -18.0732920639427 +401000 ekin = 2.82193337892235 | erot = 1.65785555934519 | epot = -22.7432945990589 | etot = -18.2635056607914 +402000 ekin = 2.71231263059655 | erot = 1.81039261887843 | epot = -22.6593739244624 | etot = -18.1366686749875 +403000 ekin = 2.66036084604549 | erot = 2.02498533176227 | epot = -22.6001656022283 | etot = -17.9148194244206 +404000 ekin = 2.57068790240545 | erot = 1.93095594974698 | epot = -22.5470237392586 | etot = -18.0453798871061 +405000 ekin = 2.56561221793745 | erot = 1.68739793089169 | epot = -22.480605837446 | etot = -18.2275956886169 +406000 ekin = 2.49833625235135 | erot = 1.48188239687435 | epot = -22.4539596863985 | etot = -18.4737410371728 +407000 ekin = 2.49021560270514 | erot = 1.5892860254214 | epot = -22.4700632657781 | etot = -18.3905616376516 +408000 ekin = 2.38021871164262 | erot = 1.73637964468692 | epot = -22.4959988290513 | etot = -18.3794004727218 +409000 ekin = 2.29461436770141 | erot = 1.95814824220571 | epot = -22.5206422995263 | etot = -18.2678796896192 +410000 ekin = 2.25736852989513 | erot = 2.37993089507051 | epot = -22.5486602508663 | etot = -17.9113608259007 +411000 ekin = 2.21596387204285 | erot = 2.74396072623423 | epot = -22.5838815063887 | etot = -17.6239569081116 +412000 ekin = 2.20994969108704 | erot = 2.86593591747017 | epot = -22.6211739699291 | etot = -17.5452883613719 +413000 ekin = 2.24794753023262 | erot = 3.00088801126985 | epot = -22.6476708665275 | etot = -17.3988353250251 +414000 ekin = 2.14160819513185 | erot = 3.01120724411814 | epot = -22.6376025284281 | etot = -17.4847870891781 +415000 ekin = 2.14491177835009 | erot = 2.93215202860195 | epot = -22.5902585718866 | etot = -17.5131947649345 +416000 ekin = 2.10193769123485 | erot = 2.98101624126922 | epot = -22.5118964710199 | etot = -17.4289425385158 +417000 ekin = 2.07066635663256 | erot = 2.60488497680169 | epot = -22.4065047924709 | etot = -17.7309534590366 +418000 ekin = 2.07740574841323 | erot = 2.73315084489166 | epot = -22.2898027885339 | etot = -17.479246195229 +419000 ekin = 1.98085199943436 | erot = 2.44747426745325 | epot = -22.163133683714 | etot = -17.7348074168264 +420000 ekin = 1.95880289350344 | erot = 2.55129347690097 | epot = -22.0482798158306 | etot = -17.5381834454262 +421000 ekin = 1.99828966251063 | erot = 2.20799196393455 | epot = -21.9395525585648 | etot = -17.7332709321197 +422000 ekin = 1.93529999466694 | erot = 2.35358466371906 | epot = -21.8587107341242 | etot = -17.5698260757382 +423000 ekin = 1.84611594143486 | erot = 2.2522856588745 | epot = -21.820655990977 | etot = -17.7222543906677 +424000 ekin = 1.92830552207798 | erot = 1.92697824358688 | epot = -21.7779729704118 | etot = -17.9226892047469 +425000 ekin = 1.87968918412311 | erot = 2.04838530467769 | epot = -21.7345809752812 | etot = -17.8065064864804 +426000 ekin = 1.85564129701465 | erot = 2.1399138178221 | epot = -21.7013928959337 | etot = -17.7058377810969 +427000 ekin = 1.86146118829923 | erot = 2.21385079035759 | epot = -21.6794945474636 | etot = -17.6041825688068 +428000 ekin = 1.93768082509312 | erot = 2.13363270684648 | epot = -21.6773435664083 | etot = -17.6060300344687 +429000 ekin = 1.99945365892741 | erot = 2.19562243163486 | epot = -21.70540364656 | etot = -17.5103275559977 +430000 ekin = 2.09718842591568 | erot = 2.34633202136167 | epot = -21.7371065581004 | etot = -17.2935861108231 +431000 ekin = 2.17999939901923 | erot = 2.30896770966998 | epot = -21.7414717361356 | etot = -17.2525046274464 +432000 ekin = 2.25849803136384 | erot = 2.37380554728488 | epot = -21.7217776472067 | etot = -17.089474068558 +433000 ekin = 2.24429029360173 | erot = 2.44429429006325 | epot = -21.7017276929561 | etot = -17.0131431092911 +434000 ekin = 2.3540638574789 | erot = 2.48920790113105 | epot = -21.7007812192857 | etot = -16.8575094606758 +435000 ekin = 2.2473788015354 | erot = 2.46595163485294 | epot = -21.7063339873007 | etot = -16.9930035509124 +436000 ekin = 2.23230082302271 | erot = 2.42669718967145 | epot = -21.7123927262193 | etot = -17.0533947135251 +437000 ekin = 2.18383665113547 | erot = 2.24664794927375 | epot = -21.7330413026264 | etot = -17.3025567022172 +438000 ekin = 2.12966913497249 | erot = 2.37196465183248 | epot = -21.7485872315853 | etot = -17.2469534447803 +439000 ekin = 2.09098898533785 | erot = 2.12933040903347 | epot = -21.7361412880266 | etot = -17.5158218936553 +440000 ekin = 2.10148571824482 | erot = 2.2779361859281 | epot = -21.7175254276832 | etot = -17.3381035235102 +441000 ekin = 2.1553286798209 | erot = 2.3186564021372 | epot = -21.6981903134064 | etot = -17.2242052314483 +442000 ekin = 2.09243597225384 | erot = 2.72841000678825 | epot = -21.6523738209045 | etot = -16.8315278418624 +443000 ekin = 2.15730367932196 | erot = 2.62581799220048 | epot = -21.5875809663665 | etot = -16.804459294844 +444000 ekin = 2.18263017921498 | erot = 2.37014829408735 | epot = -21.5048241508839 | etot = -16.9520456775816 +445000 ekin = 2.05145531635837 | erot = 2.17678227962612 | epot = -21.4326062625763 | etot = -17.2043686665918 +446000 ekin = 2.01020948431958 | erot = 2.37374422099255 | epot = -21.3645246084935 | etot = -16.9805709031814 +447000 ekin = 1.8958831793316 | erot = 2.45289089837798 | epot = -21.2952162464883 | etot = -16.9464421687787 +448000 ekin = 1.94918640966676 | erot = 2.3970392813938 | epot = -21.2255467455681 | etot = -16.8793210545075 +449000 ekin = 1.91481408982851 | erot = 2.28318705908352 | epot = -21.1543411876567 | etot = -16.9563400387447 +450000 ekin = 1.87784973555275 | erot = 2.12485795516302 | epot = -21.104620635514 | etot = -17.1019129447982 +451000 ekin = 1.97352148815462 | erot = 1.86756984773937 | epot = -21.0797511236576 | etot = -17.2386597877636 +452000 ekin = 2.04286189285661 | erot = 1.80786168372315 | epot = -21.0697245816184 | etot = -17.2190010050387 +453000 ekin = 2.13848606471689 | erot = 1.6737650166203 | epot = -21.0904747395761 | etot = -17.2782236582389 +454000 ekin = 2.1516494519113 | erot = 2.04932890222844 | epot = -21.1143650676536 | etot = -16.9133867135139 +455000 ekin = 2.19477985095264 | erot = 2.16695764653253 | epot = -21.1370563835238 | etot = -16.7753188860386 +456000 ekin = 2.1974026116872 | erot = 2.10215601431902 | epot = -21.1403905144292 | etot = -16.840831888423 +457000 ekin = 2.20601557977666 | erot = 2.13174146927016 | epot = -21.1647757949631 | etot = -16.8270187459163 +458000 ekin = 2.2269349746625 | erot = 2.00297660996798 | epot = -21.2133843445386 | etot = -16.9834727599081 +459000 ekin = 2.4030693526155 | erot = 2.07528469876378 | epot = -21.2759346114694 | etot = -16.7975805600901 +460000 ekin = 2.40922164106722 | erot = 2.23665563054181 | epot = -21.3522817196572 | etot = -16.7064044480482 +461000 ekin = 2.42000759716819 | erot = 2.33121048923255 | epot = -21.4035924354777 | etot = -16.652374349077 +462000 ekin = 2.40697031331577 | erot = 2.14275899197095 | epot = -21.4310008578857 | etot = -16.8812715525989 +463000 ekin = 2.27880926024481 | erot = 1.94507556924339 | epot = -21.4477328212942 | etot = -17.223847991806 +464000 ekin = 2.26372093546455 | erot = 1.71662964564979 | epot = -21.4283876808073 | etot = -17.4480370996929 +465000 ekin = 2.24118575319938 | erot = 1.89668392003695 | epot = -21.4003434057032 | etot = -17.2624737324669 +466000 ekin = 2.31013461832323 | erot = 2.00757055155841 | epot = -21.3608207821978 | etot = -17.0431156123161 +467000 ekin = 2.43396967913942 | erot = 2.21874571911993 | epot = -21.3053258443235 | etot = -16.6526104460642 +468000 ekin = 2.41021440017836 | erot = 1.97479498639507 | epot = -21.233460271117 | etot = -16.8484508845435 +469000 ekin = 2.3157853147123 | erot = 1.99784256139231 | epot = -21.182151702858 | etot = -16.8685238267534 +470000 ekin = 2.20506875315381 | erot = 1.87887773816018 | epot = -21.1430826832857 | etot = -17.0591361919717 +471000 ekin = 2.13628837828122 | erot = 1.99677754816689 | epot = -21.1290504063501 | etot = -16.995984479902 +472000 ekin = 2.10129418295647 | erot = 2.24056612365186 | epot = -21.1431228234936 | etot = -16.8012625168853 +473000 ekin = 2.15627273414965 | erot = 2.19993171978125 | epot = -21.173330041464 | etot = -16.8171255875331 +474000 ekin = 2.14076076010805 | erot = 2.25446359877062 | epot = -21.2210062632869 | etot = -16.8257819044082 +475000 ekin = 2.13812755485174 | erot = 2.40498819642984 | epot = -21.2865391851112 | etot = -16.7434234338296 +476000 ekin = 2.06858808991814 | erot = 2.38860590776926 | epot = -21.3434845601286 | etot = -16.8862905624412 +477000 ekin = 2.0700644049205 | erot = 2.7540657021351 | epot = -21.3922756308482 | etot = -16.5681455237926 +478000 ekin = 2.18444735013637 | erot = 2.70772307923254 | epot = -21.434381599235 | etot = -16.5422111698661 +479000 ekin = 2.19942421685253 | erot = 3.01662715265715 | epot = -21.4597482066208 | etot = -16.2436968371111 +480000 ekin = 2.09676344946083 | erot = 2.92438195103735 | epot = -21.4845635218899 | etot = -16.4634181213917 +481000 ekin = 2.05435750946169 | erot = 2.899464892258 | epot = -21.5058659565647 | etot = -16.552043554845 +482000 ekin = 1.93906176361667 | erot = 2.94002477322947 | epot = -21.5133252549458 | etot = -16.6342387180997 +483000 ekin = 1.92495432631116 | erot = 3.07385412342439 | epot = -21.5077333577222 | etot = -16.5089249079866 +484000 ekin = 1.92789828975055 | erot = 3.32856329414681 | epot = -21.5066449871575 | etot = -16.2501834032601 +485000 ekin = 1.91268771816301 | erot = 3.09586191791529 | epot = -21.4833052647979 | etot = -16.4747556287196 +486000 ekin = 1.78380043967864 | erot = 3.03494358258153 | epot = -21.4585833289247 | etot = -16.6398393066645 +487000 ekin = 1.66173050700701 | erot = 2.86000419946685 | epot = -21.4169307099543 | etot = -16.8951960034805 +488000 ekin = 1.68618039122613 | erot = 2.81632446798677 | epot = -21.3632748840397 | etot = -16.8607700248269 +489000 ekin = 1.70799546417861 | erot = 2.42402499535231 | epot = -21.2867408576367 | etot = -17.1547203981058 +490000 ekin = 1.7675823123897 | erot = 2.12271247808927 | epot = -21.2077046249559 | etot = -17.3174098344769 +491000 ekin = 1.763066632967 | erot = 2.86063070746491 | epot = -21.1723403735266 | etot = -16.5486430330947 +492000 ekin = 1.76846685645964 | erot = 2.89751715915284 | epot = -21.1637728122909 | etot = -16.4977887966784 +493000 ekin = 1.78426656200534 | erot = 3.00701255652289 | epot = -21.1773664941122 | etot = -16.3860873755839 +494000 ekin = 1.86551817373653 | erot = 2.87131917289134 | epot = -21.2025250650233 | etot = -16.4656877183954 +495000 ekin = 1.90523259261326 | erot = 3.14209453322643 | epot = -21.1998154388831 | etot = -16.1524883130435 +496000 ekin = 1.9833512663616 | erot = 2.98540814212675 | epot = -21.190647849325 | etot = -16.2218884408366 +497000 ekin = 2.0663482572869 | erot = 2.9589659087184 | epot = -21.162155154281 | etot = -16.1368409882757 +498000 ekin = 2.15272400284839 | erot = 3.02117382743709 | epot = -21.1193839391165 | etot = -15.945486108831 +499000 ekin = 2.17953814058354 | erot = 2.79565288062849 | epot = -21.107199393856 | etot = -16.132008372644 +500000 ekin = 2.18279625505118 | erot = 2.73392245688639 | epot = -21.1153073171069 | etot = -16.1985886051693 +501000 ekin = 2.1493445630415 | erot = 3.04941214942258 | epot = -21.1511220012823 | etot = -15.9523652888182 +502000 ekin = 2.24815210672142 | erot = 3.29370999045862 | epot = -21.191424172631 | etot = -15.649562075451 +503000 ekin = 2.24373540198279 | erot = 3.32111123848728 | epot = -21.2742763532377 | etot = -15.7094297127676 +504000 ekin = 2.23803989684424 | erot = 3.09914128419125 | epot = -21.3733619536836 | etot = -16.0361807726481 +505000 ekin = 2.301026054863 | erot = 3.19612982312048 | epot = -21.4437932084698 | etot = -15.9466373304863 +506000 ekin = 2.36370831780336 | erot = 3.19995831891704 | epot = -21.4937378126651 | etot = -15.9300711759447 +507000 ekin = 2.42840177155302 | erot = 2.81713782658397 | epot = -21.5299907326267 | etot = -16.2844511344897 +508000 ekin = 2.34968005299893 | erot = 2.32969767190603 | epot = -21.5629586677088 | etot = -16.8835809428039 +509000 ekin = 2.31587277783952 | erot = 2.32044150422003 | epot = -21.5800976653971 | etot = -16.9437833833376 +510000 ekin = 2.39415651583773 | erot = 2.32489194511605 | epot = -21.5909228684576 | etot = -16.8718744075039 +511000 ekin = 2.37917219486066 | erot = 2.25376804515889 | epot = -21.6001349490027 | etot = -16.9671947089831 +512000 ekin = 2.37938693355399 | erot = 1.9202388598811 | epot = -21.6111071917148 | etot = -17.3114813982797 +513000 ekin = 2.40685857959532 | erot = 2.08600293524419 | epot = -21.6155439119532 | etot = -17.1226823971136 +514000 ekin = 2.46724209327164 | erot = 2.20949952828772 | epot = -21.6418209909603 | etot = -16.9650793694009 +515000 ekin = 2.44642692672638 | erot = 2.02689318439838 | epot = -21.6526616938245 | etot = -17.1793415826998 +516000 ekin = 2.34670203308737 | erot = 2.1539612594322 | epot = -21.6543094777106 | etot = -17.1536461851911 +517000 ekin = 2.33878155191639 | erot = 2.33294662418961 | epot = -21.6421766473134 | etot = -16.9704484712074 +518000 ekin = 2.31107655587534 | erot = 2.15491971030942 | epot = -21.6319254773266 | etot = -17.1659292111418 +519000 ekin = 2.29496119138263 | erot = 2.00492803313407 | epot = -21.6347632719486 | etot = -17.3348740474319 +520000 ekin = 2.15339792107198 | erot = 2.04457004756208 | epot = -21.6507830510491 | etot = -17.4528150824151 +521000 ekin = 2.20801983612442 | erot = 2.16352250997088 | epot = -21.6715366002406 | etot = -17.2999942541453 +522000 ekin = 2.28349511901208 | erot = 2.12203826388421 | epot = -21.70670455002 | etot = -17.3011711671237 +523000 ekin = 2.28326140498752 | erot = 2.24730546524185 | epot = -21.7500540285242 | etot = -17.2194871582948 +524000 ekin = 2.4143039130042 | erot = 2.30243275419784 | epot = -21.7887659971607 | etot = -17.0720293299587 +525000 ekin = 2.46563871852205 | erot = 2.61576568534231 | epot = -21.8311918688005 | etot = -16.7497874649362 +526000 ekin = 2.44766866227838 | erot = 2.73251608599221 | epot = -21.8542594932623 | etot = -16.6740747449917 +527000 ekin = 2.49415128662355 | erot = 2.97647354160871 | epot = -21.86549614123 | etot = -16.3948713129978 +528000 ekin = 2.63765981818835 | erot = 2.90145202540047 | epot = -21.8539949982381 | etot = -16.3148831546493 +529000 ekin = 2.61312965886426 | erot = 2.63810638896243 | epot = -21.8123029021244 | etot = -16.5610668542977 +530000 ekin = 2.61679294703746 | erot = 2.67053467520203 | epot = -21.7690607572619 | etot = -16.4817331350224 +531000 ekin = 2.48476384385703 | erot = 2.71653952081332 | epot = -21.716536544046 | etot = -16.5152331793757 +532000 ekin = 2.48793546388984 | erot = 2.65738787716566 | epot = -21.6564484956907 | etot = -16.5111251546352 +533000 ekin = 2.41456215119455 | erot = 2.64489299438373 | epot = -21.6390724827862 | etot = -16.5796173372079 +534000 ekin = 2.29777827242773 | erot = 2.74873035111897 | epot = -21.6608745386253 | etot = -16.6143659150786 +535000 ekin = 2.26088917727541 | erot = 2.83473610922388 | epot = -21.6981866268837 | etot = -16.6025613403845 +536000 ekin = 2.20131769719336 | erot = 2.88353145322212 | epot = -21.7552484828583 | etot = -16.6703993324428 +537000 ekin = 2.13082565508322 | erot = 2.91286112998284 | epot = -21.7996526043397 | etot = -16.7559658192736 +538000 ekin = 2.05764519091748 | erot = 2.95211539945563 | epot = -21.8281285512859 | etot = -16.8183679609128 +539000 ekin = 1.97437084021542 | erot = 2.90970740612335 | epot = -21.8443187140806 | etot = -16.9602404677418 +540000 ekin = 1.95684111980197 | erot = 2.53831910392175 | epot = -21.8503067819185 | etot = -17.3551465581948 +541000 ekin = 2.01269488661898 | erot = 2.53569793957032 | epot = -21.8275993102506 | etot = -17.2792064840613 +542000 ekin = 2.03504454490688 | erot = 2.82348341864005 | epot = -21.8036330964535 | etot = -16.9451051329066 +543000 ekin = 2.03020807235302 | erot = 3.03370589872105 | epot = -21.8016375466952 | etot = -16.7377235756211 +544000 ekin = 2.0526905285699 | erot = 2.58799516983473 | epot = -21.8033388274283 | etot = -17.1626531290237 +545000 ekin = 2.15141870706955 | erot = 2.4042815973314 | epot = -21.8230803043774 | etot = -17.2673799999764 +546000 ekin = 2.27300091219341 | erot = 2.20572730047329 | epot = -21.8690779560946 | etot = -17.3903497434279 +547000 ekin = 2.35364033678051 | erot = 2.18498069722316 | epot = -21.9465784737243 | etot = -17.4079574397206 +548000 ekin = 2.43307589906662 | erot = 2.42293816342301 | epot = -22.0303494741984 | etot = -17.1743354117087 +549000 ekin = 2.5408859089621 | erot = 2.9095237719502 | epot = -22.1200487075606 | etot = -16.6696390266484 +550000 ekin = 2.56016664627915 | erot = 2.6839810389517 | epot = -22.1766985156474 | etot = -16.9325508304166 +551000 ekin = 2.72417690556167 | erot = 2.72891308441083 | epot = -22.2176306990375 | etot = -16.764540709065 +552000 ekin = 2.72596785657256 | erot = 2.42255580538612 | epot = -22.2421241890567 | etot = -17.093600527098 +553000 ekin = 2.78508615614561 | erot = 2.39994410027743 | epot = -22.2425789733829 | etot = -17.0575487169599 +554000 ekin = 2.81568582164743 | erot = 2.30970996795574 | epot = -22.212027345066 | etot = -17.0866315554629 +555000 ekin = 2.79395520813526 | erot = 2.24542312270131 | epot = -22.1601855930768 | etot = -17.1208072622402 +556000 ekin = 2.81007006192491 | erot = 2.29040711319246 | epot = -22.0853198857606 | etot = -16.9848427106433 +557000 ekin = 2.86720343014877 | erot = 2.06281031141597 | epot = -21.9979009255867 | etot = -17.067887184022 +558000 ekin = 2.75377155929337 | erot = 2.13725587394232 | epot = -21.8668776496785 | etot = -16.9758502164428 +559000 ekin = 2.72157639522935 | erot = 2.20102610126822 | epot = -21.7194344747875 | etot = -16.7968319782899 +560000 ekin = 2.70961845092855 | erot = 2.59816182534501 | epot = -21.5357151296297 | etot = -16.2279348533562 +561000 ekin = 2.57949305004198 | erot = 2.96337390027718 | epot = -21.3145814838315 | etot = -15.7717145335124 +562000 ekin = 2.32107059805617 | erot = 2.5114321407515 | epot = -21.0085235339445 | etot = -16.1760207951368 +563000 ekin = 2.24732443728602 | erot = 2.38790050938188 | epot = -20.815450988449 | etot = -16.1802260417811 +564000 ekin = 2.33791301852585 | erot = 2.68335523927264 | epot = -20.8066084764155 | etot = -15.785340218617 +565000 ekin = 2.3251020907636 | erot = 2.8508896099135 | epot = -20.6671406909933 | etot = -15.4911489903162 +566000 ekin = 2.20543771892918 | erot = 2.3570671903573 | epot = -20.5538554522387 | etot = -15.9913505429522 +567000 ekin = 2.11804196373759 | erot = 2.40185685943679 | epot = -20.4713035116104 | etot = -15.9514046884361 +568000 ekin = 2.22268682011198 | erot = 2.33307148175129 | epot = -20.3820924859933 | etot = -15.82633418413 +569000 ekin = 2.09547585997718 | erot = 2.62261207858588 | epot = -20.2691455782376 | etot = -15.5510576396745 +570000 ekin = 2.01580186947869 | erot = 2.33698172151224 | epot = -20.165895860353 | etot = -15.8131122693621 +571000 ekin = 2.08039178219742 | erot = 2.36534037676669 | epot = -20.0857600662143 | etot = -15.6400279072502 +572000 ekin = 2.11927324959282 | erot = 2.30282149950142 | epot = -20.0451987594367 | etot = -15.6231040103424 +573000 ekin = 2.04663917529167 | erot = 2.33972667939313 | epot = -20.0317480451749 | etot = -15.6453821904901 +574000 ekin = 2.09962922460125 | erot = 2.19990447249072 | epot = -20.0660831814173 | etot = -15.7665494843253 +575000 ekin = 2.27242130434709 | erot = 2.25609508493244 | epot = -20.1489560418931 | etot = -15.6204396526135 +576000 ekin = 2.39016715864509 | erot = 2.22255127128249 | epot = -20.2603613797462 | etot = -15.6476429498186 +577000 ekin = 2.36412563740733 | erot = 2.30198986937718 | epot = -20.3752615554301 | etot = -15.7091460486456 +578000 ekin = 2.49125580710745 | erot = 2.42660786227683 | epot = -20.5025207025988 | etot = -15.5846570332145 +579000 ekin = 2.56165048094669 | erot = 2.83228223321291 | epot = -20.6368911222347 | etot = -15.2429584080751 +580000 ekin = 2.59857076318839 | erot = 2.86537715884225 | epot = -20.7281657529402 | etot = -15.2642178309096 +581000 ekin = 2.75751410053949 | erot = 3.20102304026106 | epot = -20.7812637399731 | etot = -14.8227265991726 +582000 ekin = 2.72186433456398 | erot = 2.73127793091829 | epot = -20.8119294300415 | etot = -15.3587871645592 +583000 ekin = 2.62273499225633 | erot = 2.46109328120281 | epot = -20.8274714671204 | etot = -15.7436431936613 +584000 ekin = 2.65791178049948 | erot = 2.52854330537008 | epot = -20.8318022222694 | etot = -15.6453471363999 +585000 ekin = 2.61150125120808 | erot = 2.75251814406226 | epot = -20.8423541781133 | etot = -15.478334782843 +586000 ekin = 2.56490529514512 | erot = 2.76819989101138 | epot = -20.8235905183125 | etot = -15.490485332156 +587000 ekin = 2.44377479420604 | erot = 2.55313165140467 | epot = -20.7873967690622 | etot = -15.7904903234515 +588000 ekin = 2.54600679288713 | erot = 2.00966564099413 | epot = -20.741489849751 | etot = -16.1858174158697 +589000 ekin = 2.42615788479188 | erot = 1.8739594454408 | epot = -20.7098613915249 | etot = -16.4097440612923 +590000 ekin = 2.42016761405622 | erot = 1.7197705476391 | epot = -20.6824691484087 | etot = -16.5425309867133 +591000 ekin = 2.3876073780024 | erot = 1.84146371886644 | epot = -20.6722800899372 | etot = -16.4432089930684 +592000 ekin = 2.31657054464644 | erot = 1.96505693643476 | epot = -20.70316667755 | etot = -16.4215391964688 +593000 ekin = 2.23530102205155 | erot = 1.81162578854711 | epot = -20.7586825210083 | etot = -16.7117557104097 +594000 ekin = 2.21499618339358 | erot = 1.98026347110251 | epot = -20.8347835084312 | etot = -16.6395238539351 +595000 ekin = 2.17351092068557 | erot = 2.27153694538247 | epot = -20.9049251653836 | etot = -16.4598772993155 +596000 ekin = 2.135367214222 | erot = 2.30838064667257 | epot = -20.9560792436855 | etot = -16.5123313827909 +597000 ekin = 2.05769259414603 | erot = 2.38187665146476 | epot = -20.9894852475398 | etot = -16.549916001929 +598000 ekin = 2.05674814899225 | erot = 2.42014079217215 | epot = -21.0044596830564 | etot = -16.527570741892 +599000 ekin = 1.95864026709762 | erot = 2.3999507598191 | epot = -20.9740626757909 | etot = -16.6154716488742 +600000 ekin = 1.92217253864623 | erot = 2.27990516657244 | epot = -20.9285242414058 | etot = -16.7264465361872 +601000 ekin = 1.98018146832075 | erot = 2.20890815410628 | epot = -20.8846332261999 | etot = -16.6955436037729 +602000 ekin = 1.90184071583288 | erot = 2.1591383050006 | epot = -20.8542535717546 | etot = -16.7932745509212 +603000 ekin = 1.87414785472449 | erot = 2.20472694083466 | epot = -20.840804642708 | etot = -16.7619298471489 +604000 ekin = 1.89566967553992 | erot = 2.33936411504472 | epot = -20.8324704464852 | etot = -16.5974366559006 +605000 ekin = 1.90221219714126 | erot = 2.24714804248274 | epot = -20.8240875666947 | etot = -16.6747273270707 +606000 ekin = 1.98126421387493 | erot = 2.18362681345839 | epot = -20.8318161332644 | etot = -16.6669251059311 +607000 ekin = 1.96256992421039 | erot = 2.3146612889166 | epot = -20.8422192283423 | etot = -16.5649880152153 +608000 ekin = 2.00857732853944 | erot = 2.3524665478589 | epot = -20.8480147460994 | etot = -16.4869708697011 +609000 ekin = 1.95325682031753 | erot = 2.81335207348484 | epot = -20.8594200048123 | etot = -16.0928111110099 +610000 ekin = 1.98193326810065 | erot = 2.88259052339696 | epot = -20.8472840007396 | etot = -15.982760209242 +611000 ekin = 2.04137421596162 | erot = 2.49925666829921 | epot = -20.8306415233214 | etot = -16.2900106390606 +612000 ekin = 2.16269789015088 | erot = 2.70058773214418 | epot = -20.7942268006619 | etot = -15.9309411783669 +613000 ekin = 2.06529168540835 | erot = 2.42568351626014 | epot = -20.7614875640906 | etot = -16.2705123624221 +614000 ekin = 2.1337254705834 | erot = 2.26794536225568 | epot = -20.7223835113489 | etot = -16.3207126785098 +615000 ekin = 2.15900283469812 | erot = 2.41796083425712 | epot = -20.6594009316035 | etot = -16.0824372626483 +616000 ekin = 2.18075700318094 | erot = 2.25199751704725 | epot = -20.6022951429065 | etot = -16.1695406226783 +617000 ekin = 2.15965098363264 | erot = 2.22906613418694 | epot = -20.5852528289999 | etot = -16.1965357111803 +618000 ekin = 2.23225625672975 | erot = 2.44686544718953 | epot = -20.6102249700191 | etot = -15.9311032660998 +619000 ekin = 2.26975454903642 | erot = 2.34289253878031 | epot = -20.6719638155448 | etot = -16.0593167277281 +620000 ekin = 2.30973430443481 | erot = 2.69227064537991 | epot = -20.770197880988 | etot = -15.7681929311733 +621000 ekin = 2.47203322805276 | erot = 3.06119226990021 | epot = -20.9146158917184 | etot = -15.3813903937654 +622000 ekin = 2.62348274560247 | erot = 3.16275527232554 | epot = -21.0868239893485 | etot = -15.3005859714205 +623000 ekin = 2.67387060573014 | erot = 3.22531872328046 | epot = -21.2795790465578 | etot = -15.3803897175472 +624000 ekin = 2.77334044145783 | erot = 3.19930974567985 | epot = -21.4804753178404 | etot = -15.5078251307027 +625000 ekin = 2.822304660725 | erot = 2.97471991851 | epot = -21.6768467596154 | etot = -15.8798221803804 +626000 ekin = 2.97306496702188 | erot = 3.02810006646584 | epot = -21.8368791799813 | etot = -15.8357141464936 +627000 ekin = 2.9396359895919 | erot = 3.11546514885634 | epot = -21.9295648605418 | etot = -15.8744637220935 +628000 ekin = 2.9467540174413 | erot = 2.87563053223973 | epot = -21.9734618105422 | etot = -16.1510772608612 +629000 ekin = 2.93549647211195 | erot = 2.94179551334333 | epot = -21.9629357939843 | etot = -16.085643808529 +630000 ekin = 2.968513495898 | erot = 2.66241758633508 | epot = -21.9367067820004 | etot = -16.3057756997674 +631000 ekin = 2.97170810029481 | erot = 2.92784888357905 | epot = -21.9408587478561 | etot = -16.0413017639823 +632000 ekin = 3.00915408594534 | erot = 3.03331194667377 | epot = -21.966297586726 | etot = -15.9238315541069 +633000 ekin = 3.15130786380813 | erot = 2.90447111403432 | epot = -21.9802035040988 | etot = -15.9244245262564 +634000 ekin = 3.08724307225627 | erot = 3.06470523223771 | epot = -21.9813618086078 | etot = -15.8294135041138 +635000 ekin = 3.09485256628982 | erot = 3.05293629484957 | epot = -21.9761085643258 | etot = -15.8283197031864 +636000 ekin = 3.1883367624613 | erot = 3.09853352594533 | epot = -21.9262309231058 | etot = -15.6393606346991 +637000 ekin = 3.17249776983431 | erot = 2.76836567164433 | epot = -21.8463187618964 | etot = -15.9054553204178 +638000 ekin = 3.15773051904013 | erot = 2.74718314777848 | epot = -21.7521034668652 | etot = -15.8471898000466 +639000 ekin = 3.08619022126253 | erot = 2.75291211878172 | epot = -21.619880700477 | etot = -15.7807783604328 +640000 ekin = 3.13541342359575 | erot = 2.75186869517588 | epot = -21.4236473324243 | etot = -15.5363652136527 +641000 ekin = 2.97070406886251 | erot = 2.53928201823126 | epot = -21.2113872532509 | etot = -15.7014011661571 +642000 ekin = 2.96213641788611 | erot = 2.46548060107447 | epot = -20.9928030195295 | etot = -15.5651860005689 +643000 ekin = 2.84219149582751 | erot = 2.30604210385225 | epot = -20.7796379309883 | etot = -15.6314043313085 +644000 ekin = 2.73987448812059 | erot = 1.92488908230375 | epot = -20.5971129650472 | etot = -15.9323493946229 +645000 ekin = 2.66964682664563 | erot = 2.17741731737643 | epot = -20.4501395419028 | etot = -15.6030753978807 +646000 ekin = 2.55685727423904 | erot = 1.94955682330786 | epot = -20.3484174743049 | etot = -15.842003376758 +647000 ekin = 2.36548817737579 | erot = 2.05467058240558 | epot = -20.2308525146964 | etot = -15.8106937549151 +648000 ekin = 2.31008857244576 | erot = 1.85050053837927 | epot = -20.1170577319198 | etot = -15.9564686210947 +649000 ekin = 2.28205025869235 | erot = 1.7126370869863 | epot = -20.0254728385507 | etot = -16.0307854928721 +650000 ekin = 2.21196677463625 | erot = 1.82025099236611 | epot = -19.9537436999672 | etot = -15.9215259329649 +651000 ekin = 2.17096351970622 | erot = 1.64111059964159 | epot = -19.8939461254392 | etot = -16.0818720060914 +652000 ekin = 2.24485056260397 | erot = 1.59015920734423 | epot = -19.855915209439 | etot = -16.0209054394908 +653000 ekin = 2.24348598334154 | erot = 1.56547926791898 | epot = -19.8354995105725 | etot = -16.026534259312 +654000 ekin = 2.34367054322139 | erot = 1.59100225910914 | epot = -19.8036561058559 | etot = -15.8689833035253 +655000 ekin = 2.33139381348415 | erot = 1.73360745289318 | epot = -19.7790891006602 | etot = -15.7140878342829 +656000 ekin = 2.39082402474816 | erot = 1.66512195058768 | epot = -19.7882728464569 | etot = -15.7323268711211 +657000 ekin = 2.3632649420265 | erot = 1.64634599165861 | epot = -19.8156605115385 | etot = -15.8060495778534 +658000 ekin = 2.37356060304643 | erot = 1.59216090461383 | epot = -19.8647456377848 | etot = -15.8990241301246 +659000 ekin = 2.48069174292895 | erot = 1.49175770497902 | epot = -19.9602607152512 | etot = -15.9878112673432 +660000 ekin = 2.43784148373522 | erot = 1.69304245258743 | epot = -20.0982797920097 | etot = -15.9673958556871 +661000 ekin = 2.50127283299376 | erot = 1.90162951574041 | epot = -20.2564772898339 | etot = -15.8535749410997 +662000 ekin = 2.65651409235402 | erot = 1.9769416830246 | epot = -20.4351000172128 | etot = -15.8016442418342 +663000 ekin = 2.59069846598309 | erot = 2.27024751168609 | epot = -20.5951722286013 | etot = -15.7342262509321 +664000 ekin = 2.6519936252655 | erot = 2.41512175478277 | epot = -20.723695654942 | etot = -15.6565802748938 +665000 ekin = 2.74059693842602 | erot = 2.18558347698592 | epot = -20.8362709840434 | etot = -15.9100905686315 +666000 ekin = 2.81567682366608 | erot = 2.347498605977 | epot = -20.9472815722846 | etot = -15.7841061426415 +667000 ekin = 2.85397277941909 | erot = 2.78444099743822 | epot = -21.0512547888643 | etot = -15.4128410120069 +668000 ekin = 2.9029560959486 | erot = 2.67434743985664 | epot = -21.1196454976531 | etot = -15.5423419618479 +669000 ekin = 2.82586988686545 | erot = 2.59996675336106 | epot = -21.1269738870857 | etot = -15.7011372468592 +670000 ekin = 2.79168631385998 | erot = 2.56332899434135 | epot = -21.1062374856375 | etot = -15.7512221774362 +671000 ekin = 2.78377934011034 | erot = 2.65037677108214 | epot = -21.0707534252218 | etot = -15.6365973140293 +672000 ekin = 2.80370333364227 | erot = 2.43772748784314 | epot = -21.0308122724572 | etot = -15.7893814509718 +673000 ekin = 2.76915399868745 | erot = 2.51561518037604 | epot = -20.9769263473735 | etot = -15.6921571683101 +674000 ekin = 2.64183624634861 | erot = 2.55097233507923 | epot = -20.9182849770311 | etot = -15.7254763956033 +675000 ekin = 2.62521142757518 | erot = 2.64780321266178 | epot = -20.8750415391241 | etot = -15.6020268988872 +676000 ekin = 2.56750452241289 | erot = 2.50976436481742 | epot = -20.8718880077793 | etot = -15.794619120549 +677000 ekin = 2.54381281980489 | erot = 2.88598144344514 | epot = -20.8743650878302 | etot = -15.4445708245802 +678000 ekin = 2.41460230362222 | erot = 2.74956960106234 | epot = -20.8645099379745 | etot = -15.70033803329 +679000 ekin = 2.45714396740976 | erot = 2.51630907313236 | epot = -20.8333930763114 | etot = -15.8599400357693 +680000 ekin = 2.39813210053791 | erot = 2.44684074439997 | epot = -20.7887522768168 | etot = -15.943779431879 +681000 ekin = 2.43918264143159 | erot = 2.34640131965711 | epot = -20.747680811383 | etot = -15.9620968502943 +682000 ekin = 2.35991514290778 | erot = 2.52582496731603 | epot = -20.678338166726 | etot = -15.7925980565022 +683000 ekin = 2.52475831935497 | erot = 2.4303254284145 | epot = -20.5982055545541 | etot = -15.6431218067846 +684000 ekin = 2.58660934635461 | erot = 2.11878822836059 | epot = -20.4924135763666 | etot = -15.7870160016514 +685000 ekin = 2.55154119483633 | erot = 1.7348658418517 | epot = -20.3822175109813 | etot = -16.0958104742933 +686000 ekin = 2.63111018797748 | erot = 1.47730091117203 | epot = -20.3126109077788 | etot = -16.2041998086293 +687000 ekin = 2.63969682019115 | erot = 1.47332301857272 | epot = -20.2996486685951 | etot = -16.1866288298313 +688000 ekin = 2.72349207947758 | erot = 1.29409931094976 | epot = -20.3234627588057 | etot = -16.3058713683784 +689000 ekin = 2.73079979716482 | erot = 1.5600672648961 | epot = -20.4074074566846 | etot = -16.1165403946237 +690000 ekin = 2.88862138997103 | erot = 1.53763438603398 | epot = -20.527130706041 | etot = -16.100874930036 +691000 ekin = 2.93184490556452 | erot = 1.68041505604352 | epot = -20.6817002649686 | etot = -16.0694403033606 +692000 ekin = 3.03965167588275 | erot = 1.53360102419195 | epot = -20.8394269438009 | etot = -16.2661742437262 +693000 ekin = 3.11332037021317 | erot = 1.78276814996271 | epot = -20.9856322860994 | etot = -16.0895437659235 +694000 ekin = 3.26591256423417 | erot = 1.83297982799403 | epot = -21.1162583961236 | etot = -16.0173660038954 +695000 ekin = 3.39944935277176 | erot = 1.85369820811794 | epot = -21.2109777365153 | etot = -15.9578301756256 +696000 ekin = 3.30343203418373 | erot = 1.83180202140646 | epot = -21.2772827777983 | etot = -16.1420487222082 +697000 ekin = 3.22977317647616 | erot = 1.99511551134609 | epot = -21.3085920420929 | etot = -16.0837033542707 +698000 ekin = 3.36545228088468 | erot = 1.93865151713971 | epot = -21.2924696712876 | etot = -15.9883658732632 +699000 ekin = 3.26727101649092 | erot = 2.00750907689809 | epot = -21.2347192164136 | etot = -15.9599391230246 +700000 ekin = 3.23373130843489 | erot = 1.95814796460311 | epot = -21.1439766208011 | etot = -15.9520973477631 +701000 ekin = 3.07791756459632 | erot = 1.84629538321615 | epot = -21.0368350139918 | etot = -16.1126220661793 +702000 ekin = 2.95524336171474 | erot = 2.05334887389002 | epot = -20.9320932298123 | etot = -15.9235009942076 +703000 ekin = 2.81685700197358 | erot = 2.30798807393501 | epot = -20.8529482411061 | etot = -15.7281031651975 +704000 ekin = 2.7860374569489 | erot = 2.41032504549238 | epot = -20.7817305926663 | etot = -15.585368090225 +705000 ekin = 2.82734195960163 | erot = 2.58886515581049 | epot = -20.7054861279342 | etot = -15.2892790125221 +706000 ekin = 2.69252213630991 | erot = 2.87186287347298 | epot = -20.6341395720106 | etot = -15.0697545622277 +707000 ekin = 2.67677781124234 | erot = 2.61015441384314 | epot = -20.5829958432682 | etot = -15.2960636181827 +708000 ekin = 2.61607470121092 | erot = 2.52638154954409 | epot = -20.5707989768077 | etot = -15.4283427260527 +709000 ekin = 2.66476396394708 | erot = 2.77686126060226 | epot = -20.5966805252115 | etot = -15.1550553006622 +710000 ekin = 2.72473753944311 | erot = 3.01436891653856 | epot = -20.6381576133419 | etot = -14.8990511573603 +711000 ekin = 2.73828751365553 | erot = 2.96087104909546 | epot = -20.6834857916291 | etot = -14.9843272288781 +712000 ekin = 2.62321032142564 | erot = 3.36842837276305 | epot = -20.7033938368062 | etot = -14.7117551426175 +713000 ekin = 2.57840853452334 | erot = 3.23870482700723 | epot = -20.7157410164414 | etot = -14.8986276549108 +714000 ekin = 2.57830571481508 | erot = 3.18574747943756 | epot = -20.7368579407289 | etot = -14.9728047464762 +715000 ekin = 2.55353778251633 | erot = 3.0602947148483 | epot = -20.754741492098 | etot = -15.1409089947334 +716000 ekin = 2.55549921704991 | erot = 2.85756803731166 | epot = -20.7715752448115 | etot = -15.35850799045 +717000 ekin = 2.6684096005884 | erot = 3.13695167508794 | epot = -20.7817582371967 | etot = -14.9763969615203 +718000 ekin = 2.70162233045692 | erot = 2.88936608298093 | epot = -20.7821953404604 | etot = -15.1912069270225 +719000 ekin = 2.67856075035663 | erot = 3.06593156988603 | epot = -20.7772381096807 | etot = -15.032745789438 +720000 ekin = 2.73835391684204 | erot = 3.1260661579715 | epot = -20.7642516702523 | etot = -14.8998315954388 +721000 ekin = 2.83298219908736 | erot = 2.86786361439848 | epot = -20.7356626767526 | etot = -15.0348168632668 +722000 ekin = 2.84238954774469 | erot = 3.0130054489483 | epot = -20.6952880713167 | etot = -14.8398930746237 +723000 ekin = 2.83841887662251 | erot = 2.85261974479237 | epot = -20.6504830813442 | etot = -14.9594444599293 +724000 ekin = 3.01277617592967 | erot = 3.09042764557525 | epot = -20.6160634840685 | etot = -14.5128596625636 +725000 ekin = 3.17120635017279 | erot = 2.96143140596372 | epot = -20.5877395535624 | etot = -14.4551017974259 +726000 ekin = 3.20454859904875 | erot = 2.97124869107361 | epot = -20.5737408249939 | etot = -14.3979435348715 +727000 ekin = 3.19846557634571 | erot = 2.77789168617429 | epot = -20.5945168300514 | etot = -14.6181595675314 +728000 ekin = 3.28654276144371 | erot = 2.57414717613078 | epot = -20.640457349214 | etot = -14.7797674116395 +729000 ekin = 3.3439785552026 | erot = 2.60607683819484 | epot = -20.6877535154514 | etot = -14.7376981220539 +730000 ekin = 3.33088715350237 | erot = 2.65576997467221 | epot = -20.7175880662468 | etot = -14.7309309380722 +731000 ekin = 3.33990502646308 | erot = 2.78966197817343 | epot = -20.7385421874511 | etot = -14.6089751828146 +732000 ekin = 3.27037431476543 | erot = 3.16404088131425 | epot = -20.7088668644641 | etot = -14.2744516683844 +733000 ekin = 3.16062340528016 | erot = 3.37415612395544 | epot = -20.6516575424073 | etot = -14.1168780131717 +734000 ekin = 3.09953693998324 | erot = 3.25267070419762 | epot = -20.5803936969356 | etot = -14.2281860527547 +735000 ekin = 2.94450728592261 | erot = 2.96857162868856 | epot = -20.4729949298543 | etot = -14.5599160152432 +736000 ekin = 2.7958481765176 | erot = 2.9239669205071 | epot = -20.3407691844256 | etot = -14.6209540874009 +737000 ekin = 2.72272921166398 | erot = 3.17345753492493 | epot = -20.1979266935853 | etot = -14.3017399469964 +738000 ekin = 2.54332056785739 | erot = 3.29818161761707 | epot = -20.0303847475409 | etot = -14.1888825620664 +739000 ekin = 2.32323875619857 | erot = 2.93500343249744 | epot = -19.8750675706789 | etot = -14.6168253819829 +740000 ekin = 2.15390188391517 | erot = 2.57318962024238 | epot = -19.7116721317164 | etot = -14.9845806275589 +741000 ekin = 1.95437882697948 | erot = 2.32607517304431 | epot = -19.5750053199849 | etot = -15.2945513199611 +742000 ekin = 1.92783578015067 | erot = 2.13064797487019 | epot = -19.4713087417752 | etot = -15.4128249867544 +743000 ekin = 2.04931727768884 | erot = 2.05953320755507 | epot = -19.3808587546544 | etot = -15.2720082694105 +744000 ekin = 1.97574953400554 | erot = 2.0627248717493 | epot = -19.3292238016071 | etot = -15.2907493958523 +745000 ekin = 2.04017863714732 | erot = 1.82427330713394 | epot = -19.3294627618532 | etot = -15.4650108175719 +746000 ekin = 2.0239515938615 | erot = 1.96899911255019 | epot = -19.3725184887274 | etot = -15.3795677823157 +747000 ekin = 2.09406854938782 | erot = 1.94863482625804 | epot = -19.4739827252228 | etot = -15.4312793495769 +748000 ekin = 2.2981509463802 | erot = 1.9007444973105 | epot = -19.6283880334729 | etot = -15.4294925897822 +749000 ekin = 2.35637166185873 | erot = 1.88187224436553 | epot = -19.8091245759456 | etot = -15.5708806697214 +750000 ekin = 2.46261791012991 | erot = 1.68915240890073 | epot = -20.0059909069074 | etot = -15.8542205878767 +751000 ekin = 2.60407300534198 | erot = 1.90400653681735 | epot = -20.2085470980303 | etot = -15.700467555871 +752000 ekin = 2.69082470142479 | erot = 2.30656368674329 | epot = -20.4330055381863 | etot = -15.4356171500182 +753000 ekin = 2.86185352213773 | erot = 2.08508944835044 | epot = -20.6608245815304 | etot = -15.7138816110423 +754000 ekin = 2.98333808215677 | erot = 2.53924444651836 | epot = -20.8729357638507 | etot = -15.3503532351755 +755000 ekin = 3.15712054719979 | erot = 2.80998037917417 | epot = -21.089409214386 | etot = -15.122308288012 +756000 ekin = 3.33248676900326 | erot = 2.85318697997032 | epot = -21.269924842092 | etot = -15.0842510931184 +757000 ekin = 3.41680611924925 | erot = 2.92784780738199 | epot = -21.4304548340673 | etot = -15.0858009074361 +758000 ekin = 3.39156382871297 | erot = 2.78356707636008 | epot = -21.576696598629 | etot = -15.401565693556 +759000 ekin = 3.43155653282502 | erot = 2.83467624438526 | epot = -21.6891769319694 | etot = -15.4229441547591 +760000 ekin = 3.45801219419692 | erot = 2.61557400116939 | epot = -21.7546703090586 | etot = -15.6810841136923 +761000 ekin = 3.37717727044775 | erot = 2.8956375520945 | epot = -21.789202831323 | etot = -15.5163880087808 +762000 ekin = 3.47824550195057 | erot = 2.79188597259465 | epot = -21.7977512926642 | etot = -15.527619818119 +763000 ekin = 3.47659880804314 | erot = 2.54885516262659 | epot = -21.7781604169458 | etot = -15.7527064462761 +764000 ekin = 3.45277978719522 | erot = 2.64283550756138 | epot = -21.7044469789531 | etot = -15.6088316841965 +765000 ekin = 3.39906272086552 | erot = 2.44961754559262 | epot = -21.5950318186521 | etot = -15.746351552194 +766000 ekin = 3.34001470871272 | erot = 2.39682151597884 | epot = -21.4894395399038 | etot = -15.7526033152123 +767000 ekin = 3.45549704933041 | erot = 2.33544666401034 | epot = -21.3866970636422 | etot = -15.5957533503015 +768000 ekin = 3.26198074071046 | erot = 2.45762138127352 | epot = -21.2912857370597 | etot = -15.5716836150757 +769000 ekin = 3.16082467479808 | erot = 2.36075087935245 | epot = -21.2103530429965 | etot = -15.688777488846 +770000 ekin = 3.07645918396924 | erot = 2.4925900630739 | epot = -21.1212342627875 | etot = -15.5521850157443 +771000 ekin = 2.92350840414402 | erot = 2.56275243304922 | epot = -21.0363085296096 | etot = -15.5500476924164 +772000 ekin = 2.75979211106294 | erot = 2.44752256772038 | epot = -20.938158693868 | etot = -15.7308440150847 +773000 ekin = 2.71511621634669 | erot = 2.32937899997663 | epot = -20.8439731838767 | etot = -15.7994779675533 +774000 ekin = 2.5501181043417 | erot = 2.4833205550087 | epot = -20.7658389533277 | etot = -15.7324002939773 +775000 ekin = 2.41197388502376 | erot = 2.62818884118392 | epot = -20.7179622711116 | etot = -15.6777995449039 +776000 ekin = 2.37508963815638 | erot = 2.4413693722769 | epot = -20.7211512138291 | etot = -15.9046922033958 +777000 ekin = 2.34948686881501 | erot = 2.36213131358723 | epot = -20.7370244755325 | etot = -16.0254062931302 +778000 ekin = 2.29585534902507 | erot = 2.73124120723735 | epot = -20.7683121988625 | etot = -15.7412156426001 +779000 ekin = 2.18150396589501 | erot = 2.72210705119072 | epot = -20.8059074416474 | etot = -15.9022964245616 +780000 ekin = 2.26066885699434 | erot = 2.87221231082937 | epot = -20.8394643204856 | etot = -15.7065831526618 +781000 ekin = 2.27461625652574 | erot = 2.81372031403662 | epot = -20.8757314682934 | etot = -15.787394897731 +782000 ekin = 2.19892592960391 | erot = 2.61785718560377 | epot = -20.89651313073 | etot = -16.0797300155223 +783000 ekin = 2.22941617588597 | erot = 2.47751279799165 | epot = -20.9183852720836 | etot = -16.211456298206 +784000 ekin = 2.42718924867942 | erot = 2.81382459332945 | epot = -20.9279105230659 | etot = -15.6868966810571 +785000 ekin = 2.388256325638 | erot = 2.70987963105491 | epot = -20.9108108361691 | etot = -15.8126748794762 +786000 ekin = 2.4440461871171 | erot = 2.52658585483966 | epot = -20.9041006583262 | etot = -15.9334686163694 +787000 ekin = 2.50702113933241 | erot = 2.28293105807323 | epot = -20.8749015767315 | etot = -16.0849493793259 +788000 ekin = 2.4490666689078 | erot = 2.41360841664409 | epot = -20.8341700774424 | etot = -15.9714949918905 +789000 ekin = 2.52045486785591 | erot = 2.52744454804456 | epot = -20.7905656205227 | etot = -15.7426662046222 +790000 ekin = 2.52825818807966 | erot = 2.68548159035115 | epot = -20.757581950223 | etot = -15.5438421717922 +791000 ekin = 2.64995125141675 | erot = 2.73987493548448 | epot = -20.734977399363 | etot = -15.3451512124617 +792000 ekin = 2.70397080831161 | erot = 2.64980290799394 | epot = -20.7100100046766 | etot = -15.356236288371 +793000 ekin = 2.750332948453 | erot = 2.54340061653018 | epot = -20.707836297178 | etot = -15.4141027321949 +794000 ekin = 2.8653381311493 | erot = 2.55380338833671 | epot = -20.7048471683316 | etot = -15.2857056488456 +795000 ekin = 2.78119650415431 | erot = 2.26710967345022 | epot = -20.7038606047262 | etot = -15.6555544271216 +796000 ekin = 2.7524772965948 | erot = 1.93248690499302 | epot = -20.7002506155573 | etot = -16.0152864139695 +797000 ekin = 2.87695524377423 | erot = 1.75440457751931 | epot = -20.7015802402497 | etot = -16.0702204189561 +798000 ekin = 2.92176058311519 | erot = 1.87424589751672 | epot = -20.7289229999115 | etot = -15.9329165192796 +799000 ekin = 2.84123141391943 | erot = 1.69781273980071 | epot = -20.753619486937 | etot = -16.2145753332168 +800000 ekin = 2.88647051776135 | erot = 1.8845884679479 | epot = -20.7813888694614 | etot = -16.0103298837521 +801000 ekin = 2.82188707288437 | erot = 1.97533232918764 | epot = -20.7854390466837 | etot = -15.9882196446117 +802000 ekin = 2.80670744878678 | erot = 1.92170823847808 | epot = -20.7694229323802 | etot = -16.0410072451153 +803000 ekin = 2.81917409800309 | erot = 1.86293659025146 | epot = -20.736880956466 | etot = -16.0547702682115 +804000 ekin = 2.81542679490223 | erot = 1.8248381634794 | epot = -20.7049136915727 | etot = -16.064648733191 +805000 ekin = 2.7662102530107 | erot = 1.80656496128512 | epot = -20.6689552876865 | etot = -16.0961800733907 +806000 ekin = 2.65050365938285 | erot = 2.07564631955298 | epot = -20.6394756033498 | etot = -15.913325624414 +807000 ekin = 2.5562413456694 | erot = 2.16054307897126 | epot = -20.6134778956026 | etot = -15.8966934709619 +808000 ekin = 2.4873801372098 | erot = 2.32147389178902 | epot = -20.5888178207125 | etot = -15.7799637917137 +809000 ekin = 2.4786273298817 | erot = 2.4849882609475 | epot = -20.5619387083681 | etot = -15.5983231175389 +810000 ekin = 2.39703068581775 | erot = 2.81931500773775 | epot = -20.5424309669721 | etot = -15.3260852734166 +811000 ekin = 2.37887287485907 | erot = 2.69438802886465 | epot = -20.5520463788994 | etot = -15.4787854751757 +812000 ekin = 2.28085047814072 | erot = 2.4248513842694 | epot = -20.5550539173034 | etot = -15.8493520548933 +813000 ekin = 2.25229479784389 | erot = 2.55707080478972 | epot = -20.5502753315565 | etot = -15.7409097289229 +814000 ekin = 2.22024450946151 | erot = 2.84053382533175 | epot = -20.5291885807543 | etot = -15.468410245961 +815000 ekin = 2.14652605610553 | erot = 2.67021357483755 | epot = -20.4999623788204 | etot = -15.6832227478773 +816000 ekin = 2.1594176029821 | erot = 2.59153501297938 | epot = -20.4557339217919 | etot = -15.7047813058304 +817000 ekin = 2.16476188533261 | erot = 2.3341335458438 | epot = -20.3878114616849 | etot = -15.8889160305084 +818000 ekin = 2.2316964675901 | erot = 2.16459446462076 | epot = -20.3094264209628 | etot = -15.9131354887519 +819000 ekin = 2.15183597113008 | erot = 1.96236374628699 | epot = -20.2442212233172 | etot = -16.1300215059002 +820000 ekin = 2.15160519820179 | erot = 1.78654941276898 | epot = -20.1685556064356 | etot = -16.2304009954648 +821000 ekin = 2.11411181703459 | erot = 1.59439007001321 | epot = -20.1045081087113 | etot = -16.3960062216635 +822000 ekin = 2.09578590796832 | erot = 1.82458690696502 | epot = -20.0615873148663 | etot = -16.1412144999329 +823000 ekin = 2.08554311077402 | erot = 1.79122152448752 | epot = -20.0542615586192 | etot = -16.1774969233576 +824000 ekin = 2.06608530910568 | erot = 1.83488646651528 | epot = -20.0832229529284 | etot = -16.1822511773074 +825000 ekin = 2.12914321441478 | erot = 2.12189619250101 | epot = -20.1297268549431 | etot = -15.8786874480273 +826000 ekin = 2.17617898744288 | erot = 2.29556289596594 | epot = -20.172646352924 | etot = -15.7009044695152 +827000 ekin = 2.1541933130057 | erot = 2.34308143022508 | epot = -20.2056332381724 | etot = -15.7083584949417 +828000 ekin = 2.20039878821194 | erot = 2.41783518802157 | epot = -20.2229965044045 | etot = -15.604762528171 +829000 ekin = 2.20314847732571 | erot = 2.56607297380311 | epot = -20.2051061030743 | etot = -15.4358846519455 +830000 ekin = 2.30175185120456 | erot = 2.43964061204045 | epot = -20.1552304697953 | etot = -15.4138380065503 +831000 ekin = 2.24000691994547 | erot = 2.16496177189546 | epot = -20.0860391808208 | etot = -15.6810704889798 +832000 ekin = 2.23825638063342 | erot = 2.25483913353687 | epot = -20.0235934169571 | etot = -15.5304979027868 +833000 ekin = 2.16205349111652 | erot = 1.94237500276371 | epot = -19.9879274641397 | etot = -15.8834989702595 +834000 ekin = 2.16740768022488 | erot = 1.70564999745802 | epot = -19.9844147815709 | etot = -16.111357103888 +835000 ekin = 2.17278893541051 | erot = 1.56429512699082 | epot = -20.0201055001639 | etot = -16.2830214377626 +836000 ekin = 2.12097731365457 | erot = 1.73560474622194 | epot = -20.0572346764645 | etot = -16.200652616588 +837000 ekin = 2.13598638451596 | erot = 1.79213525365432 | epot = -20.0629697156961 | etot = -16.1348480775258 +838000 ekin = 2.155236659974 | erot = 1.6597576786498 | epot = -20.0531324206633 | etot = -16.2381380820395 +839000 ekin = 2.18050335550332 | erot = 1.62185210117957 | epot = -20.0624518040168 | etot = -16.2600963473339 +840000 ekin = 2.26003994524086 | erot = 1.64754456826618 | epot = -20.0987090628808 | etot = -16.1911245493738 +841000 ekin = 2.35849160545682 | erot = 1.45991256461146 | epot = -20.1235761929062 | etot = -16.3051720228379 +842000 ekin = 2.30506950612889 | erot = 1.67704941831984 | epot = -20.1403357838886 | etot = -16.1582168594399 +843000 ekin = 2.25000612105265 | erot = 1.57916412105146 | epot = -20.178749085045 | etot = -16.3495788429409 +844000 ekin = 2.36131993993677 | erot = 1.74224823968073 | epot = -20.2587879559388 | etot = -16.1552197763213 +845000 ekin = 2.37622491879865 | erot = 1.78604993278489 | epot = -20.3527813128758 | etot = -16.1905064612923 +846000 ekin = 2.34115102661114 | erot = 1.84579845054568 | epot = -20.4555275090995 | etot = -16.2685780319426 +847000 ekin = 2.41159198035498 | erot = 1.92961286076136 | epot = -20.5532540909635 | etot = -16.2120492498472 +848000 ekin = 2.31213774862364 | erot = 2.08278486795961 | epot = -20.6337560180199 | etot = -16.2388334014366 +849000 ekin = 2.30336620270337 | erot = 2.04122209248428 | epot = -20.6821032694947 | etot = -16.337514974307 +850000 ekin = 2.25629668954079 | erot = 2.1827089461388 | epot = -20.7098894953333 | etot = -16.2708838596537 +851000 ekin = 2.29979938433515 | erot = 2.41406540449276 | epot = -20.7044118358106 | etot = -15.9905470469827 +852000 ekin = 2.26390891815863 | erot = 2.16338375104434 | epot = -20.6569849671614 | etot = -16.2296922979585 +853000 ekin = 2.3042457110132 | erot = 1.99747184850866 | epot = -20.5998336497752 | etot = -16.2981160902533 +854000 ekin = 2.36419736155972 | erot = 2.06846824934106 | epot = -20.520428197268 | etot = -16.0877625863673 +855000 ekin = 2.34728028486118 | erot = 1.93310140619988 | epot = -20.4489431066125 | etot = -16.1685614155514 +856000 ekin = 2.30561682537924 | erot = 1.7468225593453 | epot = -20.3871281777724 | etot = -16.3346887930479 +857000 ekin = 2.27745448387241 | erot = 1.8357005645436 | epot = -20.3461722185286 | etot = -16.2330171701126 +858000 ekin = 2.36509593163739 | erot = 1.75581829580622 | epot = -20.3410559181935 | etot = -16.2201416907498 +859000 ekin = 2.38832938274202 | erot = 1.82095166272789 | epot = -20.3690417944097 | etot = -16.1597607489398 +860000 ekin = 2.52181162102415 | erot = 1.95420940577044 | epot = -20.4478015207824 | etot = -15.9717804939878 +861000 ekin = 2.62858628470805 | erot = 1.82148423675546 | epot = -20.5405427960154 | etot = -16.0904722745519 +862000 ekin = 2.69973060754157 | erot = 1.84887576916208 | epot = -20.6629551977625 | etot = -16.1143488210589 +863000 ekin = 2.90205526612768 | erot = 1.95053830347129 | epot = -20.7912991546469 | etot = -15.9387055850479 +864000 ekin = 3.12658816228353 | erot = 1.98858429691946 | epot = -20.8929021658137 | etot = -15.7777297066107 +865000 ekin = 3.16945674700278 | erot = 1.86291391059874 | epot = -20.9419832509068 | etot = -15.9096125933052 +866000 ekin = 3.25216934165267 | erot = 1.97645641207249 | epot = -20.9567552239706 | etot = -15.7281294702455 +867000 ekin = 3.24945037233148 | erot = 1.84073824549816 | epot = -20.9282973760204 | etot = -15.8381087581907 +868000 ekin = 3.07999788772602 | erot = 1.92805224835509 | epot = -20.8706478182266 | etot = -15.8625976821455 +869000 ekin = 2.91009138976889 | erot = 1.95537175968492 | epot = -20.7577406936838 | etot = -15.8922775442299 +870000 ekin = 2.98633737341202 | erot = 1.74639234614442 | epot = -20.6193203055685 | etot = -15.8865905860121 +871000 ekin = 2.82797025785024 | erot = 2.22216789862767 | epot = -20.5143766346289 | etot = -15.464238478151 +872000 ekin = 2.75225970096172 | erot = 2.04685014109657 | epot = -20.4197450563602 | etot = -15.6206352143019 +873000 ekin = 2.76508179334924 | erot = 2.07802391335104 | epot = -20.3610564187726 | etot = -15.5179507120724 +874000 ekin = 2.70667266094186 | erot = 2.03935635819039 | epot = -20.3167066993019 | etot = -15.5706776801697 +875000 ekin = 2.75331326518688 | erot = 1.87289863150028 | epot = -20.292306770067 | etot = -15.6660948733799 +876000 ekin = 2.71618421707282 | erot = 1.89637161128832 | epot = -20.2754390470299 | etot = -15.6628832186688 +877000 ekin = 2.71649559901529 | erot = 2.02021579600124 | epot = -20.2646771674143 | etot = -15.5279657723978 +878000 ekin = 2.62749245340177 | erot = 1.88626086619189 | epot = -20.2836933343753 | etot = -15.7699400147816 +879000 ekin = 2.74884813769532 | erot = 1.75263692861084 | epot = -20.3265216122721 | etot = -15.825036545966 +880000 ekin = 2.71696155764851 | erot = 1.77313431669203 | epot = -20.4055312116426 | etot = -15.9154353373021 +881000 ekin = 2.78382645158866 | erot = 1.81182472346909 | epot = -20.5191596774759 | etot = -15.9235085024182 +882000 ekin = 2.81130894387483 | erot = 2.09576450580344 | epot = -20.6489904734902 | etot = -15.741917023812 +883000 ekin = 2.88120316600177 | erot = 2.27294351864316 | epot = -20.7888871990869 | etot = -15.6347405144419 +884000 ekin = 2.90293873255418 | erot = 2.48430131570204 | epot = -20.9203204845733 | etot = -15.5330804363171 +885000 ekin = 2.83822193724187 | erot = 2.33567911137689 | epot = -21.0170580718189 | etot = -15.8431570232002 +886000 ekin = 2.7998012720849 | erot = 2.39879132479689 | epot = -21.1056755206453 | etot = -15.9070829237635 +887000 ekin = 2.84559753547726 | erot = 2.23279918443315 | epot = -21.1991974917508 | etot = -16.1208007718404 +888000 ekin = 2.78048788087585 | erot = 2.21910506766716 | epot = -21.2985745989316 | etot = -16.2989816503886 +889000 ekin = 2.69583578763831 | erot = 2.42515435306393 | epot = -21.3860199387971 | etot = -16.2650297980949 +890000 ekin = 2.58377832307697 | erot = 2.46763021206656 | epot = -21.4668454924047 | etot = -16.4154369572612 +891000 ekin = 2.65145947657508 | erot = 2.54188813630614 | epot = -21.5059683813091 | etot = -16.3126207684279 +892000 ekin = 2.67593216257319 | erot = 2.30931133615829 | epot = -21.5221026652215 | etot = -16.5368591664901 +893000 ekin = 2.6330379108205 | erot = 2.54633069672426 | epot = -21.5431241050785 | etot = -16.3637554975338 +894000 ekin = 2.67500961491507 | erot = 2.62632956964415 | epot = -21.5659877596139 | etot = -16.2646485750547 +895000 ekin = 2.69351100875758 | erot = 2.87253630615187 | epot = -21.5608314238547 | etot = -15.9947841089452 +896000 ekin = 2.73971679868459 | erot = 2.83751968369822 | epot = -21.5599160231106 | etot = -15.9826795407278 +897000 ekin = 2.59024156060526 | erot = 3.14999384860218 | epot = -21.516909346574 | etot = -15.7766739373666 +898000 ekin = 2.53463691976959 | erot = 2.86279041479464 | epot = -21.4480578810232 | etot = -16.050630546459 +899000 ekin = 2.47014007897646 | erot = 2.84092875108399 | epot = -21.4001318574341 | etot = -16.0890630273737 +900000 ekin = 2.41396838915947 | erot = 2.61119437719758 | epot = -21.317178398511 | etot = -16.2920156321539 +901000 ekin = 2.39217135029622 | erot = 2.42887884956516 | epot = -21.2332353575312 | etot = -16.4121851576699 +902000 ekin = 2.35623147489354 | erot = 2.68618153800008 | epot = -21.1565378225641 | etot = -16.1141248096705 +903000 ekin = 2.40445872766512 | erot = 2.65960453389372 | epot = -21.0523977096232 | etot = -15.9883344480644 +904000 ekin = 2.38268859333766 | erot = 2.75563140701159 | epot = -20.9254211676189 | etot = -15.7871011672696 +905000 ekin = 2.33859357853608 | erot = 2.74896960744455 | epot = -20.7865758980932 | etot = -15.6990127121126 +906000 ekin = 2.24424050125722 | erot = 2.67219011400459 | epot = -20.6458687615363 | etot = -15.7294381462745 +907000 ekin = 2.11959693796271 | erot = 2.6912404276246 | epot = -20.5218058154343 | etot = -15.710968449847 +908000 ekin = 1.99538198820417 | erot = 2.73765845183768 | epot = -20.4226667461155 | etot = -15.6896263060737 +909000 ekin = 1.91948050394767 | erot = 2.81092155873009 | epot = -20.3715084186363 | etot = -15.6411063559585 +910000 ekin = 1.86559504281192 | erot = 2.50422584066007 | epot = -20.354295857683 | etot = -15.9844749742111 +911000 ekin = 1.93700212306668 | erot = 2.70182168284124 | epot = -20.3630470394691 | etot = -15.7242232335612 +912000 ekin = 2.01297731830434 | erot = 2.59333468311027 | epot = -20.4016114857549 | etot = -15.7952994843403 +913000 ekin = 2.0489325329366 | erot = 2.44335563755548 | epot = -20.4595271951783 | etot = -15.9672390246862 +914000 ekin = 2.13522967419318 | erot = 2.04488675557111 | epot = -20.5157656558596 | etot = -16.3356492260953 +915000 ekin = 2.25766070321713 | erot = 1.97393473123362 | epot = -20.6118613948288 | etot = -16.3802659603781 +916000 ekin = 2.21223622141694 | erot = 2.10345838304615 | epot = -20.754410524097 | etot = -16.4387159196339 +917000 ekin = 2.40651996373664 | erot = 1.99495172303677 | epot = -20.9073170323362 | etot = -16.5058453455628 +918000 ekin = 2.53615730988932 | erot = 2.01638663666291 | epot = -21.0405250498178 | etot = -16.4879811032656 +919000 ekin = 2.65442530964963 | erot = 2.0876213593564 | epot = -21.1719711454817 | etot = -16.4299244764757 +920000 ekin = 2.77534951778639 | erot = 2.11359099299367 | epot = -21.2829839475272 | etot = -16.3940434367471 +921000 ekin = 2.91643782768224 | erot = 2.28215815938558 | epot = -21.3691506671587 | etot = -16.1705546800909 +922000 ekin = 2.95567400678637 | erot = 1.92472032500007 | epot = -21.4077235507563 | etot = -16.5273292189699 +923000 ekin = 2.96258486890882 | erot = 1.54690402842668 | epot = -21.3938794896988 | etot = -16.8843905923633 +924000 ekin = 2.92134762613199 | erot = 1.70996406555928 | epot = -21.3449839261311 | etot = -16.7136722344398 +925000 ekin = 2.84653903464864 | erot = 1.92806668586779 | epot = -21.2846325911284 | etot = -16.510026870612 +926000 ekin = 2.90254254848598 | erot = 2.07364806195529 | epot = -21.2015262749286 | etot = -16.2253356644873 +927000 ekin = 2.91395828926413 | erot = 2.18066099339461 | epot = -21.1200145418047 | etot = -16.025395259146 +928000 ekin = 2.84512894116016 | erot = 2.48044872209653 | epot = -20.9999796012787 | etot = -15.674401938022 +929000 ekin = 2.66004165976114 | erot = 2.51779336046962 | epot = -20.8727093584572 | etot = -15.6948743382265 +930000 ekin = 2.6545466782943 | erot = 2.57569274741415 | epot = -20.7556416891754 | etot = -15.525402263467 +931000 ekin = 2.67423829393946 | erot = 2.88523636975912 | epot = -20.6759551108841 | etot = -15.1164804471855 +932000 ekin = 2.62616449296355 | erot = 2.54798110237941 | epot = -20.6086291233289 | etot = -15.4344835279859 +933000 ekin = 2.69383973705599 | erot = 2.46235736679314 | epot = -20.54561258563 | etot = -15.3894154817809 +934000 ekin = 2.7677642743111 | erot = 2.34101084786864 | epot = -20.4809121018787 | etot = -15.372136979699 +935000 ekin = 2.72642510821387 | erot = 2.35916469229107 | epot = -20.4211165962346 | etot = -15.3355267957297 +936000 ekin = 2.79063797840949 | erot = 2.07475414089715 | epot = -20.39575856362 | etot = -15.5303664443133 +937000 ekin = 2.98467692526026 | erot = 1.99225267024811 | epot = -20.4024768464832 | etot = -15.4255472509748 +938000 ekin = 3.04156516590336 | erot = 2.13242133064027 | epot = -20.3998804937967 | etot = -15.2258939972531 +939000 ekin = 3.07943235169643 | erot = 2.19292802789746 | epot = -20.377015696722 | etot = -15.1046553171281 +940000 ekin = 3.11450220916332 | erot = 2.05442808222263 | epot = -20.3386629407116 | etot = -15.1697326493257 +941000 ekin = 3.1673723572625 | erot = 2.43340006549779 | epot = -20.2760521197247 | etot = -14.6752796969644 +942000 ekin = 3.27652888451167 | erot = 2.44054387582516 | epot = -20.166869297399 | etot = -14.4497965370622 +943000 ekin = 3.13900445201123 | erot = 2.17030471354849 | epot = -20.0267063041317 | etot = -14.7173971385719 +944000 ekin = 3.1157767971462 | erot = 1.97360877260966 | epot = -19.8813791244596 | etot = -14.7919935547037 +945000 ekin = 3.14747064890608 | erot = 1.73794156198925 | epot = -19.7300654287798 | etot = -14.8446532178844 +946000 ekin = 3.06500562594212 | erot = 1.59817914677196 | epot = -19.583631952048 | etot = -14.9204471793339 +947000 ekin = 3.06465941958365 | erot = 1.56394261373887 | epot = -19.4474159558771 | etot = -14.8188139225545 +948000 ekin = 3.07897503028523 | erot = 1.70141948030273 | epot = -19.3426980410741 | etot = -14.5623035304862 +949000 ekin = 2.87406117522931 | erot = 1.60153309498399 | epot = -19.2597755284806 | etot = -14.7841812582673 +950000 ekin = 2.84815804599153 | erot = 1.42715690189525 | epot = -19.2062266956084 | etot = -14.9309117477216 +951000 ekin = 2.78080942687086 | erot = 1.40916295422846 | epot = -19.1985529774584 | etot = -15.0085805963591 +952000 ekin = 2.67957446722124 | erot = 1.63751827005628 | epot = -19.1980674262524 | etot = -14.8809746889749 +953000 ekin = 2.69185316270153 | erot = 1.85029680460109 | epot = -19.2316635394469 | etot = -14.6895135721443 +954000 ekin = 2.64694034455339 | erot = 2.11448729476975 | epot = -19.2977991859254 | etot = -14.5363715466022 +955000 ekin = 2.7322410216683 | erot = 2.37373438935249 | epot = -19.3777324828793 | etot = -14.2717570718585 +956000 ekin = 2.80603458830182 | erot = 2.32665803374312 | epot = -19.4665233130259 | etot = -14.3338306909809 +957000 ekin = 2.73176061747242 | erot = 2.74205596111945 | epot = -19.524980257439 | etot = -14.0511636788471 +958000 ekin = 2.77128367160854 | erot = 2.7068271152838 | epot = -19.5522596510488 | etot = -14.0741488641564 +959000 ekin = 2.78347654187748 | erot = 2.83940326280202 | epot = -19.5446437759979 | etot = -13.9217639713184 +960000 ekin = 2.63327999524026 | erot = 3.22713050217908 | epot = -19.5114109332442 | etot = -13.6510004358248 +961000 ekin = 2.53039842552575 | erot = 3.04837954363138 | epot = -19.4489807736386 | etot = -13.8702028044814 +962000 ekin = 2.42158405784754 | erot = 2.73764467618047 | epot = -19.3495392486846 | etot = -14.1903105146565 +963000 ekin = 2.35599553488279 | erot = 2.6817144021742 | epot = -19.2270773719362 | etot = -14.1893674348792 +964000 ekin = 2.25219457310711 | erot = 2.53224426940242 | epot = -19.0939126804605 | etot = -14.309473837951 +965000 ekin = 2.15172115406625 | erot = 2.5074263640058 | epot = -18.9655401098707 | etot = -14.3063925917986 +966000 ekin = 2.08836430745346 | erot = 2.10683533981445 | epot = -18.8740473984177 | etot = -14.6788477511498 +967000 ekin = 2.12576981405844 | erot = 2.10554977010184 | epot = -18.8222969563416 | etot = -14.5909773721813 +968000 ekin = 2.12924016899234 | erot = 1.91970464113304 | epot = -18.8304973626992 | etot = -14.7815525525738 +969000 ekin = 2.1744253034851 | erot = 2.16512140090506 | epot = -18.8673529233365 | etot = -14.5278062189463 +970000 ekin = 2.18162741265382 | erot = 2.2450862581363 | epot = -18.9283529594566 | etot = -14.5016392886665 +971000 ekin = 2.1872176318087 | erot = 2.43353633304448 | epot = -19.0277599144665 | etot = -14.4070059496134 +972000 ekin = 2.27055464044586 | erot = 2.03487376489175 | epot = -19.1290866187785 | etot = -14.8236582134409 +973000 ekin = 2.33904004605626 | erot = 2.15183928912462 | epot = -19.236661180688 | etot = -14.7457818455071 +974000 ekin = 2.4184780784401 | erot = 2.34438108784234 | epot = -19.363118432485 | etot = -14.6002592662026 +975000 ekin = 2.46206146488029 | erot = 2.35624199281868 | epot = -19.4736098152928 | etot = -14.6553063575938 +976000 ekin = 2.52456876946494 | erot = 2.27614398265605 | epot = -19.5649915573495 | etot = -14.7642788052285 +977000 ekin = 2.60637564524354 | erot = 2.0709370581174 | epot = -19.6101874123253 | etot = -14.9328747089644 +978000 ekin = 2.61064269721012 | erot = 2.07202524510603 | epot = -19.629445129702 | etot = -14.9467771873859 +979000 ekin = 2.55561169069455 | erot = 2.18920140876201 | epot = -19.6166445363163 | etot = -14.8718314368598 +980000 ekin = 2.56864273287448 | erot = 2.03395631393317 | epot = -19.6174963338761 | etot = -15.0148972870685 +981000 ekin = 2.66191070196827 | erot = 2.16659095907662 | epot = -19.6250525963019 | etot = -14.796550935257 +982000 ekin = 2.61731281327832 | erot = 2.24698893274267 | epot = -19.5974740187255 | etot = -14.7331722727045 +983000 ekin = 2.54225454915894 | erot = 2.48926874093348 | epot = -19.574589405176 | etot = -14.5430661150836 +984000 ekin = 2.50737950403369 | erot = 3.03624865807153 | epot = -19.5602814074028 | etot = -14.0166532452976 +985000 ekin = 2.4152528155718 | erot = 2.79336029081699 | epot = -19.5475069203678 | etot = -14.338893813979 +986000 ekin = 2.43517645380153 | erot = 2.71437828234941 | epot = -19.5659718124285 | etot = -14.4164170762775 +987000 ekin = 2.43635014041239 | erot = 2.70440060167985 | epot = -19.6117703785916 | etot = -14.4710196364993 +988000 ekin = 2.47223137990792 | erot = 3.04012548433553 | epot = -19.6728653378115 | etot = -14.1605084735681 +989000 ekin = 2.57461282782935 | erot = 2.65740086918251 | epot = -19.7180658550368 | etot = -14.4860521580249 +990000 ekin = 2.67359097736954 | erot = 2.60446843961488 | epot = -19.7676266504478 | etot = -14.4895672334633 +991000 ekin = 2.70426688173755 | erot = 2.7885730625978 | epot = -19.8289708825354 | etot = -14.3361309382 +992000 ekin = 2.77048904951462 | erot = 3.05066231165514 | epot = -19.9192662402538 | etot = -14.098114879084 +993000 ekin = 2.82958876080153 | erot = 2.65444369525357 | epot = -20.003093866259 | etot = -14.5190614102039 +994000 ekin = 2.90170601691379 | erot = 2.65673610083181 | epot = -20.0686975144619 | etot = -14.5102553967163 +995000 ekin = 3.03287923230155 | erot = 2.4030603061795 | epot = -20.1412612654696 | etot = -14.7053217269886 +996000 ekin = 3.01357004889798 | erot = 1.93970518668622 | epot = -20.2209046421976 | etot = -15.2676294066134 +997000 ekin = 3.16382267303453 | erot = 2.09671009945294 | epot = -20.2929309039614 | etot = -15.0323981314739 +998000 ekin = 3.20277399494172 | erot = 2.11561017239343 | epot = -20.3495982469412 | etot = -15.031214079606 +999000 ekin = 3.17166482809408 | erot = 2.14572404428889 | epot = -20.3850372708089 | etot = -15.0676483984259 +1000000 ekin = 3.19306217159923 | erot = 2.4662195338148 | epot = -20.4393210047148 | etot = -14.7800392993008 + 1000000 0.14191387 -1.3172305 0.039772926 -1.0778912 3.1162031e-05 64000 +Loop time of 26.6858 on 4 procs for 1000000 steps with 16 atoms + +Performance: 32376.758 tau/day, 37473.099 timesteps/s +99.3% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 14.528 | 16.117 | 17.521 | 33.5 | 60.39 +Bond | 0.3756 | 0.45654 | 0.49823 | 7.2 | 1.71 +Neigh | 0.011905 | 0.011947 | 0.011963 | 0.0 | 0.04 +Comm | 2.5182 | 2.6398 | 2.7955 | 7.0 | 9.89 +Output | 0.11297 | 0.11799 | 0.1276 | 1.7 | 0.44 +Modify | 1.4585 | 1.5893 | 1.7174 | 8.8 | 5.96 +Other | | 5.754 | | | 21.56 + +Nlocal: 4.00000 ave 5 max 3 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Nghost: 12.0000 ave 13 max 11 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Neighs: 49.5000 ave 60 max 39 min +Histogram: 2 0 0 0 0 0 0 0 0 2 + +Total # of neighbors = 198 +Ave neighs/atom = 12.375000 +Ave special neighs/atom = 3.7500000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.2.* nocoeff +System init for write_data ... +Total wall time: 0:00:26 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.1 deleted file mode 100644 index 18df3a8299..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.1 +++ /dev/null @@ -1,1184 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 2 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex2 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 16 atoms - reading velocities ... - 16 velocities - 16 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 13 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.002 seconds - -set atom * mass 3.1575 - 16 settings made for mass - -group all type 1 4 -16 atoms in group all - -# oxDNA2 bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA2 pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 -pair_coeff * * oxdna2/dh 0.1 1.0 0.815 - -# NVE ensemble -#fix 1 all nve/dot -fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -fix 1 all nve/dotc/langevin 0.1 ${T} 0.03 457145 angmom 10 -fix 1 all nve/dotc/langevin 0.1 0.1 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 2.6274048 - ghost atom cutoff = 2.6274048 - binsize = 1.3137024, bins = 31 31 31 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 2.627404783947349 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -24.419271289937 | etot = -24.419271289937 -Per MPI rank memory allocation (min/avg/max) = 8.146 | 8.146 | 8.146 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.5358787 0.0096742456 -1.5262045 1.0127369e-05 -1000 ekin = 1.54282272464468 | erot = 1.71757897250772 | epot = -24.4403527731341 | etot = -21.1799510759817 -2000 ekin = 1.86109566690716 | erot = 1.93804145796026 | epot = -24.3759816748265 | etot = -20.5768445499591 -3000 ekin = 2.68769182431188 | erot = 2.14559269500086 | epot = -24.2916556822451 | etot = -19.4583711629324 -4000 ekin = 2.04710303757243 | erot = 1.48774072590987 | epot = -24.190371461807 | etot = -20.6555276983247 -5000 ekin = 1.77654023802719 | erot = 2.53418650522101 | epot = -24.1246365663843 | etot = -19.8139098231361 -6000 ekin = 3.12253137872527 | erot = 2.04028266818831 | epot = -24.0491248750916 | etot = -18.8863108281781 -7000 ekin = 3.22418765752177 | erot = 2.72037570174022 | epot = -23.9458569915548 | etot = -18.0012936322928 -8000 ekin = 2.83204202112963 | erot = 2.67060276413776 | epot = -23.9211291529766 | etot = -18.4184843677092 -9000 ekin = 2.69585642754481 | erot = 2.59559820250212 | epot = -23.8340823338302 | etot = -18.5426277037833 -10000 ekin = 2.66058119525512 | erot = 1.95965933336077 | epot = -23.7132443170725 | etot = -19.0930037884567 -11000 ekin = 2.34346978235591 | erot = 2.0608750207871 | epot = -23.5779637301072 | etot = -19.1736189269642 -12000 ekin = 2.71430148816282 | erot = 2.08352509995717 | epot = -23.4639027443831 | etot = -18.6660761562631 -13000 ekin = 2.61978682102879 | erot = 2.37135270083347 | epot = -23.3602247027812 | etot = -18.3690851809189 -14000 ekin = 3.07648218347461 | erot = 2.513719767243 | epot = -23.2345584968309 | etot = -17.6443565461133 -15000 ekin = 2.98155804409324 | erot = 1.87766202539412 | epot = -23.0833749664029 | etot = -18.2241548969156 -16000 ekin = 2.18215330648447 | erot = 2.12621179836828 | epot = -22.9601160092383 | etot = -18.6517509043856 -17000 ekin = 1.85636180329758 | erot = 2.31208745603367 | epot = -22.8022922969143 | etot = -18.633843037583 -18000 ekin = 2.26768559168017 | erot = 1.2389450409061 | epot = -22.668242963885 | etot = -19.1616123312987 -19000 ekin = 2.41605854545852 | erot = 2.44791952321404 | epot = -22.5387095337131 | etot = -17.6747314650405 -20000 ekin = 2.51175765558337 | erot = 2.15047735899709 | epot = -22.3909493829452 | etot = -17.7287143683647 -21000 ekin = 2.9915110961596 | erot = 2.41132105778464 | epot = -22.5047205397251 | etot = -17.1018883857809 -22000 ekin = 3.06067007914886 | erot = 1.83986675392832 | epot = -22.6049739626141 | etot = -17.7044371295369 -23000 ekin = 2.66061083480474 | erot = 2.22251362834379 | epot = -22.5979829967718 | etot = -17.7148585336233 -24000 ekin = 2.65745533322327 | erot = 2.79344397300952 | epot = -22.5688422615674 | etot = -17.1179429553346 -25000 ekin = 2.30064465907917 | erot = 2.20975367009042 | epot = -22.5633453862602 | etot = -18.0529470570906 -26000 ekin = 1.6282588103248 | erot = 2.51914272742421 | epot = -22.6015006270016 | etot = -18.4540990892526 -27000 ekin = 1.76021840072103 | erot = 3.70719293889859 | epot = -22.6409357152274 | etot = -17.1735243756077 -28000 ekin = 2.28064774169505 | erot = 2.34192414128161 | epot = -22.7124772012735 | etot = -18.0899053182968 -29000 ekin = 2.05883865245349 | erot = 1.85387249117169 | epot = -22.7242388348361 | etot = -18.811527691211 -30000 ekin = 2.41090888362676 | erot = 1.86304539977924 | epot = -22.6876650006964 | etot = -18.4137107172904 -31000 ekin = 2.76955959719985 | erot = 2.74117025737249 | epot = -22.6962463526981 | etot = -17.1855164981257 -32000 ekin = 2.08562644954365 | erot = 2.81609166367558 | epot = -22.7309387973059 | etot = -17.8292206840867 -33000 ekin = 2.08306771838837 | erot = 3.6412168312574 | epot = -22.671701882331 | etot = -16.9474173326852 -34000 ekin = 2.32648544880974 | erot = 3.09480128654123 | epot = -22.5637155764017 | etot = -17.1424288410507 -35000 ekin = 2.32492461599899 | erot = 2.02549181832456 | epot = -22.4811871522455 | etot = -18.1307707179219 -36000 ekin = 1.9160219633488 | erot = 1.97655634076097 | epot = -22.3849871062612 | etot = -18.4924088021514 -37000 ekin = 1.57338784336504 | erot = 2.62872199467344 | epot = -22.3528406869297 | etot = -18.1507308488912 -38000 ekin = 2.21547906806797 | erot = 2.89630123965964 | epot = -22.3056616105138 | etot = -17.1938813027862 -39000 ekin = 2.55049061085212 | erot = 2.46486573403212 | epot = -22.2602280028032 | etot = -17.244871657919 -40000 ekin = 2.25628181110086 | erot = 1.87515483835113 | epot = -22.2878959489406 | etot = -18.1564592994886 -41000 ekin = 2.46478791133629 | erot = 2.50742704532316 | epot = -22.3614598606398 | etot = -17.3892449039804 -42000 ekin = 2.69217693496336 | erot = 2.04021031621289 | epot = -22.3505245167544 | etot = -17.6181372655782 -43000 ekin = 2.40211339309477 | erot = 1.6668978842528 | epot = -22.353509525279 | etot = -18.2844982479314 -44000 ekin = 2.30891568897327 | erot = 2.40213237626172 | epot = -22.3871831090405 | etot = -17.6761350438055 -45000 ekin = 1.83275065976638 | erot = 2.26068140262528 | epot = -22.4994702091406 | etot = -18.406038146749 -46000 ekin = 1.97585087518641 | erot = 3.0186371421683 | epot = -22.4902643909032 | etot = -17.4957763735485 -47000 ekin = 1.30702141485601 | erot = 1.99592830992523 | epot = -22.4679405795691 | etot = -19.1649908547879 -48000 ekin = 2.58893650014613 | erot = 1.90050780837457 | epot = -22.5072015009757 | etot = -18.017757192455 -49000 ekin = 2.30293607053961 | erot = 2.71885537559561 | epot = -22.5026363414396 | etot = -17.4808448953044 -50000 ekin = 2.47053682632632 | erot = 3.4216531112208 | epot = -22.415032340787 | etot = -16.5228424032399 -51000 ekin = 2.70972992123879 | erot = 1.4301791663753 | epot = -22.3056750708571 | etot = -18.165765983243 -52000 ekin = 3.01390456844682 | erot = 1.97787470370191 | epot = -22.2827481318966 | etot = -17.2909688597479 -53000 ekin = 2.43796472406694 | erot = 4.25598325759163 | epot = -22.2611961774508 | etot = -15.5672481957922 -54000 ekin = 2.47286167616923 | erot = 2.3677730007818 | epot = -22.243519577301 | etot = -17.40288490035 -55000 ekin = 2.25994505035907 | erot = 1.91872181759988 | epot = -22.2996523252175 | etot = -18.1209854572585 -56000 ekin = 2.3461223108806 | erot = 2.20461695689782 | epot = -22.370356062429 | etot = -17.8196167946505 -57000 ekin = 2.51587877543148 | erot = 2.87451767129977 | epot = -22.4723343857415 | etot = -17.0819379390103 -58000 ekin = 2.49925674722554 | erot = 2.80569508565646 | epot = -22.5303780310556 | etot = -17.2254261981736 -59000 ekin = 2.75080755995156 | erot = 2.17181245800364 | epot = -22.5861118023788 | etot = -17.6634917844236 -60000 ekin = 3.2849676836621 | erot = 1.98487748777051 | epot = -22.5789662701264 | etot = -17.3091210986938 -61000 ekin = 2.4147550327795 | erot = 1.80972454908232 | epot = -22.5207352876114 | etot = -18.2962557057495 -62000 ekin = 2.82665653061546 | erot = 1.68517769072779 | epot = -22.4078181490349 | etot = -17.8959839276917 -63000 ekin = 3.70002607874218 | erot = 1.92704686824234 | epot = -22.2626867402007 | etot = -16.6356137932161 -64000 ekin = 3.61736288982706 | erot = 3.03600982585025 | epot = -22.2659045523542 | etot = -15.6125318366769 -65000 ekin = 3.40363639902008 | erot = 3.89044870099903 | epot = -22.2274777177663 | etot = -14.9333926177472 -66000 ekin = 2.94418257190202 | erot = 2.45963190668857 | epot = -22.1363667635561 | etot = -16.7325522849655 -67000 ekin = 2.60477940218663 | erot = 2.10479080523513 | epot = -22.038362895265 | etot = -17.3287926878432 -68000 ekin = 2.57158327795866 | erot = 2.46431755410219 | epot = -22.0244560205645 | etot = -16.9885551885036 -69000 ekin = 2.43845102321476 | erot = 2.85996177461682 | epot = -22.0620804569545 | etot = -16.7636676591229 -70000 ekin = 3.08348233524936 | erot = 2.49640850205841 | epot = -22.1433186271748 | etot = -16.563427789867 -71000 ekin = 2.5576093427884 | erot = 2.50957641127969 | epot = -22.2697187660694 | etot = -17.2025330120013 -72000 ekin = 1.7831483145096 | erot = 2.52806261120156 | epot = -22.3815818044114 | etot = -18.0703708787002 -73000 ekin = 1.86053585113659 | erot = 2.3350857968737 | epot = -22.4387359493251 | etot = -18.2431143013148 -74000 ekin = 3.14016175467449 | erot = 2.13186507521504 | epot = -22.447062887188 | etot = -17.1750360572984 -75000 ekin = 2.60368665360454 | erot = 2.18680067560206 | epot = -22.4438479629936 | etot = -17.653360633787 -76000 ekin = 1.9633244939079 | erot = 1.96057322365503 | epot = -22.4704022140376 | etot = -18.5465044964747 -77000 ekin = 2.09841107775422 | erot = 2.1471460143176 | epot = -22.4970899098551 | etot = -18.2515328177832 -78000 ekin = 2.49484391610508 | erot = 2.50538853212234 | epot = -22.4472882748805 | etot = -17.4470558266531 -79000 ekin = 3.10058476014063 | erot = 2.47637061915656 | epot = -22.3558276087081 | etot = -16.7788722294109 -80000 ekin = 2.52610159631253 | erot = 1.89085194000216 | epot = -22.2951000287249 | etot = -17.8781464924102 -81000 ekin = 2.34286765202483 | erot = 2.2376810918426 | epot = -22.2933034850974 | etot = -17.71275474123 -82000 ekin = 1.55517061572748 | erot = 2.02195112736337 | epot = -22.2470532436032 | etot = -18.6699315005123 -83000 ekin = 2.27421747802727 | erot = 3.34135950792192 | epot = -22.2406089881454 | etot = -16.6250320021963 -84000 ekin = 2.91603956429582 | erot = 2.09861057599124 | epot = -22.2305865946953 | etot = -17.2159364544083 -85000 ekin = 3.17172070756641 | erot = 2.91883241347319 | epot = -22.2381339647476 | etot = -16.147580843708 -86000 ekin = 3.48918734688943 | erot = 2.79711547316344 | epot = -22.2890012778608 | etot = -16.0026984578079 -87000 ekin = 3.648834525211 | erot = 2.30637362835037 | epot = -22.2817018896603 | etot = -16.3264937360989 -88000 ekin = 3.16156585935194 | erot = 2.24503314085539 | epot = -22.2225172277202 | etot = -16.8159182275129 -89000 ekin = 3.32092350591891 | erot = 1.79966969251215 | epot = -22.1549711261911 | etot = -17.03437792776 -90000 ekin = 2.41383485147934 | erot = 2.22694238351369 | epot = -21.9352492588881 | etot = -17.294472023895 -91000 ekin = 1.87769980964557 | erot = 2.50898156232204 | epot = -21.766796868726 | etot = -17.3801154967584 -92000 ekin = 2.06420930396832 | erot = 2.23853979300919 | epot = -21.6902828653619 | etot = -17.3875337683844 -93000 ekin = 1.94960374605101 | erot = 3.00245663654886 | epot = -21.6771969695753 | etot = -16.7251365869754 -94000 ekin = 2.07633340602167 | erot = 3.38669471112637 | epot = -21.7794316475531 | etot = -16.3164035304051 -95000 ekin = 2.09307446139111 | erot = 2.0811295310408 | epot = -21.9165143849258 | etot = -17.7423103924939 -96000 ekin = 2.66782345206074 | erot = 1.87453507536254 | epot = -21.9748225431664 | etot = -17.4324640157432 -97000 ekin = 1.93962158410337 | erot = 2.81228342262069 | epot = -22.0301811391172 | etot = -17.2782761323932 -98000 ekin = 1.98651083318125 | erot = 2.05358325550364 | epot = -22.1050988415859 | etot = -18.065004752901 -99000 ekin = 2.50729461715162 | erot = 3.55227490812968 | epot = -22.2148658268239 | etot = -16.1552963015426 -100000 ekin = 1.87954195221303 | erot = 2.38994009743578 | epot = -22.3826768493088 | etot = -18.11319479966 -101000 ekin = 1.66917867676911 | erot = 3.61296864361924 | epot = -22.4122779848186 | etot = -17.1301306644303 -102000 ekin = 1.63707836649616 | erot = 3.33958463197985 | epot = -22.3664797586262 | etot = -17.3898167601502 -103000 ekin = 2.00216132457488 | erot = 2.34409134088738 | epot = -22.338100531932 | etot = -17.9918478664698 -104000 ekin = 2.03704734920245 | erot = 2.74903331701925 | epot = -22.3478074938274 | etot = -17.5617268276057 -105000 ekin = 1.85601249652044 | erot = 2.00020228548217 | epot = -22.2937670136133 | etot = -18.4375522316107 -106000 ekin = 1.70582694215149 | erot = 1.90992656339968 | epot = -22.3252996603125 | etot = -18.7095461547614 -107000 ekin = 2.61183521416777 | erot = 1.56756438600251 | epot = -22.3815585845482 | etot = -18.2021589843779 -108000 ekin = 2.13345133147477 | erot = 2.1967764492834 | epot = -22.2873637709221 | etot = -17.9571359901639 -109000 ekin = 2.23517703897427 | erot = 2.12289589403282 | epot = -22.1519605830327 | etot = -17.7938876500256 -110000 ekin = 1.66340581480182 | erot = 2.52573727214601 | epot = -22.1681066766204 | etot = -17.9789635896725 -111000 ekin = 2.28529122032929 | erot = 2.24044883756493 | epot = -22.1711980210611 | etot = -17.6454579631669 -112000 ekin = 2.60405127944181 | erot = 2.43646974545776 | epot = -22.1582164438795 | etot = -17.11769541898 -113000 ekin = 2.40208651796091 | erot = 3.06270264515793 | epot = -22.1587051510952 | etot = -16.6939159879764 -114000 ekin = 2.34302229470158 | erot = 2.30426477746864 | epot = -22.1439772736805 | etot = -17.4966902015103 -115000 ekin = 1.69616053999229 | erot = 3.11049212247371 | epot = -22.1736739038021 | etot = -17.3670212413361 -116000 ekin = 1.51961045217859 | erot = 2.22203808801726 | epot = -22.2355447345615 | etot = -18.4938961943657 -117000 ekin = 1.69355164638512 | erot = 2.33913072714747 | epot = -22.2671845473364 | etot = -18.2345021738038 -118000 ekin = 2.1960991163694 | erot = 2.33815079858085 | epot = -22.2453229868293 | etot = -17.7110730718791 -119000 ekin = 2.55982892523823 | erot = 2.47378749563683 | epot = -22.2824155531543 | etot = -17.2487991322793 -120000 ekin = 1.76091001620491 | erot = 2.1741296357231 | epot = -22.2369948282136 | etot = -18.3019551762855 -121000 ekin = 2.80671234452976 | erot = 2.30128219469303 | epot = -22.2260257995407 | etot = -17.1180312603179 -122000 ekin = 3.23136903340218 | erot = 3.30036165167127 | epot = -22.2515019863338 | etot = -15.7197713012603 -123000 ekin = 2.8561114897291 | erot = 3.24294818442618 | epot = -22.2018342366988 | etot = -16.1027745625435 -124000 ekin = 2.14842162472016 | erot = 2.7693802805091 | epot = -22.0303368839078 | etot = -17.1125349786785 -125000 ekin = 1.83317468651689 | erot = 1.37271219749613 | epot = -21.8885764971633 | etot = -18.6826896131502 -126000 ekin = 2.45181092117661 | erot = 3.08753876167365 | epot = -21.8912653158441 | etot = -16.3519156329938 -127000 ekin = 2.39800706812202 | erot = 2.35255982488708 | epot = -21.8786845575463 | etot = -17.1281176645372 -128000 ekin = 2.74926309150919 | erot = 1.83113656927751 | epot = -21.8947833530885 | etot = -17.3143836923018 -129000 ekin = 2.71720149007507 | erot = 2.89223888586493 | epot = -21.888738829699 | etot = -16.279298453759 -130000 ekin = 3.27436175016883 | erot = 2.48649258221715 | epot = -21.9126051843054 | etot = -16.1517508519195 -131000 ekin = 2.72616313783309 | erot = 2.50345885992118 | epot = -21.9360367126892 | etot = -16.7064147149349 -132000 ekin = 2.62485920187038 | erot = 3.40341903141799 | epot = -21.9656374341347 | etot = -15.9373592008463 -133000 ekin = 2.0325764784668 | erot = 2.89126702157637 | epot = -21.9394295827134 | etot = -17.0155860826702 -134000 ekin = 1.62930019559461 | erot = 1.67001909466596 | epot = -21.900605038258 | etot = -18.6012857479974 -135000 ekin = 2.45037614605464 | erot = 2.12340550038047 | epot = -21.8772864662343 | etot = -17.3035048197992 -136000 ekin = 2.29225558372926 | erot = 3.05501283629331 | epot = -21.7842467542129 | etot = -16.4369783341904 -137000 ekin = 2.71619061857373 | erot = 2.45779692364663 | epot = -21.6204232926258 | etot = -16.4464357504054 -138000 ekin = 3.30410447428295 | erot = 1.73171704445596 | epot = -21.609821441089 | etot = -16.57399992235 -139000 ekin = 2.77055079544968 | erot = 1.72559500013771 | epot = -21.7720020827881 | etot = -17.2758562872007 -140000 ekin = 2.72528465654122 | erot = 2.46411811431296 | epot = -21.8660237331067 | etot = -16.6766209622525 -141000 ekin = 2.78705568892822 | erot = 2.44850479765533 | epot = -21.8731300806739 | etot = -16.6375695940903 -142000 ekin = 3.51931490090282 | erot = 3.48544343137045 | epot = -21.8228511941687 | etot = -14.8180928618954 -143000 ekin = 2.59719776759383 | erot = 2.02350560733262 | epot = -21.8096443263653 | etot = -17.1889409514388 -144000 ekin = 3.74308404358447 | erot = 3.03564456771536 | epot = -21.8085900408448 | etot = -15.029861429545 -145000 ekin = 3.62659723153861 | erot = 2.70926904415538 | epot = -21.7250027836497 | etot = -15.3891365079557 -146000 ekin = 3.87407885398524 | erot = 2.49638573472853 | epot = -21.7001271601514 | etot = -15.3296625714376 -147000 ekin = 3.27961687549993 | erot = 2.08263345163676 | epot = -21.5857141934645 | etot = -16.2234638663278 -148000 ekin = 2.49678519214407 | erot = 1.65068656472224 | epot = -21.3397240410766 | etot = -17.1922522842103 -149000 ekin = 2.74324871192595 | erot = 2.27422609775036 | epot = -21.1619902393526 | etot = -16.1445154296762 -150000 ekin = 2.63493686559431 | erot = 2.89891054679402 | epot = -21.0669519346708 | etot = -15.5331045222825 -151000 ekin = 2.08067982512823 | erot = 2.11598312084942 | epot = -20.9754508944265 | etot = -16.7787879484489 -152000 ekin = 2.41049293269485 | erot = 2.60865966337995 | epot = -20.8324522723453 | etot = -15.8132996762705 -153000 ekin = 2.11771886644781 | erot = 2.2612193836258 | epot = -20.8689010813857 | etot = -16.4899628313121 -154000 ekin = 2.34048807401985 | erot = 2.61000659349907 | epot = -20.9736996291527 | etot = -16.0232049616338 -155000 ekin = 2.06125568994135 | erot = 3.02657060603564 | epot = -20.9977701757737 | etot = -15.9099438797968 -156000 ekin = 2.03103875451807 | erot = 3.1844861824748 | epot = -20.8318196513999 | etot = -15.616294714407 -157000 ekin = 2.34991277428576 | erot = 1.91129748769811 | epot = -20.8011437796089 | etot = -16.539933517625 -158000 ekin = 2.16899004769298 | erot = 2.47810803275591 | epot = -20.8955785127325 | etot = -16.2484804322837 -159000 ekin = 2.86703441642079 | erot = 2.2901833721065 | epot = -21.0162479016245 | etot = -15.8590301130972 -160000 ekin = 2.19810986416329 | erot = 2.37335510649732 | epot = -21.1025044999173 | etot = -16.5310395292567 -161000 ekin = 2.13983549244144 | erot = 2.44280202062021 | epot = -21.204645979403 | etot = -16.6220084663414 -162000 ekin = 1.75007978204456 | erot = 2.67089623079416 | epot = -21.2587160217762 | etot = -16.8377400089375 -163000 ekin = 2.22497705720617 | erot = 2.03752809750894 | epot = -21.4065038175883 | etot = -17.1439986628732 -164000 ekin = 2.74622171092286 | erot = 1.42968886006587 | epot = -21.5464343754361 | etot = -17.3705238044474 -165000 ekin = 2.65892253082074 | erot = 2.28893669468687 | epot = -21.5542883684299 | etot = -16.6064291429223 -166000 ekin = 3.28497940714848 | erot = 2.38441021083685 | epot = -21.4831502209917 | etot = -15.8137606030064 -167000 ekin = 3.03302043173269 | erot = 2.0371493034983 | epot = -21.552220768162 | etot = -16.482051032931 -168000 ekin = 3.16647476932142 | erot = 1.85328814856002 | epot = -21.6005552665342 | etot = -16.5807923486528 -169000 ekin = 2.24705103875432 | erot = 2.66949801663851 | epot = -21.5155875234663 | etot = -16.5990384680735 -170000 ekin = 2.43835864940733 | erot = 2.49651566577791 | epot = -21.3706724967315 | etot = -16.4357981815463 -171000 ekin = 1.91174741927943 | erot = 2.39538037263751 | epot = -21.2808048923853 | etot = -16.9736771004683 -172000 ekin = 2.88344950373025 | erot = 3.21569142102288 | epot = -21.2429879136862 | etot = -15.1438469889331 -173000 ekin = 2.75630897924877 | erot = 2.14100943461477 | epot = -21.2680309804945 | etot = -16.370712566631 -174000 ekin = 2.45420058414632 | erot = 2.2332035837858 | epot = -21.3153962561354 | etot = -16.6279920882033 -175000 ekin = 2.84815372525752 | erot = 2.37845124629735 | epot = -21.2811665321372 | etot = -16.0545615605823 -176000 ekin = 2.13811988096562 | erot = 1.89602404006214 | epot = -21.3483452704796 | etot = -17.3142013494519 -177000 ekin = 2.57845153047441 | erot = 2.74101209600055 | epot = -21.3192781201108 | etot = -15.9998144936358 -178000 ekin = 1.8362026158725 | erot = 2.58532929872161 | epot = -21.2513623538897 | etot = -16.8298304392955 -179000 ekin = 2.51664198429652 | erot = 2.38535598715308 | epot = -21.3137585755744 | etot = -16.4117606041248 -180000 ekin = 1.88870242540222 | erot = 2.46307032082017 | epot = -21.4708809842583 | etot = -17.1191082380359 -181000 ekin = 1.7573063317019 | erot = 3.04206214925082 | epot = -21.4638802199926 | etot = -16.6645117390399 -182000 ekin = 1.56372006631669 | erot = 2.0482446459855 | epot = -21.4014353137661 | etot = -17.7894706014639 -183000 ekin = 2.00375583158539 | erot = 2.82586034021598 | epot = -21.4815637987258 | etot = -16.6519476269244 -184000 ekin = 2.68318475320728 | erot = 2.43685976384415 | epot = -21.5996781237133 | etot = -16.4796336066618 -185000 ekin = 2.99744907214255 | erot = 3.19569112714916 | epot = -21.6712604055259 | etot = -15.4781202062342 -186000 ekin = 3.18086271329103 | erot = 2.43694344502803 | epot = -21.700014527818 | etot = -16.0822083694989 -187000 ekin = 2.64763078555984 | erot = 3.43034775414789 | epot = -21.6568302519365 | etot = -15.5788517122288 -188000 ekin = 2.86104386361227 | erot = 3.05673704653031 | epot = -21.5997264275815 | etot = -15.6819455174389 -189000 ekin = 2.64279940222614 | erot = 1.81959052043828 | epot = -21.5371949170904 | etot = -17.074804994426 -190000 ekin = 2.21943570515013 | erot = 1.84825749826526 | epot = -21.498320200761 | etot = -17.4306269973456 -191000 ekin = 2.27416889747069 | erot = 2.0662909239644 | epot = -21.4373070550835 | etot = -17.0968472336484 -192000 ekin = 2.27339562400024 | erot = 3.1084542715957 | epot = -21.4737141732368 | etot = -16.0918642776409 -193000 ekin = 1.95136295247808 | erot = 1.8894092381771 | epot = -21.4612356964994 | etot = -17.6204635058442 -194000 ekin = 2.46233473019503 | erot = 2.02708794085746 | epot = -21.3374302301573 | etot = -16.8480075591048 -195000 ekin = 3.12435057559399 | erot = 2.09826675864205 | epot = -21.2738979568211 | etot = -16.0512806225851 -196000 ekin = 2.70015718375597 | erot = 2.5128575582669 | epot = -21.1930998936957 | etot = -15.9800851516728 -197000 ekin = 2.55038574692144 | erot = 2.07531410993401 | epot = -21.0258757995296 | etot = -16.4001759426742 -198000 ekin = 2.70688003284557 | erot = 1.79490240776514 | epot = -21.0190268968 | etot = -16.5172444561893 -199000 ekin = 2.5693949791157 | erot = 2.33188600887061 | epot = -21.0320560569424 | etot = -16.1307750689561 -200000 ekin = 2.89114428387874 | erot = 1.42209502781995 | epot = -21.0251552631878 | etot = -16.7119159514891 -201000 ekin = 2.68221791581645 | erot = 1.55638461968673 | epot = -21.0246765678572 | etot = -16.786074032354 -202000 ekin = 2.26600119742896 | erot = 2.24264658465156 | epot = -20.966213452201 | etot = -16.4575656701204 -203000 ekin = 2.11315541926328 | erot = 2.03104522736692 | epot = -20.8925289725737 | etot = -16.7483283259435 -204000 ekin = 2.10598805427349 | erot = 1.8944018028419 | epot = -20.9063507999493 | etot = -16.9059609428339 -205000 ekin = 1.32797127466544 | erot = 2.12796235386513 | epot = -20.9546930460646 | etot = -17.4987594175341 -206000 ekin = 1.38118094354854 | erot = 2.25600442653048 | epot = -20.9248899100655 | etot = -17.2877045399865 -207000 ekin = 1.89847617306066 | erot = 1.80813925076998 | epot = -21.0282211762941 | etot = -17.3216057524635 -208000 ekin = 1.82509354299281 | erot = 3.24652806561536 | epot = -21.2820126865175 | etot = -16.2103910779094 -209000 ekin = 2.8041625285186 | erot = 2.34850039993979 | epot = -21.4041461087816 | etot = -16.2514831803232 -210000 ekin = 3.17398766473313 | erot = 3.11871773439181 | epot = -21.4808635207107 | etot = -15.1881581215857 -211000 ekin = 2.47010820072588 | erot = 2.09528143227157 | epot = -21.6056990668499 | etot = -17.0403094338525 -212000 ekin = 2.36989560577724 | erot = 1.93500906628112 | epot = -21.6842526468772 | etot = -17.3793479748188 -213000 ekin = 1.90065800582391 | erot = 2.51889248061745 | epot = -21.7615899372457 | etot = -17.3420394508043 -214000 ekin = 1.97423172880181 | erot = 2.4980598759111 | epot = -21.7892459673185 | etot = -17.3169543626056 -215000 ekin = 1.97168935774729 | erot = 3.17151545304801 | epot = -21.7903331088791 | etot = -16.6471282980838 -216000 ekin = 1.89146772443534 | erot = 1.88107923457565 | epot = -21.7542848995033 | etot = -17.9817379404923 -217000 ekin = 2.06396631795602 | erot = 1.95272203440507 | epot = -21.8104294829847 | etot = -17.7937411306236 -218000 ekin = 2.31997702749623 | erot = 1.68971395254107 | epot = -21.7623319926371 | etot = -17.7526410125998 -219000 ekin = 2.46685879548778 | erot = 2.20801864234035 | epot = -21.7696248586177 | etot = -17.0947474207895 -220000 ekin = 1.73830824437668 | erot = 3.03764928140501 | epot = -21.7250063140519 | etot = -16.9490487882702 -221000 ekin = 1.77900155382619 | erot = 2.78474425452726 | epot = -21.7358321600373 | etot = -17.1720863516838 -222000 ekin = 2.62686448871845 | erot = 2.86058966709522 | epot = -21.6939796138854 | etot = -16.2065254580717 -223000 ekin = 3.04452612483164 | erot = 1.94024942191071 | epot = -21.7122663420572 | etot = -16.7274907953149 -224000 ekin = 2.718937145138 | erot = 2.42480319358565 | epot = -21.6802900448522 | etot = -16.5365497061286 -225000 ekin = 2.02691300626945 | erot = 3.37602856858266 | epot = -21.6857094668298 | etot = -16.2827678919777 -226000 ekin = 2.36557492667929 | erot = 2.39082460572007 | epot = -21.7553390008386 | etot = -16.9989394684392 -227000 ekin = 2.73620885172714 | erot = 2.63025691267084 | epot = -21.818043188201 | etot = -16.451577423803 -228000 ekin = 2.08980697083006 | erot = 2.26883720629955 | epot = -21.880544956506 | etot = -17.5219007793764 -229000 ekin = 1.80144547388731 | erot = 1.79654911472853 | epot = -21.9628584317261 | etot = -18.3648638431102 -230000 ekin = 2.77451167134285 | erot = 2.22776499369623 | epot = -21.9854420760081 | etot = -16.983165410969 -231000 ekin = 3.15850107875523 | erot = 2.7756116636273 | epot = -21.9726828438209 | etot = -16.0385701014384 -232000 ekin = 1.86960416304709 | erot = 1.70620936865288 | epot = -22.0086347294912 | etot = -18.4328211977913 -233000 ekin = 1.75933775527383 | erot = 1.56532056032101 | epot = -21.9899365513674 | etot = -18.6652782357726 -234000 ekin = 2.33698261677869 | erot = 2.05550388448924 | epot = -21.9120502409319 | etot = -17.5195637396639 -235000 ekin = 1.9573829360185 | erot = 2.52333284033808 | epot = -21.8594642182283 | etot = -17.3787484418717 -236000 ekin = 2.2617849997626 | erot = 1.90928533288046 | epot = -21.8749689452558 | etot = -17.7038986126127 -237000 ekin = 2.48853198845777 | erot = 2.64888724219513 | epot = -21.9453266234327 | etot = -16.8079073927798 -238000 ekin = 2.21038428000156 | erot = 2.7424361712651 | epot = -22.0000238560637 | etot = -17.0472034047971 -239000 ekin = 2.72852713027264 | erot = 2.49133994747208 | epot = -22.0182378682277 | etot = -16.7983707904829 -240000 ekin = 3.10387064960454 | erot = 2.19174616842279 | epot = -21.9254266959964 | etot = -16.629809877969 -241000 ekin = 3.04688823533615 | erot = 2.65417483072321 | epot = -21.8524309009232 | etot = -16.1513678348639 -242000 ekin = 2.22655833358292 | erot = 2.33728691596105 | epot = -21.775606752996 | etot = -17.211761503452 -243000 ekin = 1.53720920161825 | erot = 2.80453969203578 | epot = -21.7184041577432 | etot = -17.3766552640892 -244000 ekin = 1.91538946868823 | erot = 2.4387847070438 | epot = -21.6211228029713 | etot = -17.2669486272392 -245000 ekin = 1.95684890248336 | erot = 2.60788082483666 | epot = -21.4938704859113 | etot = -16.9291407585913 -246000 ekin = 2.07153989492555 | erot = 2.40695304198482 | epot = -21.4521110801275 | etot = -16.9736181432171 -247000 ekin = 1.55669060713796 | erot = 2.27930456834644 | epot = -21.4122603878221 | etot = -17.5762652123377 -248000 ekin = 1.83803563986085 | erot = 2.56773709137239 | epot = -21.4358565123266 | etot = -17.0300837810933 -249000 ekin = 1.79842337395836 | erot = 2.04417900475198 | epot = -21.5079955681831 | etot = -17.6653931894727 -250000 ekin = 1.68165772872533 | erot = 3.39425180338125 | epot = -21.5394505717881 | etot = -16.4635410396816 -251000 ekin = 2.13109176968443 | erot = 3.25918860829495 | epot = -21.5291832995953 | etot = -16.1389029216159 -252000 ekin = 2.053654740928 | erot = 2.53782822604964 | epot = -21.5554268525819 | etot = -16.9639438856043 -253000 ekin = 1.65815317720656 | erot = 3.2103686272941 | epot = -21.5801245998449 | etot = -16.7116027953443 -254000 ekin = 2.32643739073982 | erot = 3.10897981239372 | epot = -21.5778214253297 | etot = -16.1424042221962 -255000 ekin = 2.50573519817545 | erot = 2.76783941653296 | epot = -21.5566198260725 | etot = -16.2830452113641 -256000 ekin = 1.97360306022237 | erot = 2.62555911992843 | epot = -21.5492296987675 | etot = -16.9500675186167 -257000 ekin = 2.23010041401886 | erot = 3.26408085278294 | epot = -21.5699664805037 | etot = -16.0757852137019 -258000 ekin = 2.04489236085684 | erot = 1.84672249628675 | epot = -21.6871004150333 | etot = -17.7954855578897 -259000 ekin = 2.87368351206713 | erot = 2.78936048482183 | epot = -21.79465654858 | etot = -16.131612551691 -260000 ekin = 2.90723740318823 | erot = 2.19282117735075 | epot = -21.8510164466681 | etot = -16.7509578661291 -261000 ekin = 2.76826717813612 | erot = 2.3408102568469 | epot = -21.8996159314726 | etot = -16.7905384964896 -262000 ekin = 3.52272168049175 | erot = 1.77108921100701 | epot = -21.9183679745592 | etot = -16.6245570830604 -263000 ekin = 3.08415540167847 | erot = 2.42542153733818 | epot = -21.8525939259305 | etot = -16.3430169869139 -264000 ekin = 2.24750828021794 | erot = 2.03549249484823 | epot = -21.8644003610158 | etot = -17.5813995859496 -265000 ekin = 1.9256244934252 | erot = 2.50003397851261 | epot = -21.7368613865555 | etot = -17.3112029146177 -266000 ekin = 2.39663137918843 | erot = 3.25281234980079 | epot = -21.6911624005759 | etot = -16.0417186715867 -267000 ekin = 1.71138772864696 | erot = 2.23669516146945 | epot = -21.656773778734 | etot = -17.7086908886176 -268000 ekin = 2.1012342991695 | erot = 3.22431689054768 | epot = -21.6149417342532 | etot = -16.289390544536 -269000 ekin = 1.96288847894507 | erot = 2.78695129937916 | epot = -21.5074378362073 | etot = -16.7575980578831 -270000 ekin = 2.11352321718224 | erot = 2.66970769590072 | epot = -21.4082402788558 | etot = -16.6250093657728 -271000 ekin = 2.187367149063 | erot = 3.10651896358249 | epot = -21.2262888361409 | etot = -15.9324027234954 -272000 ekin = 2.53123659603481 | erot = 2.28031086814788 | epot = -21.0667233503151 | etot = -16.2551758861324 -273000 ekin = 1.93620978534757 | erot = 1.99248019508239 | epot = -21.0024789385132 | etot = -17.0737889580832 -274000 ekin = 1.90995249837777 | erot = 2.21197524437096 | epot = -21.0425035783664 | etot = -16.9205758356177 -275000 ekin = 1.7924862003403 | erot = 3.10053081821809 | epot = -21.0804706135493 | etot = -16.1874535949909 -276000 ekin = 3.35665649861731 | erot = 2.41114048919769 | epot = -21.0250329806457 | etot = -15.2572359928307 -277000 ekin = 2.41733347319127 | erot = 1.50728350741789 | epot = -20.9704854598112 | etot = -17.045868479202 -278000 ekin = 2.53927407792784 | erot = 2.14772203209251 | epot = -20.9597795409701 | etot = -16.2727834309497 -279000 ekin = 1.9086257726176 | erot = 2.39006859456279 | epot = -20.9691625784233 | etot = -16.6704682112429 -280000 ekin = 2.3712715434438 | erot = 3.59520758009785 | epot = -20.8511344732567 | etot = -14.884655349715 -281000 ekin = 1.76900280298917 | erot = 1.79532059184944 | epot = -20.9241533960326 | etot = -17.3598300011939 -282000 ekin = 2.27081772250325 | erot = 3.05002296036257 | epot = -20.8869696699162 | etot = -15.5661289870504 -283000 ekin = 2.18678338225262 | erot = 2.20808584908431 | epot = -20.8425952687799 | etot = -16.4477260374429 -284000 ekin = 1.91967212543913 | erot = 2.20885942937705 | epot = -20.8702716845898 | etot = -16.7417401297736 -285000 ekin = 3.15534421247094 | erot = 1.80733118017555 | epot = -21.0506046634905 | etot = -16.0879292708441 -286000 ekin = 3.87414654801577 | erot = 1.83540293712377 | epot = -21.2318072144161 | etot = -15.5222577292766 -287000 ekin = 3.65199335032365 | erot = 2.91368616965972 | epot = -21.3038992633635 | etot = -14.7382197433801 -288000 ekin = 3.25566938715965 | erot = 1.61414633945368 | epot = -21.2971542306353 | etot = -16.427338504022 -289000 ekin = 2.57263419624199 | erot = 2.78652542009298 | epot = -21.270831111226 | etot = -15.911671494891 -290000 ekin = 2.70850264399552 | erot = 2.41920167874741 | epot = -21.2832461285427 | etot = -16.1555418057998 -291000 ekin = 2.06015522240602 | erot = 2.36096794039798 | epot = -21.2800181616414 | etot = -16.8588949988374 -292000 ekin = 2.28565579809197 | erot = 2.0492309975275 | epot = -21.3390392809808 | etot = -17.0041524853614 -293000 ekin = 2.24969697991474 | erot = 2.35258801570063 | epot = -21.4487457699855 | etot = -16.8464607743701 -294000 ekin = 2.93116374685755 | erot = 2.88908330420809 | epot = -21.5301464521074 | etot = -15.7098994010417 -295000 ekin = 2.66799463567933 | erot = 2.29137040664776 | epot = -21.6929279927361 | etot = -16.733562950409 -296000 ekin = 2.20703557359524 | erot = 2.91779932622371 | epot = -21.745669704948 | etot = -16.6208348051291 -297000 ekin = 2.17709774147519 | erot = 3.31374313109423 | epot = -21.7393959864692 | etot = -16.2485551138997 -298000 ekin = 2.9129468421301 | erot = 2.35672300219859 | epot = -21.6957115365355 | etot = -16.4260416922068 -299000 ekin = 3.16776997287189 | erot = 2.2391818507998 | epot = -21.8064946029841 | etot = -16.3995427793124 -300000 ekin = 3.29561200430319 | erot = 1.38909463218868 | epot = -21.88075107193 | etot = -17.1960444354381 -301000 ekin = 2.38366117761117 | erot = 3.3087020645508 | epot = -21.8991772346975 | etot = -16.2068139925356 -302000 ekin = 2.92578534773873 | erot = 3.24773085922143 | epot = -21.8654359309133 | etot = -15.6919197239531 -303000 ekin = 2.41046706286872 | erot = 2.62044101440911 | epot = -21.8547021809442 | etot = -16.8237941036664 -304000 ekin = 2.22973717088315 | erot = 2.69550632779805 | epot = -21.7935318306645 | etot = -16.8682883319833 -305000 ekin = 2.37917924648061 | erot = 2.39025207841258 | epot = -21.7682058013904 | etot = -16.9987744764972 -306000 ekin = 1.94479260294372 | erot = 2.89926351945751 | epot = -21.7686335450968 | etot = -16.9245774226955 -307000 ekin = 2.51329193607427 | erot = 2.07893464323809 | epot = -21.710948391274 | etot = -17.1187218119617 -308000 ekin = 2.81355602400968 | erot = 2.63100444247636 | epot = -21.7026983871469 | etot = -16.2581379206609 -309000 ekin = 2.33327686418279 | erot = 2.12127029003217 | epot = -21.6762127568296 | etot = -17.2216656026146 -310000 ekin = 2.52298184126179 | erot = 3.21591454963617 | epot = -21.695142164932 | etot = -15.956245774034 -311000 ekin = 2.34923515117596 | erot = 3.03949532400544 | epot = -21.7087574865082 | etot = -16.3200270113268 -312000 ekin = 1.8269200765792 | erot = 3.25879908323384 | epot = -21.581493453196 | etot = -16.495774293383 -313000 ekin = 1.63600964511319 | erot = 2.08094899400482 | epot = -21.606397547734 | etot = -17.889438908616 -314000 ekin = 2.27293762564082 | erot = 2.5685903273234 | epot = -21.6199211148905 | etot = -16.7783931619263 -315000 ekin = 2.5313505044608 | erot = 2.13255412771189 | epot = -21.6994892370102 | etot = -17.0355846048375 -316000 ekin = 1.99528950863063 | erot = 1.8009779719585 | epot = -21.7144101219026 | etot = -17.9181426413135 -317000 ekin = 2.11352183168035 | erot = 2.00935618346838 | epot = -21.702888210866 | etot = -17.5800101957173 -318000 ekin = 2.29665458459675 | erot = 1.9218837801722 | epot = -21.6711519227436 | etot = -17.4526135579747 -319000 ekin = 1.98093881438111 | erot = 1.68246475076764 | epot = -21.5680359341469 | etot = -17.9046323689982 -320000 ekin = 2.46251923881396 | erot = 3.07047264047418 | epot = -21.5096210718397 | etot = -15.9766291925515 -321000 ekin = 1.85318841838943 | erot = 2.6741946235276 | epot = -21.5386927047478 | etot = -17.0113096628308 -322000 ekin = 1.94542919328061 | erot = 3.36132448976007 | epot = -21.462118312038 | etot = -16.1553646289973 -323000 ekin = 1.92568445593302 | erot = 2.08578688156951 | epot = -21.4990899081635 | etot = -17.487618570661 -324000 ekin = 2.21374645511898 | erot = 2.45979330983641 | epot = -21.6010648344435 | etot = -16.9275250694881 -325000 ekin = 2.71973630116966 | erot = 2.37178970012744 | epot = -21.712426807882 | etot = -16.6209008065849 -326000 ekin = 1.88824000887386 | erot = 1.92165807946833 | epot = -21.7667410841736 | etot = -17.9568429958315 -327000 ekin = 3.03069091411613 | erot = 1.66905303717587 | epot = -21.8444186282852 | etot = -17.1446746769932 -328000 ekin = 2.74111841160537 | erot = 1.91707691036631 | epot = -21.8825192055331 | etot = -17.2243238835614 -329000 ekin = 2.94134490087235 | erot = 3.13982603162578 | epot = -21.9373718647512 | etot = -15.8562009322531 -330000 ekin = 2.91659917154128 | erot = 2.01302494652939 | epot = -21.9334919050175 | etot = -17.0038677869468 -331000 ekin = 2.28401437900765 | erot = 2.04959290659006 | epot = -21.9235871145697 | etot = -17.589979828972 -332000 ekin = 2.41477240701933 | erot = 3.18206286535344 | epot = -21.9762685570111 | etot = -16.3794332846383 -333000 ekin = 2.45632306729147 | erot = 2.70981698021117 | epot = -22.0802863854372 | etot = -16.9141463379346 -334000 ekin = 2.37343096192712 | erot = 2.99538841337669 | epot = -22.1169059815891 | etot = -16.7480866062853 -335000 ekin = 2.11258102220993 | erot = 3.56563799589785 | epot = -22.1589708630881 | etot = -16.4807518449803 -336000 ekin = 2.63443561655341 | erot = 2.12835506840877 | epot = -22.135253476801 | etot = -17.3724627918388 -337000 ekin = 2.74032565197819 | erot = 2.73568544119591 | epot = -22.1162186765824 | etot = -16.6402075834083 -338000 ekin = 1.84481246769261 | erot = 2.23462418681718 | epot = -22.1932263562086 | etot = -18.1137897016988 -339000 ekin = 1.56179484671187 | erot = 2.48907003494865 | epot = -22.2362997512502 | etot = -18.1854348695896 -340000 ekin = 1.46400835747893 | erot = 4.0512188877133 | epot = -22.1550062300509 | etot = -16.6397789848587 -341000 ekin = 1.68583362524713 | erot = 2.79345882658496 | epot = -22.1357452359775 | etot = -17.6564527841454 -342000 ekin = 1.96314395645267 | erot = 2.74466248035308 | epot = -22.1973030330981 | etot = -17.4894965962924 -343000 ekin = 2.66788553126356 | erot = 3.18183761806682 | epot = -22.2887136544829 | etot = -16.4389905051526 -344000 ekin = 1.78884972348303 | erot = 2.18066038812641 | epot = -22.3196903631289 | etot = -18.3501802515195 -345000 ekin = 1.54101094076145 | erot = 1.85848281555012 | epot = -22.3637723164297 | etot = -18.9642785601181 -346000 ekin = 1.69292596460904 | erot = 1.8080316670706 | epot = -22.3281555406487 | etot = -18.827197908969 -347000 ekin = 1.37586220035546 | erot = 2.61615920278041 | epot = -22.3502414839316 | etot = -18.3582200807958 -348000 ekin = 2.1379756238867 | erot = 2.8590037384953 | epot = -22.3431546343773 | etot = -17.3461752719953 -349000 ekin = 1.82920941743142 | erot = 1.97683001829644 | epot = -22.358647853278 | etot = -18.5526084175502 -350000 ekin = 1.78940567302629 | erot = 2.50961291060183 | epot = -22.3435711705442 | etot = -18.0445525869161 -351000 ekin = 1.68761490497198 | erot = 2.81740261848487 | epot = -22.413948353252 | etot = -17.9089308297951 -352000 ekin = 2.77021596792832 | erot = 2.15256490237832 | epot = -22.5845859351651 | etot = -17.6618050648585 -353000 ekin = 3.56514294827437 | erot = 1.46623266587274 | epot = -22.6366139885995 | etot = -17.6052383744524 -354000 ekin = 3.44768413783611 | erot = 2.2508741161152 | epot = -22.5521676274445 | etot = -16.8536093734932 -355000 ekin = 2.0339222695118 | erot = 2.90917743936019 | epot = -22.5104712522892 | etot = -17.5673715434172 -356000 ekin = 2.10642401704757 | erot = 3.31919387591753 | epot = -22.5408670189009 | etot = -17.1152491259358 -357000 ekin = 2.76519653125328 | erot = 2.50858960423796 | epot = -22.5185760247454 | etot = -17.2447898892542 -358000 ekin = 2.5374658712045 | erot = 2.2647702680074 | epot = -22.5067305203673 | etot = -17.7044943811554 -359000 ekin = 3.23575918003202 | erot = 2.52804611996866 | epot = -22.5983600193657 | etot = -16.834554719365 -360000 ekin = 2.59182745067507 | erot = 1.97199586910126 | epot = -22.6431957503706 | etot = -18.0793724305942 -361000 ekin = 2.61187422629997 | erot = 2.50384597992352 | epot = -22.6889255875949 | etot = -17.5732053813714 -362000 ekin = 2.38478129908564 | erot = 3.84225576928699 | epot = -22.6416012117121 | etot = -16.4145641433395 -363000 ekin = 2.88499903144359 | erot = 1.98712884581536 | epot = -22.5277585455565 | etot = -17.6556306682975 -364000 ekin = 2.24472586183289 | erot = 1.87849655022233 | epot = -22.4027818145434 | etot = -18.2795594024882 -365000 ekin = 2.04314188489358 | erot = 2.81001232738016 | epot = -22.2276048128305 | etot = -17.3744506005568 -366000 ekin = 2.26658685631362 | erot = 1.95650208645697 | epot = -22.1895525177766 | etot = -17.966463575006 -367000 ekin = 2.81568040956379 | erot = 2.51870737095405 | epot = -22.2465449976265 | etot = -16.9121572171087 -368000 ekin = 2.81607406017701 | erot = 2.1866718839128 | epot = -22.3661835489406 | etot = -17.3634376048508 -369000 ekin = 2.31666862853353 | erot = 2.84859903953565 | epot = -22.4308123375305 | etot = -17.2655446694613 -370000 ekin = 2.66612981804874 | erot = 2.10389084208224 | epot = -22.505799930102 | etot = -17.7357792699711 -371000 ekin = 2.19552758440374 | erot = 3.61117481442869 | epot = -22.5711545036622 | etot = -16.7644521048298 -372000 ekin = 1.77345963407765 | erot = 3.42406482157981 | epot = -22.66405706261 | etot = -17.4665326069525 -373000 ekin = 2.14860861324314 | erot = 2.79097682151395 | epot = -22.7141452937347 | etot = -17.7745598589776 -374000 ekin = 2.69445806056395 | erot = 3.57889438136966 | epot = -22.860153056641 | etot = -16.5868006147074 -375000 ekin = 2.40579827793462 | erot = 2.98564029581681 | epot = -22.9188993843038 | etot = -17.5274608105523 -376000 ekin = 3.36516934625557 | erot = 3.24766546156016 | epot = -22.940715917868 | etot = -16.3278811100523 -377000 ekin = 3.18983781467362 | erot = 2.65450417571542 | epot = -22.8850374180386 | etot = -17.0406954276496 -378000 ekin = 1.54656075265338 | erot = 2.66317423977111 | epot = -22.8855901030291 | etot = -18.6758551106046 -379000 ekin = 1.93839150288505 | erot = 2.54534031143981 | epot = -22.9043634096536 | etot = -18.4206315953288 -380000 ekin = 2.66254728899606 | erot = 2.88892403669479 | epot = -22.9338385289327 | etot = -17.3823672032419 -381000 ekin = 2.95357480274557 | erot = 2.1770881328374 | epot = -22.9777297037143 | etot = -17.8470667681313 -382000 ekin = 2.58828801972808 | erot = 2.01895528744468 | epot = -22.9240694006084 | etot = -18.3168260934356 -383000 ekin = 2.01537544096934 | erot = 2.50444896556415 | epot = -22.9471970402487 | etot = -18.4273726337152 -384000 ekin = 2.1008854766715 | erot = 2.19856058469132 | epot = -22.9599217884816 | etot = -18.6604757271188 -385000 ekin = 1.91384966632105 | erot = 1.63022965207194 | epot = -22.9760629278411 | etot = -19.4319836094481 -386000 ekin = 1.56010650102716 | erot = 1.35861854215736 | epot = -23.0225779741027 | etot = -20.1038529309182 -387000 ekin = 2.21264194719196 | erot = 1.75007226671446 | epot = -23.0228562328387 | etot = -19.0601420189323 -388000 ekin = 1.98740987493218 | erot = 1.95984350341523 | epot = -22.9305477811724 | etot = -18.983294402825 -389000 ekin = 2.54192883121441 | erot = 2.33922416322361 | epot = -22.9249127695712 | etot = -18.0437597751332 -390000 ekin = 2.07846479778646 | erot = 1.88716644515798 | epot = -22.8328701541731 | etot = -18.8672389112287 -391000 ekin = 1.85214179314428 | erot = 2.41299153787073 | epot = -22.7996788423596 | etot = -18.5345455113446 -392000 ekin = 2.1990161201673 | erot = 2.89998817237143 | epot = -22.7987091159473 | etot = -17.6997048234086 -393000 ekin = 2.15260515278705 | erot = 3.19524728171092 | epot = -22.8896620280071 | etot = -17.5418095935092 -394000 ekin = 1.99225032343945 | erot = 2.14729304405154 | epot = -22.8800416390029 | etot = -18.7404982715119 -395000 ekin = 2.03378474286714 | erot = 2.5027536840914 | epot = -22.9316292594111 | etot = -18.3950908324525 -396000 ekin = 2.1438632384243 | erot = 1.95894279389406 | epot = -23.0275362016084 | etot = -18.92473016929 -397000 ekin = 2.3982267029558 | erot = 1.6520465154777 | epot = -23.1343663061977 | etot = -19.0840930877642 -398000 ekin = 3.58481792746973 | erot = 2.51392910802386 | epot = -23.2457545351658 | etot = -17.1470074996722 -399000 ekin = 2.65690049350562 | erot = 1.78819644367598 | epot = -23.3515850649259 | etot = -18.9064881277443 -400000 ekin = 2.51173640894656 | erot = 2.10904826584645 | epot = -23.4207879652203 | etot = -18.8000032904273 -401000 ekin = 2.051233917874 | erot = 2.1536921336815 | epot = -23.4762000730604 | etot = -19.2712740215049 -402000 ekin = 2.43380846674055 | erot = 2.11259263785444 | epot = -23.4648112610383 | etot = -18.9184101564433 -403000 ekin = 2.53609107080855 | erot = 2.81280118329428 | epot = -23.5344895971956 | etot = -18.1855973430928 -404000 ekin = 2.18209195546023 | erot = 2.63706526020475 | epot = -23.6211046727682 | etot = -18.8019474571032 -405000 ekin = 2.45129457425945 | erot = 2.40500271478244 | epot = -23.6324000926426 | etot = -18.7761028036007 -406000 ekin = 2.21962265364597 | erot = 2.24914950938542 | epot = -23.6519777970511 | etot = -19.1832056340197 -407000 ekin = 1.98553912077512 | erot = 2.77856927236326 | epot = -23.557236944138 | etot = -18.7931285509997 -408000 ekin = 2.57635800289226 | erot = 2.58086436198046 | epot = -23.4362831006766 | etot = -18.2790607358039 -409000 ekin = 2.36933136766419 | erot = 2.25922617215654 | epot = -23.3257538962906 | etot = -18.6971963564699 -410000 ekin = 2.02248038283451 | erot = 1.96486213113069 | epot = -23.3085205990924 | etot = -19.3211780851272 -411000 ekin = 1.8788974806599 | erot = 2.6514468933077 | epot = -23.288114132028 | etot = -18.7577697580604 -412000 ekin = 1.99373261308744 | erot = 2.68967710559433 | epot = -23.2520689125676 | etot = -18.5686591938858 -413000 ekin = 2.38901265794743 | erot = 2.64559329464322 | epot = -23.1974799245766 | etot = -18.1628739719859 -414000 ekin = 2.42764537426657 | erot = 1.75171638842505 | epot = -23.1227256481796 | etot = -18.943363885488 -415000 ekin = 2.76411872449006 | erot = 2.44214574701597 | epot = -23.1777400120228 | etot = -17.9714755405168 -416000 ekin = 2.08293620051845 | erot = 2.76581176915863 | epot = -23.186622003278 | etot = -18.337874033601 -417000 ekin = 1.99975250190993 | erot = 1.9578721634496 | epot = -23.1905597787985 | etot = -19.2329351134389 -418000 ekin = 2.38311403931269 | erot = 2.55890369849375 | epot = -23.1547990589628 | etot = -18.2127813211564 -419000 ekin = 2.98411599395291 | erot = 2.57059785409318 | epot = -23.0506701290817 | etot = -17.4959562810356 -420000 ekin = 2.60188910540588 | erot = 2.46051136519661 | epot = -22.9584750453702 | etot = -17.8960745747677 -421000 ekin = 2.51721839958931 | erot = 1.77803097918895 | epot = -22.9478270423399 | etot = -18.6525776635616 -422000 ekin = 2.73215994330404 | erot = 1.67289719515518 | epot = -22.9366997516619 | etot = -18.5316426132027 -423000 ekin = 2.13301592734426 | erot = 2.54982791014141 | epot = -22.8120609726708 | etot = -18.1292171351851 -424000 ekin = 1.90609667850123 | erot = 2.31895806505094 | epot = -22.7750025410849 | etot = -18.5499477975327 -425000 ekin = 2.37363345292966 | erot = 1.95591998920184 | epot = -22.7837602756269 | etot = -18.4542068334954 -426000 ekin = 2.23506150102974 | erot = 2.60957702289923 | epot = -22.8034248715963 | etot = -17.9587863476673 -427000 ekin = 1.8858071920588 | erot = 2.12670154749625 | epot = -22.9703036100131 | etot = -18.957794870458 -428000 ekin = 1.93190556918249 | erot = 2.45435859297294 | epot = -23.1028032345637 | etot = -18.7165390724082 -429000 ekin = 1.72625681322915 | erot = 2.16391616195066 | epot = -23.1169612720762 | etot = -19.2267882968964 -430000 ekin = 2.31229851925652 | erot = 2.14059498772528 | epot = -23.123947656521 | etot = -18.6710541495392 -431000 ekin = 2.45856801873639 | erot = 2.41565239614123 | epot = -23.1343729492306 | etot = -18.260152534353 -432000 ekin = 2.80045086542028 | erot = 2.19133218252703 | epot = -23.1425691977264 | etot = -18.1507861497791 -433000 ekin = 2.20382151693237 | erot = 1.62233615534329 | epot = -23.186811655719 | etot = -19.3606539834433 -434000 ekin = 2.5912014730388 | erot = 2.35257474145033 | epot = -23.2139624944838 | etot = -18.2701862799947 -435000 ekin = 2.292878018016 | erot = 2.54026793769998 | epot = -23.1933803471397 | etot = -18.3602343914237 -436000 ekin = 2.43255475285637 | erot = 2.74965402216776 | epot = -23.2431213562246 | etot = -18.0609125812005 -437000 ekin = 1.64425595993858 | erot = 3.23323066283653 | epot = -23.2344898707627 | etot = -18.3570032479876 -438000 ekin = 1.56118873048903 | erot = 2.60253121414272 | epot = -23.1306562811571 | etot = -18.9669363365254 -439000 ekin = 2.30492577643288 | erot = 1.9389279713903 | epot = -23.1381949153658 | etot = -18.8943411675426 -440000 ekin = 2.52026113610471 | erot = 3.04666677428385 | epot = -23.1986879717886 | etot = -17.6317600614 -441000 ekin = 2.79914634628251 | erot = 2.54581028632591 | epot = -23.1725956938593 | etot = -17.8276390612509 -442000 ekin = 2.93509023618977 | erot = 2.87676477127226 | epot = -23.1159592458781 | etot = -17.304104238416 -443000 ekin = 1.96857488695096 | erot = 1.76444429617767 | epot = -23.0441054580414 | etot = -19.3110862749127 -444000 ekin = 2.00750191739409 | erot = 2.2534047751145 | epot = -22.9735423472635 | etot = -18.712635654755 -445000 ekin = 2.22546986952724 | erot = 2.06326830023309 | epot = -22.8095964231444 | etot = -18.5208582533841 -446000 ekin = 2.4450124715022 | erot = 2.3730159305034 | epot = -22.7149791043001 | etot = -17.8969507022945 -447000 ekin = 2.27692613820669 | erot = 2.40593386102284 | epot = -22.7350457195192 | etot = -18.0521857202897 -448000 ekin = 2.17715994902024 | erot = 1.93996223845971 | epot = -22.8484345777469 | etot = -18.7313123902669 -449000 ekin = 2.2196798712192 | erot = 2.34285870025318 | epot = -22.938199826666 | etot = -18.3756612551936 -450000 ekin = 2.75054977353848 | erot = 1.97938557871968 | epot = -22.8928697422248 | etot = -18.1629343899666 -451000 ekin = 2.21115355148631 | erot = 2.13373186546172 | epot = -22.9268989776618 | etot = -18.5820135607137 -452000 ekin = 2.54346617380347 | erot = 2.35731335928095 | epot = -22.9645722362833 | etot = -18.0637927031988 -453000 ekin = 2.2284644335428 | erot = 1.78504863466535 | epot = -22.9494030803646 | etot = -18.9358900121564 -454000 ekin = 2.43981950788672 | erot = 2.59540327726185 | epot = -22.8784508334485 | etot = -17.8432280482999 -455000 ekin = 2.04589395219366 | erot = 2.7960521140105 | epot = -22.6640287607136 | etot = -17.8220826945095 -456000 ekin = 2.02066497153519 | erot = 2.51421900073603 | epot = -22.4777086012038 | etot = -17.9428246289326 -457000 ekin = 2.62428771899347 | erot = 2.43881206937848 | epot = -22.3598178635714 | etot = -17.2967180751994 -458000 ekin = 2.00990487485324 | erot = 1.99234707595584 | epot = -22.2532334283702 | etot = -18.2509814775611 -459000 ekin = 1.75250109782347 | erot = 2.49689893971802 | epot = -22.2437782516535 | etot = -17.994378214112 -460000 ekin = 1.9190487289221 | erot = 2.07624013444807 | epot = -22.2370852343625 | etot = -18.2417963709923 -461000 ekin = 1.56836892852198 | erot = 1.28974645955658 | epot = -22.2063748439499 | etot = -19.3482594558713 -462000 ekin = 2.45168650095568 | erot = 1.36025556758079 | epot = -22.3059327256893 | etot = -18.4939906571528 -463000 ekin = 2.64349639743884 | erot = 2.07826809667296 | epot = -22.4269210824658 | etot = -17.705156588354 -464000 ekin = 2.67294933942793 | erot = 3.73619931212747 | epot = -22.5513294295021 | etot = -16.1421807779467 -465000 ekin = 1.95387776347697 | erot = 2.23929165445271 | epot = -22.7354276602965 | etot = -18.5422582423668 -466000 ekin = 2.13358131772513 | erot = 2.9628231040371 | epot = -22.8413443832467 | etot = -17.7449399614844 -467000 ekin = 2.46622692687387 | erot = 2.11619893803783 | epot = -23.0236293811154 | etot = -18.4412035162037 -468000 ekin = 1.99045166389675 | erot = 1.6285380006184 | epot = -23.0932840681895 | etot = -19.4742944036743 -469000 ekin = 2.49670871865504 | erot = 2.63664907892974 | epot = -23.1383213964888 | etot = -18.0049635989041 -470000 ekin = 2.92207685554493 | erot = 3.21710942124273 | epot = -23.1429890223789 | etot = -17.0038027455912 -471000 ekin = 2.36481422254557 | erot = 1.72322177619039 | epot = -23.1018283304032 | etot = -19.0137923316673 -472000 ekin = 2.18517765615792 | erot = 2.00241070370021 | epot = -23.0699010011102 | etot = -18.8823126412521 -473000 ekin = 2.37141527291476 | erot = 2.86124879212049 | epot = -23.0301508899776 | etot = -17.7974868249423 -474000 ekin = 2.18573397152438 | erot = 2.60055996125085 | epot = -22.9109845829656 | etot = -18.1246906501904 -475000 ekin = 2.39664419497567 | erot = 2.01359105802913 | epot = -22.8103966693808 | etot = -18.400161416376 -476000 ekin = 2.106779684052 | erot = 2.60326535898524 | epot = -22.8093298667681 | etot = -18.0992848237309 -477000 ekin = 2.53303116397527 | erot = 3.55507509768021 | epot = -22.7929172799516 | etot = -16.7048110182962 -478000 ekin = 2.40644412232746 | erot = 2.73235251079285 | epot = -22.7008644942783 | etot = -17.562067861158 -479000 ekin = 1.2774884884165 | erot = 2.99242202231977 | epot = -22.6580451660686 | etot = -18.3881346553323 -480000 ekin = 1.82378442133505 | erot = 2.13912569674403 | epot = -22.6273806665075 | etot = -18.6644705484284 -481000 ekin = 2.38794676527735 | erot = 3.18394268862154 | epot = -22.652698250081 | etot = -17.0808087961821 -482000 ekin = 3.20103552737715 | erot = 2.41980408559651 | epot = -22.6098898945504 | etot = -16.9890502815768 -483000 ekin = 3.03840673317681 | erot = 2.48624445057528 | epot = -22.5747152180487 | etot = -17.0500640342966 -484000 ekin = 2.70186903599877 | erot = 2.52680102607677 | epot = -22.6043659240374 | etot = -17.3756958619618 -485000 ekin = 3.27237676088605 | erot = 2.42435226331311 | epot = -22.5971021698101 | etot = -16.9003731456109 -486000 ekin = 1.96601696665902 | erot = 1.75893246838797 | epot = -22.6399989280022 | etot = -18.9150494929552 -487000 ekin = 2.62348602949564 | erot = 2.50764223408898 | epot = -22.7315097398775 | etot = -17.6003814762928 -488000 ekin = 1.75208653704965 | erot = 2.64490018417003 | epot = -22.7893685606217 | etot = -18.3923818394021 -489000 ekin = 2.08736451702833 | erot = 2.95231225184179 | epot = -22.8795542371813 | etot = -17.8398774683112 -490000 ekin = 2.30758266641326 | erot = 2.33160202425018 | epot = -22.8824154392574 | etot = -18.2432307485939 -491000 ekin = 2.48198002403303 | erot = 2.59526090835888 | epot = -22.8753520101327 | etot = -17.7981110777408 -492000 ekin = 3.28206840084522 | erot = 2.18523064608534 | epot = -22.8554585939889 | etot = -17.3881595470583 -493000 ekin = 3.37968205627646 | erot = 2.35359230702798 | epot = -22.802471593836 | etot = -17.0691972305315 -494000 ekin = 3.57469694905841 | erot = 2.2485639294812 | epot = -22.8021092664721 | etot = -16.9788483879325 -495000 ekin = 2.5052834294994 | erot = 2.15847696242519 | epot = -22.7974611109899 | etot = -18.1337007190653 -496000 ekin = 1.95424552563439 | erot = 3.58261919463167 | epot = -22.8351163728141 | etot = -17.298251652548 -497000 ekin = 2.22184693843012 | erot = 2.46505638343575 | epot = -22.8411234790096 | etot = -18.1542201571438 -498000 ekin = 1.72646972661644 | erot = 2.39649152448662 | epot = -22.7771984845447 | etot = -18.6542372334417 -499000 ekin = 2.44587532386558 | erot = 2.82724443292545 | epot = -22.7933140861756 | etot = -17.5201943293846 -500000 ekin = 2.78510450558426 | erot = 2.23272713529476 | epot = -22.8971262576266 | etot = -17.8792946167476 -501000 ekin = 2.99437147790547 | erot = 1.97777660143103 | epot = -22.9259326262666 | etot = -17.9537845469301 -502000 ekin = 2.98620318494749 | erot = 1.79968012191087 | epot = -22.9540905110158 | etot = -18.1682072041574 -503000 ekin = 2.51500641896251 | erot = 2.88866029010492 | epot = -22.9837264072572 | etot = -17.5800596981898 -504000 ekin = 2.84385497746759 | erot = 2.69349274825329 | epot = -22.9149904805499 | etot = -17.377642754829 -505000 ekin = 2.95574835602088 | erot = 2.6026753799514 | epot = -22.9888007816538 | etot = -17.4303770456815 -506000 ekin = 2.19820711369971 | erot = 1.96723089641087 | epot = -23.0300125090253 | etot = -18.8645744989147 -507000 ekin = 2.26258673474996 | erot = 2.70466389763239 | epot = -22.9957070923465 | etot = -18.0284564599641 -508000 ekin = 2.63638196787186 | erot = 2.05040146648131 | epot = -23.0074182438498 | etot = -18.3206348094966 -509000 ekin = 2.941534357322 | erot = 2.9116561510807 | epot = -23.0604926861274 | etot = -17.2073021777247 -510000 ekin = 2.26261998090286 | erot = 2.81560695024321 | epot = -23.1751735881193 | etot = -18.0969466569732 -511000 ekin = 2.89882203877689 | erot = 2.15644204743089 | epot = -23.2976829651598 | etot = -18.242418878952 -512000 ekin = 2.18248507908123 | erot = 2.32471465184078 | epot = -23.3729111641778 | etot = -18.8657114332558 -513000 ekin = 1.69088054596992 | erot = 2.87837634409229 | epot = -23.3827433252491 | etot = -18.8134864351869 -514000 ekin = 1.72555879339418 | erot = 2.33322715253437 | epot = -23.3782683624831 | etot = -19.3194824165546 -515000 ekin = 1.99840271010263 | erot = 1.80256652461596 | epot = -23.3732611472924 | etot = -19.5722919125738 -516000 ekin = 3.02857447051151 | erot = 1.5400404903518 | epot = -23.3371239983442 | etot = -18.7685090374808 -517000 ekin = 2.46355229218044 | erot = 2.11387593279357 | epot = -23.3120503202835 | etot = -18.7346220953095 -518000 ekin = 2.03623914203692 | erot = 2.51801359135206 | epot = -23.2489994054059 | etot = -18.6947466720169 -519000 ekin = 1.58667253859857 | erot = 1.63211503072947 | epot = -23.2067561094409 | etot = -19.9879685401128 -520000 ekin = 2.16324608146533 | erot = 1.89657617078696 | epot = -23.2082678544253 | etot = -19.148445602173 -521000 ekin = 1.97686811359425 | erot = 2.0872712571421 | epot = -23.2512754061872 | etot = -19.1871360354508 -522000 ekin = 2.69830866187618 | erot = 2.1956248060682 | epot = -23.3119120700689 | etot = -18.4179786021245 -523000 ekin = 2.24785090987913 | erot = 1.67440253273743 | epot = -23.3589880036331 | etot = -19.4367345610165 -524000 ekin = 2.34889284001673 | erot = 2.1007910786486 | epot = -23.3797580192055 | etot = -18.9300741005401 -525000 ekin = 2.13149576225198 | erot = 2.0723725435025 | epot = -23.4380051055748 | etot = -19.2341367998203 -526000 ekin = 2.50239998087446 | erot = 2.25424985364477 | epot = -23.4972589637756 | etot = -18.7406091292563 -527000 ekin = 3.03515775223167 | erot = 1.80505768055502 | epot = -23.554671119079 | etot = -18.7144556862923 -528000 ekin = 2.5608174763548 | erot = 2.54328225738986 | epot = -23.5720157710688 | etot = -18.4679160373241 -529000 ekin = 2.37506941472445 | erot = 1.93007818421908 | epot = -23.5564414475786 | etot = -19.251293848635 -530000 ekin = 3.3419677281169 | erot = 3.41384036164691 | epot = -23.4493550232615 | etot = -16.6935469334977 -531000 ekin = 2.4235092053109 | erot = 2.35978294499845 | epot = -23.1490536179472 | etot = -18.3657614676379 -532000 ekin = 2.58896799590229 | erot = 1.86978691602605 | epot = -23.165039392045 | etot = -18.7062844801167 -533000 ekin = 2.18027058294701 | erot = 2.16031799038535 | epot = -23.3790946936929 | etot = -19.0385061203605 -534000 ekin = 2.3479868128811 | erot = 2.0385286250955 | epot = -23.4622625656644 | etot = -19.0757471276878 -535000 ekin = 2.3782313722319 | erot = 2.07392590496072 | epot = -23.4816815929821 | etot = -19.0295243157895 -536000 ekin = 2.46212862766406 | erot = 1.89477230721272 | epot = -23.4656032882526 | etot = -19.1087023533758 -537000 ekin = 1.71194009451629 | erot = 2.13445451003515 | epot = -23.5539827524157 | etot = -19.7075881478642 -538000 ekin = 2.16675831406369 | erot = 2.76561566966347 | epot = -23.6593643234718 | etot = -18.7269903397447 -539000 ekin = 2.16624212273309 | erot = 2.29113017698322 | epot = -23.7362705602946 | etot = -19.2788982605782 -540000 ekin = 2.37614209115086 | erot = 1.63783384730145 | epot = -23.7311087126642 | etot = -19.7171327742119 -541000 ekin = 2.61201729538231 | erot = 2.5250031626081 | epot = -23.6609998128446 | etot = -18.5239793548541 -542000 ekin = 2.72899828578995 | erot = 2.10988741791456 | epot = -23.6987729418172 | etot = -18.8598872381126 -543000 ekin = 2.72077400162185 | erot = 1.85643651604112 | epot = -23.6056812049309 | etot = -19.0284706872679 -544000 ekin = 2.11785692900505 | erot = 1.50578231047403 | epot = -23.581427161181 | etot = -19.9577879217019 -545000 ekin = 1.70786262657811 | erot = 2.5699332427333 | epot = -23.5821026874923 | etot = -19.3043068181809 -546000 ekin = 2.38060529409929 | erot = 1.86647004671163 | epot = -23.6101839511561 | etot = -19.3631086103452 -547000 ekin = 2.4524914794752 | erot = 2.45758863876476 | epot = -23.659961725937 | etot = -18.749881607697 -548000 ekin = 2.39048922197387 | erot = 2.39595923181893 | epot = -23.672341518051 | etot = -18.8858930642582 -549000 ekin = 2.59237109487195 | erot = 2.03286301955741 | epot = -23.663402955197 | etot = -19.0381688407676 -550000 ekin = 1.99326412841577 | erot = 1.84900416370414 | epot = -23.6657646794243 | etot = -19.8234963873044 -551000 ekin = 2.44897958881949 | erot = 2.02189459200062 | epot = -23.6223977807006 | etot = -19.1515235998805 -552000 ekin = 2.69506011124378 | erot = 1.4087045289661 | epot = -23.4598817431801 | etot = -19.3561171029703 -553000 ekin = 1.7614112496816 | erot = 2.61025745472483 | epot = -23.2534851194706 | etot = -18.8818164150642 -554000 ekin = 2.30413102985308 | erot = 2.33068531989324 | epot = -23.2170368597895 | etot = -18.5822205100432 -555000 ekin = 3.27044533046142 | erot = 1.64227498681914 | epot = -23.1963457102547 | etot = -18.2836253929742 -556000 ekin = 2.90315678132448 | erot = 2.59895742246943 | epot = -23.1450725642432 | etot = -17.6429583604493 -557000 ekin = 2.91669736278429 | erot = 3.16406737832137 | epot = -23.1449528769861 | etot = -17.0641881358805 -558000 ekin = 2.82900232701285 | erot = 2.71147852622196 | epot = -23.1184803827916 | etot = -17.5779995295568 -559000 ekin = 2.44505587446295 | erot = 3.29469811923283 | epot = -23.1627781618237 | etot = -17.423024168128 -560000 ekin = 2.31904677659936 | erot = 2.34795233137866 | epot = -23.1210700988646 | etot = -18.4540709908866 -561000 ekin = 2.04771931333916 | erot = 2.88228436865011 | epot = -23.024411145941 | etot = -18.0944074639517 -562000 ekin = 2.23091608960519 | erot = 3.71635453668511 | epot = -22.8944164201338 | etot = -16.9471457938435 -563000 ekin = 3.1357852432065 | erot = 2.30361462487037 | epot = -22.9661332369329 | etot = -17.5267333688561 -564000 ekin = 2.43466309429864 | erot = 2.37782011884422 | epot = -22.9389295001135 | etot = -18.1264462869706 -565000 ekin = 2.74708790028088 | erot = 2.07634713087886 | epot = -22.939331551729 | etot = -18.1158965205693 -566000 ekin = 2.4222839122782 | erot = 2.23675738705857 | epot = -22.9632631791452 | etot = -18.3042218798084 -567000 ekin = 2.66083125722037 | erot = 2.00815445030396 | epot = -23.0587738412098 | etot = -18.3897881336855 -568000 ekin = 3.04192088032675 | erot = 1.98454766740893 | epot = -23.1119399549794 | etot = -18.0854714072437 -569000 ekin = 3.57500602366975 | erot = 2.06993473480211 | epot = -23.1169833765643 | etot = -17.4720426180924 -570000 ekin = 2.66021275095562 | erot = 2.34009289778314 | epot = -23.1329733111479 | etot = -18.1326676624092 -571000 ekin = 1.9492727086219 | erot = 2.84215857351434 | epot = -23.059975766874 | etot = -18.2685444847377 -572000 ekin = 2.41534745626505 | erot = 2.40867063666104 | epot = -23.0550186086203 | etot = -18.2310005156942 -573000 ekin = 1.75690848092507 | erot = 2.3167538090557 | epot = -23.1062821980692 | etot = -19.0326199080885 -574000 ekin = 2.10700070451592 | erot = 2.59266019942445 | epot = -23.1953992541668 | etot = -18.4957383502265 -575000 ekin = 2.3766207361603 | erot = 2.79835296504546 | epot = -23.2685471976934 | etot = -18.0935734964876 -576000 ekin = 2.17646651375686 | erot = 3.28542649915204 | epot = -23.3024195314184 | etot = -17.8405265185095 -577000 ekin = 2.48649787916229 | erot = 2.29384528363048 | epot = -23.3336440834232 | etot = -18.5533009206305 -578000 ekin = 2.63489334342406 | erot = 2.38537839776846 | epot = -23.3926914947912 | etot = -18.3724197535987 -579000 ekin = 2.6879639473483 | erot = 1.70827418352421 | epot = -23.3699011030343 | etot = -18.9736629721618 -580000 ekin = 2.35397680707073 | erot = 2.85531289645877 | epot = -23.3791722262718 | etot = -18.1698825227423 -581000 ekin = 2.45623723360352 | erot = 2.60459639714713 | epot = -23.3494339765039 | etot = -18.2886003457532 -582000 ekin = 2.3382526117462 | erot = 3.2061485365379 | epot = -23.4180112490559 | etot = -17.8736101007718 -583000 ekin = 1.96183434404855 | erot = 2.8182320095548 | epot = -23.5859382554133 | etot = -18.80587190181 -584000 ekin = 2.00096532862293 | erot = 1.71661883974024 | epot = -23.6753971791609 | etot = -19.9578130107977 -585000 ekin = 2.26504312453072 | erot = 2.08207426542528 | epot = -23.7221723341546 | etot = -19.3750549441986 -586000 ekin = 2.20198471634668 | erot = 1.96863181734696 | epot = -23.6845937288944 | etot = -19.5139771952007 -587000 ekin = 3.67920423738482 | erot = 1.82482965137738 | epot = -23.6620758789199 | etot = -18.1580419901577 -588000 ekin = 3.48072723000483 | erot = 2.30687784419354 | epot = -23.5628518088072 | etot = -17.7752467346088 -589000 ekin = 2.6301802350708 | erot = 2.97022216183281 | epot = -23.3751519834186 | etot = -17.774749586515 -590000 ekin = 1.60810524494739 | erot = 2.03262567379754 | epot = -23.1930040863614 | etot = -19.5522731676165 -591000 ekin = 1.81653979391832 | erot = 1.75590363843925 | epot = -23.1286401679288 | etot = -19.5561967355713 -592000 ekin = 2.57251131663395 | erot = 2.59255636832343 | epot = -23.1517404198258 | etot = -17.9866727348685 -593000 ekin = 2.43680227955855 | erot = 1.78797812851328 | epot = -23.101945124129 | etot = -18.8771647160572 -594000 ekin = 2.12130372154182 | erot = 2.16319738901753 | epot = -23.0522428105757 | etot = -18.7677417000163 -595000 ekin = 2.61503378317223 | erot = 2.04014237870419 | epot = -23.0400690201979 | etot = -18.3848928583215 -596000 ekin = 2.5838826262171 | erot = 2.12601862315907 | epot = -23.0972897944143 | etot = -18.3873885450381 -597000 ekin = 3.03557942938101 | erot = 3.13923818214656 | epot = -23.0945090272485 | etot = -16.9196914157209 -598000 ekin = 3.44798129544029 | erot = 2.86439798217039 | epot = -23.1511239016259 | etot = -16.8387446240152 -599000 ekin = 2.14574146166173 | erot = 3.49764417749902 | epot = -23.122284004392 | etot = -17.4788983652312 -600000 ekin = 2.20860876734766 | erot = 2.50874056137532 | epot = -23.121641128369 | etot = -18.4042917996461 -601000 ekin = 2.82315501435403 | erot = 2.82784045939002 | epot = -23.0925533117084 | etot = -17.4415578379644 -602000 ekin = 2.33761512592198 | erot = 2.38145173595585 | epot = -23.0579577028674 | etot = -18.3388908409896 -603000 ekin = 1.93160054442741 | erot = 1.95556752436392 | epot = -22.9401029172158 | etot = -19.0529348484245 -604000 ekin = 2.6789810993261 | erot = 3.14412986031109 | epot = -22.910832287093 | etot = -17.0877213274558 -605000 ekin = 2.71997631755228 | erot = 2.06416447860583 | epot = -22.9239871466825 | etot = -18.1398463505244 -606000 ekin = 2.99643636348445 | erot = 2.03201196902714 | epot = -22.8415583488471 | etot = -17.8131100163355 -607000 ekin = 2.88272893636888 | erot = 2.37624693398617 | epot = -22.8254440726334 | etot = -17.5664682022784 -608000 ekin = 3.65630425769789 | erot = 2.4609503215642 | epot = -22.762585585759 | etot = -16.6453310064969 -609000 ekin = 2.67762341692564 | erot = 2.28055578469673 | epot = -22.7828567112764 | etot = -17.824677509654 -610000 ekin = 2.96652133048089 | erot = 2.13934256593668 | epot = -22.7741547643332 | etot = -17.6682908679156 -611000 ekin = 3.84932586877613 | erot = 2.13519046445732 | epot = -22.7544276213926 | etot = -16.7699112881591 -612000 ekin = 2.85989656018767 | erot = 2.46801741609839 | epot = -22.6660352466822 | etot = -17.3381212703962 -613000 ekin = 2.93453113084909 | erot = 2.15612014750899 | epot = -22.6610069845369 | etot = -17.5703557061788 -614000 ekin = 2.80105508963963 | erot = 2.03410273106392 | epot = -22.7348632778619 | etot = -17.8997054571583 -615000 ekin = 2.29275813765167 | erot = 2.37294703205248 | epot = -22.8254873753585 | etot = -18.1597822056544 -616000 ekin = 1.78885710821491 | erot = 2.46510899047625 | epot = -22.9171248890198 | etot = -18.6631587903287 -617000 ekin = 2.58551875410709 | erot = 2.5373402867597 | epot = -22.9360764839305 | etot = -17.8132174430637 -618000 ekin = 2.31892663964202 | erot = 2.68589041417607 | epot = -22.8727518088247 | etot = -17.8679347550066 -619000 ekin = 1.95263551601201 | erot = 2.00547599081928 | epot = -22.8336441658867 | etot = -18.8755326590554 -620000 ekin = 2.93125230382283 | erot = 2.17152517775752 | epot = -22.9083331407927 | etot = -17.8055556592123 -621000 ekin = 2.92256345141131 | erot = 1.69365804073587 | epot = -22.9481701549848 | etot = -18.3319486628377 -622000 ekin = 2.04586667934044 | erot = 2.52349184406704 | epot = -22.8875044323845 | etot = -18.318145908977 -623000 ekin = 1.97950132185482 | erot = 3.07798060074862 | epot = -22.8981219896543 | etot = -17.8406400670509 -624000 ekin = 2.09648418588882 | erot = 2.6543004426831 | epot = -22.9137783443298 | etot = -18.1629937157579 -625000 ekin = 2.53180941807541 | erot = 2.36094945875658 | epot = -22.9713145545226 | etot = -18.0785556776906 -626000 ekin = 2.71470092938691 | erot = 2.03801315634257 | epot = -22.9996382199111 | etot = -18.2469241341817 -627000 ekin = 2.22369596417806 | erot = 2.35283010947608 | epot = -22.9578688816797 | etot = -18.3813428080256 -628000 ekin = 2.27999602854394 | erot = 2.28859122795553 | epot = -22.8528131434533 | etot = -18.2842258869538 -629000 ekin = 2.52123682351367 | erot = 1.89626016629389 | epot = -22.7899249071395 | etot = -18.372427917332 -630000 ekin = 3.09552317576679 | erot = 2.51631689437832 | epot = -22.7146675453805 | etot = -17.1028274752354 -631000 ekin = 2.38490277583395 | erot = 3.31743656633136 | epot = -22.7264783640902 | etot = -17.0241390219248 -632000 ekin = 2.58507904222623 | erot = 2.52764941236063 | epot = -22.679176298765 | etot = -17.5664478441781 -633000 ekin = 2.43449371039936 | erot = 1.90741463354387 | epot = -22.6535443404276 | etot = -18.3116359964843 -634000 ekin = 2.22577214221416 | erot = 2.00782187507303 | epot = -22.5713359353359 | etot = -18.3377419180487 -635000 ekin = 2.21828703186448 | erot = 1.98254572604181 | epot = -22.5412406270617 | etot = -18.3404078691554 -636000 ekin = 2.25203768985671 | erot = 2.77892756814694 | epot = -22.5726302712271 | etot = -17.5416650132235 -637000 ekin = 1.94361631144887 | erot = 2.61217525293607 | epot = -22.6025759792528 | etot = -18.0467844148678 -638000 ekin = 2.53948853675747 | erot = 3.14008150742344 | epot = -22.5816815234452 | etot = -16.9021114792643 -639000 ekin = 2.37754295974937 | erot = 2.49543508367508 | epot = -22.5440763882375 | etot = -17.671098344813 -640000 ekin = 2.08220370718338 | erot = 2.2194194329635 | epot = -22.4524516894458 | etot = -18.1508285492989 -641000 ekin = 2.47978319917432 | erot = 3.55852054823509 | epot = -22.3492008411224 | etot = -16.310897093713 -642000 ekin = 3.38960132344713 | erot = 2.18185754829543 | epot = -22.2381539280913 | etot = -16.6666950563487 -643000 ekin = 2.84882938996105 | erot = 2.41327361032682 | epot = -22.1919035544934 | etot = -16.9298005542056 -644000 ekin = 2.97883864641817 | erot = 1.93798086343986 | epot = -22.1756635530162 | etot = -17.2588440431582 -645000 ekin = 4.12551460905463 | erot = 1.89960199669213 | epot = -22.1698840200029 | etot = -16.1447674142562 -646000 ekin = 2.52696700152244 | erot = 2.00637752228798 | epot = -22.1094379456324 | etot = -17.576093421822 -647000 ekin = 2.55510613012742 | erot = 2.20923063557538 | epot = -22.15306269638 | etot = -17.3887259306772 -648000 ekin = 3.02954161965434 | erot = 2.11327379217002 | epot = -22.1567476137635 | etot = -17.0139322019391 -649000 ekin = 2.58451162799693 | erot = 3.20634164199495 | epot = -22.1331170602233 | etot = -16.3422637902314 -650000 ekin = 3.77201429520633 | erot = 2.43067850654692 | epot = -22.0829669606205 | etot = -15.8802741588673 -651000 ekin = 3.31373950314884 | erot = 2.36225009565165 | epot = -21.9236843158819 | etot = -16.2476947170814 -652000 ekin = 2.49269048046144 | erot = 3.02152130835781 | epot = -21.7248332635395 | etot = -16.2106214747202 -653000 ekin = 2.82562653528407 | erot = 2.5389983180152 | epot = -21.720584398338 | etot = -16.3559595450387 -654000 ekin = 2.35162706281986 | erot = 2.1592221935512 | epot = -21.9212844347389 | etot = -17.4104351783678 -655000 ekin = 2.27465971046838 | erot = 2.12498228082651 | epot = -21.901368818889 | etot = -17.5017268275941 -656000 ekin = 2.33863364839044 | erot = 2.10521355308809 | epot = -21.9220753944062 | etot = -17.4782281929276 -657000 ekin = 2.74434430715418 | erot = 2.19004311145519 | epot = -22.136208072754 | etot = -17.2018206541446 -658000 ekin = 3.04725229200292 | erot = 2.59754076353072 | epot = -22.2930322879088 | etot = -16.6482392323752 -659000 ekin = 2.86433120437707 | erot = 3.42151787717832 | epot = -22.2980196003195 | etot = -16.0121705187641 -660000 ekin = 2.91954234725913 | erot = 1.63326659953276 | epot = -22.3386449739967 | etot = -17.7858360272048 -661000 ekin = 3.21083352573749 | erot = 1.8634965142938 | epot = -22.464255649999 | etot = -17.3899256099677 -662000 ekin = 3.05903745891172 | erot = 2.20029510410105 | epot = -22.5554071532051 | etot = -17.2960745901923 -663000 ekin = 1.91661647748247 | erot = 2.47135637120535 | epot = -22.6199107053331 | etot = -18.2319378566453 -664000 ekin = 1.43090369100425 | erot = 1.36491647540447 | epot = -22.7069611889569 | etot = -19.9111410225482 -665000 ekin = 1.55691746213238 | erot = 2.30942311266534 | epot = -22.7825901033953 | etot = -18.9162495285975 -666000 ekin = 2.44471757511112 | erot = 1.77340988320563 | epot = -22.9221213287866 | etot = -18.7039938704699 -667000 ekin = 2.81231115159421 | erot = 2.33234433996922 | epot = -23.1090557968116 | etot = -17.9644003052482 -668000 ekin = 2.71678052291266 | erot = 3.19300727255308 | epot = -23.1841400059555 | etot = -17.2743522104898 -669000 ekin = 3.42188935289467 | erot = 2.44862028635832 | epot = -23.2319725107707 | etot = -17.3614628715177 -670000 ekin = 2.54095648172786 | erot = 1.9812604087298 | epot = -23.1732308879544 | etot = -18.6510139974967 -671000 ekin = 2.3805663479416 | erot = 2.98378557997481 | epot = -23.1367627748431 | etot = -17.7724108469267 -672000 ekin = 3.02750640268286 | erot = 2.54451073535057 | epot = -23.1209945952621 | etot = -17.5489774572287 -673000 ekin = 3.42534085203218 | erot = 2.36776710166581 | epot = -23.0340816238788 | etot = -17.2409736701808 -674000 ekin = 3.1798335968179 | erot = 2.09974053793233 | epot = -22.9543522982093 | etot = -17.6747781634591 -675000 ekin = 2.35355980125584 | erot = 1.53476738200232 | epot = -22.8483076435154 | etot = -18.9599804602572 -676000 ekin = 2.44776916428191 | erot = 2.24648852028555 | epot = -22.7702475408439 | etot = -18.0759898562764 -677000 ekin = 2.75780413162083 | erot = 1.93135039840676 | epot = -22.8504049108609 | etot = -18.1612503808333 -678000 ekin = 2.86691036183901 | erot = 1.65298998733351 | epot = -22.8624995890271 | etot = -18.3425992398546 -679000 ekin = 2.3422515492929 | erot = 2.69060711211823 | epot = -22.9306443341676 | etot = -17.8977856727565 -680000 ekin = 2.47029457301042 | erot = 2.90804485320413 | epot = -22.9871466954175 | etot = -17.6088072692029 -681000 ekin = 1.90527495083164 | erot = 2.57752516482763 | epot = -22.9202555721454 | etot = -18.4374554564861 -682000 ekin = 2.11691016409813 | erot = 2.69948323324142 | epot = -22.8360698295072 | etot = -18.0196764321677 -683000 ekin = 2.36499416502711 | erot = 2.12378773338609 | epot = -22.7222509077472 | etot = -18.233469009334 -684000 ekin = 2.87417187528689 | erot = 2.65554383853006 | epot = -22.652968937805 | etot = -17.1232532239881 -685000 ekin = 3.04542408260429 | erot = 2.17388790678976 | epot = -22.6211255864198 | etot = -17.4018135970258 -686000 ekin = 2.4572232047866 | erot = 2.42733555780261 | epot = -22.5527218647546 | etot = -17.6681631021654 -687000 ekin = 2.74674649482159 | erot = 1.80406297330729 | epot = -22.4878814460607 | etot = -17.9370719779318 -688000 ekin = 1.79261906898015 | erot = 2.04571284009142 | epot = -22.4053085173396 | etot = -18.566976608268 -689000 ekin = 2.87728983191097 | erot = 1.89493579527769 | epot = -22.4572844245428 | etot = -17.6850587973542 -690000 ekin = 2.12417515140944 | erot = 2.42424686393433 | epot = -22.5714890244145 | etot = -18.0230670090707 -691000 ekin = 2.15969911943639 | erot = 2.52979832764676 | epot = -22.5876082022333 | etot = -17.8981107551501 -692000 ekin = 2.88674525045811 | erot = 2.651929872236 | epot = -22.4776759351877 | etot = -16.9390008124936 -693000 ekin = 2.3092809474595 | erot = 2.51902774155063 | epot = -22.3434837669245 | etot = -17.5151750779144 -694000 ekin = 2.90071779504629 | erot = 2.34205397880616 | epot = -22.2602593853742 | etot = -17.0174876115217 -695000 ekin = 2.95797030089466 | erot = 2.23892898139626 | epot = -22.3013052624001 | etot = -17.1044059801092 -696000 ekin = 2.65789992313128 | erot = 2.33957912785853 | epot = -22.3428209998027 | etot = -17.3453419488129 -697000 ekin = 1.89103531712653 | erot = 1.78294584711428 | epot = -22.3504400882104 | etot = -18.6764589239696 -698000 ekin = 2.22798162215976 | erot = 2.82524697464217 | epot = -22.3736356240205 | etot = -17.3204070272186 -699000 ekin = 2.35365478600885 | erot = 2.0687167283237 | epot = -22.3018254917899 | etot = -17.8794539774573 -700000 ekin = 2.58198996587039 | erot = 2.33085240245665 | epot = -22.2602257590337 | etot = -17.3473833907067 -701000 ekin = 2.99678089142865 | erot = 1.89950599572306 | epot = -22.3219835402767 | etot = -17.425696653125 -702000 ekin = 2.67515901971843 | erot = 2.64727221788161 | epot = -22.3592261887725 | etot = -17.0367949511725 -703000 ekin = 2.02349561650625 | erot = 2.03753398299055 | epot = -22.4335933513225 | etot = -18.3725637518257 -704000 ekin = 1.59653691808601 | erot = 1.63621743826809 | epot = -22.4663049532561 | etot = -19.233550596902 -705000 ekin = 2.34017756427041 | erot = 1.91003662789066 | epot = -22.5429518289027 | etot = -18.2927376367416 -706000 ekin = 2.47923684970646 | erot = 3.2700255708033 | epot = -22.5105468727032 | etot = -16.7612844521934 -707000 ekin = 2.38606338090128 | erot = 2.41702366807843 | epot = -22.6028317136512 | etot = -17.7997446646715 -708000 ekin = 1.68126488203551 | erot = 2.34005210871502 | epot = -22.7455626577094 | etot = -18.7242456669589 -709000 ekin = 1.80997013861619 | erot = 2.57925481113812 | epot = -23.0628207828654 | etot = -18.6735958331111 -710000 ekin = 2.07663470081894 | erot = 1.83621025520769 | epot = -23.1969975442429 | etot = -19.2841525882163 -711000 ekin = 1.95348523042278 | erot = 2.41454584124981 | epot = -23.2350510297748 | etot = -18.8670199581022 -712000 ekin = 2.1336102176431 | erot = 1.78657393325109 | epot = -23.2637922718023 | etot = -19.3436081209081 -713000 ekin = 2.90681618138139 | erot = 1.55095647140783 | epot = -23.1828218540472 | etot = -18.725049201258 -714000 ekin = 2.06612414721503 | erot = 1.86613874365067 | epot = -23.2231257100263 | etot = -19.2908628191606 -715000 ekin = 2.52896020774463 | erot = 1.94259727228635 | epot = -23.1650750564771 | etot = -18.6935175764461 -716000 ekin = 3.03493559712718 | erot = 2.21063194998576 | epot = -23.220942309801 | etot = -17.975374762688 -717000 ekin = 3.0796637775291 | erot = 2.47088132553581 | epot = -23.3632103988425 | etot = -17.8126652957776 -718000 ekin = 3.49698025039097 | erot = 2.2716592270022 | epot = -23.4191136876981 | etot = -17.6504742103049 -719000 ekin = 4.06136594689253 | erot = 3.10418551930051 | epot = -23.4063666180316 | etot = -16.2408151518386 -720000 ekin = 2.49833724515039 | erot = 1.90909716223089 | epot = -23.2614962660793 | etot = -18.854061858698 -721000 ekin = 2.57942252693403 | erot = 1.98570182653287 | epot = -23.1432472967431 | etot = -18.5781229432762 -722000 ekin = 2.01088679016935 | erot = 2.27470118196201 | epot = -23.1033008622402 | etot = -18.8177128901089 -723000 ekin = 2.44107678295511 | erot = 2.07629727323011 | epot = -23.182141318077 | etot = -18.6647672618918 -724000 ekin = 1.90803238982749 | erot = 1.93595857250405 | epot = -23.2369669247167 | etot = -19.3929759623851 -725000 ekin = 2.19380758227312 | erot = 2.80513053743865 | epot = -23.2881919599432 | etot = -18.2892538402315 -726000 ekin = 2.27661543234077 | erot = 2.54381748597239 | epot = -23.3349497821497 | etot = -18.5145168638365 -727000 ekin = 1.72229690120046 | erot = 2.6256783446951 | epot = -23.3699085142538 | etot = -19.0219332683583 -728000 ekin = 2.25091852567842 | erot = 3.59487379729856 | epot = -23.4350255191465 | etot = -17.5892331961695 -729000 ekin = 2.68838496984081 | erot = 1.72110395862725 | epot = -23.4780978913558 | etot = -19.0686089628877 -730000 ekin = 2.53299506461663 | erot = 2.76668907196319 | epot = -23.4895234062855 | etot = -18.1898392697057 -731000 ekin = 2.6760609217159 | erot = 2.04582604734292 | epot = -23.5238636820392 | etot = -18.8019767129804 -732000 ekin = 2.77846316806001 | erot = 1.88433334184077 | epot = -23.5770897435819 | etot = -18.9142932336812 -733000 ekin = 2.18892933871209 | erot = 2.6346843690662 | epot = -23.6104212257528 | etot = -18.7868075179745 -734000 ekin = 1.69459813153559 | erot = 2.30332709760983 | epot = -23.5932285157933 | etot = -19.5953032866479 -735000 ekin = 2.17738229724133 | erot = 2.71615420236581 | epot = -23.5325385675669 | etot = -18.6390020679598 -736000 ekin = 2.29368650601869 | erot = 1.17411705869823 | epot = -23.5029023896105 | etot = -20.0350988248936 -737000 ekin = 2.20822665790328 | erot = 3.11529898775426 | epot = -23.4546507116664 | etot = -18.1311250660089 -738000 ekin = 1.72299649032066 | erot = 2.28748751322147 | epot = -23.3303512731973 | etot = -19.3198672696552 -739000 ekin = 1.39485421458765 | erot = 2.1749073819018 | epot = -23.2849045067521 | etot = -19.7151429102627 -740000 ekin = 1.90421462896905 | erot = 2.27824600991221 | epot = -23.2508192404176 | etot = -19.0683586015364 -741000 ekin = 2.02016004868753 | erot = 2.72072555133488 | epot = -23.1869993966325 | etot = -18.4461137966101 -742000 ekin = 1.97476522388772 | erot = 1.87542520854124 | epot = -23.0922795240436 | etot = -19.2420890916146 -743000 ekin = 1.96482892297271 | erot = 2.7698229839544 | epot = -22.9312319116298 | etot = -18.1965800047027 -744000 ekin = 2.04907219390093 | erot = 2.34374807852806 | epot = -22.8504155274904 | etot = -18.4575952550614 -745000 ekin = 1.66770541517404 | erot = 1.87268797271618 | epot = -22.7970674500482 | etot = -19.256674062158 -746000 ekin = 2.11646191189726 | erot = 2.03543326686021 | epot = -22.7779244301375 | etot = -18.6260292513801 -747000 ekin = 3.07958266175499 | erot = 1.66913380114814 | epot = -22.8031371397658 | etot = -18.0544206768627 -748000 ekin = 3.03808653180953 | erot = 1.85632270757018 | epot = -22.842986346491 | etot = -17.9485771071113 -749000 ekin = 2.53758140749286 | erot = 2.01198418352658 | epot = -22.8596787422339 | etot = -18.3101131512145 -750000 ekin = 2.77211189937696 | erot = 2.32629771282836 | epot = -22.9522411003111 | etot = -17.8538314881058 -751000 ekin = 2.52041553848886 | erot = 2.34908561849257 | epot = -23.012198741928 | etot = -18.1426975849466 -752000 ekin = 2.46415827942669 | erot = 1.68869996421912 | epot = -22.9896556476389 | etot = -18.8367974039931 -753000 ekin = 2.47374307089788 | erot = 1.55777194971628 | epot = -23.1131588644731 | etot = -19.081643843859 -754000 ekin = 2.52796878003787 | erot = 2.29498052924916 | epot = -23.2400216607328 | etot = -18.4170723514458 -755000 ekin = 1.52934821736739 | erot = 2.21323453725358 | epot = -23.2617539322798 | etot = -19.5191711776588 -756000 ekin = 2.10421856984007 | erot = 2.40302151559052 | epot = -23.1682224257729 | etot = -18.6609823403423 -757000 ekin = 2.92556811452857 | erot = 2.06915289798223 | epot = -23.1499528985793 | etot = -18.1552318860685 -758000 ekin = 2.37294922982789 | erot = 2.5136802398028 | epot = -23.0492487158129 | etot = -18.1626192461822 -759000 ekin = 2.60143135392931 | erot = 2.3965867167667 | epot = -22.9022185044006 | etot = -17.9042004337045 -760000 ekin = 3.23086795451839 | erot = 2.77070394347185 | epot = -22.8086083978769 | etot = -16.8070364998867 -761000 ekin = 3.41474520443683 | erot = 1.70182284622131 | epot = -22.7401488061481 | etot = -17.62358075549 -762000 ekin = 3.40874138334159 | erot = 2.5214687610176 | epot = -22.5273378250467 | etot = -16.5971276806875 -763000 ekin = 2.64282337808311 | erot = 1.82465845176878 | epot = -22.3886968592841 | etot = -17.9212150294322 -764000 ekin = 2.38098374928432 | erot = 2.71455514893631 | epot = -22.2306429954919 | etot = -17.1351040972713 -765000 ekin = 2.24220112607173 | erot = 1.94828018292253 | epot = -22.1222898533813 | etot = -17.931808544387 -766000 ekin = 2.50647054308507 | erot = 1.96127686565097 | epot = -21.9854922894721 | etot = -17.5177448807361 -767000 ekin = 2.34036216095461 | erot = 2.64592662901366 | epot = -21.9049052626546 | etot = -16.9186164726863 -768000 ekin = 1.86756150924074 | erot = 2.06140692143859 | epot = -21.8871911578369 | etot = -17.9582227271576 -769000 ekin = 3.0359885140629 | erot = 2.66441888317467 | epot = -21.8245365321496 | etot = -16.124129134912 -770000 ekin = 2.42572833720737 | erot = 1.97830348673474 | epot = -21.8109221594649 | etot = -17.4068903355227 -771000 ekin = 2.20057185883112 | erot = 2.53258595631101 | epot = -21.734014677427 | etot = -17.0008568622849 -772000 ekin = 2.75017737220644 | erot = 1.98404504724256 | epot = -21.81636663385 | etot = -17.082144214401 -773000 ekin = 2.14723700449497 | erot = 2.4151160924984 | epot = -21.9575475647945 | etot = -17.3951944678011 -774000 ekin = 2.20540233527262 | erot = 1.98379632188094 | epot = -22.0437158124788 | etot = -17.8545171553253 -775000 ekin = 2.53159855409247 | erot = 2.82258836068 | epot = -22.2468791717252 | etot = -16.8926922569528 -776000 ekin = 3.15990337350763 | erot = 2.46223603653204 | epot = -22.4204095516686 | etot = -16.7982701416289 -777000 ekin = 1.91544508000443 | erot = 1.75409994742756 | epot = -22.4517072920931 | etot = -18.7821622646612 -778000 ekin = 2.94664557229421 | erot = 2.31806053358263 | epot = -22.4632053661323 | etot = -17.1984992602554 -779000 ekin = 3.10966911142499 | erot = 2.04445735728845 | epot = -22.4851293821807 | etot = -17.3310029134672 -780000 ekin = 2.85217648357475 | erot = 3.13312150331092 | epot = -22.4501336819041 | etot = -16.4648356950184 -781000 ekin = 2.36735214903647 | erot = 3.56398811585504 | epot = -22.4171223027496 | etot = -16.4857820378581 -782000 ekin = 2.32799229473909 | erot = 2.86342068433246 | epot = -22.3437898412805 | etot = -17.1523768622089 -783000 ekin = 1.86441476378237 | erot = 3.05235927245358 | epot = -22.2079503227603 | etot = -17.2911762865243 -784000 ekin = 2.05475171167698 | erot = 2.29789662368463 | epot = -22.1006582038569 | etot = -17.7480098684953 -785000 ekin = 2.03881379634772 | erot = 2.15051381788682 | epot = -22.005618673928 | etot = -17.8162910596935 -786000 ekin = 2.37521569747453 | erot = 2.3215726256904 | epot = -21.9728072887761 | etot = -17.2760189656112 -787000 ekin = 2.76687650937794 | erot = 2.23624710557919 | epot = -21.8969738615634 | etot = -16.8938502466062 -788000 ekin = 2.13321139238913 | erot = 2.25164618737296 | epot = -21.8604412147426 | etot = -17.4755836349805 -789000 ekin = 1.98219933423288 | erot = 1.98059715582116 | epot = -21.8441893392272 | etot = -17.8813928491731 -790000 ekin = 1.67847666786903 | erot = 1.42561139395642 | epot = -21.941381415519 | etot = -18.8372933536936 -791000 ekin = 2.12688741327067 | erot = 2.53203269325841 | epot = -22.0865399118969 | etot = -17.4276198053679 -792000 ekin = 1.72796321880606 | erot = 2.2244832123241 | epot = -22.1855187635199 | etot = -18.2330723323897 -793000 ekin = 3.18410749492954 | erot = 1.94059536299771 | epot = -22.376174949317 | etot = -17.2514720913897 -794000 ekin = 2.49072782508363 | erot = 3.01187609729573 | epot = -22.4316780454308 | etot = -16.9290741230515 -795000 ekin = 2.89848925116022 | erot = 3.07660091365902 | epot = -22.516587410981 | etot = -16.5414972461618 -796000 ekin = 2.32849309170709 | erot = 1.6270978552186 | epot = -22.5662306303253 | etot = -18.6106396833996 -797000 ekin = 2.20767832793875 | erot = 3.65977564474856 | epot = -22.5353770098516 | etot = -16.6679230371643 -798000 ekin = 2.12139192163862 | erot = 2.94416204631962 | epot = -22.5360308536834 | etot = -17.4704768857252 -799000 ekin = 2.48451269034698 | erot = 2.74154593614504 | epot = -22.494267326257 | etot = -17.2682086997649 -800000 ekin = 2.17522042927318 | erot = 2.96479501864727 | epot = -22.3819091222467 | etot = -17.2418936743262 -801000 ekin = 2.54693512060825 | erot = 2.74965360561443 | epot = -22.3009510878525 | etot = -17.0043623616298 -802000 ekin = 3.02825099239106 | erot = 2.89157545074505 | epot = -22.2025114687808 | etot = -16.2826850256447 -803000 ekin = 2.21045049668896 | erot = 2.51592023666071 | epot = -22.1070021550193 | etot = -17.3806314216696 -804000 ekin = 2.91059686956699 | erot = 1.58302660030682 | epot = -22.0840071528844 | etot = -17.5903836830106 -805000 ekin = 2.67761934757361 | erot = 3.069720635569 | epot = -22.0793582077661 | etot = -16.3320182246235 -806000 ekin = 2.75980762879093 | erot = 2.21769953441322 | epot = -22.0550306032646 | etot = -17.0775234400604 -807000 ekin = 2.11045367551317 | erot = 2.83920073001796 | epot = -22.1075830544478 | etot = -17.1579286489166 -808000 ekin = 1.84392497979905 | erot = 2.29793977175805 | epot = -22.0755335570562 | etot = -17.9336688054991 -809000 ekin = 1.93171637862302 | erot = 1.94017253306181 | epot = -22.066928232689 | etot = -18.1950393210042 -810000 ekin = 1.97775979279028 | erot = 2.64727266267807 | epot = -22.1021133187779 | etot = -17.4770808633095 -811000 ekin = 2.24172070509422 | erot = 1.75504577244544 | epot = -22.10631129566 | etot = -18.1095448181203 -812000 ekin = 2.49050572737176 | erot = 2.33987726148268 | epot = -22.1241871902584 | etot = -17.2938042014039 -813000 ekin = 3.01752815471752 | erot = 2.24002143249121 | epot = -22.116807731716 | etot = -16.8592581445073 -814000 ekin = 2.86042310191006 | erot = 2.24117753130618 | epot = -22.1084772529156 | etot = -17.0068766196994 -815000 ekin = 2.57504250841232 | erot = 2.76211504651086 | epot = -21.9950814575784 | etot = -16.6579239026553 -816000 ekin = 2.19959057655107 | erot = 2.59196925340511 | epot = -22.0843867435381 | etot = -17.2928269135819 -817000 ekin = 1.75064707017923 | erot = 2.66165145686199 | epot = -22.3740333039416 | etot = -17.9617347769004 -818000 ekin = 2.24812511950443 | erot = 2.59024748858361 | epot = -22.5610880116939 | etot = -17.7227154036058 -819000 ekin = 2.12541380503016 | erot = 2.59620266733555 | epot = -22.5607008655742 | etot = -17.8390843932085 -820000 ekin = 1.93417567600985 | erot = 2.29084462576239 | epot = -22.4839831235988 | etot = -18.2589628218266 -821000 ekin = 2.11386397679857 | erot = 2.38686655216469 | epot = -22.4763699831312 | etot = -17.9756394541679 -822000 ekin = 2.26135055598867 | erot = 2.12059051821569 | epot = -22.3710179425218 | etot = -17.9890768683174 -823000 ekin = 2.31556864207286 | erot = 2.6035211830053 | epot = -22.4989638717259 | etot = -17.5798740466477 -824000 ekin = 1.73693100722561 | erot = 1.5184813450247 | epot = -22.6200824712308 | etot = -19.3646701189804 -825000 ekin = 1.63610511008412 | erot = 1.97729484626479 | epot = -22.6198519859023 | etot = -19.0064520295534 -826000 ekin = 2.00840924391468 | erot = 2.17848588495273 | epot = -22.5466792805529 | etot = -18.3597841516855 -827000 ekin = 2.18458017496693 | erot = 2.44710855022062 | epot = -22.4005998352674 | etot = -17.7689111100799 -828000 ekin = 1.91041039942926 | erot = 2.73448484092911 | epot = -22.3948766951947 | etot = -17.7499814548364 -829000 ekin = 2.07229941615034 | erot = 2.97135025315954 | epot = -22.434811171522 | etot = -17.3911615022121 -830000 ekin = 1.99297455547369 | erot = 2.1576588802149 | epot = -22.4844092218597 | etot = -18.3337757861711 -831000 ekin = 2.33243999410257 | erot = 2.3763340012213 | epot = -22.5757447430944 | etot = -17.8669707477706 -832000 ekin = 2.02856837401183 | erot = 1.94730405553331 | epot = -22.6670646845116 | etot = -18.6911922549664 -833000 ekin = 2.28622313757813 | erot = 2.15106977742247 | epot = -22.7567197431772 | etot = -18.3194268281767 -834000 ekin = 2.1210378005443 | erot = 1.51167848496405 | epot = -22.7736040844494 | etot = -19.140887798941 -835000 ekin = 2.88530231894867 | erot = 2.74026724638582 | epot = -22.8585460390106 | etot = -17.2329764736761 -836000 ekin = 3.3206881354596 | erot = 2.42232340907521 | epot = -22.8959173733727 | etot = -17.1529058288379 -837000 ekin = 2.74147966492743 | erot = 2.32128866347136 | epot = -22.890688089557 | etot = -17.8279197611582 -838000 ekin = 3.13304582679089 | erot = 3.19831100603569 | epot = -22.9167021580119 | etot = -16.5853453251853 -839000 ekin = 2.73524310738819 | erot = 2.61098784970539 | epot = -22.8499775738039 | etot = -17.5037466167103 -840000 ekin = 2.9714125620732 | erot = 1.43156525093809 | epot = -22.7764096370098 | etot = -18.3734318239986 -841000 ekin = 2.95720011963303 | erot = 2.67281496410328 | epot = -22.74090696109 | etot = -17.1108918773537 -842000 ekin = 2.17222072547984 | erot = 2.30477888514471 | epot = -22.7382739265758 | etot = -18.2612743159512 -843000 ekin = 2.83293093637601 | erot = 2.04166092897363 | epot = -22.7426999769084 | etot = -17.8681081115587 -844000 ekin = 2.95939838423659 | erot = 1.50200392453934 | epot = -22.7837663105733 | etot = -18.3223640017974 -845000 ekin = 3.16075268425023 | erot = 2.28217181916471 | epot = -22.7914034530237 | etot = -17.3484789496088 -846000 ekin = 3.33989324329164 | erot = 2.53602590130801 | epot = -22.7943672716087 | etot = -16.918448127009 -847000 ekin = 2.14144439713513 | erot = 2.75036646754355 | epot = -22.7256188129676 | etot = -17.8338079482889 -848000 ekin = 2.4890850279473 | erot = 2.8187435102158 | epot = -22.5834530760368 | etot = -17.2756245378737 -849000 ekin = 1.98022709854769 | erot = 2.56921409657545 | epot = -22.4587362353358 | etot = -17.9092950402127 -850000 ekin = 2.04755793529054 | erot = 1.80627828287466 | epot = -22.4428719719836 | etot = -18.5890357538184 -851000 ekin = 2.09705201250659 | erot = 1.85768714478959 | epot = -22.4344321769461 | etot = -18.4796930196499 -852000 ekin = 1.70813063193921 | erot = 1.42387240689476 | epot = -22.3764716053444 | etot = -19.2444685665104 -853000 ekin = 2.00143066511545 | erot = 3.04689486443609 | epot = -22.4103416022683 | etot = -17.3620160727168 -854000 ekin = 3.02152778379787 | erot = 2.22991487666191 | epot = -22.4965524184488 | etot = -17.245109757989 -855000 ekin = 2.19608144065262 | erot = 2.83673950685791 | epot = -22.5084193524114 | etot = -17.4755984049009 -856000 ekin = 2.44947147813647 | erot = 1.52884725004682 | epot = -22.4898702614234 | etot = -18.5115515332401 -857000 ekin = 2.53343898625603 | erot = 2.80401080702751 | epot = -22.3987166021506 | etot = -17.0612668088671 -858000 ekin = 2.20262532647404 | erot = 2.8247792069788 | epot = -22.32281615969 | etot = -17.2954116262372 -859000 ekin = 2.30654937158539 | erot = 2.3142791907112 | epot = -22.299521643743 | etot = -17.6786930814465 -860000 ekin = 1.99694898863895 | erot = 1.95028208283263 | epot = -22.3157281013929 | etot = -18.3684970299213 -861000 ekin = 2.69685720778408 | erot = 2.24433692481965 | epot = -22.308684325649 | etot = -17.3674901930452 -862000 ekin = 2.86020772842225 | erot = 2.41684858841926 | epot = -22.2875015844601 | etot = -17.0104452676185 -863000 ekin = 2.60869027955544 | erot = 3.3557429503542 | epot = -22.2313715051009 | etot = -16.2669382751913 -864000 ekin = 2.90975887606274 | erot = 2.2974711132053 | epot = -22.1986440077119 | etot = -16.9914140184438 -865000 ekin = 1.92891179669311 | erot = 2.15731612388581 | epot = -22.0985432850411 | etot = -18.0123153644622 -866000 ekin = 1.96989214479485 | erot = 1.64765168847281 | epot = -21.9980789481616 | etot = -18.380535114894 -867000 ekin = 1.75216909752833 | erot = 3.37220321936945 | epot = -21.9061232860984 | etot = -16.7817509692006 -868000 ekin = 1.82818520973491 | erot = 2.7944755326823 | epot = -21.9402402920261 | etot = -17.3175795496089 -869000 ekin = 2.38093069905802 | erot = 2.38587933771677 | epot = -22.0330352056336 | etot = -17.2662251688588 -870000 ekin = 1.91335987165478 | erot = 3.22058308836822 | epot = -22.0373177401659 | etot = -16.9033747801429 -871000 ekin = 3.11763256544808 | erot = 2.95338164044026 | epot = -21.9586151724215 | etot = -15.8876009665332 -872000 ekin = 2.97998053337799 | erot = 1.38590039691319 | epot = -21.8388889958107 | etot = -17.4730080655196 -873000 ekin = 2.75061349369619 | erot = 2.24383438401082 | epot = -21.7622218517437 | etot = -16.7677739740367 -874000 ekin = 2.42548927431534 | erot = 2.11161436912391 | epot = -21.6727594489541 | etot = -17.1356558055149 -875000 ekin = 2.99029100585666 | erot = 2.74121308538956 | epot = -21.668258099805 | etot = -15.9367540085588 -876000 ekin = 2.13274848736646 | erot = 2.23319212644067 | epot = -21.6688484321843 | etot = -17.3029078183771 -877000 ekin = 1.83070881561166 | erot = 1.60104159742216 | epot = -21.6264522455532 | etot = -18.1947018325194 -878000 ekin = 2.01997766473212 | erot = 2.72068834038241 | epot = -21.6321722158884 | etot = -16.8915062107738 -879000 ekin = 1.43444304741827 | erot = 2.17422518419202 | epot = -21.5502499158235 | etot = -17.9415816842133 -880000 ekin = 2.09181756708376 | erot = 2.57774127759727 | epot = -21.4848386835567 | etot = -16.8152798388756 -881000 ekin = 1.54082374125037 | erot = 1.98591349326851 | epot = -21.5198561888166 | etot = -17.9931189542977 -882000 ekin = 2.20620241649865 | erot = 2.64810056429068 | epot = -21.6150536961203 | etot = -16.760750715331 -883000 ekin = 2.22399673754477 | erot = 2.23146179436218 | epot = -21.6815278641887 | etot = -17.2260693322817 -884000 ekin = 2.78668830976032 | erot = 2.10129457858281 | epot = -21.7273526514588 | etot = -16.8393697631157 -885000 ekin = 1.92363533860365 | erot = 1.77572806384608 | epot = -21.7697843629897 | etot = -18.07042096054 -886000 ekin = 1.99837400493853 | erot = 3.11594950867252 | epot = -21.7880717591464 | etot = -16.6737482455354 -887000 ekin = 1.98879357041702 | erot = 2.81587324889294 | epot = -21.7924289081933 | etot = -16.9877620888833 -888000 ekin = 1.92038081253069 | erot = 2.32529355289366 | epot = -21.8608148998544 | etot = -17.61514053443 -889000 ekin = 1.88062951921479 | erot = 2.46119685782947 | epot = -21.9507114977877 | etot = -17.6088851207434 -890000 ekin = 1.86004220539177 | erot = 2.25705599329311 | epot = -22.0524916675628 | etot = -17.935393468878 -891000 ekin = 2.60383186011201 | erot = 2.35330732153708 | epot = -22.1901610904928 | etot = -17.2330219088437 -892000 ekin = 2.68681495848524 | erot = 2.69191866418566 | epot = -22.2914319616012 | etot = -16.9126983389303 -893000 ekin = 2.1736025604619 | erot = 2.9855340631332 | epot = -22.2913989289332 | etot = -17.1322623053381 -894000 ekin = 2.52599407841049 | erot = 2.45860683847711 | epot = -22.2814390199637 | etot = -17.2968381030761 -895000 ekin = 2.51960337440812 | erot = 2.45850851261114 | epot = -22.3091317035431 | etot = -17.3310198165238 -896000 ekin = 1.83967907235416 | erot = 2.78765565400226 | epot = -22.2817324681859 | etot = -17.6543977418295 -897000 ekin = 2.36174473729441 | erot = 2.02088352475316 | epot = -22.224489906849 | etot = -17.8418616448014 -898000 ekin = 2.11473348088257 | erot = 1.90142069141409 | epot = -22.1399662163227 | etot = -18.123812044026 -899000 ekin = 2.62624378038804 | erot = 2.33607099930376 | epot = -22.0408432520367 | etot = -17.0785284723449 -900000 ekin = 2.11340838535732 | erot = 2.28923228114128 | epot = -22.0429025506397 | etot = -17.6402618841411 -901000 ekin = 1.91566215184365 | erot = 1.81440527703791 | epot = -22.0776473770081 | etot = -18.3475799481266 -902000 ekin = 2.56900020102358 | erot = 2.49857156191872 | epot = -22.0064871081721 | etot = -16.9389153452298 -903000 ekin = 1.85775254721542 | erot = 2.1749013676366 | epot = -21.9440711401438 | etot = -17.9114172252918 -904000 ekin = 1.86494867419599 | erot = 2.32873664886262 | epot = -21.8931245107356 | etot = -17.699439187677 -905000 ekin = 2.31980147940844 | erot = 2.14361807880238 | epot = -21.8243901028494 | etot = -17.3609705446386 -906000 ekin = 2.49848643102806 | erot = 2.24843917975751 | epot = -21.8343535689989 | etot = -17.0874279582134 -907000 ekin = 4.2050438363463 | erot = 2.50213014445972 | epot = -21.9270462870553 | etot = -15.2198723062493 -908000 ekin = 3.27389112705028 | erot = 2.1139773414904 | epot = -22.0852225119256 | etot = -16.697354043385 -909000 ekin = 2.63126952270321 | erot = 1.92588883864824 | epot = -22.2068298128194 | etot = -17.6496714514679 -910000 ekin = 2.59246919961188 | erot = 2.91531362022026 | epot = -22.3084480522696 | etot = -16.8006652324374 -911000 ekin = 2.58543295146612 | erot = 4.35272230096969 | epot = -22.3704507138015 | etot = -15.4322954613657 -912000 ekin = 3.05790216539308 | erot = 3.70627231984866 | epot = -22.3924902932765 | etot = -15.6283158080348 -913000 ekin = 2.8218125632957 | erot = 2.17270533888476 | epot = -22.3593081791921 | etot = -17.3647902770116 -914000 ekin = 2.15501507966989 | erot = 1.21668054480496 | epot = -22.2678655505214 | etot = -18.8961699260465 -915000 ekin = 1.59606056510822 | erot = 2.96269780066395 | epot = -22.1741171670757 | etot = -17.6153588013035 -916000 ekin = 2.59112654939107 | erot = 3.74925924318435 | epot = -22.2377409731947 | etot = -15.8973551806193 -917000 ekin = 3.0493203689855 | erot = 2.87183972423686 | epot = -22.2632355232676 | etot = -16.3420754300453 -918000 ekin = 2.92189281092746 | erot = 2.63335972566601 | epot = -22.258652580422 | etot = -16.7034000438285 -919000 ekin = 3.21078719192946 | erot = 2.75946068538008 | epot = -22.2355180140143 | etot = -16.2652701367047 -920000 ekin = 2.28586788874951 | erot = 2.37332627126475 | epot = -22.2034083137746 | etot = -17.5442141537604 -921000 ekin = 2.38962080413001 | erot = 2.43664225646834 | epot = -22.185112667546 | etot = -17.3588496069477 -922000 ekin = 2.30442218252457 | erot = 2.41447890834928 | epot = -22.1365633702844 | etot = -17.4176622794105 -923000 ekin = 2.49327560684184 | erot = 2.66692243519056 | epot = -22.1215324922228 | etot = -16.9613344501904 -924000 ekin = 1.53749943917136 | erot = 2.96826475564971 | epot = -22.089501289138 | etot = -17.5837370943169 -925000 ekin = 1.85839296627404 | erot = 1.9630089146505 | epot = -22.0261958798282 | etot = -18.2047939989037 -926000 ekin = 1.36443105914384 | erot = 2.1171794932878 | epot = -22.0105979668103 | etot = -18.5289874143787 -927000 ekin = 2.55078266090621 | erot = 2.08770331246949 | epot = -22.0297469966776 | etot = -17.3912610233019 -928000 ekin = 2.08687332975665 | erot = 2.73936175158276 | epot = -22.0655836352027 | etot = -17.2393485538632 -929000 ekin = 1.85843511626749 | erot = 1.85229477009255 | epot = -22.1619339279447 | etot = -18.4512040415846 -930000 ekin = 1.98312827530234 | erot = 2.11072782324153 | epot = -22.148404885232 | etot = -18.0545487866881 -931000 ekin = 2.44404037283661 | erot = 1.87098036863263 | epot = -22.045526835582 | etot = -17.7305060941127 -932000 ekin = 2.74511224055608 | erot = 2.34428828961869 | epot = -22.0610647907213 | etot = -16.9716642605465 -933000 ekin = 3.03612209957546 | erot = 2.51767378960712 | epot = -21.9625270494876 | etot = -16.408731160305 -934000 ekin = 2.94656694542126 | erot = 2.48807264081831 | epot = -21.861447502856 | etot = -16.4268079166164 -935000 ekin = 2.79277367387165 | erot = 2.14683969082916 | epot = -21.8273290607191 | etot = -16.8877156960183 -936000 ekin = 2.97180432771798 | erot = 2.07585566252292 | epot = -21.8285478379897 | etot = -16.7808878477488 -937000 ekin = 3.04681426679838 | erot = 2.34693750557886 | epot = -21.7540345943249 | etot = -16.3602828219476 -938000 ekin = 2.98753455096208 | erot = 2.36094629864927 | epot = -21.669921719463 | etot = -16.3214408698516 -939000 ekin = 2.5815116272011 | erot = 2.28540517977038 | epot = -21.6416685543635 | etot = -16.774751747392 -940000 ekin = 2.64452600431539 | erot = 2.76444843839484 | epot = -21.5519696309499 | etot = -16.1429951882397 -941000 ekin = 2.27120802986608 | erot = 2.60471729926444 | epot = -21.4614510918559 | etot = -16.5855257627254 -942000 ekin = 1.87372160611096 | erot = 2.80847310756688 | epot = -21.3628386356793 | etot = -16.6806439220015 -943000 ekin = 2.47141066321096 | erot = 2.33779379941891 | epot = -21.363618035927 | etot = -16.5544135732972 -944000 ekin = 2.13394139147127 | erot = 1.92151741713676 | epot = -21.3251241131195 | etot = -17.2696653045115 -945000 ekin = 2.55903591944463 | erot = 2.20641057626278 | epot = -21.3689027899513 | etot = -16.6034562942439 -946000 ekin = 2.36057887627665 | erot = 2.87562563403205 | epot = -21.3642844166796 | etot = -16.1280799063709 -947000 ekin = 2.06640868745843 | erot = 1.87129277041451 | epot = -21.361667299016 | etot = -17.423965841143 -948000 ekin = 1.84829667860633 | erot = 1.37748341041347 | epot = -21.4043264064643 | etot = -18.1785463174445 -949000 ekin = 1.76269317475673 | erot = 2.31704682699621 | epot = -21.4241969105702 | etot = -17.3444569088173 -950000 ekin = 1.71597192365278 | erot = 2.24238818867182 | epot = -21.4137382130783 | etot = -17.4553781007537 -951000 ekin = 1.97740353609815 | erot = 2.3235775919709 | epot = -21.4747894560116 | etot = -17.1738083279426 -952000 ekin = 2.93972459147619 | erot = 2.7264267649198 | epot = -21.5184934927053 | etot = -15.8523421363093 -953000 ekin = 2.94580120867627 | erot = 2.3885651029181 | epot = -21.5142900777068 | etot = -16.1799237661125 -954000 ekin = 3.09124464575104 | erot = 1.98545519388255 | epot = -21.4222393978574 | etot = -16.3455395582238 -955000 ekin = 3.57635828612239 | erot = 2.07344149873787 | epot = -21.305651356955 | etot = -15.6558515720948 -956000 ekin = 2.96200909778686 | erot = 3.68175912378205 | epot = -21.157040218368 | etot = -14.5132719967991 -957000 ekin = 2.9934348145403 | erot = 2.66416955872305 | epot = -20.9768827662772 | etot = -15.3192783930138 -958000 ekin = 2.66519549819093 | erot = 2.94296814880089 | epot = -20.7784507090075 | etot = -15.1702870620156 -959000 ekin = 1.92857560759304 | erot = 2.44736991936641 | epot = -20.7023816787833 | etot = -16.3264361518238 -960000 ekin = 1.49450803358212 | erot = 3.13585226423836 | epot = -20.7120144681538 | etot = -16.0816541703333 -961000 ekin = 1.95028642422207 | erot = 2.08600574936454 | epot = -20.7117469089035 | etot = -16.6754547353169 -962000 ekin = 2.02517481382584 | erot = 1.89936067129151 | epot = -20.7773964294488 | etot = -16.8528609443315 -963000 ekin = 1.81867025887159 | erot = 2.47411932412279 | epot = -20.8447579345839 | etot = -16.5519683515895 -964000 ekin = 2.82276496790393 | erot = 2.43516586616438 | epot = -20.903922975909 | etot = -15.6459921418407 -965000 ekin = 2.55108655192476 | erot = 2.29878304255031 | epot = -20.9718606663833 | etot = -16.1219910719082 -966000 ekin = 2.12011039995763 | erot = 2.28469402857006 | epot = -21.0607245253139 | etot = -16.6559200967862 -967000 ekin = 1.58231560351932 | erot = 3.55759001366773 | epot = -21.1226021191741 | etot = -15.982696501987 -968000 ekin = 1.95012246688271 | erot = 2.37521006238884 | epot = -21.1148898184345 | etot = -16.7895572891629 -969000 ekin = 2.19259023755588 | erot = 2.45911390116742 | epot = -21.0842607955297 | etot = -16.4325566568064 -970000 ekin = 1.87048303167747 | erot = 2.95645393326851 | epot = -21.0144108895372 | etot = -16.1874739245912 -971000 ekin = 1.95012477829126 | erot = 3.07172629604582 | epot = -20.9855553455518 | etot = -15.9637042712147 -972000 ekin = 1.93195517458082 | erot = 2.56231250597297 | epot = -20.9701698825601 | etot = -16.4759022020063 -973000 ekin = 2.21533845309822 | erot = 2.92680845685574 | epot = -20.9736039159605 | etot = -15.8314570060066 -974000 ekin = 2.53783851969245 | erot = 2.68951943774763 | epot = -20.9250705852868 | etot = -15.6977126278467 -975000 ekin = 3.38321286183975 | erot = 2.3388937245268 | epot = -20.8976133286568 | etot = -15.1755067422903 -976000 ekin = 2.84642762041042 | erot = 3.11577005329036 | epot = -20.8920682645474 | etot = -14.9298705908466 -977000 ekin = 2.71729658676912 | erot = 2.5084228279903 | epot = -20.8689607108408 | etot = -15.6432412960814 -978000 ekin = 1.79445054300148 | erot = 2.07364967100101 | epot = -20.8420722556647 | etot = -16.9739720416622 -979000 ekin = 1.87118885565252 | erot = 2.21929236157499 | epot = -20.774871884918 | etot = -16.6843906676905 -980000 ekin = 1.92328692629603 | erot = 1.58075146493092 | epot = -20.7450294842512 | etot = -17.2409910930243 -981000 ekin = 1.54380792071409 | erot = 2.05666691648826 | epot = -20.8055779656275 | etot = -17.2051031284252 -982000 ekin = 1.84105485043124 | erot = 1.96437622792518 | epot = -20.9115808211874 | etot = -17.106149742831 -983000 ekin = 2.72418502177569 | erot = 1.79041563369968 | epot = -20.9354223873698 | etot = -16.4208217318945 -984000 ekin = 3.62593140681741 | erot = 2.63360144654398 | epot = -21.0391820820805 | etot = -14.7796492287191 -985000 ekin = 2.94852683897972 | erot = 2.17122506831154 | epot = -21.2107161619268 | etot = -16.0909642546355 -986000 ekin = 2.8730990470673 | erot = 2.17803097743515 | epot = -21.3376467553807 | etot = -16.2865167308783 -987000 ekin = 3.37014034763591 | erot = 2.51986025997469 | epot = -21.4044213003553 | etot = -15.5144206927447 -988000 ekin = 3.46869513961502 | erot = 3.24290721199116 | epot = -21.4574897009989 | etot = -14.7458873493927 -989000 ekin = 2.84166309499202 | erot = 2.20794524768456 | epot = -21.6064619775396 | etot = -16.556853634863 -990000 ekin = 2.7961621760392 | erot = 1.83962335779988 | epot = -21.6050150594377 | etot = -16.9692295255987 -991000 ekin = 3.12373716765057 | erot = 3.19217793832918 | epot = -21.5124956370547 | etot = -15.196580531075 -992000 ekin = 3.28264042603627 | erot = 2.63437573620237 | epot = -21.3974383725657 | etot = -15.4804222103271 -993000 ekin = 3.03843938464914 | erot = 2.2245111821208 | epot = -21.3215565657891 | etot = -16.0586059990192 -994000 ekin = 3.17415651424377 | erot = 2.79358782634793 | epot = -21.2400795485327 | etot = -15.272335207941 -995000 ekin = 3.20647480868909 | erot = 1.72566862077117 | epot = -21.1373044030639 | etot = -16.2051609736037 -996000 ekin = 3.05112273650758 | erot = 3.18000206414337 | epot = -21.0953933909242 | etot = -14.8642685902733 -997000 ekin = 2.95627130723369 | erot = 3.15916576717626 | epot = -21.0582569249376 | etot = -14.9428198505277 -998000 ekin = 3.0660899917632 | erot = 1.97683196852806 | epot = -20.9835503180559 | etot = -15.9406283577646 -999000 ekin = 2.08921397127967 | erot = 2.76365668450607 | epot = -20.9706997536924 | etot = -16.1178290979066 -1000000 ekin = 2.117712793702 | erot = 2.14107266477967 | epot = -20.9100710796761 | etot = -16.6512856211944 - 1000000 0.094120569 -1.3660232 0.059143724 -1.1745224 -3.0717572e-05 -Loop time of 37.9247 on 1 procs for 1000000 steps with 16 atoms - -Performance: 22782.012 tau/day, 26368.069 timesteps/s -99.5% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 27.061 | 27.061 | 27.061 | 0.0 | 71.36 -Bond | 0.98271 | 0.98271 | 0.98271 | 0.0 | 2.59 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 0.2053 | 0.2053 | 0.2053 | 0.0 | 0.54 -Output | 8e-06 | 8e-06 | 8e-06 | 0.0 | 0.00 -Modify | 9.3814 | 9.3814 | 9.3814 | 0.0 | 24.74 -Other | | 0.2939 | | | 0.77 - -Nlocal: 16.0 ave 16.0 max 16.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 103.0 ave 103.0 max 103.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 103 -Ave neighs/atom = 6.4375 -Ave special neighs/atom = 3.75 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:37 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.4 deleted file mode 100644 index 6639b696ed..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.30Jun20.duplex2.g++.4 +++ /dev/null @@ -1,1184 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 2 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex2 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 16 atoms - reading velocities ... - 16 velocities - 16 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 13 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.004 seconds - -set atom * mass 3.1575 - 16 settings made for mass - -group all type 1 4 -16 atoms in group all - -# oxDNA2 bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA2 pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqav 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqav 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqav 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 -pair_coeff * * oxdna2/dh 0.1 1.0 0.815 - -# NVE ensemble -#fix 1 all nve/dot -fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -fix 1 all nve/dotc/langevin 0.1 ${T} 0.03 457145 angmom 10 -fix 1 all nve/dotc/langevin 0.1 0.1 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 2.6274048 - ghost atom cutoff = 2.6274048 - binsize = 1.3137024, bins = 31 31 31 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 2.627404783947349 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -24.419271289937 | etot = -24.419271289937 -Per MPI rank memory allocation (min/avg/max) = 8.028 | 8.085 | 8.143 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.5358787 0.0096742456 -1.5262045 1.0127369e-05 -1000 ekin = 1.34554291364716 | erot = 2.30525041754444 | epot = -24.3924150888896 | etot = -20.741621757698 -2000 ekin = 2.15972469811184 | erot = 2.1628675965276 | epot = -24.3548203354875 | etot = -20.0322280408481 -3000 ekin = 3.26433550542939 | erot = 2.76107866472087 | epot = -24.2947953202752 | etot = -18.269381150125 -4000 ekin = 1.9203212531997 | erot = 2.133394384253 | epot = -24.234098584123 | etot = -20.1803829466703 -5000 ekin = 1.35481075814721 | erot = 2.00854026688447 | epot = -24.1768963201279 | etot = -20.8135452950963 -6000 ekin = 2.18974627635306 | erot = 1.73271671162436 | epot = -24.1096616118305 | etot = -20.1871986238531 -7000 ekin = 2.65472853187395 | erot = 1.73258720631297 | epot = -24.0561118130561 | etot = -19.6687960748691 -8000 ekin = 2.51192327964357 | erot = 2.34132844779952 | epot = -23.9708695663488 | etot = -19.1176178389058 -9000 ekin = 2.24554900802464 | erot = 2.0522939078286 | epot = -23.874757758319 | etot = -19.5769148424658 -10000 ekin = 2.36227360512089 | erot = 1.80185994066737 | epot = -23.7793375260418 | etot = -19.6152039802535 -11000 ekin = 2.03264234985168 | erot = 1.68707706801736 | epot = -23.7396221351636 | etot = -20.0199027172945 -12000 ekin = 2.66329111303325 | erot = 2.49804687909781 | epot = -23.7366995564469 | etot = -18.5753615643158 -13000 ekin = 1.89677055811531 | erot = 2.34624821263612 | epot = -23.6591067615901 | etot = -19.4160879908387 -14000 ekin = 1.91279445145792 | erot = 2.13129118502405 | epot = -23.6468743458148 | etot = -19.6027887093328 -15000 ekin = 2.41876331112169 | erot = 2.07362128417238 | epot = -23.5767792498568 | etot = -19.0843946545628 -16000 ekin = 2.76615310647131 | erot = 1.19495009524763 | epot = -23.4862363509196 | etot = -19.5251331492006 -17000 ekin = 2.45632569069911 | erot = 2.37627186077148 | epot = -23.500787861849 | etot = -18.6681903103784 -18000 ekin = 2.18348858414473 | erot = 2.46933014500077 | epot = -23.5223047738331 | etot = -18.8694860446876 -19000 ekin = 2.2074746303434 | erot = 2.45349372324724 | epot = -23.4618353655003 | etot = -18.8008670119096 -20000 ekin = 2.06964129991908 | erot = 1.80832666230414 | epot = -23.4930879797962 | etot = -19.615120017573 -21000 ekin = 2.26572194434983 | erot = 2.76680470094409 | epot = -23.5023070260553 | etot = -18.4697803807614 -22000 ekin = 2.69295306575102 | erot = 1.86984875574017 | epot = -23.4463493063166 | etot = -18.8835474848254 -23000 ekin = 1.99930153068661 | erot = 2.27735339437466 | epot = -23.3493214662276 | etot = -19.0726665411663 -24000 ekin = 2.20679650752062 | erot = 2.98147599881873 | epot = -23.273517698415 | etot = -18.0852451920757 -25000 ekin = 2.28085541692287 | erot = 2.99165466281124 | epot = -23.2072100929465 | etot = -17.9347000132124 -26000 ekin = 1.9530124305314 | erot = 2.81680126246586 | epot = -23.0636678500934 | etot = -18.2938541570962 -27000 ekin = 1.96948983508855 | erot = 2.69266617300682 | epot = -22.9870601707012 | etot = -18.3249041626058 -28000 ekin = 2.02061868464074 | erot = 2.37038530969117 | epot = -22.9383598315964 | etot = -18.5473558372645 -29000 ekin = 2.51387846128098 | erot = 2.0265039132053 | epot = -22.888959880923 | etot = -18.3485775064367 -30000 ekin = 1.95889729807242 | erot = 2.1170713545074 | epot = -22.7896312662562 | etot = -18.7136626136764 -31000 ekin = 1.81775203419098 | erot = 2.326796842935 | epot = -22.7561124537192 | etot = -18.6115635765932 -32000 ekin = 1.87947265787065 | erot = 2.0009346769358 | epot = -22.8533570528062 | etot = -18.9729497179997 -33000 ekin = 1.77435214491107 | erot = 1.82826131933673 | epot = -22.8632647352802 | etot = -19.2606512710324 -34000 ekin = 2.27098719472917 | erot = 3.11275511420439 | epot = -22.9527052663856 | etot = -17.5689629574521 -35000 ekin = 2.88921171289845 | erot = 1.82538384737236 | epot = -23.0316569923336 | etot = -18.3170614320628 -36000 ekin = 2.40471013682393 | erot = 2.59817148723643 | epot = -23.1277697887139 | etot = -18.1248881646536 -37000 ekin = 2.23499312928139 | erot = 1.74662115184433 | epot = -23.1542126827759 | etot = -19.1725984016501 -38000 ekin = 2.13875747252781 | erot = 3.07733571118648 | epot = -23.0916051545794 | etot = -17.8755119708651 -39000 ekin = 2.08901196654187 | erot = 2.81975762995374 | epot = -23.0796147800379 | etot = -18.1708451835423 -40000 ekin = 2.95155149177527 | erot = 2.19459039829335 | epot = -23.141500571363 | etot = -17.9953586812944 -41000 ekin = 2.49235596566196 | erot = 3.45295839915509 | epot = -23.115526015811 | etot = -17.1702116509939 -42000 ekin = 2.58401591894786 | erot = 3.0976076851145 | epot = -23.0181097727229 | etot = -17.3364861686605 -43000 ekin = 2.17593293893362 | erot = 2.65403748718844 | epot = -22.8962504257564 | etot = -18.0662799996343 -44000 ekin = 2.34068034665607 | erot = 3.294882771572 | epot = -22.8143844644656 | etot = -17.1788213462375 -45000 ekin = 1.87200112415306 | erot = 3.49863859200052 | epot = -22.6989374637074 | etot = -17.3282977475538 -46000 ekin = 2.60943921333194 | erot = 2.23170007842725 | epot = -22.5884035122493 | etot = -17.7472642204901 -47000 ekin = 1.89594756436345 | erot = 3.4002587629387 | epot = -22.4938472923117 | etot = -17.1976409650096 -48000 ekin = 2.49339593279701 | erot = 2.5104785556399 | epot = -22.5372062210456 | etot = -17.5333317326087 -49000 ekin = 3.2041407554348 | erot = 2.17669016194865 | epot = -22.5688036423094 | etot = -17.1879727249259 -50000 ekin = 2.93024070185999 | erot = 1.55416219951966 | epot = -22.6087903765995 | etot = -18.1243874752199 -51000 ekin = 2.8585759501124 | erot = 2.69193261792584 | epot = -22.6228353253324 | etot = -17.0723267572942 -52000 ekin = 2.3079418078843 | erot = 1.84260643306147 | epot = -22.6230480697441 | etot = -18.4724998287983 -53000 ekin = 3.1803685919024 | erot = 1.67451273370508 | epot = -22.6834814309773 | etot = -17.8286001053698 -54000 ekin = 2.6151376953128 | erot = 1.96091197875017 | epot = -22.7484551927013 | etot = -18.1724055186384 -55000 ekin = 3.1639577845443 | erot = 2.86286196426802 | epot = -22.7917236196438 | etot = -16.7649038708315 -56000 ekin = 2.52994034294643 | erot = 3.05544364249365 | epot = -22.7651844773103 | etot = -17.1798004918702 -57000 ekin = 2.40889871674401 | erot = 3.4525690879514 | epot = -22.7113139496974 | etot = -16.849846145002 -58000 ekin = 1.9363727739706 | erot = 2.52762778976703 | epot = -22.6468058892224 | etot = -18.1828053254848 -59000 ekin = 2.55505415922972 | erot = 3.52385701835933 | epot = -22.6037443858311 | etot = -16.5248332082421 -60000 ekin = 2.80945252332612 | erot = 2.88606183204889 | epot = -22.5227874119079 | etot = -16.8272730565329 -61000 ekin = 2.69750183117722 | erot = 2.55373633146433 | epot = -22.4306469225965 | etot = -17.1794087599549 -62000 ekin = 2.74494354639602 | erot = 2.23074517653766 | epot = -22.3675792436719 | etot = -17.3918905207383 -63000 ekin = 2.66335513293138 | erot = 2.46159865380861 | epot = -22.3527707145482 | etot = -17.2278169278082 -64000 ekin = 2.12832019835147 | erot = 2.78772793164811 | epot = -22.3048690294469 | etot = -17.3888208994473 -65000 ekin = 1.88429801911228 | erot = 2.70719871478483 | epot = -22.3342736701749 | etot = -17.7427769362778 -66000 ekin = 2.77106091929282 | erot = 1.94126620531915 | epot = -22.338257942783 | etot = -17.625930818171 -67000 ekin = 2.53561386235746 | erot = 2.45901054739082 | epot = -22.3780784743028 | etot = -17.3834540645545 -68000 ekin = 2.9678648663671 | erot = 1.95502711706149 | epot = -22.4420512915713 | etot = -17.5191593081427 -69000 ekin = 2.61501630036274 | erot = 2.2429513448561 | epot = -22.3607835407198 | etot = -17.502815895501 -70000 ekin = 2.41492598760663 | erot = 2.80885610657203 | epot = -22.2905725083407 | etot = -17.066790414162 -71000 ekin = 2.65062529541957 | erot = 2.88868401392431 | epot = -22.2951070257787 | etot = -16.7557977164349 -72000 ekin = 2.93273744051009 | erot = 2.82552508252073 | epot = -22.4016757930526 | etot = -16.6434132700218 -73000 ekin = 2.18922665452238 | erot = 3.03559183860538 | epot = -22.4509770394845 | etot = -17.2261585463568 -74000 ekin = 2.16074843540078 | erot = 2.83668185121384 | epot = -22.4374624006144 | etot = -17.4400321139998 -75000 ekin = 1.52329638473031 | erot = 1.91520672578907 | epot = -22.5623153080324 | etot = -19.123812197513 -76000 ekin = 1.89250964827726 | erot = 2.83358650938892 | epot = -22.6698326202442 | etot = -17.943736462578 -77000 ekin = 2.82066630152179 | erot = 3.19779433197964 | epot = -22.7402096770599 | etot = -16.7217490435584 -78000 ekin = 2.42603824235662 | erot = 2.82319136688957 | epot = -22.7334053911689 | etot = -17.4841757819227 -79000 ekin = 2.1571494738421 | erot = 1.67722302323495 | epot = -22.7616861631187 | etot = -18.9273136660417 -80000 ekin = 2.3760789053548 | erot = 2.58372913427157 | epot = -22.6889139769023 | etot = -17.729105937276 -81000 ekin = 2.73468961033338 | erot = 1.92748741387075 | epot = -22.6388260929897 | etot = -17.9766490687856 -82000 ekin = 1.90565370838817 | erot = 1.71715050303634 | epot = -22.5547415381056 | etot = -18.9319373266811 -83000 ekin = 1.63698443616271 | erot = 1.88092293220519 | epot = -22.4792739412377 | etot = -18.9613665728698 -84000 ekin = 1.65571812906993 | erot = 2.10290321918187 | epot = -22.4031972735297 | etot = -18.6445759252779 -85000 ekin = 2.40863681830855 | erot = 2.04741059095057 | epot = -22.321221903585 | etot = -17.8651744943259 -86000 ekin = 2.50560893716733 | erot = 1.80624308622105 | epot = -22.3789065133115 | etot = -18.0670544899231 -87000 ekin = 2.13576456371582 | erot = 1.97115993651017 | epot = -22.4335511413526 | etot = -18.3266266411266 -88000 ekin = 1.74897318407528 | erot = 2.37233945814529 | epot = -22.4142028246849 | etot = -18.2928901824643 -89000 ekin = 1.85559683216276 | erot = 3.29559734355419 | epot = -22.4519626048678 | etot = -17.3007684291509 -90000 ekin = 2.22181579992018 | erot = 2.33948779846394 | epot = -22.5289826258985 | etot = -17.9676790275144 -91000 ekin = 2.40596540834273 | erot = 3.11545124680293 | epot = -22.4975752624166 | etot = -16.9761586072709 -92000 ekin = 2.6773157744569 | erot = 3.00279439655287 | epot = -22.4834827179575 | etot = -16.8033725469477 -93000 ekin = 3.0427813598525 | erot = 3.03722776158512 | epot = -22.4121259471479 | etot = -16.3321168257103 -94000 ekin = 3.20507830840023 | erot = 1.86440047317737 | epot = -22.5079833350679 | etot = -17.4385045534903 -95000 ekin = 3.4839955648833 | erot = 2.87934575393031 | epot = -22.5675869456428 | etot = -16.2042456268292 -96000 ekin = 2.8873631080951 | erot = 2.38554372248299 | epot = -22.5453635283434 | etot = -17.2724566977653 -97000 ekin = 1.92899149350272 | erot = 2.09886479790579 | epot = -22.5208382020819 | etot = -18.4929819106733 -98000 ekin = 2.21420868967462 | erot = 3.66528252896999 | epot = -22.4426781355708 | etot = -16.5631869169262 -99000 ekin = 1.98238051924192 | erot = 2.77358159119584 | epot = -22.3579409961467 | etot = -17.6019788857089 -100000 ekin = 1.80278462349605 | erot = 2.65457154995031 | epot = -22.2926900475079 | etot = -17.8353338740616 -101000 ekin = 2.14042196591663 | erot = 2.38610603254675 | epot = -22.2789462117326 | etot = -17.7524182132692 -102000 ekin = 1.54923043145398 | erot = 2.30485616158943 | epot = -22.27519637673 | etot = -18.4211097836866 -103000 ekin = 1.66618004359352 | erot = 2.82192794888076 | epot = -22.3284746660305 | etot = -17.8403666735562 -104000 ekin = 1.8840390723585 | erot = 3.37607054348826 | epot = -22.4068162519772 | etot = -17.1467066361304 -105000 ekin = 2.08970806137592 | erot = 2.01278733908098 | epot = -22.450865561264 | etot = -18.3483701608071 -106000 ekin = 2.87186619049714 | erot = 1.95029477179727 | epot = -22.46479383237 | etot = -17.6426328700756 -107000 ekin = 2.28516102595382 | erot = 1.55115426482475 | epot = -22.420448971169 | etot = -18.5841336803904 -108000 ekin = 2.4440862469061 | erot = 1.71323205815914 | epot = -22.4934628688132 | etot = -18.336144563748 -109000 ekin = 2.33376449416318 | erot = 2.92962175925398 | epot = -22.4792154966925 | etot = -17.2158292432753 -110000 ekin = 2.7815613020599 | erot = 2.36483486971455 | epot = -22.4384263756784 | etot = -17.2920302039039 -111000 ekin = 2.32472851347632 | erot = 2.09554567134105 | epot = -22.3756448055424 | etot = -17.955370620725 -112000 ekin = 2.91126509700492 | erot = 1.8278781240038 | epot = -22.2278235937356 | etot = -17.4886803727269 -113000 ekin = 2.82522334536064 | erot = 1.67936756938672 | epot = -22.2030639545535 | etot = -17.6984730398062 -114000 ekin = 3.42964629994365 | erot = 2.67287683722422 | epot = -22.3274259722919 | etot = -16.224902835124 -115000 ekin = 3.0542495603856 | erot = 1.72370226125566 | epot = -22.3530732875163 | etot = -17.575121465875 -116000 ekin = 3.19934505541307 | erot = 3.20304074939432 | epot = -22.4112422200445 | etot = -16.0088564152371 -117000 ekin = 3.03942349360439 | erot = 2.40720645224432 | epot = -22.3646852618703 | etot = -16.9180553160216 -118000 ekin = 3.21704225120818 | erot = 1.46425401673931 | epot = -22.2864155249032 | etot = -17.6051192569557 -119000 ekin = 2.33989996826882 | erot = 3.07668030790319 | epot = -22.2283862990246 | etot = -16.8118060228526 -120000 ekin = 1.93772242476321 | erot = 2.20130457047854 | epot = -22.1620199969907 | etot = -18.022993001749 -121000 ekin = 1.94013950333198 | erot = 3.08987281123525 | epot = -22.1565667857742 | etot = -17.126554471207 -122000 ekin = 1.68663003450368 | erot = 1.73461876453175 | epot = -22.2565715090021 | etot = -18.8353227099667 -123000 ekin = 1.72841976989173 | erot = 2.32750063038672 | epot = -22.3665160016578 | etot = -18.3105956013793 -124000 ekin = 2.73468934475335 | erot = 1.93313584543739 | epot = -22.378088078826 | etot = -17.7102628886353 -125000 ekin = 2.77507735763211 | erot = 1.95244582221334 | epot = -22.3863676939847 | etot = -17.6588445141392 -126000 ekin = 2.04549959008918 | erot = 1.485897173428 | epot = -22.4226219879524 | etot = -18.8912252244352 -127000 ekin = 1.86410777734907 | erot = 1.58829497411524 | epot = -22.4027380289015 | etot = -18.9503352774372 -128000 ekin = 1.63329448006254 | erot = 1.88032753965974 | epot = -22.3918784566533 | etot = -18.8782564369311 -129000 ekin = 2.51522192674941 | erot = 2.38822614049102 | epot = -22.396225517968 | etot = -17.4927774507275 -130000 ekin = 1.61191166117177 | erot = 2.81688343133435 | epot = -22.341565060394 | etot = -17.9127699678878 -131000 ekin = 2.29569747740708 | erot = 2.2886876976091 | epot = -22.2184139794107 | etot = -17.6340288043945 -132000 ekin = 2.97393694467802 | erot = 2.3613525440602 | epot = -22.1410658382525 | etot = -16.8057763495143 -133000 ekin = 2.01357676743257 | erot = 2.125828419273 | epot = -22.1312019600638 | etot = -17.9917967733582 -134000 ekin = 1.56048037412857 | erot = 2.84208065022547 | epot = -22.0682869067536 | etot = -17.6657258823995 -135000 ekin = 1.79811942319758 | erot = 2.40075843487508 | epot = -22.0853555614258 | etot = -17.8864777033532 -136000 ekin = 1.63631696233012 | erot = 2.13166656554854 | epot = -22.0879615470249 | etot = -18.3199780191463 -137000 ekin = 2.36040439516093 | erot = 1.93785486632901 | epot = -22.1234845924018 | etot = -17.8252253309118 -138000 ekin = 2.94591421775872 | erot = 1.58866111192914 | epot = -22.1783168558241 | etot = -17.6437415261363 -139000 ekin = 3.17560544591524 | erot = 2.24933296614107 | epot = -22.2966418842012 | etot = -16.8717034721449 -140000 ekin = 2.24781162873235 | erot = 3.05934139328612 | epot = -22.4681108223249 | etot = -17.1609578003064 -141000 ekin = 1.89078628042285 | erot = 3.13246933186326 | epot = -22.730922227649 | etot = -17.7076666153629 -142000 ekin = 2.51033894675651 | erot = 2.4942894309123 | epot = -22.8404165502847 | etot = -17.8357881726159 -143000 ekin = 2.40438807844298 | erot = 2.71461817456284 | epot = -22.8207220890738 | etot = -17.7017158360679 -144000 ekin = 1.9307425487964 | erot = 2.67760329085926 | epot = -22.6973757396236 | etot = -18.0890298999679 -145000 ekin = 1.82681171280412 | erot = 1.73674169257736 | epot = -22.6628534675149 | etot = -19.0993000621335 -146000 ekin = 2.42423538163981 | erot = 2.0908776294658 | epot = -22.6072904345337 | etot = -18.0921774234281 -147000 ekin = 1.44607209743073 | erot = 1.8801263906251 | epot = -22.5001275476876 | etot = -19.1739290596318 -148000 ekin = 1.9349809420382 | erot = 2.57774390934154 | epot = -22.4721664357448 | etot = -17.9594415843651 -149000 ekin = 2.02370265642699 | erot = 3.3179576458013 | epot = -22.3745153112138 | etot = -17.0328550089855 -150000 ekin = 2.48124469844233 | erot = 2.68185291250579 | epot = -22.1950329772129 | etot = -17.0319353662648 -151000 ekin = 2.76319440452884 | erot = 1.87355938382631 | epot = -21.986630645846 | etot = -17.3498768574909 -152000 ekin = 2.77453107952051 | erot = 1.77016628972892 | epot = -21.7977108098427 | etot = -17.2530134405933 -153000 ekin = 3.08827014622555 | erot = 1.80976617511255 | epot = -21.6910123469878 | etot = -16.7929760256497 -154000 ekin = 2.32051051770812 | erot = 2.18004857730092 | epot = -21.6406733490634 | etot = -17.1401142540543 -155000 ekin = 1.95766873014157 | erot = 2.67064554154836 | epot = -21.7315745360126 | etot = -17.1032602643227 -156000 ekin = 2.69830438989808 | erot = 2.24987636164771 | epot = -21.7962907570244 | etot = -16.8481100054786 -157000 ekin = 3.89340900899948 | erot = 2.73733315325155 | epot = -21.8437967078712 | etot = -15.2130545456202 -158000 ekin = 2.84737207100033 | erot = 2.70157958556583 | epot = -21.878244439129 | etot = -16.3292927825628 -159000 ekin = 3.1312088996125 | erot = 2.65375527842548 | epot = -21.8350703791794 | etot = -16.0501062011414 -160000 ekin = 2.54316260055464 | erot = 3.27950281054041 | epot = -21.8888467298127 | etot = -16.0661813187176 -161000 ekin = 2.49549109190181 | erot = 2.45028506429479 | epot = -21.8585593359585 | etot = -16.9127831797619 -162000 ekin = 3.05200272259994 | erot = 2.59164651185653 | epot = -21.8439750046483 | etot = -16.2003257701918 -163000 ekin = 3.30374280597553 | erot = 2.24193960212662 | epot = -21.8717863279577 | etot = -16.3261039198555 -164000 ekin = 3.53081155329031 | erot = 2.22419322011391 | epot = -21.8162094860939 | etot = -16.0612047126897 -165000 ekin = 2.48919804649027 | erot = 2.59105984700639 | epot = -21.7395563276218 | etot = -16.6592984341251 -166000 ekin = 2.14880495285182 | erot = 3.05770380831398 | epot = -21.6850566092694 | etot = -16.4785478481036 -167000 ekin = 2.78181890034675 | erot = 2.90402826001928 | epot = -21.5971987360122 | etot = -15.9113515756462 -168000 ekin = 1.74726050172142 | erot = 2.76898886506121 | epot = -21.490566893224 | etot = -16.9743175264414 -169000 ekin = 1.8134289785439 | erot = 2.45780601602371 | epot = -21.4680710936728 | etot = -17.1968360991052 -170000 ekin = 1.69364478039988 | erot = 2.87928997590297 | epot = -21.4668806356843 | etot = -16.8939458793814 -171000 ekin = 2.14879448642638 | erot = 1.61442218455815 | epot = -21.3172106430715 | etot = -17.553993972087 -172000 ekin = 1.68431962963431 | erot = 2.36087816720612 | epot = -21.1539793618528 | etot = -17.1087815650124 -173000 ekin = 2.05784071815669 | erot = 2.17142592689102 | epot = -21.0926393885011 | etot = -16.8633727434534 -174000 ekin = 2.49611606122761 | erot = 3.09665692560806 | epot = -20.9460348670979 | etot = -15.3532618802622 -175000 ekin = 2.61673440848865 | erot = 2.88720331620426 | epot = -20.8525764091519 | etot = -15.348638684459 -176000 ekin = 2.16190213742438 | erot = 2.672518464664 | epot = -20.8442274508468 | etot = -16.0098068487584 -177000 ekin = 2.83236394902013 | erot = 2.81489135382763 | epot = -20.925759607446 | etot = -15.2785043045983 -178000 ekin = 3.17804494293424 | erot = 1.88346790512585 | epot = -21.0677853312893 | etot = -16.0062724832292 -179000 ekin = 2.33267448424065 | erot = 2.85731052069525 | epot = -21.1181390109479 | etot = -15.928154006012 -180000 ekin = 2.39061531304011 | erot = 2.93791308776 | epot = -21.1146449531392 | etot = -15.786116552339 -181000 ekin = 2.79990361156737 | erot = 3.28891520287386 | epot = -21.0834365456108 | etot = -14.9946177311695 -182000 ekin = 3.02616507870526 | erot = 2.3341432703009 | epot = -21.0600545808659 | etot = -15.6997462318597 -183000 ekin = 2.45290144562467 | erot = 2.21141617846262 | epot = -20.911866387917 | etot = -16.2475487638297 -184000 ekin = 2.56560515060991 | erot = 2.7739810551646 | epot = -20.6989716212004 | etot = -15.3593854154259 -185000 ekin = 2.17586139274635 | erot = 1.95913868179524 | epot = -20.5985322435751 | etot = -16.4635321690335 -186000 ekin = 2.07303044902321 | erot = 3.15122816264525 | epot = -20.4965070011281 | etot = -15.2722483894597 -187000 ekin = 2.44319481307615 | erot = 1.92784212082443 | epot = -20.5124982035642 | etot = -16.1414612696636 -188000 ekin = 2.28870879542405 | erot = 2.8871121346017 | epot = -20.6323506293031 | etot = -15.4565296992773 -189000 ekin = 1.68047280237829 | erot = 3.05535775765803 | epot = -20.6378101864803 | etot = -15.901979626444 -190000 ekin = 1.97184665786397 | erot = 2.95271452778009 | epot = -20.6376534135265 | etot = -15.7130922278825 -191000 ekin = 2.30626539196432 | erot = 2.64854814117512 | epot = -20.6037323569656 | etot = -15.6489188238262 -192000 ekin = 3.54976671698926 | erot = 2.91090725702116 | epot = -20.5525508832509 | etot = -14.0918769092405 -193000 ekin = 2.63938438600422 | erot = 3.14409581682352 | epot = -20.5892132844066 | etot = -14.8057330815789 -194000 ekin = 2.67903757365037 | erot = 2.30768318132376 | epot = -20.4753987179501 | etot = -15.488677962976 -195000 ekin = 1.89257615363314 | erot = 2.64508051866103 | epot = -20.4197880125065 | etot = -15.8821313402123 -196000 ekin = 2.29151017050607 | erot = 2.32636787964875 | epot = -20.4440761857987 | etot = -15.8261981356438 -197000 ekin = 2.48344018982905 | erot = 2.5654400941963 | epot = -20.516126938087 | etot = -15.4672466540616 -198000 ekin = 2.01386156849612 | erot = 1.52779840514975 | epot = -20.537160292649 | etot = -16.9955003190031 -199000 ekin = 1.50729232131931 | erot = 2.19878124720506 | epot = -20.5584754599868 | etot = -16.8524018914625 -200000 ekin = 1.64236235330806 | erot = 2.46736341802316 | epot = -20.5387924113648 | etot = -16.4290666400336 -201000 ekin = 2.627066472214 | erot = 2.61321940355396 | epot = -20.6089911163939 | etot = -15.3687052406259 -202000 ekin = 2.3129503751722 | erot = 2.54874856259559 | epot = -20.6732219111123 | etot = -15.8115229733445 -203000 ekin = 1.63961009223968 | erot = 2.10835750593015 | epot = -20.7002051999767 | etot = -16.9522376018069 -204000 ekin = 2.0558049009161 | erot = 1.9161072834091 | epot = -20.8154459612946 | etot = -16.8435337769694 -205000 ekin = 3.04603860094189 | erot = 3.24233043438682 | epot = -20.9297600758299 | etot = -14.6413910405012 -206000 ekin = 2.56775422508359 | erot = 2.20992928465512 | epot = -21.0192669133083 | etot = -16.2415834035696 -207000 ekin = 3.46597997409567 | erot = 2.48427015330086 | epot = -21.151399026488 | etot = -15.2011488990915 -208000 ekin = 2.51159742060494 | erot = 2.22948191756652 | epot = -21.2942477400986 | etot = -16.5531684019271 -209000 ekin = 3.78908644724162 | erot = 2.17660742759513 | epot = -21.4499700336111 | etot = -15.4842761587743 -210000 ekin = 3.03133642129733 | erot = 2.21595982730352 | epot = -21.5648709610245 | etot = -16.3175747124237 -211000 ekin = 1.63075564056512 | erot = 2.12650387194819 | epot = -21.6099552204253 | etot = -17.852695707912 -212000 ekin = 2.67694215598975 | erot = 2.47186432110288 | epot = -21.8481434074352 | etot = -16.6993369303425 -213000 ekin = 2.70688282449408 | erot = 1.96666534072978 | epot = -22.1170796448084 | etot = -17.4435314795845 -214000 ekin = 2.88993887341392 | erot = 3.16392577542175 | epot = -22.1689844550676 | etot = -16.1151198062319 -215000 ekin = 2.59587305508913 | erot = 1.84775314628517 | epot = -22.0799472955547 | etot = -17.6363210941804 -216000 ekin = 2.59710486720184 | erot = 2.79170232594871 | epot = -22.123050002636 | etot = -16.7342428094855 -217000 ekin = 2.50043297628753 | erot = 1.89569946865143 | epot = -22.2232445790842 | etot = -17.8271121341452 -218000 ekin = 2.42608117861514 | erot = 2.42380011003409 | epot = -22.2442965405807 | etot = -17.3944152519314 -219000 ekin = 2.31038806457503 | erot = 2.64910389607574 | epot = -22.2862511100887 | etot = -17.3267591494379 -220000 ekin = 1.69989575631519 | erot = 2.34717348369245 | epot = -22.2936253261379 | etot = -18.2465560861303 -221000 ekin = 2.0597604328414 | erot = 2.4617257870959 | epot = -22.2693428350923 | etot = -17.747856615155 -222000 ekin = 1.56778478035701 | erot = 2.12765432596982 | epot = -22.1639011265163 | etot = -18.4684620201895 -223000 ekin = 1.84761048251748 | erot = 1.88006246465219 | epot = -22.0932628941083 | etot = -18.3655899469387 -224000 ekin = 2.59436846043989 | erot = 2.94714248251079 | epot = -22.1101977210218 | etot = -16.5686867780711 -225000 ekin = 3.30446830369106 | erot = 2.86069163428051 | epot = -22.1130335717329 | etot = -15.9478736337614 -226000 ekin = 3.03148439961004 | erot = 2.0857715841185 | epot = -22.1515480756285 | etot = -17.0342920918999 -227000 ekin = 2.52473737037052 | erot = 3.1515233037479 | epot = -22.2272979755786 | etot = -16.5510373014602 -228000 ekin = 2.32773029487822 | erot = 2.67887550863523 | epot = -22.3289846157579 | etot = -17.3223788122445 -229000 ekin = 2.908632187774 | erot = 2.89972099244786 | epot = -22.4590990625921 | etot = -16.6507458823703 -230000 ekin = 2.30901008738396 | erot = 3.48892218468534 | epot = -22.5811133380347 | etot = -16.7831810659654 -231000 ekin = 2.09445974553368 | erot = 3.10137653837903 | epot = -22.6273628788262 | etot = -17.4315265949135 -232000 ekin = 2.11347252785341 | erot = 1.99214840222577 | epot = -22.6148559367411 | etot = -18.5092350066619 -233000 ekin = 2.31469131808302 | erot = 2.82702779723524 | epot = -22.573468078272 | etot = -17.4317489629538 -234000 ekin = 2.08691986790862 | erot = 2.09006771152617 | epot = -22.5768924885421 | etot = -18.3999049091073 -235000 ekin = 2.43602788311011 | erot = 2.79756094595935 | epot = -22.5841308018507 | etot = -17.3505419727812 -236000 ekin = 2.93232983655883 | erot = 3.05945149934941 | epot = -22.5011281720659 | etot = -16.5093468361576 -237000 ekin = 3.2236915032749 | erot = 3.26810349425041 | epot = -22.3869936414794 | etot = -15.8951986439541 -238000 ekin = 2.4674995923353 | erot = 2.31630563795609 | epot = -22.3210409459325 | etot = -17.5372357156411 -239000 ekin = 2.10887317283391 | erot = 2.47562990634415 | epot = -22.3008221039947 | etot = -17.7163190248166 -240000 ekin = 1.76092230208337 | erot = 2.62077674301801 | epot = -22.2503883436816 | etot = -17.8686892985802 -241000 ekin = 1.93966929781469 | erot = 1.41063904300121 | epot = -22.2367099354244 | etot = -18.8864015946085 -242000 ekin = 3.03220831764684 | erot = 2.02809667614523 | epot = -22.2529237351145 | etot = -17.1926187413224 -243000 ekin = 2.84396619393303 | erot = 1.7910064306681 | epot = -22.2768680265869 | etot = -17.6418954019858 -244000 ekin = 1.94630661585721 | erot = 2.3722540427007 | epot = -22.2272698315535 | etot = -17.9087091729956 -245000 ekin = 2.21268964174709 | erot = 2.75899365563147 | epot = -22.1926413343766 | etot = -17.2209580369981 -246000 ekin = 2.07547606015104 | erot = 2.22089229769683 | epot = -22.119471822751 | etot = -17.8231034649032 -247000 ekin = 1.58341517009487 | erot = 3.06778333448391 | epot = -22.0033087190277 | etot = -17.3521102144489 -248000 ekin = 2.1365138975527 | erot = 3.53502738921423 | epot = -21.8495423719646 | etot = -16.1780010851977 -249000 ekin = 2.17149547481658 | erot = 3.29316066315612 | epot = -21.813933670884 | etot = -16.3492775329113 -250000 ekin = 2.39365756609179 | erot = 2.39580124119371 | epot = -21.767733544404 | etot = -16.9782747371185 -251000 ekin = 1.2828204065042 | erot = 2.24293125468609 | epot = -21.7209613352709 | etot = -18.1952096740806 -252000 ekin = 1.76792385357404 | erot = 2.13774913157991 | epot = -21.715743646839 | etot = -17.8100706616851 -253000 ekin = 2.15844787240193 | erot = 2.59910839140098 | epot = -21.6939194867273 | etot = -16.9363632229244 -254000 ekin = 2.46988601582316 | erot = 1.99393049965303 | epot = -21.6738244724958 | etot = -17.2100079570196 -255000 ekin = 2.31014544453096 | erot = 2.03140480982291 | epot = -21.6888108217887 | etot = -17.3472605674348 -256000 ekin = 2.90570988017011 | erot = 2.61779108741197 | epot = -21.6304219101588 | etot = -16.1069209425767 -257000 ekin = 2.87227426842454 | erot = 2.08598550349753 | epot = -21.5998306482426 | etot = -16.6415708763206 -258000 ekin = 2.06365418401471 | erot = 2.33103720962373 | epot = -21.5019981919811 | etot = -17.1073067983427 -259000 ekin = 2.23106413601668 | erot = 2.88992031738565 | epot = -21.4929751490585 | etot = -16.3719906956562 -260000 ekin = 2.49064109684832 | erot = 2.38083177290805 | epot = -21.4659963710747 | etot = -16.5945235013183 -261000 ekin = 2.09140199827797 | erot = 2.40209752473156 | epot = -21.4076397934529 | etot = -16.9141402704433 -262000 ekin = 2.36091906713393 | erot = 2.66652490187927 | epot = -21.359937125592 | etot = -16.3324931565788 -263000 ekin = 2.2112169796158 | erot = 2.73059503173094 | epot = -21.4187723839513 | etot = -16.4769603726046 -264000 ekin = 2.28961718487933 | erot = 2.75455515229635 | epot = -21.370776058554 | etot = -16.3266037213783 -265000 ekin = 1.71596203334806 | erot = 1.76104932073225 | epot = -21.2034176623527 | etot = -17.7264063082724 -266000 ekin = 2.51424635704546 | erot = 2.09488481391075 | epot = -21.0818656942669 | etot = -16.4727345233107 -267000 ekin = 2.81393895925601 | erot = 2.14232705328249 | epot = -21.1259701200622 | etot = -16.1697041075237 -268000 ekin = 3.10191854871686 | erot = 2.80451383793942 | epot = -21.0933882633302 | etot = -15.1869558766739 -269000 ekin = 3.52550118014125 | erot = 2.35973600910593 | epot = -21.0585255577117 | etot = -15.1732883684645 -270000 ekin = 3.50731584216641 | erot = 1.86855463358785 | epot = -21.093710946541 | etot = -15.7178404707867 -271000 ekin = 3.5675331453682 | erot = 2.0823459971557 | epot = -21.1717850302959 | etot = -15.521905887772 -272000 ekin = 2.43382567191708 | erot = 3.09591378837425 | epot = -21.2584464912718 | etot = -15.7287070309805 -273000 ekin = 2.38177594135517 | erot = 3.14028416008422 | epot = -21.3418702267283 | etot = -15.8198101252889 -274000 ekin = 2.46408091312732 | erot = 2.01407385193325 | epot = -21.3513679347441 | etot = -16.8732131696836 -275000 ekin = 2.45653813926169 | erot = 3.06780010281641 | epot = -21.3769507768006 | etot = -15.8526125347225 -276000 ekin = 2.79508720985829 | erot = 2.87011619931109 | epot = -21.3368600634473 | etot = -15.671656654278 -277000 ekin = 2.21394865880382 | erot = 2.19504097967885 | epot = -21.2606836087454 | etot = -16.8516939702627 -278000 ekin = 2.75723780567064 | erot = 3.25107227641375 | epot = -21.1755556732391 | etot = -15.1672455911547 -279000 ekin = 2.50738352588257 | erot = 1.80312795092014 | epot = -21.119949297869 | etot = -16.8094378210662 -280000 ekin = 2.35419479075042 | erot = 1.7566104351529 | epot = -21.0612865360217 | etot = -16.9504813101184 -281000 ekin = 2.54091624756361 | erot = 2.29354970120309 | epot = -21.0950091005497 | etot = -16.260543151783 -282000 ekin = 2.99712896075656 | erot = 2.42094408338315 | epot = -21.2220089565004 | etot = -15.8039359123607 -283000 ekin = 2.56696810638689 | erot = 2.10068113035835 | epot = -21.403161576838 | etot = -16.7355123400928 -284000 ekin = 2.50149529685552 | erot = 3.12894850572552 | epot = -21.5256946024495 | etot = -15.8952507998684 -285000 ekin = 2.42104861452631 | erot = 1.7773884250687 | epot = -21.6343236201921 | etot = -17.4358865805971 -286000 ekin = 1.95703367775988 | erot = 2.02947038358402 | epot = -21.6777606373854 | etot = -17.6912565760415 -287000 ekin = 2.563069553437 | erot = 2.57822888294094 | epot = -21.7096788412169 | etot = -16.568380404839 -288000 ekin = 2.18408141161779 | erot = 1.69724000161796 | epot = -21.6059228036045 | etot = -17.7246013903687 -289000 ekin = 2.32975723406079 | erot = 1.67288237726622 | epot = -21.4690249265465 | etot = -17.4663853152195 -290000 ekin = 2.22773933829104 | erot = 2.00568808096403 | epot = -21.3936416309443 | etot = -17.1602142116892 -291000 ekin = 1.46140048209222 | erot = 2.68187349132486 | epot = -21.320309661152 | etot = -17.177035687735 -292000 ekin = 2.07752653885401 | erot = 2.42042811850752 | epot = -21.2225710152689 | etot = -16.7246163579074 -293000 ekin = 2.14598735312316 | erot = 1.87232699516306 | epot = -21.1503112105659 | etot = -17.1319968622797 -294000 ekin = 2.15249843510191 | erot = 2.17548638187737 | epot = -21.1209057143321 | etot = -16.7929208973528 -295000 ekin = 2.13417246804068 | erot = 2.31578295657371 | epot = -21.023273761855 | etot = -16.5733183372406 -296000 ekin = 1.52381700282724 | erot = 2.92433462308731 | epot = -21.0839283123442 | etot = -16.6357766864297 -297000 ekin = 2.45165869902145 | erot = 2.17953392904489 | epot = -21.0491333291916 | etot = -16.4179407011252 -298000 ekin = 1.77920935759369 | erot = 2.01251348063453 | epot = -21.0971977522748 | etot = -17.3054749140465 -299000 ekin = 1.87538650376616 | erot = 1.65135039658661 | epot = -21.119277949862 | etot = -17.5925410495092 -300000 ekin = 2.3167056751994 | erot = 1.510902648654 | epot = -21.178913099451 | etot = -17.3513047755976 -301000 ekin = 2.00567209290794 | erot = 2.01270349508404 | epot = -21.2857234594098 | etot = -17.2673478714178 -302000 ekin = 1.78598592595272 | erot = 2.2354055492879 | epot = -21.3905601140029 | etot = -17.3691686387622 -303000 ekin = 2.73278841880507 | erot = 1.64856089415774 | epot = -21.3608973804115 | etot = -16.9795480674487 -304000 ekin = 2.5809493598196 | erot = 2.00558555026353 | epot = -21.400198286629 | etot = -16.8136633765459 -305000 ekin = 2.43647384348742 | erot = 2.28275438290435 | epot = -21.3863075230184 | etot = -16.6670792966266 -306000 ekin = 2.14332823539982 | erot = 2.4338461634411 | epot = -21.3233075109442 | etot = -16.7461331121032 -307000 ekin = 3.21424191196812 | erot = 3.27591538479569 | epot = -21.289790084126 | etot = -14.7996327873622 -308000 ekin = 3.45838026839176 | erot = 2.68116130354006 | epot = -21.3419403426811 | etot = -15.2023987707493 -309000 ekin = 2.38041738433959 | erot = 2.92081370932153 | epot = -21.4463399141034 | etot = -16.1451088204423 -310000 ekin = 2.50977269558789 | erot = 2.34824464102402 | epot = -21.4648074532888 | etot = -16.6067901166769 -311000 ekin = 2.57488628819259 | erot = 2.293754673538 | epot = -21.5151382155269 | etot = -16.6464972537963 -312000 ekin = 2.09623150906876 | erot = 2.93795890592974 | epot = -21.6260240426366 | etot = -16.5918336276381 -313000 ekin = 1.8184499729194 | erot = 2.28463898505893 | epot = -21.6999003790643 | etot = -17.5968114210859 -314000 ekin = 2.3228324174232 | erot = 2.19580475273396 | epot = -21.6870491287185 | etot = -17.1684119585613 -315000 ekin = 1.84546653836013 | erot = 2.13886071139629 | epot = -21.7312132691438 | etot = -17.7468860193873 -316000 ekin = 2.1657114199577 | erot = 3.03124199276298 | epot = -21.7430929234306 | etot = -16.5461395107099 -317000 ekin = 2.42793755919909 | erot = 3.57187833839244 | epot = -21.8303487369249 | etot = -15.8305328393334 -318000 ekin = 2.31418145055206 | erot = 3.02858542885927 | epot = -21.9347898317926 | etot = -16.5920229523813 -319000 ekin = 2.35032973997068 | erot = 3.16078759112674 | epot = -22.0387665246751 | etot = -16.5276491935776 -320000 ekin = 1.78202525445684 | erot = 2.83297321443624 | epot = -22.1187616541783 | etot = -17.5037631852852 -321000 ekin = 2.87441941784728 | erot = 2.26223197636944 | epot = -22.1065455913123 | etot = -16.9698941970956 -322000 ekin = 2.79013397204362 | erot = 2.68769432639935 | epot = -22.1121405540937 | etot = -16.6343122556507 -323000 ekin = 2.070121980457 | erot = 2.31830584817612 | epot = -22.1539458855415 | etot = -17.7655180569083 -324000 ekin = 2.58383941134683 | erot = 2.58296807603305 | epot = -22.1539753505051 | etot = -16.9871678631253 -325000 ekin = 3.43451304817783 | erot = 2.45405386180802 | epot = -21.938960387404 | etot = -16.0503934774181 -326000 ekin = 3.49680929786584 | erot = 2.85196633398113 | epot = -21.8204400999953 | etot = -15.4716644681484 -327000 ekin = 2.68799300805475 | erot = 2.21805195956654 | epot = -21.7892073548558 | etot = -16.8831623872345 -328000 ekin = 1.81477491971657 | erot = 2.35891534842888 | epot = -21.7275637950057 | etot = -17.5538735268602 -329000 ekin = 2.19319322627006 | erot = 2.40717958919081 | epot = -21.6826095784948 | etot = -17.0822367630339 -330000 ekin = 1.87131927244382 | erot = 2.03694340108429 | epot = -21.5934239674847 | etot = -17.6851612939566 -331000 ekin = 2.37197683084608 | erot = 1.80087022346348 | epot = -21.5641185835514 | etot = -17.3912715292419 -332000 ekin = 1.69601394569048 | erot = 2.54947032294377 | epot = -21.5986464339748 | etot = -17.3531621653406 -333000 ekin = 1.59867443991714 | erot = 2.14911483871162 | epot = -21.7162173059518 | etot = -17.9684280273231 -334000 ekin = 2.25811733625553 | erot = 2.62323988136568 | epot = -21.7749416190679 | etot = -16.8935844014467 -335000 ekin = 2.93433632601273 | erot = 3.10350297573268 | epot = -21.7966831809595 | etot = -15.7588438792141 -336000 ekin = 2.76337640462581 | erot = 2.54930710489019 | epot = -21.7180312833467 | etot = -16.4053477738307 -337000 ekin = 3.19235531401951 | erot = 3.87146146874103 | epot = -21.8022396262892 | etot = -14.7384228435286 -338000 ekin = 2.33305125173566 | erot = 2.13094194678887 | epot = -21.8068682042896 | etot = -17.3428750057651 -339000 ekin = 1.71673308889604 | erot = 2.30964121170968 | epot = -21.7941224580796 | etot = -17.7677481574739 -340000 ekin = 1.59424151294027 | erot = 3.16324993863714 | epot = -21.7679173396748 | etot = -17.0104258880973 -341000 ekin = 1.69465464335694 | erot = 3.18694861883744 | epot = -21.7067352043109 | etot = -16.8251319421165 -342000 ekin = 1.81243763026219 | erot = 2.60448215582795 | epot = -21.5993126794634 | etot = -17.1823928933732 -343000 ekin = 3.08243814047349 | erot = 2.9217466333323 | epot = -21.5855979229594 | etot = -15.5814131491536 -344000 ekin = 2.94964594107348 | erot = 3.10231272046816 | epot = -21.5506154266351 | etot = -15.4986567650935 -345000 ekin = 2.34525111670595 | erot = 2.88045261854212 | epot = -21.530734043011 | etot = -16.3050303077629 -346000 ekin = 2.03136740406842 | erot = 3.44352096435563 | epot = -21.4703041890966 | etot = -15.9954158206726 -347000 ekin = 2.34515762081498 | erot = 1.91414074840886 | epot = -21.3488386855954 | etot = -17.0895403163716 -348000 ekin = 2.76763212340836 | erot = 2.78035348102326 | epot = -21.3102796687364 | etot = -15.7622940643048 -349000 ekin = 2.29342234253801 | erot = 3.14526664575919 | epot = -21.3922932631024 | etot = -15.9536042748052 -350000 ekin = 2.17828641691343 | erot = 2.38211689163937 | epot = -21.3570978647003 | etot = -16.7966945561475 -351000 ekin = 2.2787342054874 | erot = 2.85568682453813 | epot = -21.3165609660186 | etot = -16.182139935993 -352000 ekin = 2.70894563927919 | erot = 2.77656375044279 | epot = -21.3565059314145 | etot = -15.8709965416925 -353000 ekin = 1.74748047732915 | erot = 2.14191122851256 | epot = -21.3195625770357 | etot = -17.430170871194 -354000 ekin = 2.30492780756568 | erot = 2.37159952583724 | epot = -21.3742968901642 | etot = -16.6977695567612 -355000 ekin = 2.32493886573112 | erot = 2.38411746089983 | epot = -21.339340741587 | etot = -16.6302844149561 -356000 ekin = 2.9749649543268 | erot = 2.9916655517553 | epot = -21.2468948072712 | etot = -15.2802643011891 -357000 ekin = 1.79541671946026 | erot = 2.13971792108731 | epot = -21.2216819829681 | etot = -17.2865473424205 -358000 ekin = 2.06637919290965 | erot = 1.9076530715578 | epot = -21.2447441674953 | etot = -17.2707119030278 -359000 ekin = 2.02344077580052 | erot = 2.11726163321539 | epot = -21.2183688961264 | etot = -17.0776664871105 -360000 ekin = 2.64012587839158 | erot = 2.43776362828977 | epot = -21.1472477161847 | etot = -16.0693582095033 -361000 ekin = 2.41850555983882 | erot = 2.39054736245265 | epot = -21.2133787743639 | etot = -16.4043258520724 -362000 ekin = 2.2486199222758 | erot = 2.04489136793498 | epot = -21.2088914287919 | etot = -16.9153801385811 -363000 ekin = 3.21904252076974 | erot = 1.79717950163013 | epot = -21.2620537293498 | etot = -16.24583170695 -364000 ekin = 2.9845697448498 | erot = 2.18316673460243 | epot = -21.2883338312843 | etot = -16.120597351832 -365000 ekin = 2.49427392981412 | erot = 2.31205455481896 | epot = -21.4001153296815 | etot = -16.5937868450484 -366000 ekin = 2.61706523565788 | erot = 2.20229130507574 | epot = -21.4506718008962 | etot = -16.6313152601626 -367000 ekin = 2.24650816549397 | erot = 1.87906237362998 | epot = -21.5207044850599 | etot = -17.3951339459359 -368000 ekin = 2.46672276241562 | erot = 2.37638546053105 | epot = -21.5628581383216 | etot = -16.7197499153749 -369000 ekin = 2.03614635149851 | erot = 2.85426887707092 | epot = -21.6803034764487 | etot = -16.7898882478793 -370000 ekin = 2.13410724028005 | erot = 2.17304603842012 | epot = -21.7343761700058 | etot = -17.4272228913057 -371000 ekin = 2.21722409826115 | erot = 2.11058746733929 | epot = -21.6422617131998 | etot = -17.3144501475994 -372000 ekin = 1.88083333566673 | erot = 1.90617172826127 | epot = -21.6005499693118 | etot = -17.8135449053838 -373000 ekin = 1.98298204516521 | erot = 1.78267682128409 | epot = -21.5708808628646 | etot = -17.8052219964153 -374000 ekin = 2.88981201933268 | erot = 1.90326894499807 | epot = -21.4624711307906 | etot = -16.6693901664599 -375000 ekin = 2.31951869092549 | erot = 1.92779670517485 | epot = -21.3521768069862 | etot = -17.1048614108859 -376000 ekin = 2.60113015271722 | erot = 2.31181306588444 | epot = -21.34681055463 | etot = -16.4338673360283 -377000 ekin = 2.23867315344604 | erot = 1.65923992926403 | epot = -21.2611852709131 | etot = -17.363272188203 -378000 ekin = 2.38125181613766 | erot = 2.54002618279121 | epot = -21.2390275318703 | etot = -16.3177495329414 -379000 ekin = 2.06952281308678 | erot = 2.11888196225292 | epot = -21.194025606577 | etot = -17.0056208312373 -380000 ekin = 2.59961269461524 | erot = 2.3751200788503 | epot = -21.1885781090515 | etot = -16.2138453355859 -381000 ekin = 2.42019573552876 | erot = 2.20667402504614 | epot = -21.1989968748535 | etot = -16.5721271142786 -382000 ekin = 2.04746564398744 | erot = 3.34439482672214 | epot = -21.2903574441545 | etot = -15.8984969734449 -383000 ekin = 2.65699216362738 | erot = 1.56546061375907 | epot = -21.3572338418187 | etot = -17.1347810644322 -384000 ekin = 2.43156675693926 | erot = 2.00097327452753 | epot = -21.3434156392382 | etot = -16.9108756077714 -385000 ekin = 1.95152101616516 | erot = 3.28345377140313 | epot = -21.4173973675698 | etot = -16.1824225800015 -386000 ekin = 2.10919215730741 | erot = 2.90700736383436 | epot = -21.3963452767614 | etot = -16.3801457556197 -387000 ekin = 2.34448447096483 | erot = 2.50155013212484 | epot = -21.3487258248084 | etot = -16.5026912217187 -388000 ekin = 2.71771591111729 | erot = 2.76803950274557 | epot = -21.3515918112166 | etot = -15.8658363973537 -389000 ekin = 3.06825183100775 | erot = 3.06148533146046 | epot = -21.4826430036711 | etot = -15.3529058412029 -390000 ekin = 2.56997560639923 | erot = 2.05646161654304 | epot = -21.5623801506968 | etot = -16.9359429277546 -391000 ekin = 2.1110114400687 | erot = 2.44612603817531 | epot = -21.6052888202632 | etot = -17.0481513420191 -392000 ekin = 2.58328475785099 | erot = 2.75249392862464 | epot = -21.7336094646938 | etot = -16.3978307782182 -393000 ekin = 2.03977041996533 | erot = 1.67448219405536 | epot = -21.8740604202474 | etot = -18.1598078062267 -394000 ekin = 2.1229408356241 | erot = 2.43410977254954 | epot = -21.9094739378951 | etot = -17.3524233297214 -395000 ekin = 2.48696003315341 | erot = 2.48225062557349 | epot = -21.8799685903484 | etot = -16.9107579316215 -396000 ekin = 3.18909661029635 | erot = 1.62675064803775 | epot = -21.8520000277039 | etot = -17.0361527693698 -397000 ekin = 2.39161566907255 | erot = 2.17052346752458 | epot = -21.7939512244376 | etot = -17.2318120878404 -398000 ekin = 2.29946433742664 | erot = 2.18115834594542 | epot = -21.7285069861955 | etot = -17.2478843028235 -399000 ekin = 2.65449075133045 | erot = 2.80318185995816 | epot = -21.6503181327212 | etot = -16.1926455214325 -400000 ekin = 1.800915604111 | erot = 2.76596769548035 | epot = -21.6418619272709 | etot = -17.0749786276795 -401000 ekin = 2.35073130822393 | erot = 3.1229922205774 | epot = -21.6675586342212 | etot = -16.1938351054199 -402000 ekin = 3.95550191914708 | erot = 3.58855023837881 | epot = -21.5840051268208 | etot = -14.0399529692949 -403000 ekin = 3.59615502379622 | erot = 3.44558176696768 | epot = -21.5781150073617 | etot = -14.5363782165978 -404000 ekin = 2.50360365952137 | erot = 3.01285184176069 | epot = -21.6258060641303 | etot = -16.1093505628483 -405000 ekin = 2.77241560720113 | erot = 3.10596549510783 | epot = -21.704678917892 | etot = -15.826297815583 -406000 ekin = 2.33934923007339 | erot = 2.04671975867729 | epot = -21.819104286388 | etot = -17.4330352976373 -407000 ekin = 2.34277955096234 | erot = 1.89301717692526 | epot = -21.8450916691373 | etot = -17.6092949412497 -408000 ekin = 1.91561948833426 | erot = 2.19551604353608 | epot = -21.8744041835349 | etot = -17.7632686516646 -409000 ekin = 1.98819074442449 | erot = 1.93870533007334 | epot = -21.921903026697 | etot = -17.9950069521992 -410000 ekin = 1.59047218684375 | erot = 1.93259851333214 | epot = -21.969890787558 | etot = -18.4468200873821 -411000 ekin = 1.88305362601542 | erot = 2.47249081001963 | epot = -22.0985208042931 | etot = -17.742976368258 -412000 ekin = 2.51301623282815 | erot = 2.67550740966365 | epot = -22.2078537029906 | etot = -17.0193300604988 -413000 ekin = 2.81407439938451 | erot = 3.21402559358062 | epot = -22.1310120840187 | etot = -16.1029120910536 -414000 ekin = 2.79247479268938 | erot = 2.73425265524033 | epot = -22.0977113063587 | etot = -16.570983858429 -415000 ekin = 2.47916660937974 | erot = 2.2538291443672 | epot = -22.1646477745644 | etot = -17.4316520208175 -416000 ekin = 3.33232223339091 | erot = 1.56386062957 | epot = -22.1461937000839 | etot = -17.250010837123 -417000 ekin = 3.95877285814837 | erot = 2.43917045295873 | epot = -22.0789469190762 | etot = -15.6810036079691 -418000 ekin = 2.77978041892218 | erot = 2.67961998913593 | epot = -21.9429456651673 | etot = -16.4835452571092 -419000 ekin = 2.38024484823696 | erot = 2.99229133054455 | epot = -21.8677152868896 | etot = -16.4951791081081 -420000 ekin = 1.82267088279317 | erot = 1.83608705422836 | epot = -21.870451160571 | etot = -18.2116932235495 -421000 ekin = 1.36907389827089 | erot = 1.7797704929584 | epot = -21.8376802512791 | etot = -18.6888358600498 -422000 ekin = 1.39969148752264 | erot = 2.73407059574398 | epot = -21.8945647860022 | etot = -17.7608027027356 -423000 ekin = 1.56110844196111 | erot = 3.07614792088633 | epot = -21.9244447660987 | etot = -17.2871884032512 -424000 ekin = 2.34533519268149 | erot = 2.03540102416745 | epot = -21.9949085928942 | etot = -17.6141723760453 -425000 ekin = 2.30531135176125 | erot = 2.5628563075006 | epot = -22.0442964382176 | etot = -17.1761287789557 -426000 ekin = 2.08911806268394 | erot = 3.11967927432985 | epot = -21.9925431949266 | etot = -16.7837458579128 -427000 ekin = 2.15676382580403 | erot = 2.43973499877679 | epot = -21.8818966255662 | etot = -17.2853978009854 -428000 ekin = 1.77792840961357 | erot = 1.65301904457092 | epot = -21.8564247195203 | etot = -18.4254772653358 -429000 ekin = 1.64662621362122 | erot = 2.54748287085176 | epot = -21.8025042608483 | etot = -17.6083951763753 -430000 ekin = 2.65482151975961 | erot = 2.86424448473893 | epot = -21.8233021230657 | etot = -16.3042361185671 -431000 ekin = 2.76450737503174 | erot = 1.57600071919883 | epot = -21.8149424651896 | etot = -17.474434370959 -432000 ekin = 2.55825491646852 | erot = 1.62501657592138 | epot = -21.782511983832 | etot = -17.5992404914421 -433000 ekin = 2.01126969712347 | erot = 2.46583763941079 | epot = -21.8897978226513 | etot = -17.4126904861171 -434000 ekin = 3.04567132520196 | erot = 2.70385575793897 | epot = -22.0064907697329 | etot = -16.256963686592 -435000 ekin = 3.55537447133515 | erot = 1.38977885610833 | epot = -22.1475448623269 | etot = -17.2023915348834 -436000 ekin = 2.99751349357597 | erot = 2.00759426062759 | epot = -22.1521181601551 | etot = -17.1470104059515 -437000 ekin = 3.22719371512018 | erot = 1.7857012571478 | epot = -22.1712823460501 | etot = -17.1583873737822 -438000 ekin = 2.89146439117069 | erot = 1.84455801050198 | epot = -22.1285919294041 | etot = -17.3925695277315 -439000 ekin = 2.4298540579217 | erot = 2.69925899679117 | epot = -22.1231674050022 | etot = -16.9940543502893 -440000 ekin = 2.25394774327534 | erot = 3.00779841178563 | epot = -22.1604171321029 | etot = -16.898670977042 -441000 ekin = 2.90484412816846 | erot = 2.87153501323763 | epot = -22.3059803982533 | etot = -16.5296012568472 -442000 ekin = 2.09031226167651 | erot = 1.73424350391287 | epot = -22.3736918061838 | etot = -18.5491360405944 -443000 ekin = 1.88581876804904 | erot = 2.00333583047903 | epot = -22.4253701402759 | etot = -18.5362155417478 -444000 ekin = 2.07231382818727 | erot = 2.15535274194041 | epot = -22.4449863446106 | etot = -18.2173197744829 -445000 ekin = 2.10994187816787 | erot = 2.27934343705762 | epot = -22.5011906844133 | etot = -18.1119053691878 -446000 ekin = 2.42762161250135 | erot = 2.85815816680871 | epot = -22.5326129135227 | etot = -17.2468331342127 -447000 ekin = 2.18601253591574 | erot = 2.99495256710103 | epot = -22.609768680069 | etot = -17.4288035770523 -448000 ekin = 2.33389346287827 | erot = 2.95385139208094 | epot = -22.6330370332815 | etot = -17.3452921783223 -449000 ekin = 2.34940633774375 | erot = 2.93264896913184 | epot = -22.632810074435 | etot = -17.3507547675594 -450000 ekin = 1.83766660151173 | erot = 1.69672449717286 | epot = -22.577435118717 | etot = -19.0430440200324 -451000 ekin = 1.97812884417234 | erot = 1.92764750146577 | epot = -22.5879223350906 | etot = -18.6821459894525 -452000 ekin = 1.36037939407656 | erot = 1.88463175839662 | epot = -22.5510765694841 | etot = -19.3060654170109 -453000 ekin = 2.08089341129519 | erot = 2.55704963640352 | epot = -22.3855210194734 | etot = -17.7475779717747 -454000 ekin = 1.45876213242879 | erot = 2.19347003321548 | epot = -22.2423919107779 | etot = -18.5901597451336 -455000 ekin = 1.65659111626477 | erot = 2.72276980532162 | epot = -22.0960205273875 | etot = -17.7166596058011 -456000 ekin = 2.34656659310869 | erot = 1.9986137505101 | epot = -22.0123490462426 | etot = -17.6671687026238 -457000 ekin = 2.02190390619673 | erot = 2.36256741542514 | epot = -21.9726531641996 | etot = -17.5881818425778 -458000 ekin = 1.74372434205051 | erot = 2.25707911101456 | epot = -21.9983442618521 | etot = -17.997540808787 -459000 ekin = 2.51332199676583 | erot = 2.31717011174282 | epot = -22.0772270520059 | etot = -17.2467349434973 -460000 ekin = 2.2034722783839 | erot = 2.00072694492175 | epot = -22.0506516825516 | etot = -17.846452459246 -461000 ekin = 2.27677089259524 | erot = 2.92031766851146 | epot = -21.9925449331789 | etot = -16.7954563720722 -462000 ekin = 2.6185812356449 | erot = 1.79402090094851 | epot = -22.0230696595749 | etot = -17.6104675229815 -463000 ekin = 2.59249670562421 | erot = 3.30012727643189 | epot = -21.9571457322291 | etot = -16.064521750173 -464000 ekin = 2.18969352756478 | erot = 2.37346543558646 | epot = -21.8914572439365 | etot = -17.3282982807853 -465000 ekin = 2.55190117035706 | erot = 3.6026040005498 | epot = -21.8125549491858 | etot = -15.6580497782789 -466000 ekin = 1.97953104510473 | erot = 2.88392288093832 | epot = -21.8154103020505 | etot = -16.9519563760074 -467000 ekin = 1.6387129632993 | erot = 2.61654440984279 | epot = -21.8983950281207 | etot = -17.6431376549786 -468000 ekin = 1.11239222475223 | erot = 3.3637902926771 | epot = -21.9583777645662 | etot = -17.4821952471369 -469000 ekin = 1.72382156581199 | erot = 2.77626770299012 | epot = -21.9878353154891 | etot = -17.487746046687 -470000 ekin = 1.8714597310977 | erot = 2.88190687781237 | epot = -22.0448924208381 | etot = -17.291525811928 -471000 ekin = 2.74011620634609 | erot = 2.33779564753422 | epot = -22.0936369539761 | etot = -17.0157251000958 -472000 ekin = 2.69470680116255 | erot = 2.14464177510474 | epot = -22.1704276099478 | etot = -17.3310790336805 -473000 ekin = 2.28376217878235 | erot = 2.08795770091158 | epot = -22.1987443333452 | etot = -17.8270244536512 -474000 ekin = 2.23739040654538 | erot = 2.17996427776831 | epot = -22.2112749348846 | etot = -17.7939202505709 -475000 ekin = 2.52078584565558 | erot = 2.10760071935559 | epot = -22.2127629874904 | etot = -17.5843764224793 -476000 ekin = 2.21655354698253 | erot = 1.76978147174391 | epot = -22.1154823176964 | etot = -18.12914729897 -477000 ekin = 2.49538102143271 | erot = 2.39024231683251 | epot = -22.0840161006559 | etot = -17.1983927623907 -478000 ekin = 1.92447460017176 | erot = 2.05040869255766 | epot = -22.1087248977672 | etot = -18.1338416050377 -479000 ekin = 2.27800579519478 | erot = 3.09893174949893 | epot = -22.0960233927896 | etot = -16.7190858480959 -480000 ekin = 1.67638938499079 | erot = 2.75323401987762 | epot = -22.1000079080955 | etot = -17.6703845032271 -481000 ekin = 1.81944275684786 | erot = 2.94268362469552 | epot = -22.0498104845242 | etot = -17.2876841029808 -482000 ekin = 2.15574027829653 | erot = 2.0725438892243 | epot = -22.0125690425762 | etot = -17.7842848750553 -483000 ekin = 1.49597116676185 | erot = 1.99734627551918 | epot = -21.9777307226356 | etot = -18.4844132803546 -484000 ekin = 1.8484819245566 | erot = 2.33821326463838 | epot = -22.0508318876624 | etot = -17.8641366984674 -485000 ekin = 1.63994328771 | erot = 2.49471615719057 | epot = -22.0805056177628 | etot = -17.9458461728623 -486000 ekin = 1.86887650973413 | erot = 2.15138584351099 | epot = -22.0672609747503 | etot = -18.0469986215052 -487000 ekin = 2.36601044267131 | erot = 3.10120454318392 | epot = -22.1385621074087 | etot = -16.6713471215534 -488000 ekin = 2.28411726066255 | erot = 3.25699291514219 | epot = -22.0925409557863 | etot = -16.5514307799816 -489000 ekin = 2.42268424794998 | erot = 2.54559333727918 | epot = -22.0028229962135 | etot = -17.0345454109843 -490000 ekin = 2.15695777466101 | erot = 3.5405265432528 | epot = -21.8987471713935 | etot = -16.2012628534796 -491000 ekin = 2.21843295915446 | erot = 2.48759605623037 | epot = -21.7849993207689 | etot = -17.0789703053841 -492000 ekin = 2.42523259661774 | erot = 2.76338555140187 | epot = -21.7546976439717 | etot = -16.5660794959521 -493000 ekin = 1.78787643025978 | erot = 2.27566821203155 | epot = -21.8142896153583 | etot = -17.7507449730669 -494000 ekin = 2.08684832766799 | erot = 3.00001715875608 | epot = -21.8562812315893 | etot = -16.7694157451653 -495000 ekin = 2.13573322112433 | erot = 2.49326389133065 | epot = -21.9467671324553 | etot = -17.3177700200003 -496000 ekin = 2.04467628391159 | erot = 2.6162845895522 | epot = -21.9884683374098 | etot = -17.327507463946 -497000 ekin = 2.51418899377052 | erot = 1.70810866993563 | epot = -21.9276447401884 | etot = -17.7053470764823 -498000 ekin = 2.15585318171628 | erot = 1.79538414401099 | epot = -21.8645241799653 | etot = -17.913286854238 -499000 ekin = 3.01701290816369 | erot = 1.75748039597449 | epot = -21.8892368424083 | etot = -17.1147435382701 -500000 ekin = 2.75239118232731 | erot = 2.51840040194924 | epot = -21.8902992314675 | etot = -16.6195076471909 -501000 ekin = 2.67894034986861 | erot = 3.01164832527811 | epot = -21.7709154896334 | etot = -16.0803268144867 -502000 ekin = 1.89316543275823 | erot = 3.89794024057184 | epot = -21.6531840495811 | etot = -15.862078376251 -503000 ekin = 1.79271217239337 | erot = 2.94195973795538 | epot = -21.4642442224488 | etot = -16.7295723121 -504000 ekin = 1.6771855422807 | erot = 3.03652723399754 | epot = -21.3696883509301 | etot = -16.6559755746518 -505000 ekin = 2.71833858397102 | erot = 2.13541162175611 | epot = -21.3703611232649 | etot = -16.5166109175378 -506000 ekin = 2.26393943112 | erot = 2.03997434566047 | epot = -21.3701060081751 | etot = -17.0661922313946 -507000 ekin = 3.13593335317162 | erot = 2.43613799195774 | epot = -21.4594670249601 | etot = -15.8873956798307 -508000 ekin = 2.50977944502594 | erot = 2.54754436309782 | epot = -21.6189261516985 | etot = -16.5616023435747 -509000 ekin = 2.11418702736586 | erot = 2.82587497425585 | epot = -21.7696504732974 | etot = -16.8295884716757 -510000 ekin = 2.14979144320026 | erot = 1.42702348952371 | epot = -21.8372692973069 | etot = -18.2604543645829 -511000 ekin = 2.52507885024672 | erot = 2.75237930607404 | epot = -21.9038675932379 | etot = -16.6264094369171 -512000 ekin = 2.30816398580866 | erot = 2.74440410404474 | epot = -21.9049605915963 | etot = -16.8523925017429 -513000 ekin = 2.48929206456089 | erot = 2.14820879347373 | epot = -21.8691788664222 | etot = -17.2316780083876 -514000 ekin = 2.80085464362196 | erot = 2.54503473578109 | epot = -22.0226541110001 | etot = -16.6767647315971 -515000 ekin = 2.54939499554986 | erot = 1.81858738302198 | epot = -22.114703586072 | etot = -17.7467212075001 -516000 ekin = 2.82421125785514 | erot = 2.22239822832894 | epot = -22.1991501131327 | etot = -17.1525406269486 -517000 ekin = 2.04384407501393 | erot = 2.05286256711726 | epot = -22.223660515307 | etot = -18.1269538731759 -518000 ekin = 2.19097977809323 | erot = 2.75238147912107 | epot = -22.2176385899556 | etot = -17.2742773327413 -519000 ekin = 2.24039331018443 | erot = 2.22517425402749 | epot = -22.3147614078005 | etot = -17.8491938435885 -520000 ekin = 1.89059175672112 | erot = 2.20041051856069 | epot = -22.3991443907322 | etot = -18.3081421154504 -521000 ekin = 2.59226785962331 | erot = 1.8787186288573 | epot = -22.558855864031 | etot = -18.0878693755504 -522000 ekin = 3.47620702193973 | erot = 1.77094959979111 | epot = -22.6529022954593 | etot = -17.4057456737285 -523000 ekin = 2.86949346153076 | erot = 2.45905269319727 | epot = -22.6983641285372 | etot = -17.3698179738092 -524000 ekin = 2.43223643727573 | erot = 2.35710345393931 | epot = -22.6347622840061 | etot = -17.8454223927911 -525000 ekin = 1.58633727726026 | erot = 2.6771932767998 | epot = -22.5981477078776 | etot = -18.3346171538175 -526000 ekin = 1.68956829163897 | erot = 1.56381447059437 | epot = -22.5455188933618 | etot = -19.2921361311285 -527000 ekin = 2.25335664013444 | erot = 1.91897798598234 | epot = -22.438285347212 | etot = -18.2659507210952 -528000 ekin = 2.66417770052522 | erot = 2.81695730712898 | epot = -22.4214392419194 | etot = -16.9403042342652 -529000 ekin = 2.68388271083098 | erot = 3.01210908187864 | epot = -22.4261041670352 | etot = -16.7301123743256 -530000 ekin = 2.58091136149224 | erot = 2.12874327798812 | epot = -22.2849687345625 | etot = -17.5753140950821 -531000 ekin = 2.96791741143998 | erot = 2.35396590663619 | epot = -22.1825114215506 | etot = -16.8606281034744 -532000 ekin = 2.56040610657616 | erot = 2.30869688210952 | epot = -22.1966779750303 | etot = -17.3275749863446 -533000 ekin = 2.47127792277395 | erot = 2.96337405559089 | epot = -22.2034167916881 | etot = -16.7687648133233 -534000 ekin = 2.10109006711395 | erot = 2.06160691104878 | epot = -22.2334884486858 | etot = -18.0707914705231 -535000 ekin = 3.76901503112188 | erot = 2.6463468036932 | epot = -22.2244389422279 | etot = -15.8090771074128 -536000 ekin = 2.76978499488531 | erot = 1.95801212091677 | epot = -22.1621143741426 | etot = -17.4343172583406 -537000 ekin = 2.84173849615256 | erot = 2.62706904536459 | epot = -22.0817906214053 | etot = -16.6129830798882 -538000 ekin = 2.68461551572766 | erot = 2.11438749606247 | epot = -22.0095123737601 | etot = -17.21050936197 -539000 ekin = 2.71441959372568 | erot = 2.40909357772199 | epot = -22.1283805595379 | etot = -17.0048673880902 -540000 ekin = 2.43554469514557 | erot = 2.49366634622684 | epot = -22.2721085965986 | etot = -17.3428975552261 -541000 ekin = 3.40478335851234 | erot = 2.79351301825373 | epot = -22.3438323146239 | etot = -16.1455359378578 -542000 ekin = 2.43305477389315 | erot = 2.89262463310066 | epot = -22.3528484076625 | etot = -17.0271690006687 -543000 ekin = 2.33384318243661 | erot = 2.87812814268662 | epot = -22.3517509549719 | etot = -17.1397796298486 -544000 ekin = 2.20405054763978 | erot = 1.45974147181057 | epot = -22.3200355678433 | etot = -18.656243548393 -545000 ekin = 2.44190363474283 | erot = 2.14425712944393 | epot = -22.3037584455754 | etot = -17.7175976813886 -546000 ekin = 1.97349236865067 | erot = 2.22849747468303 | epot = -22.2610854898172 | etot = -18.0590956464835 -547000 ekin = 2.54002964967593 | erot = 1.88937782138629 | epot = -22.2132220899932 | etot = -17.783814618931 -548000 ekin = 1.68504847096503 | erot = 1.6504983981354 | epot = -22.1188297609737 | etot = -18.7832828918733 -549000 ekin = 1.8698904826159 | erot = 2.68379586673466 | epot = -22.3014742550974 | etot = -17.7477879057469 -550000 ekin = 1.81227590400771 | erot = 1.59168663528122 | epot = -22.4534648123994 | etot = -19.0495022731104 -551000 ekin = 2.18778306678591 | erot = 2.27083852152173 | epot = -22.5132391469467 | etot = -18.0546175586391 -552000 ekin = 2.0524867508114 | erot = 2.50762393323791 | epot = -22.5694064381206 | etot = -18.0092957540712 -553000 ekin = 2.95456875477793 | erot = 2.14561779139538 | epot = -22.6592693777082 | etot = -17.5590828315349 -554000 ekin = 2.82905646744367 | erot = 1.93590782360605 | epot = -22.8091725556775 | etot = -18.0442082646278 -555000 ekin = 2.39158205650881 | erot = 2.26907880603287 | epot = -22.8586370928634 | etot = -18.1979762303218 -556000 ekin = 2.29372548723881 | erot = 2.58079244425137 | epot = -22.9103117359013 | etot = -18.0357938044111 -557000 ekin = 2.83941059371958 | erot = 1.46630907998336 | epot = -22.9934681858733 | etot = -18.6877485121704 -558000 ekin = 2.74456573812684 | erot = 2.01705053511004 | epot = -23.0249165386548 | etot = -18.263300265418 -559000 ekin = 3.32001639007045 | erot = 2.33065957496589 | epot = -23.0702860514081 | etot = -17.4196100863717 -560000 ekin = 3.06548847901962 | erot = 2.32403726670831 | epot = -23.0562195399467 | etot = -17.6666937942187 -561000 ekin = 2.86648091511123 | erot = 2.08496682915783 | epot = -22.9734465855435 | etot = -18.0219988412745 -562000 ekin = 3.27266742525966 | erot = 2.5148755055394 | epot = -22.8741285027176 | etot = -17.0865855719185 -563000 ekin = 2.66038974520286 | erot = 1.64110018949295 | epot = -22.8474543828021 | etot = -18.5459644481063 -564000 ekin = 2.80468636683463 | erot = 2.52664241131886 | epot = -22.8018617517494 | etot = -17.4705329735959 -565000 ekin = 2.64616861412633 | erot = 2.04566022999095 | epot = -22.7506810734506 | etot = -18.0588522293334 -566000 ekin = 2.31863979249599 | erot = 2.17936618392302 | epot = -22.753817383677 | etot = -18.255811407258 -567000 ekin = 1.93243531435252 | erot = 2.8201914219892 | epot = -22.7091974553673 | etot = -17.9565707190256 -568000 ekin = 2.20145087944368 | erot = 2.21735208955968 | epot = -22.7289431019428 | etot = -18.3101401329394 -569000 ekin = 2.47195478734592 | erot = 2.65975337798175 | epot = -22.6704691958401 | etot = -17.5387610305124 -570000 ekin = 2.43702231300343 | erot = 1.88676767986218 | epot = -22.6634145438588 | etot = -18.3396245509932 -571000 ekin = 2.89036429172333 | erot = 2.95615513706037 | epot = -22.6566784173206 | etot = -16.8101589885369 -572000 ekin = 1.93616423502164 | erot = 3.77280866215609 | epot = -22.6161904936583 | etot = -16.9072175964806 -573000 ekin = 2.40449703945409 | erot = 2.31309419006005 | epot = -22.592333216152 | etot = -17.8747419866379 -574000 ekin = 1.69163306749095 | erot = 2.32935369197413 | epot = -22.6465956635078 | etot = -18.6256089040427 -575000 ekin = 1.84139068594293 | erot = 1.86447317795677 | epot = -22.7237799324543 | etot = -19.0179160685546 -576000 ekin = 3.22131124370819 | erot = 2.95816228283025 | epot = -22.6715615977237 | etot = -16.4920880711853 -577000 ekin = 2.86651980816624 | erot = 2.88003300402859 | epot = -22.6040632784101 | etot = -16.8575104662152 -578000 ekin = 2.38036632496091 | erot = 2.76701770395377 | epot = -22.3994142750986 | etot = -17.2520302461839 -579000 ekin = 2.40092915325622 | erot = 1.9941192489901 | epot = -22.2419585433873 | etot = -17.846910141141 -580000 ekin = 2.62012657675686 | erot = 1.97778552777916 | epot = -22.0959374453144 | etot = -17.4980253407783 -581000 ekin = 2.04604501901225 | erot = 3.02029740769394 | epot = -21.969203567202 | etot = -16.9028611404958 -582000 ekin = 2.17538959702762 | erot = 3.10891247706868 | epot = -21.8431272977465 | etot = -16.5588252236502 -583000 ekin = 2.1277994052252 | erot = 2.71423548986473 | epot = -21.8070587526078 | etot = -16.9650238575179 -584000 ekin = 2.99172160795183 | erot = 2.61848378659144 | epot = -21.79936869936 | etot = -16.1891633048167 -585000 ekin = 2.41567815843635 | erot = 2.49971455295247 | epot = -21.7559519530568 | etot = -16.840559241668 -586000 ekin = 3.5784340003808 | erot = 1.99027982649426 | epot = -21.7770294519877 | etot = -16.2083156251126 -587000 ekin = 3.53538631245293 | erot = 1.96660128703793 | epot = -21.754918588089 | etot = -16.2529309885981 -588000 ekin = 2.80370665446806 | erot = 1.58935491344442 | epot = -21.7265541827784 | etot = -17.3334926148659 -589000 ekin = 2.31177964330664 | erot = 2.19607744710081 | epot = -21.7746975125222 | etot = -17.2668404221147 -590000 ekin = 2.5714466329988 | erot = 1.71442868035276 | epot = -21.7777302960456 | etot = -17.491854982694 -591000 ekin = 1.90022629380971 | erot = 3.80795912333789 | epot = -21.8668982157977 | etot = -16.1587127986501 -592000 ekin = 2.10279882895952 | erot = 2.85583901759444 | epot = -21.9108757117546 | etot = -16.9522378652007 -593000 ekin = 1.66307844177278 | erot = 2.45945798543616 | epot = -21.9477120734663 | etot = -17.8251756462574 -594000 ekin = 1.85147702439684 | erot = 2.37601059124117 | epot = -22.0726279896574 | etot = -17.8451403740194 -595000 ekin = 1.62809593102861 | erot = 2.1376140673132 | epot = -22.2629667751952 | etot = -18.4972567768534 -596000 ekin = 1.85098827042652 | erot = 1.55279926082377 | epot = -22.3598865590345 | etot = -18.9560990277842 -597000 ekin = 2.21895198056269 | erot = 2.31253848766694 | epot = -22.4199578312546 | etot = -17.8884673630249 -598000 ekin = 1.87160565114506 | erot = 3.0277507704973 | epot = -22.4911453410919 | etot = -17.5917889194496 -599000 ekin = 2.84158802287444 | erot = 2.1920185610572 | epot = -22.5193833279106 | etot = -17.4857767439789 -600000 ekin = 2.63818657196383 | erot = 2.13278760870029 | epot = -22.4344536662284 | etot = -17.6634794855643 -601000 ekin = 2.95993107274926 | erot = 3.20885509956692 | epot = -22.3072696496284 | etot = -16.1384834773122 -602000 ekin = 2.94299398558342 | erot = 2.68013224377472 | epot = -22.2188520758353 | etot = -16.5957258464772 -603000 ekin = 2.59660369946999 | erot = 2.70989416331592 | epot = -22.1609733489959 | etot = -16.85447548621 -604000 ekin = 1.79240933557438 | erot = 2.1163931677418 | epot = -22.191830604205 | etot = -18.2830281008888 -605000 ekin = 1.83069958852698 | erot = 2.27958589555072 | epot = -22.223893707794 | etot = -18.1136082237163 -606000 ekin = 2.33186424204054 | erot = 2.19630763210353 | epot = -22.1677269529972 | etot = -17.6395550788531 -607000 ekin = 2.71182931402141 | erot = 2.97109858003922 | epot = -22.1521845558164 | etot = -16.4692566617558 -608000 ekin = 2.41997749037237 | erot = 2.41608876723459 | epot = -22.1090787304487 | etot = -17.2730124728417 -609000 ekin = 1.88827272588068 | erot = 2.63293672960969 | epot = -21.998471393382 | etot = -17.4772619378917 -610000 ekin = 3.00352553825308 | erot = 2.17715232945663 | epot = -21.921125149498 | etot = -16.7404472817883 -611000 ekin = 2.45802371980552 | erot = 2.74758446810105 | epot = -21.9175611897393 | etot = -16.7119530018327 -612000 ekin = 2.52205492882348 | erot = 2.13390999483971 | epot = -21.952922358004 | etot = -17.2969574343408 -613000 ekin = 3.0366403087624 | erot = 2.11840093313595 | epot = -22.0002186117394 | etot = -16.8451773698411 -614000 ekin = 2.28547905389303 | erot = 3.00549626246339 | epot = -22.0746950370029 | etot = -16.7837197206465 -615000 ekin = 1.68496895203681 | erot = 2.6238974067784 | epot = -22.0312524650619 | etot = -17.7223861062467 -616000 ekin = 1.93869933628639 | erot = 2.84243572789263 | epot = -22.0598022720905 | etot = -17.2786672079115 -617000 ekin = 2.16688154116712 | erot = 2.51660309412659 | epot = -22.0580971291184 | etot = -17.3746124938247 -618000 ekin = 3.09921969264655 | erot = 2.74549226450141 | epot = -22.0155339259629 | etot = -16.1708219688149 -619000 ekin = 3.43177694169698 | erot = 2.12198343059748 | epot = -21.986089674814 | etot = -16.4323293025195 -620000 ekin = 4.28772375093259 | erot = 2.22706390062221 | epot = -21.9590250230057 | etot = -15.4442373714509 -621000 ekin = 3.0817377949309 | erot = 2.5715302712226 | epot = -21.9009729000649 | etot = -16.2477048339114 -622000 ekin = 2.73165859080048 | erot = 2.62811367428178 | epot = -21.8396158670716 | etot = -16.4798436019893 -623000 ekin = 2.85443766883212 | erot = 2.89934248449797 | epot = -21.6835451183467 | etot = -15.9297649650166 -624000 ekin = 2.03264036935949 | erot = 3.41736745424461 | epot = -21.5163207310271 | etot = -16.066312907423 -625000 ekin = 2.93853121772536 | erot = 2.67773115439888 | epot = -21.3838363274969 | etot = -15.7675739553726 -626000 ekin = 2.62777924734508 | erot = 2.18162282576041 | epot = -21.3730333234904 | etot = -16.5636312503849 -627000 ekin = 2.31990667522995 | erot = 2.39482401666938 | epot = -21.4354987061654 | etot = -16.7207680142661 -628000 ekin = 2.22203953187498 | erot = 2.76412791129531 | epot = -21.5952632825804 | etot = -16.6090958394101 -629000 ekin = 2.21775645889425 | erot = 1.98065436363089 | epot = -21.7562971185524 | etot = -17.5578862960273 -630000 ekin = 2.47359866092386 | erot = 2.13925319586019 | epot = -21.7758191809316 | etot = -17.1629673241476 -631000 ekin = 2.05051856532003 | erot = 1.79291928253663 | epot = -21.7853759251476 | etot = -17.9419380772909 -632000 ekin = 1.64850143430096 | erot = 3.28395498862858 | epot = -21.8317536045469 | etot = -16.8992971816173 -633000 ekin = 2.35005689695082 | erot = 2.3390788040001 | epot = -21.9523909247055 | etot = -17.2632552237546 -634000 ekin = 2.35693540441333 | erot = 2.46483135146881 | epot = -22.0188246134313 | etot = -17.1970578575491 -635000 ekin = 1.98898390231468 | erot = 3.3707265296603 | epot = -22.0674825033302 | etot = -16.7077720713553 -636000 ekin = 2.50980012291046 | erot = 2.48689559173921 | epot = -22.0698487955046 | etot = -17.073153080855 -637000 ekin = 2.77498878878958 | erot = 2.80713853773056 | epot = -21.9907400151913 | etot = -16.4086126886711 -638000 ekin = 2.43806293105884 | erot = 2.79004417520011 | epot = -22.0575076323657 | etot = -16.8294005261068 -639000 ekin = 1.88083948877533 | erot = 2.09676394462429 | epot = -22.048310763883 | etot = -18.0707073304834 -640000 ekin = 2.08188388766029 | erot = 3.35897660071801 | epot = -21.9960574959824 | etot = -16.5551970076041 -641000 ekin = 2.09182696029806 | erot = 2.24096762672331 | epot = -22.0953763111483 | etot = -17.7625817241269 -642000 ekin = 2.29622874060124 | erot = 2.6949832870016 | epot = -22.151409557085 | etot = -17.1601975294822 -643000 ekin = 2.73569648066616 | erot = 2.20073493313118 | epot = -22.0949564882595 | etot = -17.1585250744621 -644000 ekin = 2.8774767032651 | erot = 3.41751476954418 | epot = -22.1298161092011 | etot = -15.8348246363918 -645000 ekin = 2.4290925856966 | erot = 2.10618409243776 | epot = -22.0667334414767 | etot = -17.5314567633423 -646000 ekin = 2.69467422761642 | erot = 1.80008229703286 | epot = -21.8974158987303 | etot = -17.402659374081 -647000 ekin = 2.50876501618975 | erot = 2.02696268329777 | epot = -21.7872910341098 | etot = -17.2515633346223 -648000 ekin = 2.30426131969587 | erot = 1.6458501532655 | epot = -21.8921456933826 | etot = -17.9420342204213 -649000 ekin = 2.59259139367702 | erot = 1.74799625276216 | epot = -22.0338111702567 | etot = -17.6932235238175 -650000 ekin = 2.70418822875775 | erot = 2.18747773876972 | epot = -22.1379356884042 | etot = -17.2462697208768 -651000 ekin = 2.13264787236381 | erot = 3.27713220231 | epot = -22.2140357553834 | etot = -16.8042556807096 -652000 ekin = 2.3441787788075 | erot = 2.31061064519192 | epot = -22.2512463247192 | etot = -17.5964569007197 -653000 ekin = 2.0783895005922 | erot = 2.15412898001082 | epot = -22.2780657745064 | etot = -18.0455472939034 -654000 ekin = 2.30897991961162 | erot = 1.85124051868153 | epot = -22.3104418685982 | etot = -18.150221430305 -655000 ekin = 2.12106061544383 | erot = 1.78500189152084 | epot = -22.2852988882964 | etot = -18.3792363813318 -656000 ekin = 2.4735695444961 | erot = 2.3420013127236 | epot = -22.2660003992253 | etot = -17.4504295420056 -657000 ekin = 2.49468968638545 | erot = 2.86409627910532 | epot = -22.2925124601966 | etot = -16.9337264947059 -658000 ekin = 2.49656210866705 | erot = 2.87057420343463 | epot = -22.2700281258802 | etot = -16.9028918137786 -659000 ekin = 3.4002230119036 | erot = 2.78079262685479 | epot = -22.1392014132181 | etot = -15.9581857744598 -660000 ekin = 2.71468183951524 | erot = 2.00084154317764 | epot = -22.0088760160501 | etot = -17.2933526333572 -661000 ekin = 2.22564214621743 | erot = 2.53966313147986 | epot = -21.8739603827229 | etot = -17.1086551050257 -662000 ekin = 2.02829181839209 | erot = 2.53975139691216 | epot = -21.8209028819505 | etot = -17.2528596666463 -663000 ekin = 2.23525378228906 | erot = 2.31366678132105 | epot = -21.7767349910666 | etot = -17.2278144274565 -664000 ekin = 2.34360790891041 | erot = 1.86434304281456 | epot = -21.6752271215873 | etot = -17.4672761698624 -665000 ekin = 2.6131782266455 | erot = 2.2942197715156 | epot = -21.6042046109401 | etot = -16.696806612779 -666000 ekin = 1.62393527088755 | erot = 2.31134155882296 | epot = -21.5004119311113 | etot = -17.5651351014008 -667000 ekin = 1.67276637494452 | erot = 2.8234547562148 | epot = -21.4092484100762 | etot = -16.9130272789169 -668000 ekin = 2.49690543622955 | erot = 3.27659348221062 | epot = -21.2758920536656 | etot = -15.5023931352255 -669000 ekin = 1.62806554113038 | erot = 2.65931770046313 | epot = -21.2000245357891 | etot = -16.9126412941955 -670000 ekin = 2.23977376187302 | erot = 2.6095972175341 | epot = -21.1325862484852 | etot = -16.2832152690781 -671000 ekin = 2.28188801168356 | erot = 2.16305917244004 | epot = -21.0881674881013 | etot = -16.6432203039777 -672000 ekin = 1.98109020838353 | erot = 1.6545553737063 | epot = -21.0064866117102 | etot = -17.3708410296204 -673000 ekin = 1.94244230895293 | erot = 2.07625571526623 | epot = -20.9829498347911 | etot = -16.964251810572 -674000 ekin = 2.13730353222164 | erot = 2.16737069376511 | epot = -21.0214974795938 | etot = -16.716823253607 -675000 ekin = 2.0738264400087 | erot = 2.48606196350775 | epot = -21.0590224845651 | etot = -16.4991340810486 -676000 ekin = 2.45892166960283 | erot = 2.79866228976047 | epot = -21.091647649138 | etot = -15.8340636897747 -677000 ekin = 2.20625727487218 | erot = 2.63108770232727 | epot = -21.1176354388896 | etot = -16.2802904616901 -678000 ekin = 2.15213590782194 | erot = 2.79904006113487 | epot = -21.0140734470396 | etot = -16.0628974780828 -679000 ekin = 2.18343356480304 | erot = 2.18490396550911 | epot = -20.9181838430532 | etot = -16.549846312741 -680000 ekin = 2.10821203830737 | erot = 2.68505727915271 | epot = -20.9461225832237 | etot = -16.1528532657636 -681000 ekin = 2.19096880009954 | erot = 1.84583521880628 | epot = -21.049747832921 | etot = -17.0129438140152 -682000 ekin = 3.05384884549289 | erot = 2.40296404987894 | epot = -21.0557501140049 | etot = -15.5989372186331 -683000 ekin = 2.86746710745163 | erot = 2.09710011404619 | epot = -21.0757665962385 | etot = -16.1111993747407 -684000 ekin = 1.99137037242252 | erot = 2.9957171615915 | epot = -21.113690638146 | etot = -16.126603104132 -685000 ekin = 1.5741328626647 | erot = 2.03056483786644 | epot = -21.1261282639781 | etot = -17.5214305634469 -686000 ekin = 2.37471898314499 | erot = 2.54238213977475 | epot = -21.1270745420036 | etot = -16.2099734190839 -687000 ekin = 1.90729058124661 | erot = 2.87801884923459 | epot = -21.1165743035804 | etot = -16.3312648730992 -688000 ekin = 2.62048299874671 | erot = 2.25003931366163 | epot = -21.0986223733053 | etot = -16.228100060897 -689000 ekin = 2.68144410783034 | erot = 2.65050786826928 | epot = -21.2128570731653 | etot = -15.8809050970657 -690000 ekin = 2.57020917801037 | erot = 2.48157927371166 | epot = -21.3777687615583 | etot = -16.3259803098363 -691000 ekin = 2.19847693909567 | erot = 2.52609380111695 | epot = -21.4850476477408 | etot = -16.7604769075282 -692000 ekin = 2.34330258125554 | erot = 3.25002655945746 | epot = -21.4986374232228 | etot = -15.9053082825098 -693000 ekin = 2.29392126490893 | erot = 3.00689891870992 | epot = -21.5194889284254 | etot = -16.2186687448065 -694000 ekin = 2.65812969336117 | erot = 2.58735606777937 | epot = -21.7321648892945 | etot = -16.4866791281539 -695000 ekin = 2.4316162204446 | erot = 1.19791474341253 | epot = -21.9242547697609 | etot = -18.2947238059037 -696000 ekin = 1.81693709897036 | erot = 1.47023542418153 | epot = -21.8934819532786 | etot = -18.6063094301267 -697000 ekin = 2.39493869239631 | erot = 2.11395689699314 | epot = -21.9285847092192 | etot = -17.4196891198297 -698000 ekin = 2.35958906151814 | erot = 1.92876427029827 | epot = -22.0159711481531 | etot = -17.7276178163367 -699000 ekin = 2.48368136666702 | erot = 2.56159396613047 | epot = -22.0103910104183 | etot = -16.9651156776208 -700000 ekin = 2.1450801922911 | erot = 2.29917908979014 | epot = -21.922109394496 | etot = -17.4778501124148 -701000 ekin = 2.1745638313557 | erot = 2.20111278634863 | epot = -21.8156387421437 | etot = -17.4399621244394 -702000 ekin = 1.56478756336654 | erot = 2.01119937519508 | epot = -21.7778672436792 | etot = -18.2018803051176 -703000 ekin = 2.06132778292139 | erot = 2.17314611223241 | epot = -21.7930054701539 | etot = -17.5585315750001 -704000 ekin = 2.81983493340982 | erot = 1.94305987211435 | epot = -21.8114535861206 | etot = -17.0485587805964 -705000 ekin = 2.82055978010065 | erot = 2.18251946343581 | epot = -21.766252843205 | etot = -16.7631735996685 -706000 ekin = 1.98110988281637 | erot = 2.32695112193058 | epot = -21.78040819482 | etot = -17.4723471900731 -707000 ekin = 1.91160206821925 | erot = 2.05897248195774 | epot = -21.833053672666 | etot = -17.862479122489 -708000 ekin = 2.49797260430835 | erot = 2.18514664814829 | epot = -21.8432772467022 | etot = -17.1601579942456 -709000 ekin = 2.86869907833219 | erot = 2.56795355151628 | epot = -21.8927607091555 | etot = -16.456108079307 -710000 ekin = 2.19600917748735 | erot = 2.26596247481176 | epot = -21.8688086872618 | etot = -17.4068370349627 -711000 ekin = 2.34017154985874 | erot = 1.44618662245857 | epot = -21.9060063017349 | etot = -18.1196481294176 -712000 ekin = 2.571626566146 | erot = 2.28694259963336 | epot = -22.0214699153591 | etot = -17.1629007495797 -713000 ekin = 1.98520968446438 | erot = 2.33486849904896 | epot = -22.1149578958933 | etot = -17.7948797123799 -714000 ekin = 2.59962138344223 | erot = 2.10724318046303 | epot = -22.1786558411969 | etot = -17.4717912772916 -715000 ekin = 2.4195410390622 | erot = 3.74883662346075 | epot = -22.1475942949397 | etot = -15.9792166324167 -716000 ekin = 2.84279313896907 | erot = 2.86022834631577 | epot = -22.0565535101519 | etot = -16.3535320248671 -717000 ekin = 3.44629592734909 | erot = 3.22665808286196 | epot = -21.9609198250287 | etot = -15.2879658148176 -718000 ekin = 3.10244803746594 | erot = 3.95040927490044 | epot = -21.8593081248118 | etot = -14.8064508124454 -719000 ekin = 2.37775253377205 | erot = 2.95612290233182 | epot = -21.8454876437379 | etot = -16.511612207634 -720000 ekin = 2.21232762300396 | erot = 3.13525351489473 | epot = -21.8232438423991 | etot = -16.4756627045004 -721000 ekin = 1.69400550933915 | erot = 2.23173955948197 | epot = -21.7326772937498 | etot = -17.8069322249286 -722000 ekin = 1.90042078179571 | erot = 2.80431814967802 | epot = -21.7394766818033 | etot = -17.0347377503296 -723000 ekin = 2.36468467929204 | erot = 2.56344225093691 | epot = -21.6720290892733 | etot = -16.7439021590444 -724000 ekin = 1.73517505640396 | erot = 2.45263100900798 | epot = -21.6468054707964 | etot = -17.4589994053844 -725000 ekin = 2.29142999435738 | erot = 2.94537439813943 | epot = -21.7063452187228 | etot = -16.4695408262259 -726000 ekin = 1.63432825555556 | erot = 2.30396244675118 | epot = -21.7456114234691 | etot = -17.8073207211624 -727000 ekin = 2.48133238220639 | erot = 3.20400739682796 | epot = -21.7806560741677 | etot = -16.0953162951334 -728000 ekin = 2.22757813298303 | erot = 2.16464177499475 | epot = -21.7790073705306 | etot = -17.3867874625529 -729000 ekin = 1.89754664123238 | erot = 1.65708384447828 | epot = -21.818793017262 | etot = -18.2641625315513 -730000 ekin = 1.81104622151894 | erot = 2.15772480190845 | epot = -21.8166979693399 | etot = -17.8479269459125 -731000 ekin = 2.20035848812534 | erot = 2.984094437949 | epot = -21.7770198662085 | etot = -16.5925669401341 -732000 ekin = 2.43533262071618 | erot = 2.2714682081237 | epot = -21.6795793034593 | etot = -16.9727784746194 -733000 ekin = 3.07400414774412 | erot = 2.56794551470528 | epot = -21.7282232978635 | etot = -16.0862736354141 -734000 ekin = 2.38495425977383 | erot = 2.02723577856807 | epot = -21.7862523639798 | etot = -17.3740623256379 -735000 ekin = 2.14308578867868 | erot = 1.55617115431814 | epot = -21.8355194712534 | etot = -18.1362625282566 -736000 ekin = 2.14719637814141 | erot = 3.43682718130883 | epot = -21.9432003809582 | etot = -16.359176821508 -737000 ekin = 1.74871923076117 | erot = 3.58265582775873 | epot = -21.961923642904 | etot = -16.6305485843841 -738000 ekin = 2.04024583543123 | erot = 2.50826561687817 | epot = -21.9946639190404 | etot = -17.446152466731 -739000 ekin = 1.85177899677126 | erot = 2.20064138018375 | epot = -22.0123052281368 | etot = -17.9598848511818 -740000 ekin = 2.83857272073312 | erot = 2.79134975714448 | epot = -22.0279140396377 | etot = -16.39799156176 -741000 ekin = 2.46635495152007 | erot = 2.9103294596823 | epot = -22.0794124202159 | etot = -16.7027280090136 -742000 ekin = 2.71465468895042 | erot = 3.27392339093581 | epot = -22.2079531631203 | etot = -16.2193750832341 -743000 ekin = 2.22475007867544 | erot = 3.21169489639582 | epot = -22.3366771138424 | etot = -16.9002321387711 -744000 ekin = 2.01249089419451 | erot = 3.77628990094158 | epot = -22.4195693816618 | etot = -16.6307885865257 -745000 ekin = 3.1550015757828 | erot = 2.315867165247 | epot = -22.4039856366928 | etot = -16.933116895663 -746000 ekin = 2.9760064146713 | erot = 2.63068823711827 | epot = -22.3618535919292 | etot = -16.7551589401397 -747000 ekin = 2.34106182302225 | erot = 2.04664398645464 | epot = -22.354695038859 | etot = -17.9669892293821 -748000 ekin = 2.37138666208783 | erot = 2.40542984904221 | epot = -22.3895155133383 | etot = -17.6126990022083 -749000 ekin = 2.06138370471239 | erot = 2.76626854206187 | epot = -22.3750763140021 | etot = -17.5474240672278 -750000 ekin = 1.64672066604894 | erot = 2.38347386235118 | epot = -22.4369940886927 | etot = -18.4067995602926 -751000 ekin = 1.78177119419735 | erot = 2.81833680350818 | epot = -22.5257071681888 | etot = -17.9255991704833 -752000 ekin = 1.34818171721257 | erot = 1.45846043808637 | epot = -22.6018348796366 | etot = -19.7951927243377 -753000 ekin = 1.87655795218726 | erot = 2.45353295142028 | epot = -22.5520612881159 | etot = -18.2219703845083 -754000 ekin = 1.74975840903648 | erot = 2.74283699647828 | epot = -22.4634749655138 | etot = -17.9708795599991 -755000 ekin = 2.42034607898545 | erot = 2.41190491839854 | epot = -22.3898060492349 | etot = -17.5575550518509 -756000 ekin = 1.85451473741877 | erot = 2.78171703843177 | epot = -22.3128363094556 | etot = -17.6766045336051 -757000 ekin = 1.97510746852342 | erot = 2.51748911462571 | epot = -22.1174762043225 | etot = -17.6248796211734 -758000 ekin = 1.22903408000892 | erot = 2.60716879638028 | epot = -21.9785553297124 | etot = -18.1423524533232 -759000 ekin = 2.21600197663295 | erot = 1.43977874856212 | epot = -22.1451816653321 | etot = -18.4894009401371 -760000 ekin = 2.68031518877979 | erot = 2.41730519207617 | epot = -22.2523665710424 | etot = -17.1547461901865 -761000 ekin = 2.17596592269854 | erot = 2.27182574078646 | epot = -22.3278934724238 | etot = -17.8801018089388 -762000 ekin = 2.18672258558963 | erot = 1.66841951917867 | epot = -22.3560817096941 | etot = -18.5009396049258 -763000 ekin = 2.45624456911328 | erot = 3.353199087397 | epot = -22.4226856635722 | etot = -16.6132420070619 -764000 ekin = 2.82991156680043 | erot = 2.78772749955354 | epot = -22.4168769890428 | etot = -16.7992379226888 -765000 ekin = 1.82695315748762 | erot = 2.76260899367527 | epot = -22.3180874182918 | etot = -17.7285252671289 -766000 ekin = 2.64718727066684 | erot = 2.30809984362825 | epot = -22.1747973384657 | etot = -17.2195102241706 -767000 ekin = 2.57546948652102 | erot = 2.85622460559127 | epot = -22.0792338208857 | etot = -16.6475397287734 -768000 ekin = 1.86461408985655 | erot = 2.77026783876655 | epot = -22.0997460179139 | etot = -17.4648640892908 -769000 ekin = 2.39719072886598 | erot = 2.30714111472591 | epot = -22.1774105238745 | etot = -17.4730786802827 -770000 ekin = 2.47072108127125 | erot = 3.23258521636165 | epot = -22.2814001434105 | etot = -16.5780938457776 -771000 ekin = 2.33036519398503 | erot = 2.29089498051982 | epot = -22.3195270405423 | etot = -17.6982668660374 -772000 ekin = 2.26183241289834 | erot = 3.00933524584073 | epot = -22.4177530473637 | etot = -17.1465853886246 -773000 ekin = 2.23430073882848 | erot = 1.82006063686398 | epot = -22.4857511691573 | etot = -18.4313897934648 -774000 ekin = 2.82253641499965 | erot = 2.20426049452907 | epot = -22.4768371725758 | etot = -17.4500402630471 -775000 ekin = 1.80826097265228 | erot = 1.8594330353803 | epot = -22.4067702410985 | etot = -18.7390762330659 -776000 ekin = 1.40036201749763 | erot = 3.15425759738852 | epot = -22.3648422416548 | etot = -17.8102226267687 -777000 ekin = 1.64191168277988 | erot = 2.80572311301618 | epot = -22.2758078856404 | etot = -17.8281730898443 -778000 ekin = 1.48568750761886 | erot = 2.23411617896699 | epot = -22.2807840878112 | etot = -18.5609804012253 -779000 ekin = 1.86180462326533 | erot = 1.89442532300483 | epot = -22.3101851282869 | etot = -18.5539551820167 -780000 ekin = 1.70083326144506 | erot = 2.31232836878966 | epot = -22.368088335214 | etot = -18.3549267049793 -781000 ekin = 2.10015890171884 | erot = 2.56021799860011 | epot = -22.4467515624801 | etot = -17.7863746621612 -782000 ekin = 2.56555999292579 | erot = 1.95862112685967 | epot = -22.3484071481452 | etot = -17.8242260283597 -783000 ekin = 2.16519753597492 | erot = 2.88346819560595 | epot = -22.2452576468217 | etot = -17.1965919152409 -784000 ekin = 2.82020985681265 | erot = 2.22817695283317 | epot = -22.2217547403593 | etot = -17.1733679307135 -785000 ekin = 3.11754466459225 | erot = 2.90955325829367 | epot = -22.2354545908828 | etot = -16.2083566679969 -786000 ekin = 2.79942218761003 | erot = 3.42875764975157 | epot = -22.250592498505 | etot = -16.0224126611434 -787000 ekin = 2.38458676493535 | erot = 3.01099796177293 | epot = -22.1654452152169 | etot = -16.7698604885087 -788000 ekin = 1.98626456977422 | erot = 2.00275328811937 | epot = -22.1112200648967 | etot = -18.1222022070031 -789000 ekin = 2.44233063979376 | erot = 2.28313889802901 | epot = -22.0447230803812 | etot = -17.3192535425585 -790000 ekin = 3.54880462493947 | erot = 2.80770271341156 | epot = -21.9679846446661 | etot = -15.6114773063151 -791000 ekin = 3.07908349792595 | erot = 2.4183569461896 | epot = -21.9560607901314 | etot = -16.4586203460158 -792000 ekin = 3.91821329297348 | erot = 1.97340936537895 | epot = -21.8852423103708 | etot = -15.9936196520184 -793000 ekin = 2.24372361561433 | erot = 2.58378808209984 | epot = -21.7746367758897 | etot = -16.9471250781755 -794000 ekin = 2.14759663301018 | erot = 2.45362282428674 | epot = -21.6057162069285 | etot = -17.0044967496316 -795000 ekin = 1.62843452575834 | erot = 2.41204885281414 | epot = -21.4428571758252 | etot = -17.4023737972527 -796000 ekin = 2.20611316383669 | erot = 2.13895899282881 | epot = -21.3315860267741 | etot = -16.9865138701086 -797000 ekin = 1.8301274808806 | erot = 1.99903093547351 | epot = -21.3391948873385 | etot = -17.5100364709844 -798000 ekin = 2.25726523935456 | erot = 2.51247281070767 | epot = -21.3769575532967 | etot = -16.6072195032345 -799000 ekin = 1.90933563327017 | erot = 2.87396619489344 | epot = -21.3621013619625 | etot = -16.5787995337988 -800000 ekin = 2.16791860235721 | erot = 2.34759279016547 | epot = -21.2767357657464 | etot = -16.7612243732237 -801000 ekin = 1.87657888051436 | erot = 1.64443435892708 | epot = -21.1205442749523 | etot = -17.5995310355109 -802000 ekin = 2.22680112501959 | erot = 2.21115076271302 | epot = -21.0075202165858 | etot = -16.5695683288532 -803000 ekin = 2.68720281674732 | erot = 1.9055828700456 | epot = -20.9783230569545 | etot = -16.3855373701615 -804000 ekin = 2.34742553306287 | erot = 2.89589931482196 | epot = -20.9208915085851 | etot = -15.6775666607002 -805000 ekin = 1.76090854918944 | erot = 2.71265295620197 | epot = -20.7896819578332 | etot = -16.3161204524417 -806000 ekin = 1.7462870636756 | erot = 2.0675335773069 | epot = -20.7361496593739 | etot = -16.9223290183914 -807000 ekin = 1.56796585063504 | erot = 1.70424554994442 | epot = -20.7915009374418 | etot = -17.5192895368624 -808000 ekin = 2.1089079867654 | erot = 2.39841171836652 | epot = -20.8718914314634 | etot = -16.3645717263314 -809000 ekin = 2.64205233751098 | erot = 1.51708231521757 | epot = -20.860658338686 | etot = -16.7015236859574 -810000 ekin = 3.09559784865049 | erot = 2.66400816236668 | epot = -20.7931361339113 | etot = -15.0335301228942 -811000 ekin = 3.04444079406036 | erot = 3.63356452868707 | epot = -20.8528361945454 | etot = -14.174830871798 -812000 ekin = 2.15160129632237 | erot = 2.79692069084717 | epot = -20.9401885998277 | etot = -15.9916666126582 -813000 ekin = 2.1866812847642 | erot = 3.17352337049868 | epot = -21.140046139319 | etot = -15.7798414840561 -814000 ekin = 1.72120340413861 | erot = 2.99586512288056 | epot = -21.2431304413524 | etot = -16.5260619143332 -815000 ekin = 2.15308486059066 | erot = 2.27039729778303 | epot = -21.2454651427287 | etot = -16.821982984355 -816000 ekin = 2.70853368688568 | erot = 1.52116799452424 | epot = -21.261293152511 | etot = -17.0315914711011 -817000 ekin = 2.58931303514761 | erot = 2.58517904286731 | epot = -21.3952446820623 | etot = -16.2207526040474 -818000 ekin = 2.27857909894085 | erot = 2.24637345033467 | epot = -21.4314613483393 | etot = -16.9065087990638 -819000 ekin = 2.10638790580901 | erot = 3.01120037058918 | epot = -21.4323015928675 | etot = -16.3147133164693 -820000 ekin = 2.45664566148736 | erot = 2.7075790370773 | epot = -21.3792192523262 | etot = -16.2149945537616 -821000 ekin = 2.56775447201567 | erot = 2.5492984098592 | epot = -21.3164894306539 | etot = -16.199436548779 -822000 ekin = 3.57289533285904 | erot = 2.21052116492673 | epot = -21.2854519181088 | etot = -15.502035420323 -823000 ekin = 3.55319917858674 | erot = 2.72446531740647 | epot = -21.2720447371835 | etot = -14.9943802411903 -824000 ekin = 4.11549879731445 | erot = 3.29143140978184 | epot = -21.2030896509282 | etot = -13.7961594438319 -825000 ekin = 2.91512457403517 | erot = 3.47068683775168 | epot = -21.0609871292213 | etot = -14.6751757174345 -826000 ekin = 1.7163898925254 | erot = 1.97834164539342 | epot = -20.8767355772593 | etot = -17.1820040393405 -827000 ekin = 1.87677701795696 | erot = 2.56463384104522 | epot = -20.7854029227346 | etot = -16.3439920637325 -828000 ekin = 2.38062360557162 | erot = 2.54648236886784 | epot = -20.7050759849485 | etot = -15.7779700105091 -829000 ekin = 2.23108302894327 | erot = 1.78470720624501 | epot = -20.6073113475481 | etot = -16.5915211123598 -830000 ekin = 2.54725147866706 | erot = 2.32441333820119 | epot = -20.4877024469931 | etot = -15.6160376301249 -831000 ekin = 2.68575093093387 | erot = 2.09843530086498 | epot = -20.3759551828171 | etot = -15.5917689510182 -832000 ekin = 2.59940424582709 | erot = 2.00750749806411 | epot = -20.1908446114452 | etot = -15.583932867554 -833000 ekin = 2.42127651950715 | erot = 2.60529540830756 | epot = -20.078944485857 | etot = -15.0523725580422 -834000 ekin = 2.84384893680911 | erot = 2.32747318035689 | epot = -20.0706360897591 | etot = -14.8993139725931 -835000 ekin = 2.7678557540129 | erot = 2.75945454275209 | epot = -20.196580890927 | etot = -14.669270594162 -836000 ekin = 2.53473695255286 | erot = 2.86392788167815 | epot = -20.358210381663 | etot = -14.9595455474319 -837000 ekin = 1.73656397849906 | erot = 1.97461102829179 | epot = -20.4142699072864 | etot = -16.7030949004955 -838000 ekin = 1.97190242589771 | erot = 2.78134736415134 | epot = -20.4306923978834 | etot = -15.6774426078343 -839000 ekin = 1.96899626495587 | erot = 2.72126775666989 | epot = -20.4229760480712 | etot = -15.7327120264454 -840000 ekin = 1.7171072647053 | erot = 2.97405496575738 | epot = -20.5310188981682 | etot = -15.8398566677055 -841000 ekin = 2.84263223284519 | erot = 2.84805882649256 | epot = -20.7029997187952 | etot = -15.0123086594574 -842000 ekin = 2.60852389795254 | erot = 2.84079273136912 | epot = -20.7559161264561 | etot = -15.3065994971344 -843000 ekin = 2.05482516428399 | erot = 2.60168054731321 | epot = -20.7398205878817 | etot = -16.0833148762845 -844000 ekin = 1.55484491564895 | erot = 1.93946122833937 | epot = -20.793873895268 | etot = -17.2995677512796 -845000 ekin = 2.34415562398594 | erot = 2.33054915402977 | epot = -20.9292293378503 | etot = -16.2545245598346 -846000 ekin = 2.10828138543307 | erot = 2.31084128804075 | epot = -21.0208568932193 | etot = -16.6017342197455 -847000 ekin = 2.49792342883821 | erot = 2.62762350266534 | epot = -20.9870443583388 | etot = -15.8614974268353 -848000 ekin = 2.16881569142256 | erot = 1.47414765167355 | epot = -21.0272780430065 | etot = -17.3843146999104 -849000 ekin = 2.02577069067687 | erot = 2.48073789957305 | epot = -21.0548829559118 | etot = -16.5483743656619 -850000 ekin = 2.56121323608232 | erot = 2.68216361525941 | epot = -21.0531120198317 | etot = -15.80973516849 -851000 ekin = 2.18318825014005 | erot = 2.93699487251027 | epot = -21.072057934595 | etot = -15.9518748119447 -852000 ekin = 2.47242228011125 | erot = 2.47093974244847 | epot = -21.1036036708141 | etot = -16.1602416482544 -853000 ekin = 2.39779726435527 | erot = 2.98937612414091 | epot = -21.0464025867825 | etot = -15.6592291982864 -854000 ekin = 2.33702117267764 | erot = 2.85284252822427 | epot = -20.9556796853364 | etot = -15.7658159844345 -855000 ekin = 2.34760752254692 | erot = 2.06775496176188 | epot = -20.9732459823191 | etot = -16.5578834980103 -856000 ekin = 2.50439922073455 | erot = 2.74747347867824 | epot = -20.8640767421381 | etot = -15.6122040427253 -857000 ekin = 2.54554426380173 | erot = 3.02043559253138 | epot = -20.7373381265487 | etot = -15.1713582702156 -858000 ekin = 3.06972052097933 | erot = 2.1533020939209 | epot = -20.6779613423402 | etot = -15.45493872744 -859000 ekin = 2.85296234704364 | erot = 2.24390648873861 | epot = -20.6722067614218 | etot = -15.5753379256396 -860000 ekin = 2.81550228271929 | erot = 1.51851082884538 | epot = -20.6725383213113 | etot = -16.3385252097467 -861000 ekin = 2.27514176030031 | erot = 2.84648353799519 | epot = -20.6420712292961 | etot = -15.5204459310006 -862000 ekin = 2.9987675929355 | erot = 1.87057008174782 | epot = -20.6660164836296 | etot = -15.7966788089463 -863000 ekin = 2.82347853622627 | erot = 1.77874439342615 | epot = -20.7576165207476 | etot = -16.1553935910952 -864000 ekin = 2.92188345840032 | erot = 2.64334274850666 | epot = -20.9261206064404 | etot = -15.3608943995334 -865000 ekin = 3.33407052864803 | erot = 2.25520565932836 | epot = -21.0515135151698 | etot = -15.4622373271934 -866000 ekin = 2.86068791662345 | erot = 3.16201991362392 | epot = -21.1397264169455 | etot = -15.1170185866981 -867000 ekin = 2.74707401666422 | erot = 3.06797998358081 | epot = -21.1320468209182 | etot = -15.3169928206732 -868000 ekin = 2.19562503546865 | erot = 2.22513352423332 | epot = -21.0678608919895 | etot = -16.6471023322876 -869000 ekin = 2.92239622436426 | erot = 2.5008962182639 | epot = -21.0133576609085 | etot = -15.5900652182804 -870000 ekin = 2.48942591106965 | erot = 2.13034723792471 | epot = -20.996084603173 | etot = -16.3763114541786 -871000 ekin = 2.19159342044105 | erot = 2.37819238438806 | epot = -20.874805817807 | etot = -16.3050200129778 -872000 ekin = 1.55149762269136 | erot = 2.09773965219071 | epot = -20.8507483226038 | etot = -17.2015110477217 -873000 ekin = 1.39031919518734 | erot = 2.27780516445362 | epot = -20.9245661591995 | etot = -17.2564417995585 -874000 ekin = 1.41307234618125 | erot = 2.76889585749685 | epot = -21.0893130528338 | etot = -16.9073448491557 -875000 ekin = 1.1903759815938 | erot = 2.71897418399016 | epot = -21.2265810734678 | etot = -17.3172309078839 -876000 ekin = 1.81153308354558 | erot = 2.98976206981359 | epot = -21.2471086207564 | etot = -16.4458134673973 -877000 ekin = 2.36285714663855 | erot = 2.036005929661 | epot = -21.3279144058001 | etot = -16.9290513295006 -878000 ekin = 2.12543608141368 | erot = 1.75442210002794 | epot = -21.3225487572348 | etot = -17.4426905757932 -879000 ekin = 2.27283239224876 | erot = 2.70186511894803 | epot = -21.3124243745064 | etot = -16.3377268633096 -880000 ekin = 2.68477293779859 | erot = 2.77341018951834 | epot = -21.3544902274222 | etot = -15.8963071001053 -881000 ekin = 2.87581138753759 | erot = 2.33631707903057 | epot = -21.330399862467 | etot = -16.1182713958988 -882000 ekin = 2.3286795198909 | erot = 2.16799605433164 | epot = -21.25964008372 | etot = -16.7629645094974 -883000 ekin = 2.36016075059912 | erot = 1.97853915282771 | epot = -21.0668204006881 | etot = -16.7281204972613 -884000 ekin = 2.52365942577107 | erot = 2.24976084040446 | epot = -20.9653280828805 | etot = -16.191907816705 -885000 ekin = 2.84734342605207 | erot = 2.26485201008783 | epot = -20.9652017220512 | etot = -15.8530062859113 -886000 ekin = 3.18250292594555 | erot = 1.73451408298307 | epot = -21.0018071240468 | etot = -16.0847901151182 -887000 ekin = 2.68810301741898 | erot = 2.50208813779432 | epot = -21.0684744202113 | etot = -15.878283264998 -888000 ekin = 2.15240565341107 | erot = 2.83219210215604 | epot = -21.1767699295518 | etot = -16.1921721739847 -889000 ekin = 2.16923637104046 | erot = 2.20209706465088 | epot = -21.1021053306932 | etot = -16.7307718950019 -890000 ekin = 1.7855023510616 | erot = 2.98359580087557 | epot = -21.1862135178402 | etot = -16.4171153659031 -891000 ekin = 1.64893562703222 | erot = 2.27727861261825 | epot = -21.3185718288916 | etot = -17.3923575892411 -892000 ekin = 1.96573403811713 | erot = 2.36272783048894 | epot = -21.459073017988 | etot = -17.1306111493819 -893000 ekin = 1.79366158034469 | erot = 1.8414245936827 | epot = -21.5466572595161 | etot = -17.9115710854887 -894000 ekin = 2.81388625610773 | erot = 2.80751276121754 | epot = -21.653645549411 | etot = -16.0322465320857 -895000 ekin = 2.00720208466152 | erot = 2.75365533683677 | epot = -21.7495268499499 | etot = -16.9886694284516 -896000 ekin = 1.6504129469732 | erot = 2.56279209882525 | epot = -21.8921291347682 | etot = -17.6789240889697 -897000 ekin = 1.78028626356388 | erot = 2.35359760186793 | epot = -22.0277295687316 | etot = -17.8938457032998 -898000 ekin = 1.85084740655105 | erot = 2.39311858936893 | epot = -22.0484278013109 | etot = -17.804461805391 -899000 ekin = 1.66159541585127 | erot = 3.04237586636532 | epot = -21.9567167335553 | etot = -17.2527454513387 -900000 ekin = 2.15147578839776 | erot = 2.62380976965387 | epot = -21.9142539059027 | etot = -17.1389683478511 -901000 ekin = 2.41284637562283 | erot = 2.69705294858772 | epot = -21.9824283113928 | etot = -16.8725289871823 -902000 ekin = 2.57612159273654 | erot = 2.40607700278042 | epot = -21.9951115024172 | etot = -17.0129129069002 -903000 ekin = 2.40399270595578 | erot = 2.40563977691886 | epot = -22.0217108129385 | etot = -17.2120783300639 -904000 ekin = 1.99424328949364 | erot = 3.12247316074079 | epot = -22.0941051678023 | etot = -16.9773887175679 -905000 ekin = 2.45187750521127 | erot = 2.11892854013094 | epot = -22.0607781456761 | etot = -17.4899721003339 -906000 ekin = 2.69425177422441 | erot = 1.66991173750643 | epot = -22.0544281667485 | etot = -17.6902646550177 -907000 ekin = 2.57312994796075 | erot = 2.16897016056236 | epot = -22.0362779601713 | etot = -17.2941778516482 -908000 ekin = 2.96409406517859 | erot = 2.4024711800449 | epot = -22.0175634304182 | etot = -16.6509981851947 -909000 ekin = 3.12776536145526 | erot = 2.11994277048498 | epot = -22.0594136296836 | etot = -16.8117054977433 -910000 ekin = 2.92235459450191 | erot = 3.50321314826196 | epot = -22.1261319680945 | etot = -15.7005642253306 -911000 ekin = 1.85367265839013 | erot = 2.7340677155879 | epot = -22.1669720947937 | etot = -17.5792317208157 -912000 ekin = 2.6441002333698 | erot = 1.86322369928707 | epot = -22.1988213519214 | etot = -17.6914974192646 -913000 ekin = 2.46819903214737 | erot = 2.03086240531084 | epot = -22.3188294931139 | etot = -17.8197680556557 -914000 ekin = 2.0189364132938 | erot = 2.94279285834543 | epot = -22.3498562089308 | etot = -17.3881269372916 -915000 ekin = 2.82747738433327 | erot = 2.11633807308138 | epot = -22.3626846124428 | etot = -17.4188691550282 -916000 ekin = 2.54297245214782 | erot = 3.23310309863579 | epot = -22.4639551563544 | etot = -16.6878796055708 -917000 ekin = 2.317284459617 | erot = 2.24259984965456 | epot = -22.4622375561737 | etot = -17.9023532469021 -918000 ekin = 2.08741226822699 | erot = 2.05691148612588 | epot = -22.3736961837371 | etot = -18.2293724293842 -919000 ekin = 2.60375298745589 | erot = 2.38992198070848 | epot = -22.381600437649 | etot = -17.3879254694846 -920000 ekin = 3.21906968424263 | erot = 2.75034755110955 | epot = -22.4644247832706 | etot = -16.4950075479185 -921000 ekin = 2.67870624565115 | erot = 1.98396423697626 | epot = -22.5250790361652 | etot = -17.8624085535378 -922000 ekin = 1.43278887121421 | erot = 1.5212533647767 | epot = -22.5927230801778 | etot = -19.6386808441869 -923000 ekin = 1.69060624417004 | erot = 1.88306141910809 | epot = -22.6640058777009 | etot = -19.0903382144228 -924000 ekin = 2.14344220825837 | erot = 1.52268950055615 | epot = -22.6406273602344 | etot = -18.9744956514199 -925000 ekin = 2.26099137202492 | erot = 1.33050593263702 | epot = -22.5231436368656 | etot = -18.9316463322036 -926000 ekin = 2.00910763305932 | erot = 2.07375747532886 | epot = -22.4432067940419 | etot = -18.3603416856537 -927000 ekin = 2.53244780866363 | erot = 1.99782770480987 | epot = -22.5729932869624 | etot = -18.0427177734889 -928000 ekin = 2.57222338912656 | erot = 2.50502398255852 | epot = -22.7398443943546 | etot = -17.6625970226695 -929000 ekin = 2.6604125156482 | erot = 1.82856993040844 | epot = -22.7887212302343 | etot = -18.2997387841776 -930000 ekin = 2.41305450735431 | erot = 2.00588068310628 | epot = -22.8018421191433 | etot = -18.3829069286827 -931000 ekin = 3.02564328504603 | erot = 2.11587474765859 | epot = -22.7554011904621 | etot = -17.6138831577575 -932000 ekin = 2.345493847807 | erot = 1.88252953078422 | epot = -22.8017329710419 | etot = -18.5737095924506 -933000 ekin = 2.1694502869689 | erot = 2.85662500627744 | epot = -22.8226969360083 | etot = -17.796621642762 -934000 ekin = 2.17146721978253 | erot = 2.11951749144879 | epot = -22.863822849274 | etot = -18.5728381380427 -935000 ekin = 2.34458616912959 | erot = 2.23416576036772 | epot = -22.8574077017674 | etot = -18.2786557722701 -936000 ekin = 2.28175701976408 | erot = 2.53013652057632 | epot = -22.9767476232764 | etot = -18.164854082936 -937000 ekin = 2.30615675948239 | erot = 2.82847988543263 | epot = -23.0701138758201 | etot = -17.9354772309051 -938000 ekin = 2.44231188769576 | erot = 2.0074347584303 | epot = -23.1347662810948 | etot = -18.6850196349687 -939000 ekin = 2.97733385945386 | erot = 2.10203628017719 | epot = -23.1190097237646 | etot = -18.0396395841336 -940000 ekin = 3.7421677147709 | erot = 2.68152697601896 | epot = -23.0475806158046 | etot = -16.6238859250147 -941000 ekin = 3.11295236744588 | erot = 2.28688684379554 | epot = -22.9429748609955 | etot = -17.5431356497541 -942000 ekin = 3.46623937507365 | erot = 1.87520710821393 | epot = -22.9025531718167 | etot = -17.5611066885292 -943000 ekin = 3.79173660111055 | erot = 2.70947594186532 | epot = -22.8673682470227 | etot = -16.3661557040469 -944000 ekin = 2.65981718352589 | erot = 2.74921677045581 | epot = -22.8292657284419 | etot = -17.4202317744602 -945000 ekin = 2.54666185018866 | erot = 2.02257137114126 | epot = -22.723461570169 | etot = -18.154228348839 -946000 ekin = 2.4639439434652 | erot = 1.67047296565225 | epot = -22.5521488157529 | etot = -18.4177319066355 -947000 ekin = 2.40802147360554 | erot = 1.99436728079209 | epot = -22.4558507483505 | etot = -18.0534619939529 -948000 ekin = 3.53638943439814 | erot = 2.58008822568542 | epot = -22.320526737886 | etot = -16.2040490778025 -949000 ekin = 2.98836642878581 | erot = 2.43483192716865 | epot = -22.1062186298424 | etot = -16.6830202738879 -950000 ekin = 1.8506029036585 | erot = 3.01144415000371 | epot = -21.9461665434677 | etot = -17.0841194898055 -951000 ekin = 2.24126333899115 | erot = 2.360964782598 | epot = -21.903362150983 | etot = -17.3011340293938 -952000 ekin = 2.17635665089897 | erot = 1.66171020386367 | epot = -21.8837115918785 | etot = -18.0456447371159 -953000 ekin = 2.32438986511484 | erot = 1.96772774373572 | epot = -21.8620448131731 | etot = -17.5699272043226 -954000 ekin = 1.49063234940533 | erot = 3.34928565739799 | epot = -21.7945452107542 | etot = -16.9546272039509 -955000 ekin = 1.88418951039555 | erot = 2.69014814861619 | epot = -21.7200686498238 | etot = -17.1457309908121 -956000 ekin = 1.69291601426871 | erot = 2.1645662569751 | epot = -21.67000557149 | etot = -17.8125233002462 -957000 ekin = 1.73501465937615 | erot = 1.64299266035092 | epot = -21.6537546166965 | etot = -18.2757472969694 -958000 ekin = 1.60433119962989 | erot = 2.19178936617743 | epot = -21.6456701616229 | etot = -17.8495495958156 -959000 ekin = 2.59325237116392 | erot = 2.48228488776355 | epot = -21.6578286055141 | etot = -16.5822913465866 -960000 ekin = 2.55452313966818 | erot = 2.05772019404723 | epot = -21.6609487080123 | etot = -17.0487053742969 -961000 ekin = 2.2782724554851 | erot = 2.17961583407472 | epot = -21.6530067200073 | etot = -17.1951184304475 -962000 ekin = 1.6603646541701 | erot = 3.50991264012086 | epot = -21.6636215038227 | etot = -16.4933442095318 -963000 ekin = 1.98983107474213 | erot = 1.50487996807377 | epot = -21.607445249844 | etot = -18.1127342070281 -964000 ekin = 2.1801653377091 | erot = 2.29029841094579 | epot = -21.5573031984776 | etot = -17.0868394498227 -965000 ekin = 2.10786877123582 | erot = 2.32216595776003 | epot = -21.5484811250514 | etot = -17.1184463960556 -966000 ekin = 3.14104688246034 | erot = 3.41837947669167 | epot = -21.5824220489405 | etot = -15.0229956897885 -967000 ekin = 3.05692240987348 | erot = 2.17321453760644 | epot = -21.5249732131507 | etot = -16.2948362656708 -968000 ekin = 2.05076027636617 | erot = 2.141245653077 | epot = -21.4468841606018 | etot = -17.2548782311586 -969000 ekin = 2.21533565656662 | erot = 2.21730696558968 | epot = -21.3811315205225 | etot = -16.9484888983662 -970000 ekin = 2.44655838306382 | erot = 2.63914635686249 | epot = -21.3181700854761 | etot = -16.2324653455498 -971000 ekin = 2.47235597423318 | erot = 2.68612281916571 | epot = -21.3025617859469 | etot = -16.1440829925481 -972000 ekin = 3.18960516897918 | erot = 2.4589698172248 | epot = -21.2512287640521 | etot = -15.6026537778481 -973000 ekin = 3.35448615918215 | erot = 2.61012714046349 | epot = -21.181846043468 | etot = -15.2172327438223 -974000 ekin = 2.7109696336397 | erot = 2.1297885006349 | epot = -21.0805156487717 | etot = -16.2397575144971 -975000 ekin = 1.81281242624849 | erot = 2.07588193669119 | epot = -20.9951812472117 | etot = -17.106486884272 -976000 ekin = 2.37607937449446 | erot = 1.37987096361839 | epot = -20.8918377653923 | etot = -17.1358874272794 -977000 ekin = 2.85561145367248 | erot = 3.03617871388547 | epot = -21.0084630734088 | etot = -15.1166729058509 -978000 ekin = 3.13898187042855 | erot = 3.01123432026038 | epot = -21.0722585106273 | etot = -14.9220423199384 -979000 ekin = 3.64209617929686 | erot = 2.4613128172747 | epot = -20.9585875203481 | etot = -14.8551785237765 -980000 ekin = 3.43702129901554 | erot = 3.27336305014796 | epot = -20.899855999005 | etot = -14.1894716498415 -981000 ekin = 2.95818777403214 | erot = 2.46809133944498 | epot = -20.986328819352 | etot = -15.5600497058749 -982000 ekin = 2.05833121455625 | erot = 2.23576836357638 | epot = -21.0416114809553 | etot = -16.7475119028227 -983000 ekin = 2.55525912528627 | erot = 1.97278253435511 | epot = -21.0429704338791 | etot = -16.5149287742377 -984000 ekin = 2.32118186028681 | erot = 2.58283774029526 | epot = -21.0821921217354 | etot = -16.1781725211533 -985000 ekin = 2.30313916872571 | erot = 3.01566259403689 | epot = -21.1725352249725 | etot = -15.8537334622099 -986000 ekin = 2.02463184559008 | erot = 2.17884306421032 | epot = -21.2738965581199 | etot = -17.0704216483195 -987000 ekin = 2.38600679522579 | erot = 1.60423682215952 | epot = -21.2561563051098 | etot = -17.2659126877245 -988000 ekin = 2.73915294843957 | erot = 2.71140680891282 | epot = -21.1542786885715 | etot = -15.7037189312192 -989000 ekin = 2.26683184377889 | erot = 2.87747329962287 | epot = -21.0926545062066 | etot = -15.9483493628049 -990000 ekin = 2.20939931770178 | erot = 2.59683743799389 | epot = -21.0191461353302 | etot = -16.2129093796345 -991000 ekin = 2.18257135988803 | erot = 2.54653688104725 | epot = -20.9118811472645 | etot = -16.1827729063292 -992000 ekin = 1.69790066377666 | erot = 2.49595921156529 | epot = -20.9746634507321 | etot = -16.7808035753901 -993000 ekin = 1.37402706728143 | erot = 1.97741928391721 | epot = -21.0641158581349 | etot = -17.7126695069363 -994000 ekin = 1.46483900547317 | erot = 2.95778549110336 | epot = -21.1249692907517 | etot = -16.7023447941752 -995000 ekin = 2.31288950128446 | erot = 1.68061050856792 | epot = -21.1893866548865 | etot = -17.1958866450341 -996000 ekin = 2.91614737481324 | erot = 2.86807519675625 | epot = -21.1735004751445 | etot = -15.389277903575 -997000 ekin = 3.14120073227004 | erot = 2.13892252916595 | epot = -21.1699471293629 | etot = -15.8898238679269 -998000 ekin = 2.24295362120275 | erot = 3.02318042682039 | epot = -21.1015606373099 | etot = -15.8354265892868 -999000 ekin = 2.61556215485409 | erot = 1.7387146959943 | epot = -21.020005228283 | etot = -16.6657283774346 -1000000 ekin = 2.3401430299422 | erot = 2.86437072240568 | epot = -21.0184376568778 | etot = -15.8139239045299 - 1000000 0.10400636 -1.3745197 0.060867347 -1.1673934 0.00013768636 -Loop time of 34.1939 on 4 procs for 1000000 steps with 16 atoms - -Performance: 25267.628 tau/day, 29244.940 timesteps/s -99.5% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 0.63601 | 12.258 | 23.186 | 288.0 | 35.85 -Bond | 0.0885 | 0.40672 | 0.6818 | 42.6 | 1.19 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 2.65 | 2.786 | 2.9058 | 5.7 | 8.15 -Output | 1.9e-05 | 2.575e-05 | 2.8e-05 | 0.0 | 0.00 -Modify | 0.21592 | 2.7491 | 5.2145 | 132.7 | 8.04 -Other | | 15.99 | | | 46.78 - -Nlocal: 4.0 ave 8.0 max 0.0 min -Histogram: 1 1 0 0 0 0 0 0 1 1 -Nghost: 11.0 ave 14.0 max 8.0 min -Histogram: 1 1 0 0 0 0 0 0 1 1 -Neighs: 41.75 ave 81.0 max 0.0 min -Histogram: 1 1 0 0 0 0 0 0 0 2 - -Total # of neighbors = 167 -Ave neighs/atom = 10.4375 -Ave special neighs/atom = 3.75 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:34 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/data.duplex3 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/data.duplex3 index bbd584163b..d2556f87e9 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/data.duplex3 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/data.duplex3 @@ -1,73 +1,68 @@ -# LAMMPS data file +LAMMPS data file via write_data, version 27 May 2021 + 10 atoms -10 ellipsoids -8 bonds - 4 atom types +8 bonds 1 bond types +10 ellipsoids -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi Masses -1 1.0 -2 1.0 -3 1.0 -4 1.0 +1 1 +2 1 +3 1 +4 1 -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms +Atoms # hybrid -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.860249842674776e-01 -3.518234140414736e-01 3.897628551303122e-01 1 1 1 -3 3 -1.874009511073395e-01 -5.699832309147915e-01 7.795257102606244e-01 1 1 1 -4 4 1.824198365552941e-01 -5.715968887521518e-01 1.169288565390937e+00 1 1 1 -5 1 4.829362784135484e-01 -3.560513319622209e-01 1.559051420521249e+00 1 1 1 -6 4 -4.829362784135484e-01 3.560513319622209e-01 1.559051420521249e+00 2 1 1 -7 1 -1.824198365552941e-01 5.715968887521516e-01 1.169288565390937e+00 2 1 1 -8 2 1.874009511073395e-01 5.699832309147913e-01 7.795257102606243e-01 2 1 1 -9 3 4.860249842674775e-01 3.518234140414733e-01 3.897628551303121e-01 2 1 1 -10 4 5.999999999999996e-01 -1.332267629550188e-16 -1.110223024625157e-16 2 1 1 +1 1 -0.11270997503399371 -0.7862611620723637 1.3165400870544903 1 1 0.060395054525384434 0 0 0 +2 2 -0.16100240482903602 -1.0148422652606093 1.7725173088171975 1 1 0.060395054525384434 0 0 0 +3 3 -0.07298109176865208 -1.2058352049378398 2.2155374630046025 1 1 0.060395054525384434 0 0 0 +4 4 0.20885923193243378 -1.2688318677749852 2.7293157091426354 1 1 0.060395054525384434 0 0 0 +5 1 0.4977080746488808 -1.1877183116613397 3.1217952838980874 1 1 0.060395054525384434 0 0 0 +6 4 -0.2268968274787041 -0.189603020612256 3.1084583050105072 2 1 0.060395054525384434 0 0 0 +7 1 -0.0350302960648884 -0.11245734514413211 2.7014501755341493 2 1 0.060395054525384434 0 0 0 +8 2 0.25244681036675387 -0.03694235704351071 2.3220950502861553 2 1 0.060395054525384434 0 0 0 +9 3 0.6676541258850296 -0.19471246409842435 2.0340464261767104 2 1 0.060395054525384434 0 0 0 +10 4 0.934602266948905 -0.5194117909409754 1.8612193115349325 2 1 0.060395054525384434 0 0 0 -# Atom-ID, translational velocity, angular momentum Velocities -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 +1 0.7350861197179651 -0.21340767305489933 0.039697389523131524 0.514970941606362 -0.5778402699166201 0.41643574848945447 +2 0.45886825731636693 0.15479323180826426 0.45998155912439004 -0.09532046111956156 -0.028811462065931184 0.1672428695820793 +3 -0.10009582230026307 -0.1356043155573722 -0.1357102030132947 0.512435093836635 0.8794667047362844 -0.4062045597142004 +4 -0.030407148345627223 -0.009119685021467273 0.2894674569635424 -0.22197357320787495 0.46474035192627294 -0.07166539037437039 +5 0.021807141873185235 -0.3544326055489752 0.4440408124043861 -0.019877710182688496 0.008454084203717545 -0.16574323908949498 +6 0.058814594979770644 -0.23964725458291067 0.09430081861001074 -0.16841516333125345 -0.27499692207835863 0.49231682345951117 +7 -0.004278840261670186 0.011171100752661912 -0.10686407869958243 0.3533956051874728 -0.5781793964284943 0.171273466705473 +8 -0.5678723978567293 -0.05635280062816237 -0.12337612014269532 -0.06293014166900977 -0.5548255617488771 -0.3948679676680598 +9 0.07493146865794496 0.37868089841113717 0.11143666048372917 -0.35561925325917687 -0.3453461570214745 -0.5277976799082732 +10 -0.48819053761319386 -0.11027061946453155 0.19465531836187655 0.10340969323917759 0.3809806548307742 0.25623918588602335 -# Atom-ID, shape, quaternion -Ellipsoids - -1 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 9.513258223252946e-01 0.000000000000000e+00 0.000000000000000e+00 3.081869234362515e-01 -3 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 8.100416404457962e-01 0.000000000000000e+00 0.000000000000000e+00 5.863723567357894e-01 -4 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 5.899012371043606e-01 0.000000000000000e+00 0.000000000000000e+00 8.074754054847398e-01 -5 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 3.123349185122326e-01 0.000000000000000e+00 0.000000000000000e+00 9.499720515246527e-01 -6 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 0.000000000000000e+00 9.499720515246527e-01 -3.123349185122326e-01 -0.000000000000000e+00 -7 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 0.000000000000000e+00 8.074754054847401e-01 -5.899012371043604e-01 0.000000000000000e+00 -8 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 0.000000000000000e+00 5.863723567357896e-01 -8.100416404457959e-01 0.000000000000000e+00 -9 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 -0.000000000000000e+00 -3.081869234362514e-01 9.513258223252947e-01 0.000000000000000e+00 -10 3.1622776601683795+00 3.1622776601683795+00 3.1622776601683795+00 -0.000000000000000e+00 1.110223024625157e-16 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology Bonds -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 6 7 -6 1 7 8 -7 1 8 9 -8 1 9 10 +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 6 7 +6 1 7 8 +7 1 8 9 +8 1 9 10 + +Ellipsoids + +1 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.9824438652148015 -0.023183015026523597 -0.18238525095550406 0.031657854475291056 +2 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.9303156820429525 0.02962373336578937 -0.07607439157272995 0.3575581814380256 +3 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.7912072782182723 -0.043679545103099016 -0.05996218100443608 0.6070318583758278 +4 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.6531869542452552 -0.03659000162837596 0.004181596561545229 0.7563005281201641 +5 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.3249781771672557 0.06207197535108856 0.03689277251937633 0.9429608568635791 +6 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.08029535222204207 0.8726095530830543 -0.46831094470633033 -0.11309325067392484 +7 3.1622776601683795 3.1622776601683795 3.1622776601683795 -0.1303991484205687 0.7764383491760718 -0.6081660772848121 0.10135864274905797 +8 3.1622776601683795 3.1622776601683795 3.1622776601683795 -0.14971034142173664 0.5769499085020084 -0.7973230447846137 0.09482393688465168 +9 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.21130729744233523 -0.37917864508185584 0.8946270178621702 -0.10590221939385809 +10 3.1622776601683795 3.1622776601683795 3.1622776601683795 0.34278400171414436 0.15185237372800306 0.9252984668160771 0.05712032974191834 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/in.duplex3 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/in.duplex3 index 8c917321c7..0dba271f98 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/in.duplex3 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/in.duplex3 @@ -2,6 +2,7 @@ variable number equal 3 variable ofreq equal 1000 variable efreq equal 1000 variable T equal 0.1 +variable rhos equal 0.2 units lj @@ -11,11 +12,11 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 1 delay 0 check yes read_data data.duplex3 @@ -38,30 +39,19 @@ pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 # NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" +compute quat all property/atom quatw quati quatj quatk compute erot all erotate/asphere compute ekin all ke @@ -72,10 +62,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" run 1000000 -#write_restart config.${number}.* +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 new file mode 100644 index 0000000000..ac55cbd994 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 @@ -0,0 +1,1181 @@ +LAMMPS (27 May 2021) +variable number equal 3 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex3 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 10 atoms + reading velocities ... + 10 velocities + scanning bonds ... + 2 = max bonds/atom + 10 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 8 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.003 seconds + +set atom * mass 1.0 +Setting atom values ... + 10 settings made for mass + +group all type 1 4 +10 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA2 pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.3.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 1.18025158324274 | erot = 2.17908479136507 | epot = -11.4931199991265 | etot = -8.13378362451864 +Per MPI rank memory allocation (min/avg/max) = 9.448 | 9.448 | 9.448 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.087426043 -1.2259004 0.076588446 -1.0312868 -7.7802026e-06 64000 +1000 ekin = 1.08696491147664 | erot = 2.23197650714075 | epot = -11.4527250425129 | etot = -8.13378362389549 +2000 ekin = 1.01265115460252 | erot = 2.29132031278141 | epot = -11.4377550908151 | etot = -8.13378362343119 +3000 ekin = 0.964951920610361 | erot = 2.35614244814783 | epot = -11.4548779921653 | etot = -8.13378362340706 +4000 ekin = 0.945861179227109 | erot = 2.42482489276794 | epot = -11.504469695762 | etot = -8.13378362376699 +5000 ekin = 0.952186940161594 | erot = 2.49508744948287 | epot = -11.5810580140496 | etot = -8.13378362440513 +6000 ekin = 0.976836955567338 | erot = 2.56435791368456 | epot = -11.6749784943528 | etot = -8.1337836251009 +7000 ekin = 1.01151727363105 | erot = 2.63034980765842 | epot = -11.7756507069156 | etot = -8.13378362562613 +8000 ekin = 1.04963768886897 | erot = 2.69159648304405 | epot = -11.8750177977506 | etot = -8.13378362583758 +9000 ekin = 1.08831406483925 | erot = 2.74768757650641 | epot = -11.9697852671577 | etot = -8.133783625812 +10000 ekin = 1.12769894654433 | erot = 2.79881902231422 | epot = -12.0603015945014 | etot = -8.13378362564289 +11000 ekin = 1.16997706279096 | erot = 2.84539220453504 | epot = -12.1491528928086 | etot = -8.13378362548262 +12000 ekin = 1.21772825403563 | erot = 2.88753582693543 | epot = -12.2390477064186 | etot = -8.13378362544753 +13000 ekin = 1.2724727764863 | erot = 2.92478423931379 | epot = -12.3310406413901 | etot = -8.13378362559001 +14000 ekin = 1.33384628320073 | erot = 2.95599632290764 | epot = -12.4236262320191 | etot = -8.13378362591071 +15000 ekin = 1.39936071611664 | erot = 2.97947113417335 | epot = -12.512615476685 | etot = -8.13378362639499 +16000 ekin = 1.46443870928024 | erot = 2.99312358077433 | epot = -12.5913459174139 | etot = -8.13378362735931 +17000 ekin = 1.52113741921509 | erot = 2.9943026010584 | epot = -12.6492236482456 | etot = -8.13378362797207 +18000 ekin = 1.56143918576787 | erot = 2.98098620608849 | epot = -12.6762090203242 | etot = -8.13378362846781 +19000 ekin = 1.57873438318794 | erot = 2.95206674454563 | epot = -12.6645847564923 | etot = -8.13378362875874 +20000 ekin = 1.56841348053791 | erot = 2.90735147312963 | epot = -12.6095485824455 | etot = -8.133783628778 +21000 ekin = 1.52886464109308 | erot = 2.84765291368983 | epot = -12.5103011832753 | etot = -8.13378362849243 +22000 ekin = 1.46209217703488 | erot = 2.77478397647202 | epot = -12.3706597813886 | etot = -8.13378362788172 +23000 ekin = 1.37376733102673 | erot = 2.6915572831373 | epot = -12.1991082412398 | etot = -8.13378362707573 +24000 ekin = 1.27262109890791 | erot = 2.60118350194759 | epot = -12.0075882269997 | etot = -8.13378362614423 +25000 ekin = 1.16926502294375 | erot = 2.50703692695192 | epot = -11.8100855751042 | etot = -8.13378362520853 +26000 ekin = 1.0747148994514 | erot = 2.41235840152815 | epot = -11.6208569253572 | etot = -8.13378362437762 +27000 ekin = 0.998982995755809 | erot = 2.31997753232677 | epot = -11.4527441518066 | etot = -8.13378362372405 +28000 ekin = 0.950065052892319 | erot = 2.23215621537589 | epot = -11.3160048915417 | etot = -8.13378362327347 +29000 ekin = 0.933483801722587 | erot = 2.15056100102976 | epot = -11.2178284257646 | etot = -8.13378362301223 +30000 ekin = 0.95233516433604 | erot = 2.07633501131224 | epot = -11.1624537985557 | etot = -8.13378362290739 +31000 ekin = 1.00761822011315 | erot = 2.01025995539434 | epot = -11.1516617984317 | etot = -8.13378362292424 +32000 ekin = 1.09859027316477 | erot = 1.95287201474931 | epot = -11.1852459109706 | etot = -8.13378362305649 +33000 ekin = 1.2229634825769 | erot = 1.90442653272443 | epot = -11.2611736386122 | etot = -8.13378362331086 +34000 ekin = 1.37683793249577 | erot = 1.8649833610543 | epot = -11.3756049172808 | etot = -8.13378362373071 +35000 ekin = 1.55422271443449 | erot = 1.83436013830191 | epot = -11.5223664771471 | etot = -8.13378362441069 +36000 ekin = 1.74589607048132 | erot = 1.81205442227464 | epot = -11.6917341182485 | etot = -8.13378362549252 +37000 ekin = 1.93777565280851 | erot = 1.79705197600549 | epot = -11.8686112558399 | etot = -8.13378362702594 +38000 ekin = 2.11051089015034 | erot = 1.78782890330234 | epot = -12.0321234221666 | etot = -8.13378362871392 +39000 ekin = 2.24321482588503 | erot = 1.78271510837231 | epot = -12.1597135641243 | etot = -8.133783629867 +40000 ekin = 2.32146151921639 | erot = 1.78073283005123 | epot = -12.2359779791646 | etot = -8.13378362989703 +41000 ekin = 2.34386750101386 | erot = 1.78241563043111 | epot = -12.2600667603297 | etot = -8.13378362888477 +42000 ekin = 2.32118218527095 | erot = 1.78979050959074 | epot = -12.2447563223397 | etot = -8.133783627478 +43000 ekin = 2.26309111555158 | erot = 1.80539262076469 | epot = -12.2022673943963 | etot = -8.13378365808002 +44000 ekin = 2.15856242114831 | erot = 1.84609032619602 | epot = -12.1384363880306 | etot = -8.13378364068628 +45000 ekin = 2.08936731003525 | erot = 1.88904724563036 | epot = -12.1121981822921 | etot = -8.13378362662651 +46000 ekin = 1.9964611597006 | erot = 1.93503982400423 | epot = -12.0652846104764 | etot = -8.13378362677155 +47000 ekin = 1.89712577412051 | erot = 1.98806984898582 | epot = -12.0189792501525 | etot = -8.13378362704613 +48000 ekin = 1.79036864863104 | erot = 2.04496273496233 | epot = -11.9691150108767 | etot = -8.13378362728334 +49000 ekin = 1.67630116263937 | erot = 2.10216327906907 | epot = -11.9122480690704 | etot = -8.13378362736196 +50000 ekin = 1.55727015247065 | erot = 2.15637892895979 | epot = -11.8474327086503 | etot = -8.13378362721984 +51000 ekin = 1.43817433709145 | erot = 2.20514040032694 | epot = -11.7770983642843 | etot = -8.13378362686593 +52000 ekin = 1.32596547232174 | erot = 2.24710946475006 | epot = -11.7068585634503 | etot = -8.13378362637853 +53000 ekin = 1.22848082922914 | erot = 2.2820475921038 | epot = -11.6443120472107 | etot = -8.13378362587772 +54000 ekin = 1.15295119316271 | erot = 2.31049933939888 | epot = -11.5972341580451 | etot = -8.13378362548352 +55000 ekin = 1.10463170766328 | erot = 2.33334681406839 | epot = -11.5717621470129 | etot = -8.13378362528126 +56000 ekin = 1.08590799517335 | erot = 2.35139880092329 | epot = -11.5710904214036 | etot = -8.133783625307 +57000 ekin = 1.09599893485501 | erot = 2.36511154450529 | epot = -11.5948941049137 | etot = -8.13378362555341 +58000 ekin = 1.13119803471017 | erot = 2.37445830578815 | epot = -11.6394399664723 | etot = -8.13378362597402 +59000 ekin = 1.18549837183919 | erot = 2.37891691863231 | epot = -11.6981989169902 | etot = -8.13378362651871 +60000 ekin = 1.25136230662771 | erot = 2.37755306615247 | epot = -11.7626989998987 | etot = -8.1337836271185 +61000 ekin = 1.32065657328812 | erot = 2.3691782337931 | epot = -11.8236184347914 | etot = -8.13378362771016 +62000 ekin = 1.38555350991078 | erot = 2.35258911579052 | epot = -11.871926253894 | etot = -8.13378362819273 +63000 ekin = 1.43966787267656 | erot = 2.32682848519596 | epot = -11.900279986355 | etot = -8.13378362848243 +64000 ekin = 1.47909503438177 | erot = 2.29144993715397 | epot = -11.904328600069 | etot = -8.13378362853329 +65000 ekin = 1.50288049774097 | erot = 2.24670960905114 | epot = -11.8833737351501 | etot = -8.13378362835798 +66000 ekin = 1.5127450759902 | erot = 2.19359684183 | epot = -11.8401255458509 | etot = -8.13378362803075 +67000 ekin = 1.51208659633015 | erot = 2.13371356874813 | epot = -11.7795837927184 | etot = -8.13378362764017 +68000 ekin = 1.50462166617945 | erot = 2.06904733139784 | epot = -11.7074526249093 | etot = -8.13378362733203 +69000 ekin = 1.49293889166151 | erot = 2.00167765430527 | epot = -11.6284001731037 | etot = -8.13378362713692 +70000 ekin = 1.47793621174634 | erot = 1.93361210060374 | epot = -11.5453319394055 | etot = -8.13378362705547 +71000 ekin = 1.45891349102838 | erot = 1.86670994694699 | epot = -11.4594070650146 | etot = -8.13378362703923 +72000 ekin = 1.43427842101615 | erot = 1.80270883809022 | epot = -11.3707708861216 | etot = -8.13378362701521 +73000 ekin = 1.40258583891021 | erot = 1.74331039193092 | epot = -11.2796798577521 | etot = -8.13378362691097 +74000 ekin = 1.36359371155269 | erot = 1.69025647754919 | epot = -11.1876338157821 | etot = -8.13378362668024 +75000 ekin = 1.31886252565201 | erot = 1.64533820718028 | epot = -11.0979843591716 | etot = -8.13378362633934 +76000 ekin = 1.27181692773741 | erot = 1.61030043593592 | epot = -11.0159009896013 | etot = -8.13378362592798 +77000 ekin = 1.22767338921994 | erot = 1.58670952555608 | epot = -10.9481665402833 | etot = -8.1337836255073 +78000 ekin = 1.19187425881965 | erot = 1.57555521121131 | epot = -10.9012130952116 | etot = -8.13378362518063 +79000 ekin = 1.16922470588817 | erot = 1.5771660153409 | epot = -10.8801743462041 | etot = -8.133783624975 +80000 ekin = 1.16351312193735 | erot = 1.59112852775418 | epot = -10.8884252746035 | etot = -8.13378362491193 +81000 ekin = 1.17709123428941 | erot = 1.61633850893096 | epot = -10.9272133682121 | etot = -8.1337836249917 +82000 ekin = 1.21064005584025 | erot = 1.65118762576695 | epot = -10.9956113068161 | etot = -8.13378362520889 +83000 ekin = 1.26297331742732 | erot = 1.69382675572848 | epot = -11.0905836987108 | etot = -8.13378362555503 +84000 ekin = 1.33092648687658 | erot = 1.74243133123673 | epot = -11.2071414441142 | etot = -8.13378362600085 +85000 ekin = 1.40961218427362 | erot = 1.7954064033782 | epot = -11.3388022141303 | etot = -8.13378362647843 +86000 ekin = 1.49330005467921 | erot = 1.85150064414008 | epot = -11.478584325705 | etot = -8.13378362688575 +87000 ekin = 1.57653380716702 | erot = 1.90982169886824 | epot = -11.6201391333936 | etot = -8.13378362735836 +88000 ekin = 1.65416408678856 | erot = 1.96971725895481 | epot = -11.7576649732582 | etot = -8.13378362751481 +89000 ekin = 1.72360216634181 | erot = 2.03055934337529 | epot = -11.8879451373045 | etot = -8.1337836275874 +90000 ekin = 1.785009845894 | erot = 2.09126219979601 | epot = -12.0100556734362 | etot = -8.13378362774622 +91000 ekin = 1.83789001415892 | erot = 2.15001837237356 | epot = -12.1216920145417 | etot = -8.13378362800922 +92000 ekin = 1.87517809322897 | erot = 2.20985483887517 | epot = -12.21881656028 | etot = -8.1337836281759 +93000 ekin = 1.90356384535099 | erot = 2.26204903047949 | epot = -12.2993965046575 | etot = -8.13378362882701 +94000 ekin = 1.91566641673062 | erot = 2.30892488078268 | epot = -12.3583749263608 | etot = -8.13378362884745 +95000 ekin = 1.9109576938402 | erot = 2.34997522029996 | epot = -12.3947165431007 | etot = -8.13378362896051 +96000 ekin = 1.88948402498914 | erot = 2.38411475951057 | epot = -12.4073824132803 | etot = -8.13378362878061 +97000 ekin = 1.85343811133912 | erot = 2.4113304629222 | epot = -12.3985522027163 | etot = -8.13378362845495 +98000 ekin = 1.8068427523029 | erot = 2.43203206054824 | epot = -12.3726584408911 | etot = -8.13378362803995 +99000 ekin = 1.75478641123191 | erot = 2.44692977736841 | epot = -12.3354998162068 | etot = -8.13378362760648 +100000 ekin = 1.69590911435714 | erot = 2.45386958409525 | epot = -12.2835623848859 | etot = -8.1337836864335 +101000 ekin = 1.68113249375248 | erot = 2.36572534112453 | epot = -12.1806414642139 | etot = -8.13378362933689 +102000 ekin = 1.7267856590017 | erot = 2.35051337712499 | epot = -12.2110826965905 | etot = -8.13378366046378 +103000 ekin = 1.68338599487705 | erot = 2.35411811039604 | epot = -12.1712877656948 | etot = -8.13378366042173 +104000 ekin = 1.64323586412853 | erot = 2.35701648102718 | epot = -12.1340360056519 | etot = -8.13378366049622 +105000 ekin = 1.60584113472054 | erot = 2.35932964102246 | epot = -12.0989544363531 | etot = -8.1337836606101 +106000 ekin = 1.57044138011807 | erot = 2.36092776943221 | epot = -12.0651528102264 | etot = -8.13378366067613 +107000 ekin = 1.53705400250973 | erot = 2.36166253248191 | epot = -12.0325001956581 | etot = -8.13378366066648 +108000 ekin = 1.50696391591126 | erot = 2.3612855734919 | epot = -12.0020331499846 | etot = -8.13378366058145 +109000 ekin = 1.48244426546657 | erot = 2.35938088270994 | epot = -11.9756088087053 | etot = -8.13378366052874 +110000 ekin = 1.46539913148075 | erot = 2.35530683146149 | epot = -11.9544896235796 | etot = -8.13378366063734 +111000 ekin = 1.45548748017616 | erot = 2.34818065606081 | epot = -11.9374517972408 | etot = -8.13378366100382 +112000 ekin = 1.44872729612952 | erot = 2.3369554826694 | epot = -11.9194664403751 | etot = -8.13378366157621 +113000 ekin = 1.43805495586496 | erot = 2.32068695509389 | epot = -11.8925255730876 | etot = -8.13378366212871 +114000 ekin = 1.41640788690877 | erot = 2.29883886662103 | epot = -11.8490304158909 | etot = -8.13378366236113 +115000 ekin = 1.3806378182208 | erot = 2.27153218573294 | epot = -11.7859536655159 | etot = -8.13378366156219 +116000 ekin = 1.3363054030841 | erot = 2.23942220246119 | epot = -11.7095112666475 | etot = -8.13378366110222 +117000 ekin = 1.29001229198302 | erot = 2.20380811829898 | epot = -11.6276040708683 | etot = -8.13378366058632 +118000 ekin = 1.2471154883471 | erot = 2.16635124019895 | epot = -11.5472503887776 | etot = -8.13378366023153 +119000 ekin = 1.21073685469415 | erot = 2.12872161390258 | epot = -11.4732421286711 | etot = -8.13378366007441 +120000 ekin = 1.18115748419429 | erot = 2.09256534610061 | epot = -11.40750649033 | etot = -8.13378366003514 +121000 ekin = 1.15688642101082 | erot = 2.05947511288391 | epot = -11.3501451939309 | etot = -8.13378366003619 +122000 ekin = 1.13593168276749 | erot = 2.03084061403901 | epot = -11.3005559568652 | etot = -8.13378366005868 +123000 ekin = 1.11638811965923 | erot = 2.00761097209058 | epot = -11.2577827519199 | etot = -8.13378366017012 +124000 ekin = 1.09616325371727 | erot = 1.99019695902073 | epot = -11.2201438730112 | etot = -8.13378366027324 +125000 ekin = 1.07358508996122 | erot = 1.97820026039366 | epot = -11.1855690107827 | etot = -8.13378366042782 +126000 ekin = 1.04712198978498 | erot = 1.9703093700724 | epot = -11.1512150205173 | etot = -8.1337836606599 +127000 ekin = 1.01560359550538 | erot = 1.96476336054353 | epot = -11.1141506168026 | etot = -8.13378366075366 +128000 ekin = 0.979281846652461 | erot = 1.95990906194967 | epot = -11.0729745693076 | etot = -8.13378366070543 +129000 ekin = 0.940294043230153 | erot = 1.95428772921574 | epot = -11.0283654329015 | etot = -8.1337836604556 +130000 ekin = 0.902735823607613 | erot = 1.94710047764783 | epot = -10.9836199613556 | etot = -8.13378366010013 +131000 ekin = 0.872329759140091 | erot = 1.93820575526851 | epot = -10.9443191739575 | etot = -8.13378365954893 +132000 ekin = 0.855045600562661 | erot = 1.92803271303708 | epot = -10.91686197287 | etot = -8.13378365927029 +133000 ekin = 0.854775562822957 | erot = 1.91694878880986 | epot = -10.9055080107091 | etot = -8.13378365907624 +134000 ekin = 0.873981086379292 | erot = 1.90549522489472 | epot = -10.9132599702538 | etot = -8.13378365897974 +135000 ekin = 0.913690181742145 | erot = 1.89429118508536 | epot = -10.9417650257947 | etot = -8.13378365896716 +136000 ekin = 0.973734451665867 | erot = 1.88395321784255 | epot = -10.9914713285358 | etot = -8.13378365902736 +137000 ekin = 1.05255313135959 | erot = 1.87488800080386 | epot = -11.061224792006 | etot = -8.13378365984251 +138000 ekin = 1.14435249948545 | erot = 1.8662689721206 | epot = -11.1444051316855 | etot = -8.13378366007948 +139000 ekin = 1.24448357091338 | erot = 1.8582143500676 | epot = -11.2364815813236 | etot = -8.13378366034262 +140000 ekin = 1.34860347563747 | erot = 1.85113522079124 | epot = -11.3335223570932 | etot = -8.1337836606645 +141000 ekin = 1.45162669266304 | erot = 1.84534635451925 | epot = -11.430756708267 | etot = -8.13378366108474 +142000 ekin = 1.54663919844502 | erot = 1.84103156950906 | epot = -11.5214544297491 | etot = -8.13378366179501 +143000 ekin = 1.62470110239408 | erot = 1.83813053702609 | epot = -11.5966153018864 | etot = -8.13378366246618 +144000 ekin = 1.67710589256287 | erot = 1.83622813336409 | epot = -11.6471176890259 | etot = -8.13378366309898 +145000 ekin = 1.69650852159047 | erot = 1.83477115527449 | epot = -11.6650633403349 | etot = -8.13378366346991 +146000 ekin = 1.6799825027065 | erot = 1.83334306418678 | epot = -11.6471092301924 | etot = -8.13378366329909 +147000 ekin = 1.63255928725504 | erot = 1.83204496822992 | epot = -11.5983879178782 | etot = -8.13378366239327 +148000 ekin = 1.56926257377443 | erot = 1.83182914755782 | epot = -11.5348753821883 | etot = -8.13378366085607 +149000 ekin = 1.5130082497773 | erot = 1.8345272799431 | epot = -11.4813191889253 | etot = -8.13378365920492 +150000 ekin = 1.4872496378471 | erot = 1.84235837448555 | epot = -11.4633916705174 | etot = -8.1337836581848 +151000 ekin = 1.50619323822985 | erot = 1.85697474829955 | epot = -11.4969516448356 | etot = -8.13378365830622 +152000 ekin = 1.56855992602591 | erot = 1.8784728263849 | epot = -11.5808164119014 | etot = -8.1337836594906 +153000 ekin = 1.659144896466 | erot = 1.90493735115907 | epot = -11.6978659087716 | etot = -8.13378366114655 +154000 ekin = 1.75680978950758 | erot = 1.93282846213553 | epot = -11.8234219142217 | etot = -8.1337836625786 +155000 ekin = 1.84344901658449 | erot = 1.95802697046832 | epot = -11.9352596504334 | etot = -8.13378366338056 +156000 ekin = 1.90893795388443 | erot = 1.97697594926066 | epot = -12.0196975667215 | etot = -8.13378366357642 +157000 ekin = 1.95061494385923 | erot = 1.98738512433497 | epot = -12.0717837316312 | etot = -8.13378366343705 +158000 ekin = 1.96976178337713 | erot = 1.98837447181473 | epot = -12.0919199183611 | etot = -8.13378366316927 +159000 ekin = 1.96892634677231 | erot = 1.98033790354813 | epot = -12.0830479131017 | etot = -8.13378366278126 +160000 ekin = 1.9516760180595 | erot = 1.96478101829957 | epot = -12.050240698581 | etot = -8.13378366222189 +161000 ekin = 1.92323849263791 | erot = 1.94408396543495 | epot = -12.001106119617 | etot = -8.13378366154412 +162000 ekin = 1.89012785139911 | erot = 1.92106669306923 | epot = -11.9449782053599 | etot = -8.13378366089159 +163000 ekin = 1.85873206626373 | erot = 1.89844726529898 | epot = -11.8909629919524 | etot = -8.13378366038965 +164000 ekin = 1.83396756863943 | erot = 1.87841814938186 | epot = -11.8461693781076 | etot = -8.13378366008633 +165000 ekin = 1.81873657814088 | erot = 1.86247026312249 | epot = -11.8149905012201 | etot = -8.13378365995669 +166000 ekin = 1.81415764355322 | erot = 1.85144128795253 | epot = -11.7993825914514 | etot = -8.1337836599456 +167000 ekin = 1.82014338462818 | erot = 1.84569577974688 | epot = -11.7996228243663 | etot = -8.1337836599912 +168000 ekin = 1.83604973591334 | erot = 1.84534918673525 | epot = -11.8151825826932 | etot = -8.13378366004457 +169000 ekin = 1.86118807804032 | erot = 1.85047766429904 | epot = -11.8454494024153 | etot = -8.13378366007595 +170000 ekin = 1.89508209492126 | erot = 1.86127600745024 | epot = -11.8901417624553 | etot = -8.13378366008384 +171000 ekin = 1.93739070093814 | erot = 1.87813927221141 | epot = -11.9493136332464 | etot = -8.13378366009684 +172000 ekin = 1.98746465492706 | erot = 1.90165699566163 | epot = -12.0229053107602 | etot = -8.13378366017153 +173000 ekin = 2.04358732260736 | erot = 1.93252470914458 | epot = -12.1098956921179 | etot = -8.13378366036599 +174000 ekin = 2.10212586880692 | erot = 1.9713911136612 | epot = -12.2073006432561 | etot = -8.13378366078798 +175000 ekin = 2.15653164019911 | erot = 2.01868623997432 | epot = -12.3090015416377 | etot = -8.13378366146426 +176000 ekin = 2.19700590631317 | erot = 2.07444517694542 | epot = -12.4052347456347 | etot = -8.13378366237607 +177000 ekin = 2.21275117726748 | erot = 2.13809655452265 | epot = -12.4846313951108 | etot = -8.13378366332064 +178000 ekin = 2.19103084137816 | erot = 2.20849637361836 | epot = -12.5333108794522 | etot = -8.13378366445569 +179000 ekin = 2.0500295875572 | erot = 2.27647492405869 | epot = -12.4602881626278 | etot = -8.13378365101191 +180000 ekin = 2.00100366281084 | erot = 2.36086155180544 | epot = -12.49564888609 | etot = -8.13378367147368 +181000 ekin = 1.82885344502819 | erot = 2.44444025932702 | epot = -12.4070773745337 | etot = -8.13378367017847 +182000 ekin = 1.62724610560594 | erot = 2.53221325513872 | epot = -12.2932430288217 | etot = -8.13378366807706 +183000 ekin = 1.42880501135671 | erot = 2.62540058534349 | epot = -12.1879892625419 | etot = -8.13378366584172 +184000 ekin = 1.26714962832124 | erot = 2.72561981850446 | epot = -12.1265531111181 | etot = -8.13378366429242 +185000 ekin = 1.16606552757969 | erot = 2.83366450732262 | epot = -12.1335136988422 | etot = -8.13378366393991 +186000 ekin = 1.13327188784896 | erot = 2.94811459460546 | epot = -12.2151701472116 | etot = -8.13378366475722 +187000 ekin = 1.16127663962576 | erot = 3.06454091657731 | epot = -12.3596012225475 | etot = -8.13378366634445 +188000 ekin = 1.23275799228642 | erot = 3.17578119614188 | epot = -12.5423228566629 | etot = -8.13378366823461 +189000 ekin = 1.32637276316072 | erot = 3.27316596760526 | epot = -12.7333224008237 | etot = -8.13378367005767 +190000 ekin = 1.42100795808807 | erot = 3.34817980173637 | epot = -12.9029714313702 | etot = -8.13378367154575 +191000 ekin = 1.49794111549843 | erot = 3.39410379075346 | epot = -13.0258285788618 | etot = -8.13378367260988 +192000 ekin = 1.54262156679656 | erot = 3.4072016542923 | epot = -13.0836068940668 | etot = -8.13378367297795 +193000 ekin = 1.54797240883502 | erot = 3.38715231466146 | epot = -13.0689083961198 | etot = -8.13378367262328 +194000 ekin = 1.51467582661458 | erot = 3.33705387754744 | epot = -12.9855133757564 | etot = -8.13378367159443 +195000 ekin = 1.45101621748247 | erot = 3.2626931288523 | epot = -12.8474930164474 | etot = -8.13378367011261 +196000 ekin = 1.37083042970781 | erot = 3.17132041678911 | epot = -12.6759345150009 | etot = -8.13378366850402 +197000 ekin = 1.29009120536726 | erot = 3.070362659358 | epot = -12.4942375317752 | etot = -8.13378366704997 +198000 ekin = 1.22364196643961 | erot = 2.96652382643999 | epot = -12.3239494587833 | etot = -8.13378366590366 +199000 ekin = 1.18307710083256 | erot = 2.86542144217758 | epot = -12.1822822081301 | etot = -8.13378366511998 +200000 ekin = 1.17564340951927 | erot = 2.77158698378744 | epot = -12.0810140580301 | etot = -8.13378366472343 +201000 ekin = 1.20359619391753 | erot = 2.68856918537176 | epot = -12.0259490440297 | etot = -8.13378366474036 +202000 ekin = 1.26374726413799 | erot = 2.61894189740052 | epot = -12.0164728267167 | etot = -8.13378366517818 +203000 ekin = 1.34751597563128 | erot = 2.56419616426444 | epot = -12.0454958058709 | etot = -8.13378366597521 +204000 ekin = 1.44203337890014 | erot = 2.52468734318922 | epot = -12.1005043890645 | etot = -8.13378366697514 +205000 ekin = 1.53246038205369 | erot = 2.49972903140502 | epot = -12.1659730814068 | etot = -8.13378366794806 +206000 ekin = 1.60510558525686 | erot = 2.48793425280268 | epot = -12.226823506722 | etot = -8.13378366866246 +207000 ekin = 1.6503955672318 | erot = 2.48771410987726 | epot = -12.2718933460774 | etot = -8.13378366896831 +208000 ekin = 1.6647192426388 | erot = 2.49772662877186 | epot = -12.2962295402584 | etot = -8.13378366884771 +209000 ekin = 1.65060780281985 | erot = 2.51706178773876 | epot = -12.3014532589741 | etot = -8.13378366841553 +210000 ekin = 1.6152961353015 | erot = 2.54506818372093 | epot = -12.2941479869023 | etot = -8.13378366787986 +211000 ekin = 1.56815998339941 | erot = 2.58088870847273 | epot = -12.2828323593492 | etot = -8.1337836674771 +212000 ekin = 1.51779769211966 | erot = 2.62289115839993 | epot = -12.2744725179132 | etot = -8.13378366739362 +213000 ekin = 1.46970697786411 | erot = 2.66822787294319 | epot = -12.2717185184984 | etot = -8.13378366769114 +214000 ekin = 1.42551121611936 | erot = 2.71271314915558 | epot = -12.2720080334461 | etot = -8.1337836681712 +215000 ekin = 1.38449526701769 | erot = 2.75113858809828 | epot = -12.2694175238335 | etot = -8.13378366871751 +216000 ekin = 1.34611450510656 | erot = 2.77818905444611 | epot = -12.2580872284511 | etot = -8.13378366889838 +217000 ekin = 1.31348152811926 | erot = 2.7896405318765 | epot = -12.2369057285547 | etot = -8.13378366855898 +218000 ekin = 1.29458639919466 | erot = 2.78319145109127 | epot = -12.2115615182389 | etot = -8.13378366795296 +219000 ekin = 1.29978448123113 | erot = 2.75785865494217 | epot = -12.1914268036072 | etot = -8.13378366743386 +220000 ekin = 1.33694784981763 | erot = 2.7136363430195 | epot = -12.1843678601775 | etot = -8.13378366734035 +221000 ekin = 1.40745643921106 | erot = 2.65092088134252 | epot = -12.1921609882712 | etot = -8.13378366771763 +222000 ekin = 1.50572252625996 | erot = 2.57029476952272 | epot = -12.2098009641037 | etot = -8.13378366832102 +223000 ekin = 1.62210843375796 | erot = 2.47289007334085 | epot = -12.2287821759282 | etot = -8.13378366882936 +224000 ekin = 1.74679393022953 | erot = 2.36097135919324 | epot = -12.2415489584554 | etot = -8.1337836690326 +225000 ekin = 1.87205636329989 | erot = 2.23842454190504 | epot = -12.2442645742133 | etot = -8.13378366900838 +226000 ekin = 1.99134598106712 | erot = 2.11064622098391 | epot = -12.2357758711293 | etot = -8.13378366907824 +227000 ekin = 2.09586639151718 | erot = 1.9836470405116 | epot = -12.2132971015581 | etot = -8.1337836695293 +228000 ekin = 2.17197666667466 | erot = 1.86293503717766 | epot = -12.1686953741912 | etot = -8.13378367033886 +229000 ekin = 2.20263173192656 | erot = 1.75265294154698 | epot = -12.0890683445905 | etot = -8.133783671117 +230000 ekin = 2.17321554606928 | erot = 1.65532359970842 | epot = -11.9623228171293 | etot = -8.13378367135164 +231000 ekin = 2.07854920573229 | erot = 1.57213281486697 | epot = -11.7844656913359 | etot = -8.13378367073669 +232000 ekin = 1.92671195021964 | erot = 1.50340464294821 | epot = -11.5639002625321 | etot = -8.13378366936424 +233000 ekin = 1.73729705956061 | erot = 1.44896834770241 | epot = -11.320049074932 | etot = -8.13378366766899 +234000 ekin = 1.53556953354815 | erot = 1.40834045937497 | epot = -11.0776936590029 | etot = -8.13378366607974 +235000 ekin = 1.34558700580172 | erot = 1.38078818073889 | epot = -10.8601588514745 | etot = -8.13378366493391 +236000 ekin = 1.18525206422618 | erot = 1.36570263210385 | epot = -10.6847383605463 | etot = -8.13378366421624 +237000 ekin = 1.06637029724371 | erot = 1.36251012102833 | epot = -10.5626640820865 | etot = -8.13378366381442 +238000 ekin = 0.995491212021415 | erot = 1.37070429771399 | epot = -10.4999791733994 | etot = -8.13378366366397 +239000 ekin = 0.975031518632071 | erot = 1.38971384126899 | epot = -10.49852902367 | etot = -8.13378366376892 +240000 ekin = 1.00352423904758 | erot = 1.4186603402425 | epot = -10.5559682434632 | etot = -8.13378366417311 +241000 ekin = 1.07556704774244 | erot = 1.45612900246834 | epot = -10.6654797151283 | etot = -8.13378366491751 +242000 ekin = 1.18122375067339 | erot = 1.49994629855496 | epot = -10.8149537152528 | etot = -8.13378366602447 +243000 ekin = 1.30634294707463 | erot = 1.54703331020089 | epot = -10.9871599246161 | etot = -8.13378366734062 +244000 ekin = 1.43466609576172 | erot = 1.59374373480244 | epot = -11.1621934990192 | etot = -8.13378366845507 +245000 ekin = 1.55091944171262 | erot = 1.63606515904662 | epot = -11.3207682704728 | etot = -8.13378366971357 +246000 ekin = 1.63963426714594 | erot = 1.67091688012747 | epot = -11.44433481791 | etot = -8.13378367063654 +247000 ekin = 1.68912292676109 | erot = 1.69643192578617 | epot = -11.5193385235868 | etot = -8.13378367103955 +248000 ekin = 1.69418623366497 | erot = 1.71223298155038 | epot = -11.5402028860522 | etot = -8.13378367083691 +249000 ekin = 1.65708464249967 | erot = 1.71943097162633 | epot = -11.5102992843205 | etot = -8.13378367019453 +250000 ekin = 1.58639864685292 | erot = 1.72015982289402 | epot = -11.4403421388607 | etot = -8.13378366911377 +251000 ekin = 1.4955593640773 | erot = 1.71716072440084 | epot = -11.3465037564424 | etot = -8.13378366796425 +252000 ekin = 1.39930346630793 | erot = 1.71298107622663 | epot = -11.2460682095263 | etot = -8.13378366699178 +253000 ekin = 1.31034898359465 | erot = 1.70949093459542 | epot = -11.1536235845406 | etot = -8.13378366635058 +254000 ekin = 1.23716194123275 | erot = 1.70776552340113 | epot = -11.0787111307323 | etot = -8.1337836660984 +255000 ekin = 1.1830573384521 | erot = 1.70821467485075 | epot = -11.0250556794499 | etot = -8.13378366614706 +256000 ekin = 1.14729363432733 | erot = 1.71063275158168 | epot = -10.9917100522905 | etot = -8.13378366638151 +257000 ekin = 1.12650460108618 | erot = 1.71454195552784 | epot = -10.9748302232638 | etot = -8.13378366664974 +258000 ekin = 1.11669715917854 | erot = 1.71938873503291 | epot = -10.9698695610653 | etot = -8.13378366685386 +259000 ekin = 1.11461746403823 | erot = 1.72463904931068 | epot = -10.973040180336 | etot = -8.13378366698711 +260000 ekin = 1.11796213299236 | erot = 1.72976096813939 | epot = -10.981506768234 | etot = -8.13378366710223 +261000 ekin = 1.12495929560755 | erot = 1.73429797646801 | epot = -10.9930409392085 | etot = -8.1337836671329 +262000 ekin = 1.13415334886775 | erot = 1.73799782227182 | epot = -11.0059348383752 | etot = -8.13378366723562 +263000 ekin = 1.14419248657758 | erot = 1.74014341283967 | epot = -11.0181195666639 | etot = -8.13378366724668 +264000 ekin = 1.15486713033053 | erot = 1.7401404967673 | epot = -11.0287912942166 | etot = -8.13378366711881 +265000 ekin = 1.16757148072449 | erot = 1.73774643956173 | epot = -11.0391015871626 | etot = -8.1337836668764 +266000 ekin = 1.18492523334689 | erot = 1.73313774545392 | epot = -11.0518466454007 | etot = -8.13378366659988 +267000 ekin = 1.20976553808707 | erot = 1.72682085390381 | epot = -11.0703700583714 | etot = -8.13378366638055 +268000 ekin = 1.24403111905802 | erot = 1.71946869065433 | epot = -11.0972834759964 | etot = -8.13378366628403 +269000 ekin = 1.28796807043146 | erot = 1.71176934564053 | epot = -11.1335210824081 | etot = -8.13378366633612 +270000 ekin = 1.33984072253416 | erot = 1.70434119615581 | epot = -11.1779655852127 | etot = -8.13378366652273 +271000 ekin = 1.39615730896201 | erot = 1.69774776464813 | epot = -11.227688740386 | etot = -8.13378366677587 +272000 ekin = 1.45234426470507 | erot = 1.69276715684496 | epot = -11.2788950886237 | etot = -8.13378366707369 +273000 ekin = 1.50368133069818 | erot = 1.68992546991268 | epot = -11.3273904679252 | etot = -8.13378366731432 +274000 ekin = 1.54639996325692 | erot = 1.68983337628906 | epot = -11.370017006958 | etot = -8.13378366741207 +275000 ekin = 1.57877490148782 | erot = 1.69332235277359 | epot = -11.405880921593 | etot = -8.13378366733158 +276000 ekin = 1.60168052283352 | erot = 1.70138855155485 | epot = -11.4368527414861 | etot = -8.1337836670977 +277000 ekin = 1.61832490283022 | erot = 1.71502642603267 | epot = -11.4671349956655 | etot = -8.13378366680262 +278000 ekin = 1.63311060675218 | erot = 1.73495415768089 | epot = -11.501848431012 | etot = -8.1337836665789 +279000 ekin = 1.64995273994814 | erot = 1.76130541527939 | epot = -11.5450418217722 | etot = -8.1337836665447 +280000 ekin = 1.67073877093319 | erot = 1.79339849893235 | epot = -11.5979209366104 | etot = -8.1337836667449 +281000 ekin = 1.69438407984855 | erot = 1.82970064438583 | epot = -11.6578683914556 | etot = -8.13378366722118 +282000 ekin = 1.71376506080659 | erot = 1.86795891950317 | epot = -11.7155076481287 | etot = -8.13378366781891 +283000 ekin = 1.72224450525134 | erot = 1.90529068548182 | epot = -11.7613188590736 | etot = -8.13378366834043 +284000 ekin = 1.71505262177091 | erot = 1.93881515489562 | epot = -11.7876514453522 | etot = -8.13378366868565 +285000 ekin = 1.68954869056389 | erot = 1.96608819497543 | epot = -11.7894205543611 | etot = -8.1337836688218 +286000 ekin = 1.6455513774762 | erot = 1.98537597121296 | epot = -11.7647110174623 | etot = -8.13378366877313 +287000 ekin = 1.58495470813084 | erot = 1.99578989882447 | epot = -11.7145282755466 | etot = -8.13378366859128 +288000 ekin = 1.51101761585498 | erot = 1.997297767928 | epot = -11.6420990521125 | etot = -8.13378366832957 +289000 ekin = 1.42766231980924 | erot = 1.99063899576454 | epot = -11.5520849836069 | etot = -8.13378366803313 +290000 ekin = 1.33894501486224 | erot = 1.97716758999151 | epot = -11.4498962725851 | etot = -8.13378366773135 +291000 ekin = 1.24881721188078 | erot = 1.95864649302987 | epot = -11.3412473723324 | etot = -8.1337836674218 +292000 ekin = 1.16137515575752 | erot = 1.9370295819175 | epot = -11.2321884047302 | etot = -8.13378366705515 +293000 ekin = 1.08169833470813 | erot = 1.91427738455251 | epot = -11.1297593858174 | etot = -8.13378366655679 +294000 ekin = 1.01689863826428 | erot = 1.89223243581134 | epot = -11.0429147399724 | etot = -8.13378366589681 +295000 ekin = 0.976377352950436 | erot = 1.87253324956362 | epot = -10.9826942676921 | etot = -8.13378366517802 +296000 ekin = 0.970182395978853 | erot = 1.85650679550316 | epot = -10.9604728561383 | etot = -8.13378366465628 +297000 ekin = 1.00537151816994 | erot = 1.84499118418623 | epot = -10.9841463669816 | etot = -8.1337836646254 +298000 ekin = 1.08200534146755 | erot = 1.83812417715671 | epot = -11.0539131838581 | etot = -8.13378366523386 +299000 ekin = 1.19125189129762 | erot = 1.83519410294265 | epot = -11.1602296606164 | etot = -8.13378366637616 +300000 ekin = 1.31698721061339 | erot = 1.83465168975443 | epot = -11.2854225681148 | etot = -8.13378366774697 +301000 ekin = 1.44008784809306 | erot = 1.83433803115556 | epot = -11.4082095482411 | etot = -8.13378366899252 +302000 ekin = 1.54329548540286 | erot = 1.83190000196868 | epot = -11.5089791572108 | etot = -8.13378366983924 +303000 ekin = 1.61484992407284 | erot = 1.82529439832888 | epot = -11.5739279925558 | etot = -8.13378367015409 +304000 ekin = 1.65011047810433 | erot = 1.81324433416773 | epot = -11.5971384822047 | etot = -8.13378366993262 +305000 ekin = 1.65140814366736 | erot = 1.79549497030326 | epot = -11.5806867832608 | etot = -8.13378366929013 +306000 ekin = 1.62643416627377 | erot = 1.77280218913901 | epot = -11.533020023822 | etot = -8.13378366840924 +307000 ekin = 1.58577500467182 | erot = 1.74668500708233 | epot = -11.4662436792488 | etot = -8.13378366749463 +308000 ekin = 1.54030424866681 | erot = 1.71903801624656 | epot = -11.3931259316282 | etot = -8.13378366671483 +309000 ekin = 1.49900091050482 | erot = 1.69173690591874 | epot = -11.3245214826124 | etot = -8.13378366618884 +310000 ekin = 1.46747597212437 | erot = 1.66636932779528 | epot = -11.2676289658614 | etot = -8.13378366594171 +311000 ekin = 1.44771419446156 | erot = 1.6441044887676 | epot = -11.2256023491818 | etot = -8.13378366595262 +312000 ekin = 1.43839141863275 | erot = 1.62568199896143 | epot = -11.1978570837366 | etot = -8.13378366614239 +313000 ekin = 1.43594352565088 | erot = 1.61150443049421 | epot = -11.1812316225552 | etot = -8.1337836664101 +314000 ekin = 1.43595255617279 | erot = 1.60177116104702 | epot = -11.1715073838761 | etot = -8.13378366665631 +315000 ekin = 1.43500742740862 | erot = 1.59648896098777 | epot = -11.1652800551048 | etot = -8.13378366670845 +316000 ekin = 1.43108473245696 | erot = 1.59565804393669 | epot = -11.1605264431174 | etot = -8.13378366672371 +317000 ekin = 1.42390336283974 | erot = 1.59957952106222 | epot = -11.1572665504315 | etot = -8.13378366652955 +318000 ekin = 1.41631295378698 | erot = 1.60866819207144 | epot = -11.1587648120198 | etot = -8.13378366616138 +319000 ekin = 1.41381426232924 | erot = 1.62334142232199 | epot = -11.1709393503737 | etot = -8.13378366572251 +320000 ekin = 1.42315030252084 | erot = 1.64384116840171 | epot = -11.2007751362867 | etot = -8.13378366536418 +321000 ekin = 1.45024845494019 | erot = 1.67003325939975 | epot = -11.254065379577 | etot = -8.13378366523704 +322000 ekin = 1.49815500536719 | erot = 1.70123818171236 | epot = -11.3331768525215 | etot = -8.13378366544195 +323000 ekin = 1.5656935250191 | erot = 1.73609284126415 | epot = -11.4355700322998 | etot = -8.13378366601658 +324000 ekin = 1.64679224021207 | erot = 1.77264010659864 | epot = -11.5532160138045 | etot = -8.13378366699375 +325000 ekin = 1.73163775630944 | erot = 1.80818795205414 | epot = -11.6736093764064 | etot = -8.13378366804283 +326000 ekin = 1.80750329208306 | erot = 1.83980749295526 | epot = -11.7810944543854 | etot = -8.13378366934709 +327000 ekin = 1.85797659456583 | erot = 1.86537346541973 | epot = -11.8571337303115 | etot = -8.13378367032595 +328000 ekin = 1.87027520748892 | erot = 1.88392315073226 | epot = -11.8879820288801 | etot = -8.13378367065894 +329000 ekin = 1.83949589054753 | erot = 1.89597309718836 | epot = -11.8692526579141 | etot = -8.13378367017824 +330000 ekin = 1.77117100868916 | erot = 1.90323589019464 | epot = -11.8081905678794 | etot = -8.13378366899564 +331000 ekin = 1.68023517873261 | erot = 1.90771959425499 | epot = -11.7217384405322 | etot = -8.13378366754461 +332000 ekin = 1.58599656571375 | erot = 1.91066851347188 | epot = -11.6304487455355 | etot = -8.13378366634985 +333000 ekin = 1.50566649891541 | erot = 1.91203797343775 | epot = -11.5514881380513 | etot = -8.13378366569817 +334000 ekin = 1.44997196058942 | erot = 1.91073772769977 | epot = -11.4944933538496 | etot = -8.13378366556045 +335000 ekin = 1.42175053140811 | erot = 1.90515605629062 | epot = -11.4606902539324 | etot = -8.13378366623365 +336000 ekin = 1.41662531058447 | erot = 1.89330033651394 | epot = -11.443709313723 | etot = -8.13378366662462 +337000 ekin = 1.42902342419931 | erot = 1.87459660541457 | epot = -11.4374036965604 | etot = -8.13378366694656 +338000 ekin = 1.45347553474132 | erot = 1.84924982279079 | epot = -11.436509024704 | etot = -8.13378366717192 +339000 ekin = 1.48532648332251 | erot = 1.81789825388619 | epot = -11.437008404542 | etot = -8.13378366733331 +340000 ekin = 1.52068113212483 | erot = 1.7813105429029 | epot = -11.4357753425016 | etot = -8.13378366747389 +341000 ekin = 1.55606070128828 | erot = 1.74019406298435 | epot = -11.4300384318866 | etot = -8.13378366761401 +342000 ekin = 1.58819693536375 | erot = 1.69515176482855 | epot = -11.4171323679322 | etot = -8.13378366773992 +343000 ekin = 1.61415529814652 | erot = 1.64675903935083 | epot = -11.3946980053116 | etot = -8.13378366781428 +344000 ekin = 1.63171879307199 | erot = 1.5956931979438 | epot = -11.3611956588164 | etot = -8.13378366780064 +345000 ekin = 1.63976605961451 | erot = 1.54282704209179 | epot = -11.3163767694008 | etot = -8.13378366769452 +346000 ekin = 1.63837200138269 | erot = 1.48918714016891 | epot = -11.261342809072 | etot = -8.13378366752041 +347000 ekin = 1.62852754177371 | erot = 1.43587351565002 | epot = -11.1981847247542 | etot = -8.13378366733049 +348000 ekin = 1.61158889283558 | erot = 1.383925469405 | epot = -11.1292980294128 | etot = -8.1337836671722 +349000 ekin = 1.5887355743944 | erot = 1.33422850520572 | epot = -11.0567477466733 | etot = -8.13378366707318 +350000 ekin = 1.56064786721382 | erot = 1.28749851959908 | epot = -10.9819300538446 | etot = -8.13378366703172 +351000 ekin = 1.5275419119129 | erot = 1.24434620359442 | epot = -10.9056717825208 | etot = -8.13378366701344 +352000 ekin = 1.48960299203902 | erot = 1.20538641998081 | epot = -10.8287730789796 | etot = -8.13378366695982 +353000 ekin = 1.44778264502937 | erot = 1.17134399709156 | epot = -10.7529103089083 | etot = -8.13378366678739 +354000 ekin = 1.40533100953332 | erot = 1.1432484492258 | epot = -10.6823631252447 | etot = -8.13378366648562 +355000 ekin = 1.36869095863465 | erot = 1.1225024206929 | epot = -10.624977045382 | etot = -8.13378366605446 +356000 ekin = 1.34490175995569 | erot = 1.10992990778131 | epot = -10.5886153331834 | etot = -8.13378366544639 +357000 ekin = 1.34315796276069 | erot = 1.10621719879611 | epot = -10.5831588263828 | etot = -8.13378366482595 +358000 ekin = 1.37283801207955 | erot = 1.11171347587719 | epot = -10.6183351524124 | etot = -8.13378366445567 +359000 ekin = 1.43996759058378 | erot = 1.12612871057391 | epot = -10.6998799657445 | etot = -8.13378366458682 +360000 ekin = 1.5438844591409 | erot = 1.14830381564085 | epot = -10.8259719400993 | etot = -8.13378366531752 +361000 ekin = 1.6758653150916 | erot = 1.1761890541914 | epot = -10.9858380358532 | etot = -8.13378366657025 +362000 ekin = 1.82005627455488 | erot = 1.20703160753363 | epot = -11.1608715500439 | etot = -8.13378366795535 +363000 ekin = 1.9585058393723 | erot = 1.23798141777755 | epot = -11.3302709261634 | etot = -8.13378366901354 +364000 ekin = 2.07580017664351 | erot = 1.26672677095187 | epot = -11.4763106177171 | etot = -8.13378367012168 +365000 ekin = 2.15891662517396 | erot = 1.29173621495671 | epot = -11.584436510601 | etot = -8.13378367047035 +366000 ekin = 2.20238380195759 | erot = 1.31262064914767 | epot = -11.648788121337 | etot = -8.13378367023179 +367000 ekin = 2.20851727275297 | erot = 1.33022857587875 | epot = -11.6725295182418 | etot = -8.13378366961006 +368000 ekin = 2.18513118770515 | erot = 1.34632721320016 | epot = -11.6652420696031 | etot = -8.13378366869782 +369000 ekin = 2.14321144646592 | erot = 1.36315448463329 | epot = -11.6401495989026 | etot = -8.13378366780341 +370000 ekin = 2.0938828241329 | erot = 1.3829685872043 | epot = -11.6106350785139 | etot = -8.13378366717668 +371000 ekin = 2.04539161606643 | erot = 1.40758201280279 | epot = -11.5867572956931 | etot = -8.13378366682384 +372000 ekin = 2.00261126514667 | erot = 1.43827057512733 | epot = -11.5746655069399 | etot = -8.13378366666586 +373000 ekin = 1.96798302472881 | erot = 1.47584503943877 | epot = -11.5776117307477 | etot = -8.13378366658016 +374000 ekin = 1.9427642201498 | erot = 1.52074221163615 | epot = -11.597290098334 | etot = -8.13378366654806 +375000 ekin = 1.92741631545116 | erot = 1.57302624843808 | epot = -11.6342262305069 | etot = -8.13378366661764 +376000 ekin = 1.92110841836679 | erot = 1.63232320681306 | epot = -11.6872152920288 | etot = -8.13378366684891 +377000 ekin = 1.92083197489726 | erot = 1.69770894533778 | epot = -11.7523245875375 | etot = -8.13378366730242 +378000 ekin = 1.92097158012141 | erot = 1.7676305565423 | epot = -11.8223858045367 | etot = -8.13378366787296 +379000 ekin = 1.9143805691691 | erot = 1.83964318712979 | epot = -11.8878074249498 | etot = -8.13378366865087 +380000 ekin = 1.89241520119535 | erot = 1.91106138176889 | epot = -11.937260252322 | etot = -8.13378366935773 +381000 ekin = 1.84711843121381 | erot = 1.97933543814508 | epot = -11.9602375392247 | etot = -8.13378366986585 +382000 ekin = 1.77364821788772 | erot = 2.04210934440012 | epot = -11.9495412323447 | etot = -8.13378367005691 +383000 ekin = 1.67178472399728 | erot = 2.09754562136732 | epot = -11.9031140151878 | etot = -8.13378366982318 +384000 ekin = 1.54709556481459 | erot = 2.14438708234362 | epot = -11.8252663163777 | etot = -8.13378366921949 +385000 ekin = 1.41093432867779 | erot = 2.18184182145105 | epot = -11.7265598182848 | etot = -8.13378366815593 +386000 ekin = 1.27958936994579 | erot = 2.21051340231035 | epot = -11.6238864391451 | etot = -8.13378366688898 +387000 ekin = 1.17137861198561 | erot = 2.23163165239764 | epot = -11.5367939301736 | etot = -8.13378366579032 +388000 ekin = 1.10179780402574 | erot = 2.2463475452751 | epot = -11.4819290145282 | etot = -8.13378366522735 +389000 ekin = 1.07882148968846 | erot = 2.25505587957373 | epot = -11.4676610376626 | etot = -8.13378366840039 +390000 ekin = 1.07051570135838 | erot = 2.26936424220882 | epot = -11.4736636037163 | etot = -8.13378366014913 +391000 ekin = 1.12513305991642 | erot = 2.28557987987656 | epot = -11.5444966077453 | etot = -8.1337836679523 +392000 ekin = 1.21295440172366 | erot = 2.2706367034028 | epot = -11.6173747716316 | etot = -8.13378366650518 +393000 ekin = 1.30924312365442 | erot = 2.24076930893579 | epot = -11.6837960997181 | etot = -8.13378366712787 +394000 ekin = 1.40561895760616 | erot = 2.19794335034461 | epot = -11.737345975341 | etot = -8.13378366739023 +395000 ekin = 1.49662707239319 | erot = 2.14293675801978 | epot = -11.7733474977479 | etot = -8.13378366733488 +396000 ekin = 1.5807772799153 | erot = 2.07761988891138 | epot = -11.7921808358758 | etot = -8.13378366704916 +397000 ekin = 1.65955042581882 | erot = 2.00469837191084 | epot = -11.798032464358 | etot = -8.13378366662836 +398000 ekin = 1.73622447988647 | erot = 1.92743077252919 | epot = -11.7974389185614 | etot = -8.13378366614571 +399000 ekin = 1.81471876942244 | erot = 1.84941455049526 | epot = -11.7979169856369 | etot = -8.13378366571923 +400000 ekin = 1.89831345083278 | erot = 1.77428869309233 | epot = -11.8063858093355 | etot = -8.13378366541043 +401000 ekin = 1.98857882165089 | erot = 1.70555701947636 | epot = -11.8279195064046 | etot = -8.13378366527734 +402000 ekin = 2.08469272454778 | erot = 1.64640053761285 | epot = -11.8648769274935 | etot = -8.13378366533283 +403000 ekin = 2.18333492883602 | erot = 1.59947809827672 | epot = -11.9165966926831 | etot = -8.1337836655704 +404000 ekin = 2.27899469657512 | erot = 1.56671457666659 | epot = -11.9794929390995 | etot = -8.13378366585775 +405000 ekin = 2.36506409046644 | erot = 1.54904572147253 | epot = -12.0478934783876 | etot = -8.1337836664486 +406000 ekin = 2.43306193249797 | erot = 1.54630434412229 | epot = -12.1131499437779 | etot = -8.13378366715766 +407000 ekin = 2.47364186380494 | erot = 1.55689186413063 | epot = -12.1643173959541 | etot = -8.13378366801855 +408000 ekin = 2.47760299472499 | erot = 1.5781064138446 | epot = -12.1894930773328 | etot = -8.13378366876325 +409000 ekin = 2.43822850842607 | erot = 1.60664113475467 | epot = -12.1786533122588 | etot = -8.13378366907809 +410000 ekin = 2.35516301280273 | erot = 1.63934184028366 | epot = -12.1282885218163 | etot = -8.1337836687299 +411000 ekin = 2.23661952277215 | erot = 1.67408087730624 | epot = -12.0444840678237 | etot = -8.13378366774526 +412000 ekin = 2.09851267461913 | erot = 1.71012170017578 | epot = -11.9424180412146 | etot = -8.1337836664197 +413000 ekin = 1.96056484793908 | erot = 1.7477880401112 | epot = -11.8421365532043 | etot = -8.13378366515403 +414000 ekin = 1.84128090481493 | erot = 1.78771082122122 | epot = -11.7627753903064 | etot = -8.13378366427029 +415000 ekin = 1.7539044233613 | erot = 1.83009103154469 | epot = -11.7177791188321 | etot = -8.13378366392606 +416000 ekin = 1.70439570487831 | erot = 1.87425008285661 | epot = -11.7124294518623 | etot = -8.13378366412735 +417000 ekin = 1.69131554252948 | erot = 1.918501478837 | epot = -11.7436006861831 | etot = -8.13378366481665 +418000 ekin = 1.7068949003181 | erot = 1.96025799788764 | epot = -11.8009365639631 | etot = -8.13378366575732 +419000 ekin = 1.73962222230371 | erot = 1.99637255840703 | epot = -11.8697784474997 | etot = -8.13378366678895 +420000 ekin = 1.77669286262483 | erot = 2.02357619714979 | epot = -11.9340527274781 | etot = -8.13378366770344 +421000 ekin = 1.8065782408294 | erot = 2.03903049555701 | epot = -11.9793924047138 | etot = -8.13378366832744 +422000 ekin = 1.82111290085909 | erot = 2.04088419799601 | epot = -11.9957807674282 | etot = -8.13378366857305 +423000 ekin = 1.81648584568676 | erot = 2.02865244729856 | epot = -11.9789219614447 | etot = -8.13378366845938 +424000 ekin = 1.79301691785087 | erot = 2.00326876348606 | epot = -11.9300693494109 | etot = -8.13378366807394 +425000 ekin = 1.75424046968078 | erot = 1.96680784722196 | epot = -11.854831984411 | etot = -8.13378366750822 +426000 ekin = 1.70601392329189 | erot = 1.92202692837053 | epot = -11.7618245184899 | etot = -8.1337836668275 +427000 ekin = 1.65580906012917 | erot = 1.87186985441136 | epot = -11.6614625806787 | etot = -8.13378366613817 +428000 ekin = 1.61207963969401 | erot = 1.81905558542235 | epot = -11.5649188905524 | etot = -8.13378366543605 +429000 ekin = 1.5833999942279 | erot = 1.7657989317176 | epot = -11.4829825908563 | etot = -8.13378366491079 +430000 ekin = 1.57646033947372 | erot = 1.71346152699375 | epot = -11.4237055311687 | etot = -8.13378366470128 +431000 ekin = 1.59418488210765 | erot = 1.66239892772925 | epot = -11.3903674747264 | etot = -8.13378366488948 +432000 ekin = 1.63452809771756 | erot = 1.6120557480409 | epot = -11.3803675111914 | etot = -8.13378366543294 +433000 ekin = 1.69077410977045 | erot = 1.56136635610619 | epot = -11.3859241320172 | etot = -8.13378366614059 +434000 ekin = 1.75368500742851 | erot = 1.50939558466423 | epot = -11.3968642588277 | etot = -8.13378366673501 +435000 ekin = 1.81477188941446 | erot = 1.45598133799928 | epot = -11.4045368944161 | etot = -8.13378366700231 +436000 ekin = 1.86895151228373 | erot = 1.40204530898049 | epot = -11.4047804881002 | etot = -8.13378366683597 +437000 ekin = 1.91551323813672 | erot = 1.34941425923527 | epot = -11.3987111639605 | etot = -8.1337836665885 +438000 ekin = 1.95545357706279 | erot = 1.30011080733717 | epot = -11.3893480508802 | etot = -8.13378366648026 +439000 ekin = 1.98811153075646 | erot = 1.25557284833876 | epot = -11.3774680457415 | etot = -8.13378366664625 +440000 ekin = 2.00986623436097 | erot = 1.2163020416111 | epot = -11.3599519429673 | etot = -8.13378366699526 +441000 ekin = 2.0153035076586 | erot = 1.18202297032889 | epot = -11.3311101452758 | etot = -8.13378366728832 +442000 ekin = 1.99936349679035 | erot = 1.15207873138256 | epot = -11.2852258960272 | etot = -8.13378366785425 +443000 ekin = 1.95696749681663 | erot = 1.12547607064077 | epot = -11.216227234986 | etot = -8.13378366752865 +444000 ekin = 1.89166490098974 | erot = 1.10194461447989 | epot = -11.1273931823301 | etot = -8.13378366686045 +445000 ekin = 1.81328868644751 | erot = 1.08168732032588 | epot = -11.0287596725674 | etot = -8.13378366579406 +446000 ekin = 1.73577899474701 | erot = 1.06505071492863 | epot = -10.934613374722 | etot = -8.13378366504638 +447000 ekin = 1.67093185588831 | erot = 1.05239705126931 | epot = -10.8571125714695 | etot = -8.13378366431192 +448000 ekin = 1.6291185681957 | erot = 1.04409603312635 | epot = -10.8069982651693 | etot = -8.13378366384729 +449000 ekin = 1.61731626297075 | erot = 1.04041489697141 | epot = -10.7915148237036 | etot = -8.1337836637614 +450000 ekin = 1.63711697605715 | erot = 1.04135992229639 | epot = -10.8122605626986 | etot = -8.13378366434503 +451000 ekin = 1.68320258142166 | erot = 1.04620824656513 | epot = -10.8631944930204 | etot = -8.13378366503363 +452000 ekin = 1.74581668011681 | erot = 1.05391169410103 | epot = -10.9335120399974 | etot = -8.13378366577957 +453000 ekin = 1.81457146100472 | erot = 1.06335165863441 | epot = -11.0117067861179 | etot = -8.1337836664788 +454000 ekin = 1.87975957938335 | erot = 1.07317402238505 | epot = -11.0867172689043 | etot = -8.13378366713586 +455000 ekin = 1.93251877587776 | erot = 1.08171623325473 | epot = -11.1480186769427 | etot = -8.1337836678102 +456000 ekin = 1.96415416826711 | erot = 1.08704156958797 | epot = -11.1849794063562 | etot = -8.13378366850113 +457000 ekin = 1.96605348077107 | erot = 1.0872339429417 | epot = -11.1870710927834 | etot = -8.13378366907065 +458000 ekin = 1.93127523761038 | erot = 1.08096076790399 | epot = -11.146019674778 | etot = -8.13378366926365 +459000 ekin = 1.85771594839341 | erot = 1.06809531780711 | epot = -11.0595949350253 | etot = -8.13378366882483 +460000 ekin = 1.75147188083719 | erot = 1.05009293158359 | epot = -10.9353484800662 | etot = -8.13378366764541 +461000 ekin = 1.62834142733938 | erot = 1.02990811326467 | epot = -10.7920332065062 | etot = -8.13378366590216 +462000 ekin = 1.51195360647934 | erot = 1.01153881174451 | epot = -10.6572760812002 | etot = -8.13378366297633 +463000 ekin = 1.43011910143845 | erot = 1.00022578453823 | epot = -10.5641285481517 | etot = -8.13378366217503 +464000 ekin = 1.39582910827496 | erot = 0.998198432077561 | epot = -10.5278112022032 | etot = -8.13378366185073 +465000 ekin = 1.41007554850175 | erot = 1.0059200900327 | epot = -10.5497793012377 | etot = -8.13378366270329 +466000 ekin = 1.46251969360673 | erot = 1.02219738030602 | epot = -10.6185007378636 | etot = -8.13378366395089 +467000 ekin = 1.49627186628377 | erot = 1.05472101821887 | epot = -10.684776548826 | etot = -8.13378366432334 +468000 ekin = 1.51725853676448 | erot = 1.12479885662203 | epot = -10.7758410579224 | etot = -8.1337836645359 +469000 ekin = 1.58140637755478 | erot = 1.16828828958825 | epot = -10.883478331625 | etot = -8.13378366448195 +470000 ekin = 1.60068578299443 | erot = 1.18114141021191 | epot = -10.9156108575561 | etot = -8.13378366434975 +471000 ekin = 1.59076368327275 | erot = 1.18707237247091 | epot = -10.9116197194443 | etot = -8.1337836637006 +472000 ekin = 1.56124060600587 | erot = 1.18572143101271 | epot = -10.880745699812 | etot = -8.13378366279344 +473000 ekin = 1.52502097411989 | erot = 1.17792025681201 | epot = -10.8367248927673 | etot = -8.13378366183537 +474000 ekin = 1.49533177226198 | erot = 1.16544446213558 | epot = -10.794559895353 | etot = -8.13378366095545 +475000 ekin = 1.48386630176111 | erot = 1.15068540215573 | epot = -10.7683353641552 | etot = -8.13378366023836 +476000 ekin = 1.49971334632826 | erot = 1.13623821677978 | epot = -10.7697352228517 | etot = -8.13378365974365 +477000 ekin = 1.54871118769558 | erot = 1.1244843335277 | epot = -10.8069791813352 | etot = -8.13378366011192 +478000 ekin = 1.62953491120423 | erot = 1.11764268903608 | epot = -10.8809612604802 | etot = -8.13378366023986 +479000 ekin = 1.73735741643918 | erot = 1.11700620811327 | epot = -10.9881472852187 | etot = -8.13378366066626 +480000 ekin = 1.86556210288033 | erot = 1.12262064775157 | epot = -11.1219664120646 | etot = -8.13378366143269 +481000 ekin = 2.00121026337205 | erot = 1.13364860021322 | epot = -11.2686425499513 | etot = -8.133783686366 +482000 ekin = 2.04617329758791 | erot = 1.16256926170154 | epot = -11.3425262237766 | etot = -8.13378366448714 +483000 ekin = 2.14335261834806 | erot = 1.21476273130068 | epot = -11.4918990325578 | etot = -8.13378368290904 +484000 ekin = 2.2027099535623 | erot = 1.23147381806936 | epot = -11.5679674446503 | etot = -8.13378367301867 +485000 ekin = 2.20682939440963 | erot = 1.23835798982089 | epot = -11.5789710574828 | etot = -8.13378367325232 +486000 ekin = 2.16589682794253 | erot = 1.24300370551841 | epot = -11.5426842062897 | etot = -8.13378367282871 +487000 ekin = 2.08668888864966 | erot = 1.24625551752124 | epot = -11.4667280780175 | etot = -8.1337836718466 +488000 ekin = 1.98386509125085 | erot = 1.24977318046638 | epot = -11.3674219422406 | etot = -8.13378367052335 +489000 ekin = 1.87707931030754 | erot = 1.25547012773704 | epot = -11.2663331072054 | etot = -8.13378366916079 +490000 ekin = 1.78677596317084 | erot = 1.26490338721995 | epot = -11.1854630185179 | etot = -8.13378366812706 +491000 ekin = 1.72903831214138 | erot = 1.27867004038139 | epot = -11.1414920203219 | etot = -8.13378366779911 +492000 ekin = 1.71039979057821 | erot = 1.29591768107264 | epot = -11.1401011400708 | etot = -8.13378366841992 +493000 ekin = 1.72454317156128 | erot = 1.31423280426762 | epot = -11.1725596457329 | etot = -8.13378366990395 +494000 ekin = 1.75332785015452 | erot = 1.33022406246675 | epot = -11.2173355843439 | etot = -8.13378367172259 +495000 ekin = 1.77349565825588 | erot = 1.34086561473228 | epot = -11.2481449460261 | etot = -8.13378367303795 +496000 ekin = 1.76725059667724 | erot = 1.34512484286663 | epot = -11.2461591126952 | etot = -8.13378367315135 +497000 ekin = 1.7312763798942 | erot = 1.34494708212178 | epot = -11.2100071339786 | etot = -8.1337836719626 +498000 ekin = 1.6785500090819 | erot = 1.34489121264458 | epot = -11.1572248917632 | etot = -8.13378367003671 +499000 ekin = 1.63191747119711 | erot = 1.35056727533229 | epot = -11.1162684147433 | etot = -8.13378366821386 +500000 ekin = 1.61378359990016 | erot = 1.3667636468144 | epot = -11.1143309138658 | etot = -8.1337836671512 +501000 ekin = 1.63758101988153 | erot = 1.39609850676614 | epot = -11.1674631937492 | etot = -8.13378366710158 +502000 ekin = 1.70413807541162 | erot = 1.43847493669148 | epot = -11.2763966800707 | etot = -8.13378366796759 +503000 ekin = 1.80268297747421 | erot = 1.49115460253747 | epot = -11.4276212495037 | etot = -8.13378366949198 +504000 ekin = 1.91419549778944 | erot = 1.54914693963942 | epot = -11.5971261088563 | etot = -8.13378367142744 +505000 ekin = 2.01490443998012 | erot = 1.60576406504308 | epot = -11.7544521785637 | etot = -8.13378367354047 +506000 ekin = 2.07966541471014 | erot = 1.65345439354067 | epot = -11.8669034836903 | etot = -8.13378367543949 +507000 ekin = 2.0870035389711 | erot = 1.68517460629498 | epot = -11.9059618217443 | etot = -8.13378367647819 +508000 ekin = 2.02663352663423 | erot = 1.69625747623648 | epot = -11.8566746789393 | etot = -8.1337836760686 +509000 ekin = 1.90589064134063 | erot = 1.68599529702703 | epot = -11.7256696125548 | etot = -8.13378367418714 +510000 ekin = 1.74959091232253 | erot = 1.6578768825328 | epot = -11.5412514663215 | etot = -8.13378367146617 +511000 ekin = 1.59231955658714 | erot = 1.61826266731548 | epot = -11.3443658926793 | etot = -8.1337836687767 +512000 ekin = 1.4675585606025 | erot = 1.57434662380356 | epot = -11.1756888512879 | etot = -8.13378366688181 +513000 ekin = 1.39839916093078 | erot = 1.53234768377589 | epot = -11.0645305108162 | etot = -8.1337836661095 +514000 ekin = 1.39338903686576 | erot = 1.49706258344478 | epot = -11.024235286466 | etot = -8.13378366615549 +515000 ekin = 1.44495159062055 | erot = 1.47110271002976 | epot = -11.0498379682116 | etot = -8.13378366756126 +516000 ekin = 1.53288312821577 | erot = 1.45357064724467 | epot = -11.1202374448468 | etot = -8.13378366938636 +517000 ekin = 1.63159033312452 | erot = 1.44224294472879 | epot = -11.2076169492315 | etot = -8.13378367137819 +518000 ekin = 1.71409401455657 | erot = 1.4340839943587 | epot = -11.2819616821534 | etot = -8.13378367323809 +519000 ekin = 1.75665192756545 | erot = 1.42579002916916 | epot = -11.3162256317321 | etot = -8.13378367499745 +520000 ekin = 1.7418734594754 | erot = 1.41504839774918 | epot = -11.2907055324296 | etot = -8.13378367520502 +521000 ekin = 1.66871703040513 | erot = 1.40071550595816 | epot = -11.2032162101125 | etot = -8.13378367374925 +522000 ekin = 1.55952182856079 | erot = 1.38339983650052 | epot = -11.0767053362008 | etot = -8.13378367113947 +523000 ekin = 1.45114556551557 | erot = 1.3656830806487 | epot = -10.9506123146215 | etot = -8.13378366845718 +524000 ekin = 1.38091842212804 | erot = 1.35134919390869 | epot = -10.8660512824825 | etot = -8.13378366644579 +525000 ekin = 1.37601425591404 | erot = 1.34456662955946 | epot = -10.8543645508839 | etot = -8.13378366541038 +526000 ekin = 1.44870428485067 | erot = 1.34909740179289 | epot = -10.9315853521545 | etot = -8.13378366551097 +527000 ekin = 1.59459863547139 | erot = 1.36714947552062 | epot = -11.0955317779062 | etot = -8.13378366691416 +528000 ekin = 1.79183405481955 | erot = 1.39841904593302 | epot = -11.3240367701712 | etot = -8.13378366941866 +529000 ekin = 2.00478978697981 | erot = 1.43972835787733 | epot = -11.5783018172282 | etot = -8.13378367237111 +530000 ekin = 2.19333795601797 | erot = 1.48552207657973 | epot = -11.8126437074869 | etot = -8.13378367488922 +531000 ekin = 2.32431476965854 | erot = 1.52928747155543 | epot = -11.9873859175034 | etot = -8.13378367628947 +532000 ekin = 2.37971447238515 | erot = 1.56539257217842 | epot = -12.0788907210183 | etot = -8.13378367645474 +533000 ekin = 2.35771666715934 | erot = 1.59048999440141 | epot = -12.0819903372246 | etot = -8.13378367566386 +534000 ekin = 2.26899715449254 | erot = 1.60407394358798 | epot = -12.0068547722132 | etot = -8.13378367413272 +535000 ekin = 2.13365177459914 | erot = 1.60831072461823 | epot = -11.8757461712403 | etot = -8.13378367202297 +536000 ekin = 1.97886376167499 | erot = 1.60719127867242 | epot = -11.7198387100764 | etot = -8.13378366972895 +537000 ekin = 1.83421887315024 | erot = 1.60523898301454 | epot = -11.5732415239291 | etot = -8.13378366776436 +538000 ekin = 1.72531720892644 | erot = 1.6063251928936 | epot = -11.4654260683311 | etot = -8.13378366651106 +539000 ekin = 1.66856519905571 | erot = 1.6130147293037 | epot = -11.4153635944826 | etot = -8.13378366612323 +540000 ekin = 1.66907056567834 | erot = 1.62662968765102 | epot = -11.4294839194914 | etot = -8.13378366616205 +541000 ekin = 1.72153495927027 | erot = 1.64788745986125 | epot = -11.5032060864798 | etot = -8.13378366734831 +542000 ekin = 1.80903650496826 | erot = 1.6754786968006 | epot = -11.6182988706809 | etot = -8.13378366891207 +543000 ekin = 1.90894616835527 | erot = 1.70734508947704 | epot = -11.7500749283668 | etot = -8.13378367053448 +544000 ekin = 1.99777842839545 | erot = 1.74125357780754 | epot = -11.8728156781218 | etot = -8.13378367191885 +545000 ekin = 2.05546409374589 | erot = 1.77521000036354 | epot = -11.9644577669439 | etot = -8.13378367283447 +546000 ekin = 2.0686759531372 | erot = 1.80779483608995 | epot = -12.010254462383 | etot = -8.13378367315581 +547000 ekin = 2.03267806245649 | erot = 1.83838588998092 | epot = -12.0048476253046 | etot = -8.13378367286718 +548000 ekin = 1.95148731421225 | erot = 1.86718390882578 | epot = -11.9524548951405 | etot = -8.13378367210244 +549000 ekin = 1.8364504233007 | erot = 1.89487456520005 | epot = -11.8651086595368 | etot = -8.13378367103609 +550000 ekin = 1.70373130495423 | erot = 1.92233248820751 | epot = -11.759847463038 | etot = -8.13378366987622 +551000 ekin = 1.57139422781184 | erot = 1.95024291868203 | epot = -11.6554208153043 | etot = -8.13378366881045 +552000 ekin = 1.45663332557803 | erot = 1.97878558863039 | epot = -11.5692025822013 | etot = -8.13378366799288 +553000 ekin = 1.37337409019781 | erot = 2.00744335365785 | epot = -11.514601111401 | etot = -8.13378366754535 +554000 ekin = 1.33029485862609 | erot = 2.03496657145449 | epot = -11.4990450976237 | etot = -8.13378366754314 +555000 ekin = 1.32945359625969 | erot = 2.05953157376214 | epot = -11.5227688380181 | etot = -8.13378366799624 +556000 ekin = 1.36589068757554 | erot = 2.07909837609474 | epot = -11.5787727324803 | etot = -8.13378366881005 +557000 ekin = 1.42857577084349 | erot = 2.09193210847118 | epot = -11.6542915491153 | etot = -8.13378366980064 +558000 ekin = 1.50275359964642 | erot = 2.0971531414025 | epot = -11.7336904117795 | etot = -8.13378367073055 +559000 ekin = 1.5732183090821 | erot = 2.09511862189602 | epot = -11.8021206023728 | etot = -8.13378367139464 +560000 ekin = 1.62740172364156 | erot = 2.08745496893393 | epot = -11.8486403643022 | etot = -8.13378367172671 +561000 ekin = 1.65692416188639 | erot = 2.07666092047554 | epot = -11.8673687541686 | etot = -8.1337836718067 +562000 ekin = 1.65737426356301 | erot = 2.06544534214492 | epot = -11.8566032774398 | etot = -8.13378367173188 +563000 ekin = 1.62727808428054 | erot = 2.05615555038101 | epot = -11.8172173064481 | etot = -8.13378367178653 +564000 ekin = 1.56679933056227 | erot = 2.05047511799567 | epot = -11.7510581199095 | etot = -8.13378367135161 +565000 ekin = 1.48206055329241 | erot = 2.04917576858623 | epot = -11.6650199925243 | etot = -8.13378367064571 +566000 ekin = 1.38423866544633 | erot = 2.05221850150355 | epot = -11.5702408367324 | etot = -8.13378366978251 +567000 ekin = 1.28749391779739 | erot = 2.05873429505507 | epot = -11.4800118818374 | etot = -8.1337836689849 +568000 ekin = 1.20570431103048 | erot = 2.06705692034106 | epot = -11.4065448998275 | etot = -8.13378366845593 +569000 ekin = 1.14918558023023 | erot = 2.07495244466236 | epot = -11.3579216931806 | etot = -8.13378366828806 +570000 ekin = 1.12276449646133 | erot = 2.0800727296248 | epot = -11.3366208945299 | etot = -8.13378366844375 +571000 ekin = 1.12567595872038 | erot = 2.08050218013808 | epot = -11.3399618076578 | etot = -8.13378366879936 +572000 ekin = 1.15294903410684 | erot = 2.07519259345207 | epot = -11.3619252967597 | etot = -8.1337836692008 +573000 ekin = 1.19838854918916 | erot = 2.06451015558718 | epot = -11.3966823740033 | etot = -8.13378366922693 +574000 ekin = 1.25460427389363 | erot = 2.04968889738792 | epot = -11.4380768408067 | etot = -8.13378366952511 +575000 ekin = 1.31454735695641 | erot = 2.03199549862925 | epot = -11.4803265251173 | etot = -8.1337836695316 +576000 ekin = 1.37512583611565 | erot = 2.01319845741347 | epot = -11.5221079628331 | etot = -8.13378366930401 +577000 ekin = 1.43682760503374 | erot = 1.99528982934824 | epot = -11.5659011033457 | etot = -8.13378366896374 +578000 ekin = 1.50235588202076 | erot = 1.98017269182895 | epot = -11.6163122424743 | etot = -8.13378366862455 +579000 ekin = 1.57520818416944 | erot = 1.96938672247359 | epot = -11.6783785750011 | etot = -8.13378366835812 +580000 ekin = 1.65868462493027 | erot = 1.96390249857606 | epot = -11.7563707921455 | etot = -8.13378366863916 +581000 ekin = 1.75247311826583 | erot = 1.964193085348 | epot = -11.8504498724769 | etot = -8.1337836688631 +582000 ekin = 1.85283782857648 | erot = 1.96967477641674 | epot = -11.9562962743711 | etot = -8.13378366937788 +583000 ekin = 1.95429754597291 | erot = 1.97826405495591 | epot = -12.066345271253 | etot = -8.13378367032418 +584000 ekin = 2.04662916571901 | erot = 1.98631443704582 | epot = -12.1667272745352 | etot = -8.13378367177041 +585000 ekin = 2.11419694671166 | erot = 1.98862566442593 | epot = -12.2366062846758 | etot = -8.13378367353824 +586000 ekin = 2.13871236987807 | erot = 1.97915340581891 | epot = -12.2516494507778 | etot = -8.13378367508081 +587000 ekin = 2.10465783247187 | erot = 1.95256271523672 | epot = -12.1910042235991 | etot = -8.13378367589049 +588000 ekin = 2.00543191748367 | erot = 1.90599988278188 | epot = -12.0452154755429 | etot = -8.13378367527739 +589000 ekin = 1.85115446103193 | erot = 1.84021509336813 | epot = -11.8251532276766 | etot = -8.13378367327653 +590000 ekin = 1.66921622806881 | erot = 1.7593335110468 | epot = -11.5623334095075 | etot = -8.13378367039186 +591000 ekin = 1.4977485483699 | erot = 1.66961531493353 | epot = -11.301147530791 | etot = -8.13378366748759 +592000 ekin = 1.3741820859932 | erot = 1.57786762200031 | epot = -11.0858333735134 | etot = -8.13378366551992 +593000 ekin = 1.32230765433201 | erot = 1.49017042368006 | epot = -10.9462617430894 | etot = -8.13378366507729 +594000 ekin = 1.34433584581037 | erot = 1.41110289037398 | epot = -10.8892224022201 | etot = -8.13378366603572 +595000 ekin = 1.42313762141316 | erot = 1.34352894995369 | epot = -10.9004502389494 | etot = -8.13378366758259 +596000 ekin = 1.53140640357297 | erot = 1.2890571416378 | epot = -10.954247214935 | etot = -8.13378366972426 +597000 ekin = 1.63793776665428 | erot = 1.24822708399061 | epot = -11.0199485217856 | etot = -8.13378367114073 +598000 ekin = 1.71853369497769 | erot = 1.2204230558525 | epot = -11.0727404229811 | etot = -8.13378367215094 +599000 ekin = 1.75676579673027 | erot = 1.20417119499066 | epot = -11.0947206644564 | etot = -8.1337836727355 +600000 ekin = 1.74415562351976 | erot = 1.19748501258577 | epot = -11.0754243089205 | etot = -8.13378367281501 +601000 ekin = 1.68078686628586 | erot = 1.19842786468434 | epot = -11.0129984032571 | etot = -8.13378367228694 +602000 ekin = 1.57592768465231 | erot = 1.20571835984157 | epot = -10.9154297156343 | etot = -8.13378367114043 +603000 ekin = 1.44736021988517 | erot = 1.21906556666636 | epot = -10.8002094561225 | etot = -8.13378366957098 +604000 ekin = 1.31829530123861 | erot = 1.23900632721026 | epot = -10.6910852964334 | etot = -8.13378366798455 +605000 ekin = 1.21203583246857 | erot = 1.26625018196504 | epot = -10.6120696811956 | etot = -8.13378366676199 +606000 ekin = 1.14717881943141 | erot = 1.30114918573908 | epot = -10.5821116711541 | etot = -8.13378366598363 +607000 ekin = 1.13493137969479 | erot = 1.34344256501772 | epot = -10.6121576106247 | etot = -8.13378366591218 +608000 ekin = 1.17769398074636 | erot = 1.39211398656162 | epot = -10.7035916336137 | etot = -8.13378366630573 +609000 ekin = 1.27083042497278 | erot = 1.44572829443333 | epot = -10.8503423864876 | etot = -8.13378366708152 +610000 ekin = 1.40359308953523 | erot = 1.50241692808371 | epot = -11.0397936861299 | etot = -8.13378366851095 +611000 ekin = 1.55996607947085 | erot = 1.55982171139623 | epot = -11.253571460636 | etot = -8.13378366976893 +612000 ekin = 1.72323074885771 | erot = 1.61567444068065 | epot = -11.4726888606333 | etot = -8.13378367109498 +613000 ekin = 1.87623356286519 | erot = 1.6673223462411 | epot = -11.6773395814989 | etot = -8.13378367239258 +614000 ekin = 2.00332542687796 | erot = 1.7118578677057 | epot = -11.848966967905 | etot = -8.13378367332138 +615000 ekin = 2.0938447106915 | erot = 1.74706892485491 | epot = -11.9746973091449 | etot = -8.13378367359853 +616000 ekin = 2.14582652012112 | erot = 1.77208418550434 | epot = -12.051694378647 | etot = -8.13378367302157 +617000 ekin = 2.16764032551907 | erot = 1.787864761544 | epot = -12.0892887588653 | etot = -8.13378367180225 +618000 ekin = 2.17543321836212 | erot = 1.79702594193842 | epot = -12.1062428306546 | etot = -8.1337836703541 +619000 ekin = 2.1876501512488 | erot = 1.8030963157551 | epot = -12.124530136227 | etot = -8.13378366922312 +620000 ekin = 2.21827388575881 | erot = 1.80941579610169 | epot = -12.1614733506214 | etot = -8.13378366876093 +621000 ekin = 2.27256724286288 | erot = 1.81817906105508 | epot = -12.2245299729512 | etot = -8.13378366903325 +622000 ekin = 2.34686215368936 | erot = 1.82980019933667 | epot = -12.3104460229147 | etot = -8.13378366988869 +623000 ekin = 2.4307948396215 | erot = 1.84272954678992 | epot = -12.4073080575094 | etot = -8.13378367109801 +624000 ekin = 2.51074859399526 | erot = 1.85365912854803 | epot = -12.4981913948869 | etot = -8.1337836723436 +625000 ekin = 2.57376014758728 | erot = 1.85839628629478 | epot = -12.5659401070749 | etot = -8.13378367319283 +626000 ekin = 2.61178608744766 | erot = 1.85335246050013 | epot = -12.5989222212804 | etot = -8.13378367333261 +627000 ekin = 2.6243966691599 | erot = 1.83675929860226 | epot = -12.5949396406032 | etot = -8.13378367284104 +628000 ekin = 2.61715143116715 | erot = 1.80883297814718 | epot = -12.5597680815357 | etot = -8.1337836722214 +629000 ekin = 2.59614002780091 | erot = 1.77076928021921 | epot = -12.5006929799575 | etot = -8.1337836719374 +630000 ekin = 2.56316564608668 | erot = 1.723688622724 | epot = -12.4206379408549 | etot = -8.13378367204425 +631000 ekin = 2.51545670840082 | erot = 1.66841938704622 | epot = -12.3176597676969 | etot = -8.13378367224985 +632000 ekin = 2.4489810628424 | erot = 1.60594586085273 | epot = -12.1887105959476 | etot = -8.13378367225249 +633000 ekin = 2.36287257797967 | erot = 1.53782426737418 | epot = -12.0344805167116 | etot = -8.1337836713577 +634000 ekin = 2.26405242524487 | erot = 1.46623278030137 | epot = -11.8640688761309 | etot = -8.13378367058465 +635000 ekin = 2.16101755721023 | erot = 1.39475566087719 | epot = -11.6895568877986 | etot = -8.13378366971122 +636000 ekin = 2.06475253332371 | erot = 1.32686506233873 | epot = -11.5254012642579 | etot = -8.13378366859544 +637000 ekin = 1.98973271037489 | erot = 1.26596624428898 | epot = -11.3894826221215 | etot = -8.1337836674576 +638000 ekin = 1.95146778322825 | erot = 1.21514985243662 | epot = -11.3004013022987 | etot = -8.13378366663381 +639000 ekin = 1.96182069136293 | erot = 1.17695161175979 | epot = -11.272555969308 | etot = -8.13378366618532 +640000 ekin = 2.02679898932639 | erot = 1.15239183903012 | epot = -11.3129744949322 | etot = -8.13378366657568 +641000 ekin = 2.14199910312227 | erot = 1.14071086556531 | epot = -11.4164936363349 | etot = -8.13378366764727 +642000 ekin = 2.29285046318152 | erot = 1.13915186811449 | epot = -11.5657860007545 | etot = -8.13378366945849 +643000 ekin = 2.45552552112392 | erot = 1.14338828233112 | epot = -11.7326974750702 | etot = -8.13378367161514 +644000 ekin = 2.60133752583305 | erot = 1.14835367490429 | epot = -11.8834748743272 | etot = -8.1337836735899 +645000 ekin = 2.70371430392415 | erot = 1.14938437136379 | epot = -11.9868823501667 | etot = -8.1337836748788 +646000 ekin = 2.744636075582 | erot = 1.14332224209664 | epot = -12.0217419928935 | etot = -8.13378367521483 +647000 ekin = 2.71817787236065 | erot = 1.12915792946784 | epot = -11.9811194764621 | etot = -8.13378367463366 +648000 ekin = 2.63028246065005 | erot = 1.10798613625818 | epot = -11.872052270303 | etot = -8.13378367339473 +649000 ekin = 2.49559189346646 | erot = 1.08245328244387 | epot = -11.7118288477749 | etot = -8.13378367186454 +650000 ekin = 2.33293161554164 | erot = 1.05592857135036 | epot = -11.5226438572628 | etot = -8.13378367037085 +651000 ekin = 2.16312160403298 | erot = 1.03179243268154 | epot = -11.3286977053646 | etot = -8.13378366865011 +652000 ekin = 2.00437764472146 | erot = 1.01263346474868 | epot = -11.1507947776017 | etot = -8.13378366813157 +653000 ekin = 1.86320148187803 | erot = 0.999771298662386 | epot = -10.9967564484983 | etot = -8.13378366795787 +654000 ekin = 1.74159938814689 | erot = 0.993638993393247 | epot = -10.8690220495596 | etot = -8.13378366801952 +655000 ekin = 1.63877614369039 | erot = 0.99396111060154 | epot = -10.7665209224779 | etot = -8.13378366818596 +656000 ekin = 1.55293696393068 | erot = 0.999977751464522 | epot = -10.6866983837236 | etot = -8.1337836683284 +657000 ekin = 1.4830110556397 | erot = 1.01069155837519 | epot = -10.6274862823631 | etot = -8.13378366834819 +658000 ekin = 1.42991653831793 | erot = 1.02511295990871 | epot = -10.5888131664256 | etot = -8.13378366819894 +659000 ekin = 1.39703562132026 | erot = 1.04246417552511 | epot = -10.5732834647551 | etot = -8.13378366790973 +660000 ekin = 1.38964145709929 | erot = 1.06228082947049 | epot = -10.5857059541379 | etot = -8.13378366756814 +661000 ekin = 1.41337783438477 | erot = 1.08434723256929 | epot = -10.6315087343526 | etot = -8.13378366739853 +662000 ekin = 1.47169034616437 | erot = 1.10850483082505 | epot = -10.7139788445443 | etot = -8.13378366755489 +663000 ekin = 1.56097330111961 | erot = 1.13389735843563 | epot = -10.828654328347 | etot = -8.13378366879182 +664000 ekin = 1.66624490138187 | erot = 1.15850228666744 | epot = -10.9585308577766 | etot = -8.13378366972733 +665000 ekin = 1.77303863682182 | erot = 1.18152952432618 | epot = -11.0883518319651 | etot = -8.13378367081709 +666000 ekin = 1.86640057268967 | erot = 1.20258304574751 | epot = -11.2027672900294 | etot = -8.13378367159224 +667000 ekin = 1.93466412848224 | erot = 1.22193419207504 | epot = -11.2903819923641 | etot = -8.13378367180684 +668000 ekin = 1.97306030167035 | erot = 1.24062017116845 | epot = -11.3474641442683 | etot = -8.13378367142951 +669000 ekin = 1.98443783023637 | erot = 1.26004202124033 | epot = -11.378263522163 | etot = -8.13378367068634 +670000 ekin = 1.9765286197099 | erot = 1.28134194904741 | epot = -11.3916542389414 | etot = -8.13378367018408 +671000 ekin = 1.9564957951922 | erot = 1.30490078083266 | epot = -11.3951802458008 | etot = -8.13378366977592 +672000 ekin = 1.92875532537167 | erot = 1.33065660863054 | epot = -11.393195603566 | etot = -8.13378366956377 +673000 ekin = 1.89553670247147 | erot = 1.35854540535517 | epot = -11.3878657772974 | etot = -8.13378366947073 +674000 ekin = 1.85764904382712 | erot = 1.38884570045576 | epot = -11.3802784136313 | etot = -8.13378366934839 +675000 ekin = 1.81704545026849 | erot = 1.42228413605197 | epot = -11.3731132555849 | etot = -8.13378366926441 +676000 ekin = 1.7750503131025 | erot = 1.45971003523414 | epot = -11.3685440174361 | etot = -8.13378366909944 +677000 ekin = 1.73347451743517 | erot = 1.50191216833304 | epot = -11.3691703547236 | etot = -8.13378366895543 +678000 ekin = 1.69449339360511 | erot = 1.54922606358681 | epot = -11.3775031261123 | etot = -8.13378366892035 +679000 ekin = 1.65969071094794 | erot = 1.60118456838311 | epot = -11.3946589483665 | etot = -8.13378366903543 +680000 ekin = 1.62957005382932 | erot = 1.65634116858653 | epot = -11.4196948917059 | etot = -8.13378366929006 +681000 ekin = 1.60362252577982 | erot = 1.71228358652976 | epot = -11.4496897819403 | etot = -8.13378366963076 +682000 ekin = 1.58083074253738 | erot = 1.7658282644008 | epot = -11.4804426769224 | etot = -8.13378366998426 +683000 ekin = 1.56032431136392 | erot = 1.8133847914997 | epot = -11.5074927731469 | etot = -8.13378367028329 +684000 ekin = 1.54183455725445 | erot = 1.85142632174186 | epot = -11.5270445498266 | etot = -8.13378367083033 +685000 ekin = 1.52410759949766 | erot = 1.87642082988534 | epot = -11.5343121005203 | etot = -8.13378367113729 +686000 ekin = 1.50494379430242 | erot = 1.88570070119914 | epot = -11.5244281669065 | etot = -8.13378367140491 +687000 ekin = 1.48208036602769 | erot = 1.87831367884654 | epot = -11.4941777164845 | etot = -8.13378367161027 +688000 ekin = 1.45289287171996 | erot = 1.85497856866512 | epot = -11.4416551120323 | etot = -8.13378367164724 +689000 ekin = 1.41601907826432 | erot = 1.8181143734901 | epot = -11.3679171230975 | etot = -8.1337836713431 +690000 ekin = 1.37394775598182 | erot = 1.77166312492028 | epot = -11.2793945514636 | etot = -8.13378367056153 +691000 ekin = 1.33508615019417 | erot = 1.72071496355898 | epot = -11.1895847830891 | etot = -8.13378366933599 +692000 ekin = 1.31344376450669 | erot = 1.67094159749672 | epot = -11.1181690299549 | etot = -8.13378366795151 +693000 ekin = 1.32488046337475 | erot = 1.62783697437785 | epot = -11.0865011046416 | etot = -8.13378366688899 +694000 ekin = 1.38078608497536 | erot = 1.59583179973088 | epot = -11.1104015513359 | etot = -8.13378366662966 +695000 ekin = 1.48192861174078 | erot = 1.57745304982384 | epot = -11.1931653289766 | etot = -8.13378366741196 +696000 ekin = 1.61569966760638 | erot = 1.57278041423419 | epot = -11.3222637509355 | etot = -8.13378366909492 +697000 ekin = 1.75843097203778 | erot = 1.57943520716472 | epot = -11.4716498504213 | etot = -8.13378367121885 +698000 ekin = 1.88185215222092 | erot = 1.59316882058948 | epot = -11.6088046459987 | etot = -8.13378367318828 +699000 ekin = 1.96106579204364 | erot = 1.6089630633681 | epot = -11.7038125298792 | etot = -8.13378367446748 +700000 ekin = 1.98131680913957 | erot = 1.62236339276214 | epot = -11.7374638766332 | etot = -8.13378367473148 +701000 ekin = 1.94164145669884 | erot = 1.6306282568673 | epot = -11.7060533875213 | etot = -8.13378367395514 +702000 ekin = 1.85450233235272 | erot = 1.63328569355592 | epot = -11.6215716983308 | etot = -8.13378367242212 +703000 ekin = 1.7418140490781 | erot = 1.63189519933292 | epot = -11.5074929188567 | etot = -8.13378367044569 +704000 ekin = 1.62890053404882 | erot = 1.6293262484493 | epot = -11.3920104513919 | etot = -8.13378366889381 +705000 ekin = 1.53704055738389 | erot = 1.6282829775182 | epot = -11.299107202664 | etot = -8.13378366776194 +706000 ekin = 1.48137553865796 | erot = 1.63090498235445 | epot = -11.2460641881485 | etot = -8.13378366713611 +707000 ekin = 1.47012654301194 | erot = 1.63856880545727 | epot = -11.2424790154184 | etot = -8.13378366694916 +708000 ekin = 1.50545482973272 | erot = 1.65189802615415 | epot = -11.2911365229591 | etot = -8.1337836670722 +709000 ekin = 1.58434919626737 | erot = 1.67079586465923 | epot = -11.3889287286485 | etot = -8.13378366772192 +710000 ekin = 1.69830399771202 | erot = 1.6942063928158 | epot = -11.5262940590363 | etot = -8.13378366850847 +711000 ekin = 1.83638650826424 | erot = 1.72024670598225 | epot = -11.6904168837644 | etot = -8.13378366951786 +712000 ekin = 1.98510691897145 | erot = 1.74609277613641 | epot = -11.8649833659246 | etot = -8.13378367081678 +713000 ekin = 2.12899307618644 | erot = 1.7680461105034 | epot = -12.0308228587421 | etot = -8.13378367205223 +714000 ekin = 2.25375007879498 | erot = 1.7824326423488 | epot = -12.1699663939697 | etot = -8.13378367282589 +715000 ekin = 2.34975342441665 | erot = 1.78632122215087 | epot = -12.2698583198712 | etot = -8.13378367330363 +716000 ekin = 2.41256025262349 | erot = 1.77808812755726 | epot = -12.3244320533565 | etot = -8.13378367317575 +717000 ekin = 2.444747705476 | erot = 1.75804788175171 | epot = -12.3365792597721 | etot = -8.13378367254438 +718000 ekin = 2.45412216709769 | erot = 1.72831089168567 | epot = -12.3162167308183 | etot = -8.13378367203498 +719000 ekin = 2.44845378811745 | erot = 1.69204638293305 | epot = -12.2742838422258 | etot = -8.13378367117532 +720000 ekin = 2.43656682430699 | erot = 1.653290129109 | epot = -12.2236406239898 | etot = -8.13378367057385 +721000 ekin = 2.42365620512495 | erot = 1.61605001928987 | epot = -12.1734898947957 | etot = -8.13378367038088 +722000 ekin = 2.40904119938158 | erot = 1.58378410659312 | epot = -12.1266089765732 | etot = -8.13378367059853 +723000 ekin = 2.3864714698943 | erot = 1.55915433553323 | epot = -12.0794094764985 | etot = -8.13378367107095 +724000 ekin = 2.34659230996706 | erot = 1.54397640928961 | epot = -12.0243523907976 | etot = -8.13378367154094 +725000 ekin = 2.28077035574305 | erot = 1.53931973020303 | epot = -11.9538737576909 | etot = -8.13378367174481 +726000 ekin = 2.18489434266674 | erot = 1.54571264604936 | epot = -11.8643906602243 | etot = -8.13378367150821 +727000 ekin = 2.06179491770445 | erot = 1.56339646494477 | epot = -11.7589750534567 | etot = -8.13378367080751 +728000 ekin = 1.92142302763715 | erot = 1.59252552388938 | epot = -11.6477322213166 | etot = -8.13378366979011 +729000 ekin = 1.77863161459794 | erot = 1.63318133799263 | epot = -11.5455966213271 | etot = -8.13378366873648 +730000 ekin = 1.64935549787291 | erot = 1.68520345518385 | epot = -11.4683426210401 | etot = -8.13378366798338 +731000 ekin = 1.54617340799689 | erot = 1.74777370763628 | epot = -11.4277307834043 | etot = -8.13378366777111 +732000 ekin = 1.47444012325245 | erot = 1.81876025838851 | epot = -11.4269840497906 | etot = -8.13378366814959 +733000 ekin = 1.43189319813654 | erot = 1.89484027034483 | epot = -11.4605171374844 | etot = -8.13378366900304 +734000 ekin = 1.41017780820787 | erot = 1.9717467742621 | epot = -11.5157082525372 | etot = -8.13378367006727 +735000 ekin = 1.39820849324681 | erot = 2.04483940824086 | epot = -11.5768315724998 | etot = -8.13378367101211 +736000 ekin = 1.38628872342963 | erot = 2.1098536340319 | epot = -11.629926029011 | etot = -8.13378367154951 +737000 ekin = 1.36961596692138 | erot = 2.16355925928473 | epot = -11.666958897757 | etot = -8.13378367155092 +738000 ekin = 1.34981044643678 | erot = 2.20404797657756 | epot = -11.6876420941275 | etot = -8.13378367111314 +739000 ekin = 1.33372653200929 | erot = 2.23055395776276 | epot = -11.6980641602756 | etot = -8.13378367050359 +740000 ekin = 1.3301641929815 | erot = 2.24303198933214 | epot = -11.7069798523032 | etot = -8.13378366998951 +741000 ekin = 1.34641052650463 | erot = 2.2418933687733 | epot = -11.7220875649558 | etot = -8.13378366967791 +742000 ekin = 1.38645577649994 | erot = 2.22809836951193 | epot = -11.7483378155421 | etot = -8.13378366953023 +743000 ekin = 1.45103879195972 | erot = 2.20332817129236 | epot = -11.78815063276 | etot = -8.13378366950794 +744000 ekin = 1.53803120218704 | erot = 2.16985299830389 | epot = -11.8416678701947 | etot = -8.13378366970373 +745000 ekin = 1.64150939164163 | erot = 2.12988595975433 | epot = -11.9051790216537 | etot = -8.13378367025773 +746000 ekin = 1.75074962764797 | erot = 2.084703178296 | epot = -11.9692364772113 | etot = -8.1337836712673 +747000 ekin = 1.84985303111399 | erot = 2.03398729131739 | epot = -12.0176239950727 | etot = -8.13378367264135 +748000 ekin = 1.91944439124215 | erot = 1.97579729236821 | epot = -12.0290253576846 | etot = -8.13378367407423 +749000 ekin = 1.94080211587345 | erot = 1.90728805389936 | epot = -11.9818738448716 | etot = -8.13378367509876 +750000 ekin = 1.90175708676013 | erot = 1.82602227398459 | epot = -11.8615630358879 | etot = -8.13378367514313 +751000 ekin = 1.80442251329281 | erot = 1.73210123664164 | epot = -11.6703074242648 | etot = -8.1337836743303 +752000 ekin = 1.66438096328043 | erot = 1.62791173823168 | epot = -11.4260763737933 | etot = -8.13378367228118 +753000 ekin = 1.50959112394011 | erot = 1.51791168435355 | epot = -11.1612864778764 | etot = -8.13378366958272 +754000 ekin = 1.37530205555393 | erot = 1.40846180207067 | epot = -10.9175475248678 | etot = -8.13378366724317 +755000 ekin = 1.29223158174511 | erot = 1.30628357856271 | epot = -10.7322988261904 | etot = -8.13378366588257 +756000 ekin = 1.27251368864282 | erot = 1.21592403401268 | epot = -10.6222213891157 | etot = -8.13378366646025 +757000 ekin = 1.30634776760893 | erot = 1.13861892039767 | epot = -10.5787503559391 | etot = -8.13378366793255 +758000 ekin = 1.37185376254112 | erot = 1.07351073769267 | epot = -10.5791481697238 | etot = -8.13378366949005 +759000 ekin = 1.44617278830652 | erot = 1.01897341841095 | epot = -10.5989298771961 | etot = -8.13378367047867 +760000 ekin = 1.51270256478521 | erot = 0.973207034201279 | epot = -10.6196932701063 | etot = -8.13378367111983 +761000 ekin = 1.56039612701659 | erot = 0.934439072310183 | epot = -10.6286188703599 | etot = -8.13378367103315 +762000 ekin = 1.58948756763392 | erot = 0.901622731963786 | epot = -10.6248939700571 | etot = -8.13378367045936 +763000 ekin = 1.6081000860162 | erot = 0.874391507873671 | epot = -10.6162752635655 | etot = -8.13378366967559 +764000 ekin = 1.62768531422658 | erot = 0.85268931978755 | epot = -10.6141583029787 | etot = -8.13378366896457 +765000 ekin = 1.65693698084451 | erot = 0.836745239155022 | epot = -10.6274658895786 | etot = -8.13378366957904 +766000 ekin = 1.70304081024591 | erot = 0.827639758108534 | epot = -10.6644642391042 | etot = -8.13378367074981 +767000 ekin = 1.76603010804118 | erot = 0.819745786937045 | epot = -10.719559566307 | etot = -8.13378367132874 +768000 ekin = 1.83976621727053 | erot = 0.813915606764605 | epot = -10.7874654957395 | etot = -8.13378367170441 +769000 ekin = 1.91953928655326 | erot = 0.809315266601798 | epot = -10.8626382251549 | etot = -8.13378367199988 +770000 ekin = 2.00068337351142 | erot = 0.805269377200869 | epot = -10.9397364229424 | etot = -8.13378367223007 +771000 ekin = 2.0793260708754 | erot = 0.801470015544521 | epot = -11.0145797587906 | etot = -8.1337836723707 +772000 ekin = 2.15218258758158 | erot = 0.797728511847476 | epot = -11.0836947720041 | etot = -8.13378367257508 +773000 ekin = 2.215163463711 | erot = 0.793769932168822 | epot = -11.1427170688048 | etot = -8.13378367292501 +774000 ekin = 2.26234547299599 | erot = 0.789120208329084 | epot = -11.1852493547345 | etot = -8.13378367340947 +775000 ekin = 2.2874744000011 | erot = 0.782940858124726 | epot = -11.2041989316363 | etot = -8.13378367351048 +776000 ekin = 2.28487294056893 | erot = 0.774236455836067 | epot = -11.1928930694771 | etot = -8.13378367307206 +777000 ekin = 2.25459623259119 | erot = 0.763986238603041 | epot = -11.1523661447046 | etot = -8.13378367351038 +778000 ekin = 2.19483848049885 | erot = 0.752926118481735 | epot = -11.0815482726377 | etot = -8.13378367365716 +779000 ekin = 2.10207554487688 | erot = 0.741428699342712 | epot = -10.977287917918 | etot = -8.13378367369838 +780000 ekin = 1.97507844669044 | erot = 0.730439747664591 | epot = -10.8393018678568 | etot = -8.13378367350181 +781000 ekin = 1.81624237984421 | erot = 0.720681720728676 | epot = -10.6707077731406 | etot = -8.1337836725677 +782000 ekin = 1.63737679986566 | erot = 0.713965531361904 | epot = -10.4851260026997 | etot = -8.13378367147211 +783000 ekin = 1.45327094387194 | erot = 0.712334775531163 | epot = -10.2993893897495 | etot = -8.13378367034642 +784000 ekin = 1.27931304177932 | erot = 0.717795316544328 | epot = -10.1308920276493 | etot = -8.1337836693256 +785000 ekin = 1.12953341818588 | erot = 0.732133377036545 | epot = -9.99545046375494 | etot = -8.13378366853252 +786000 ekin = 1.01482431807516 | erot = 0.75676028119027 | epot = -9.90536826732165 | etot = -8.13378366805622 +787000 ekin = 0.941643963861821 | erot = 0.792599099777889 | epot = -9.86802673157384 | etot = -8.13378366793413 +788000 ekin = 0.911510796364499 | erot = 0.840020856535235 | epot = -9.88531532103858 | etot = -8.13378366813885 +789000 ekin = 0.921376349366559 | erot = 0.898827357285067 | epot = -9.95398737525229 | etot = -8.13378366860067 +790000 ekin = 0.964654482908816 | erot = 0.968273092073714 | epot = -10.0667112442091 | etot = -8.13378366922659 +791000 ekin = 1.03261133424169 | erot = 1.04710148108381 | epot = -10.2134964852509 | etot = -8.13378366992542 +792000 ekin = 1.11580285054382 | erot = 1.1335694535575 | epot = -10.3831559747086 | etot = -8.13378367060725 +793000 ekin = 1.20528065134038 | erot = 1.22546277764693 | epot = -10.564527100244 | etot = -8.13378367125664 +794000 ekin = 1.29310700795432 | erot = 1.32020213138516 | epot = -10.7470928111702 | etot = -8.13378367183071 +795000 ekin = 1.37238467366043 | erot = 1.41513363975781 | epot = -10.9213019889647 | etot = -8.13378367554646 +796000 ekin = 1.40835913071784 | erot = 1.52971390350303 | epot = -11.0718567048725 | etot = -8.13378367065163 +797000 ekin = 1.45167190325032 | erot = 1.62512604237268 | epot = -11.2105816179767 | etot = -8.13378367235371 +798000 ekin = 1.48145722831594 | erot = 1.70064689495524 | epot = -11.315887795752 | etot = -8.13378367248079 +799000 ekin = 1.49559633326826 | erot = 1.76394329939591 | epot = -11.3933233050887 | etot = -8.13378367242451 +800000 ekin = 1.49744893756744 | erot = 1.81327291257992 | epot = -11.4445055223208 | etot = -8.1337836721734 +801000 ekin = 1.49251279282898 | erot = 1.84780559274824 | epot = -11.474102057282 | etot = -8.13378367170478 +802000 ekin = 1.48820480029175 | erot = 1.86779013866172 | epot = -11.4897786100697 | etot = -8.13378367111621 +803000 ekin = 1.49253566042202 | erot = 1.87451451169702 | epot = -11.5008338427093 | etot = -8.13378367059025 +804000 ekin = 1.51166035431581 | erot = 1.86997050314966 | epot = -11.5154145278029 | etot = -8.1337836703374 +805000 ekin = 1.54725262775303 | erot = 1.85635941634672 | epot = -11.5373957145955 | etot = -8.13378367049578 +806000 ekin = 1.59533620639011 | erot = 1.83572111155612 | epot = -11.564840988593 | etot = -8.13378367064673 +807000 ekin = 1.64925672169128 | erot = 1.81037056530018 | epot = -11.5934109583748 | etot = -8.13378367138333 +808000 ekin = 1.69787116914676 | erot = 1.78132459589074 | epot = -11.6129794371364 | etot = -8.13378367209885 +809000 ekin = 1.73004744232766 | erot = 1.74897468678329 | epot = -11.6128058016954 | etot = -8.1337836725845 +810000 ekin = 1.73831051801208 | erot = 1.71353607858786 | epot = -11.5856302703687 | etot = -8.13378367376877 +811000 ekin = 1.71623548897176 | erot = 1.67428462341833 | epot = -11.5243037859089 | etot = -8.1337836735188 +812000 ekin = 1.66416936451911 | erot = 1.6311516443523 | epot = -11.4291046817249 | etot = -8.1337836728535 +813000 ekin = 1.59176171307477 | erot = 1.58513406243779 | epot = -11.310679447357 | etot = -8.13378367184445 +814000 ekin = 1.51369575692981 | erot = 1.53752063411804 | epot = -11.1850000616811 | etot = -8.13378367063321 +815000 ekin = 1.44735421380952 | erot = 1.48989097525174 | epot = -11.071028858495 | etot = -8.13378366943376 +816000 ekin = 1.40949972398155 | erot = 1.44406671642419 | epot = -10.9873501088976 | etot = -8.13378366849187 +817000 ekin = 1.41268037621161 | erot = 1.40200084694727 | epot = -10.9484648911793 | etot = -8.13378366802041 +818000 ekin = 1.46212175579676 | erot = 1.36558649857796 | epot = -10.9614919225081 | etot = -8.13378366813336 +819000 ekin = 1.55434977585278 | erot = 1.336454660745 | epot = -11.0245881053256 | etot = -8.13378366872777 +820000 ekin = 1.67879137036297 | erot = 1.31590146922143 | epot = -11.1284765091675 | etot = -8.13378366958314 +821000 ekin = 1.82107935884616 | erot = 1.30489182432771 | epot = -11.2597548536193 | etot = -8.13378367044544 +822000 ekin = 1.9529446672913 | erot = 1.31620699209334 | epot = -11.4029353289519 | etot = -8.13378366956727 +823000 ekin = 2.07449183310668 | erot = 1.34466437793314 | epot = -11.5529398817822 | etot = -8.13378367074238 +824000 ekin = 2.19907919113028 | erot = 1.36469015638506 | epot = -11.6975530185003 | etot = -8.13378367098496 +825000 ekin = 2.30563380742784 | erot = 1.39476757368218 | epot = -11.8341850523186 | etot = -8.13378367120861 +826000 ekin = 2.39103700944343 | erot = 1.43354131849664 | epot = -11.9583619997604 | etot = -8.13378367182035 +827000 ekin = 2.44908730441079 | erot = 1.47824975100237 | epot = -12.0611207278221 | etot = -8.13378367240897 +828000 ekin = 2.47400495198267 | erot = 1.52536858867821 | epot = -12.1331572137293 | etot = -8.13378367306841 +829000 ekin = 2.46026919533199 | erot = 1.57083290047245 | epot = -12.1648857694072 | etot = -8.13378367360277 +830000 ekin = 2.40417117554425 | erot = 1.61070673365405 | epot = -12.1486615829917 | etot = -8.13378367379336 +831000 ekin = 2.30626797389012 | erot = 1.64206892762421 | epot = -12.0821205749624 | etot = -8.13378367344809 +832000 ekin = 2.17314973465443 | erot = 1.66378895326424 | epot = -11.970722360519 | etot = -8.13378367260036 +833000 ekin = 2.0166788300711 | erot = 1.67684011585974 | epot = -11.8273026173371 | etot = -8.13378367140623 +834000 ekin = 1.85232718449021 | erot = 1.68370832890753 | epot = -11.6698191834907 | etot = -8.13378367009299 +835000 ekin = 1.6961628249867 | erot = 1.68768571762743 | epot = -11.5176322117046 | etot = -8.13378366909043 +836000 ekin = 1.56059049298033 | erot = 1.69176136007029 | epot = -11.3861355304923 | etot = -8.13378367744166 +837000 ekin = 1.46494691496556 | erot = 1.67922598580687 | epot = -11.2779565658808 | etot = -8.13378366510835 +838000 ekin = 1.41623376459279 | erot = 1.68359587929023 | epot = -11.2336133181403 | etot = -8.13378367425731 +839000 ekin = 1.38164226014501 | erot = 1.69827238735174 | epot = -11.2136983221133 | etot = -8.13378367461659 +840000 ekin = 1.37281419718589 | erot = 1.71791872249748 | epot = -11.2245165947878 | etot = -8.13378367510438 +841000 ekin = 1.38251849199312 | erot = 1.74222357843919 | epot = -11.2585257460257 | etot = -8.1337836755934 +842000 ekin = 1.40440815950989 | erot = 1.77053653194949 | epot = -11.3087283675096 | etot = -8.1337836760502 +843000 ekin = 1.43288889939346 | erot = 1.80208713639206 | epot = -11.36875971227 | etot = -8.13378367648447 +844000 ekin = 1.46337505833392 | erot = 1.83581425241861 | epot = -11.4329729876798 | etot = -8.13378367692722 +845000 ekin = 1.49225138986042 | erot = 1.87011931161695 | epot = -11.4961543788775 | etot = -8.13378367740011 +846000 ekin = 1.51675477488435 | erot = 1.90271354937653 | epot = -11.5532520021354 | etot = -8.13378367787456 +847000 ekin = 1.53514567596946 | erot = 1.93076451186911 | epot = -11.5996938660634 | etot = -8.13378367822481 +848000 ekin = 1.5475881716074 | erot = 1.9514972978589 | epot = -11.632869147723 | etot = -8.1337836782567 +849000 ekin = 1.55740275322743 | erot = 1.9631393326447 | epot = -11.6543257637317 | etot = -8.13378367785955 +850000 ekin = 1.57132389425342 | erot = 1.96572299080043 | epot = -11.6708305622391 | etot = -8.13378367718525 +851000 ekin = 1.59707563447322 | erot = 1.96110149884602 | epot = -11.6919608099609 | etot = -8.13378367664163 +852000 ekin = 1.63865350802047 | erot = 1.95197424600859 | epot = -11.7244114307046 | etot = -8.1337836766755 +853000 ekin = 1.69191652794579 | erot = 1.94037118794228 | epot = -11.76607139336 | etot = -8.13378367747194 +854000 ekin = 1.74370784126291 | erot = 1.92645693876828 | epot = -11.8039484587425 | etot = -8.13378367871129 +855000 ekin = 1.77620146931273 | erot = 1.90847432072674 | epot = -11.818459469993 | etot = -8.13378367995357 +856000 ekin = 1.77433273173135 | erot = 1.88315818040523 | epot = -11.7912745926414 | etot = -8.13378368050482 +857000 ekin = 1.73346273143704 | erot = 1.84735528760624 | epot = -11.7146016990445 | etot = -8.13378368000122 +858000 ekin = 1.66317903320086 | erot = 1.79946643714417 | epot = -11.5964291488827 | etot = -8.13378367853766 +859000 ekin = 1.58513293484139 | erot = 1.74007953892668 | epot = -11.458996150389 | etot = -8.13378367662096 +860000 ekin = 1.52581941755169 | erot = 1.67168470790424 | epot = -11.331287800361 | etot = -8.1337836749051 +861000 ekin = 1.50775028697231 | erot = 1.59782760957668 | epot = -11.2393615704181 | etot = -8.1337836738691 +862000 ekin = 1.54306866341494 | erot = 1.52225954455881 | epot = -11.1991118816238 | etot = -8.13378367365005 +863000 ekin = 1.63171594645684 | erot = 1.4484512777512 | epot = -11.2139508982985 | etot = -8.13378367409045 +864000 ekin = 1.76367870734132 | erot = 1.37946094103656 | epot = -11.2769233232937 | etot = -8.13378367491581 +865000 ekin = 1.92306453000344 | erot = 1.31796433803999 | epot = -11.374812543916 | etot = -8.13378367587256 +866000 ekin = 2.09215456398996 | erot = 1.26628926074898 | epot = -11.4922275013027 | etot = -8.13378367656379 +867000 ekin = 2.25558706658228 | erot = 1.22649711213513 | epot = -11.6158678560148 | etot = -8.13378367729736 +868000 ekin = 2.40057443601768 | erot = 1.20017706609103 | epot = -11.7345351799089 | etot = -8.13378367780019 +869000 ekin = 2.51819395230402 | erot = 1.18842551997292 | epot = -11.8404031503536 | etot = -8.13378367807667 +870000 ekin = 2.60380767640006 | erot = 1.19178595733222 | epot = -11.9293773119552 | etot = -8.13378367822295 +871000 ekin = 2.65597330550025 | erot = 1.2100890019769 | epot = -11.9998459858056 | etot = -8.13378367832845 +872000 ekin = 2.67413391804158 | erot = 1.24223617488104 | epot = -12.0501537716578 | etot = -8.13378367873519 +873000 ekin = 2.65523813357981 | erot = 1.28590823790636 | epot = -12.0749300508519 | etot = -8.13378367936569 +874000 ekin = 2.59426343770237 | erot = 1.33769628220084 | epot = -12.0657433999318 | etot = -8.13378368002863 +875000 ekin = 2.48661885037869 | erot = 1.39359938802698 | epot = -12.0140019187687 | etot = -8.13378368036305 +876000 ekin = 2.3325716344682 | erot = 1.44985984558333 | epot = -11.9162151600516 | etot = -8.13378368000003 +877000 ekin = 2.14151731726319 | erot = 1.50380376851767 | epot = -11.7791047646106 | etot = -8.13378367882977 +878000 ekin = 1.9328320049617 | erot = 1.55419737766281 | epot = -11.6208130598149 | etot = -8.13378367719035 +879000 ekin = 1.7311757375338 | erot = 1.60084517557068 | epot = -11.4658045888545 | etot = -8.13378367575007 +880000 ekin = 1.55787151453529 | erot = 1.64373016650857 | epot = -11.3353853561002 | etot = -8.13378367505636 +881000 ekin = 1.42384142286017 | erot = 1.68244604710334 | epot = -11.2400711450968 | etot = -8.13378367513324 +882000 ekin = 1.32893688630863 | erot = 1.71640874325353 | epot = -11.1791293051203 | etot = -8.13378367555812 +883000 ekin = 1.26714280246917 | erot = 1.74554143071219 | epot = -11.1464679089137 | etot = -8.13378367573232 +884000 ekin = 1.23268823978927 | erot = 1.77071758428828 | epot = -11.1371895000291 | etot = -8.13378367595158 +885000 ekin = 1.22008849612494 | erot = 1.7931216686051 | epot = -11.1469938408411 | etot = -8.13378367611103 +886000 ekin = 1.2253247993799 | erot = 1.81382116066767 | epot = -11.1729296362917 | etot = -8.13378367624409 +887000 ekin = 1.24494548115686 | erot = 1.8333603965884 | epot = -11.2120895542136 | etot = -8.13378367646834 +888000 ekin = 1.27500212875267 | erot = 1.85168867131358 | epot = -11.2604744768214 | etot = -8.13378367675513 +889000 ekin = 1.31152735197782 | erot = 1.86844690158133 | epot = -11.3137579306675 | etot = -8.13378367710839 +890000 ekin = 1.34986317506705 | erot = 1.88304641086648 | epot = -11.366693263463 | etot = -8.13378367752949 +891000 ekin = 1.38390530402723 | erot = 1.89468392941472 | epot = -11.4123729115327 | etot = -8.13378367809074 +892000 ekin = 1.4056939593949 | erot = 1.90226748680413 | epot = -11.4417451252141 | etot = -8.13378367901505 +893000 ekin = 1.40448288905364 | erot = 1.90432470807527 | epot = -11.4425912768364 | etot = -8.13378367970753 +894000 ekin = 1.37144289320793 | erot = 1.89954369080315 | epot = -11.4047702640041 | etot = -8.13378367999306 +895000 ekin = 1.30348485852156 | erot = 1.88750423015747 | epot = -11.3247727648586 | etot = -8.13378367617955 +896000 ekin = 1.22187336955615 | erot = 1.87071061704799 | epot = -11.2263676621213 | etot = -8.13378367551712 +897000 ekin = 1.14754845755141 | erot = 1.85263803873205 | epot = -11.1339701707916 | etot = -8.13378367450818 +898000 ekin = 1.08944016629691 | erot = 1.83653761360572 | epot = -11.0597614538287 | etot = -8.13378367392606 +899000 ekin = 1.05403951151006 | erot = 1.82413022658184 | epot = -11.0119534116858 | etot = -8.13378367359388 +900000 ekin = 1.04500203344446 | erot = 1.81619426344812 | epot = -10.994979970496 | etot = -8.13378367360344 +901000 ekin = 1.06222206934733 | erot = 1.8123440310837 | epot = -11.0083497743595 | etot = -8.13378367392844 +902000 ekin = 1.10209713935283 | erot = 1.81111462916561 | epot = -11.0469954429736 | etot = -8.13378367445512 +903000 ekin = 1.15876030908375 | erot = 1.81037876576567 | epot = -11.1029227498814 | etot = -8.133783675032 +904000 ekin = 1.22532881863849 | erot = 1.80797942318881 | epot = -11.1670919177971 | etot = -8.13378367596983 +905000 ekin = 1.29206809096935 | erot = 1.80250391199268 | epot = -11.2283556794293 | etot = -8.13378367646727 +906000 ekin = 1.35183435815479 | erot = 1.79300035919243 | epot = -11.2786183941064 | etot = -8.13378367675922 +907000 ekin = 1.3997999182264 | erot = 1.77946415971456 | epot = -11.3130477549044 | etot = -8.13378367696348 +908000 ekin = 1.43268044790834 | erot = 1.76253539555357 | epot = -11.3289995204751 | etot = -8.13378367701317 +909000 ekin = 1.44897967363112 | erot = 1.74341748034194 | epot = -11.3261808308616 | etot = -8.13378367688856 +910000 ekin = 1.44937912475448 | erot = 1.72390580409483 | epot = -11.3070686054089 | etot = -8.13378367655958 +911000 ekin = 1.43727653989154 | erot = 1.70617572380865 | epot = -11.2772359397525 | etot = -8.13378367605232 +912000 ekin = 1.41843448636244 | erot = 1.69263823222815 | epot = -11.2448563940395 | etot = -8.13378367544888 +913000 ekin = 1.40006194548143 | erot = 1.68549440970377 | epot = -11.2193400300544 | etot = -8.13378367486918 +914000 ekin = 1.38958826580783 | erot = 1.68634774644355 | epot = -11.2097196867265 | etot = -8.13378367447512 +915000 ekin = 1.39244841973003 | erot = 1.69595180427737 | epot = -11.2221838984246 | etot = -8.13378367441721 +916000 ekin = 1.41015014804868 | erot = 1.71401831960836 | epot = -11.2579521424291 | etot = -8.13378367477205 +917000 ekin = 1.4392962972226 | erot = 1.73916764012751 | epot = -11.3122476128452 | etot = -8.13378367549508 +918000 ekin = 1.47227942866918 | erot = 1.76903078857887 | epot = -11.3750938936502 | etot = -8.13378367640215 +919000 ekin = 1.49986621796558 | erot = 1.80052098861358 | epot = -11.4341708837671 | etot = -8.13378367718791 +920000 ekin = 1.51501277126177 | erot = 1.83027923256497 | epot = -11.47907568142 | etot = -8.13378367759328 +921000 ekin = 1.50567012556585 | erot = 1.85806253127122 | epot = -11.4975163336852 | etot = -8.13378367684813 +922000 ekin = 1.50530570224327 | erot = 1.88405749197312 | epot = -11.5231468708389 | etot = -8.13378367662252 +923000 ekin = 1.51005072191376 | erot = 1.89398296774265 | epot = -11.5378173655129 | etot = -8.13378367585645 +924000 ekin = 1.52928061141758 | erot = 1.89561779711381 | epot = -11.5586820839691 | etot = -8.13378367543768 +925000 ekin = 1.56873673267864 | erot = 1.88910082656719 | epot = -11.5916212349651 | etot = -8.13378367571927 +926000 ekin = 1.62371911818097 | erot = 1.87429650776439 | epot = -11.6317993026299 | etot = -8.13378367668451 +927000 ekin = 1.67952368644808 | erot = 1.85068760938675 | epot = -11.6639949737938 | etot = -8.13378367795893 +928000 ekin = 1.71651231901818 | erot = 1.81783745876575 | epot = -11.6681334568181 | etot = -8.13378367903418 +929000 ekin = 1.71702542960752 | erot = 1.77614095786796 | epot = -11.6269500669844 | etot = -8.13378367950894 +930000 ekin = 1.67099557211838 | erot = 1.7274288922438 | epot = -11.5322081435662 | etot = -8.13378367920398 +931000 ekin = 1.57874461917618 | erot = 1.67513458289526 | epot = -11.3876628802403 | etot = -8.13378367816882 +932000 ekin = 1.4507920768008 | erot = 1.62392798760098 | epot = -11.2085037410289 | etot = -8.13378367662711 +933000 ekin = 1.30531755494448 | erot = 1.57894109498966 | epot = -11.018042324831 | etot = -8.1337836748969 +934000 ekin = 1.16422088167371 | erot = 1.54485802656028 | epot = -10.8428625815313 | etot = -8.13378367329727 +935000 ekin = 1.04864497283229 | erot = 1.52509209112999 | epot = -10.7075207361246 | etot = -8.13378367216232 +936000 ekin = 0.974709276492776 | erot = 1.52116328044459 | epot = -10.6296562286223 | etot = -8.13378367168494 +937000 ekin = 0.950462282016656 | erot = 1.53244919686212 | epot = -10.6166951508385 | etot = -8.13378367195971 +938000 ekin = 0.974421294284288 | erot = 1.55616007219735 | epot = -10.6643650394247 | etot = -8.13378367294306 +939000 ekin = 1.03606886900089 | erot = 1.58755449752601 | epot = -10.7574070409824 | etot = -8.13378367445547 +940000 ekin = 1.1182684113919 | erot = 1.62042989204406 | epot = -10.8724819796331 | etot = -8.13378367619717 +941000 ekin = 1.20122028724958 | erot = 1.64794232232013 | epot = -10.9829462873571 | etot = -8.13378367778742 +942000 ekin = 1.26717763839312 | erot = 1.66371923985981 | epot = -11.0646805571373 | etot = -8.13378367888438 +943000 ekin = 1.30509212601128 | erot = 1.66314531309206 | epot = -11.1020211182277 | etot = -8.13378367912435 +944000 ekin = 1.31392377996911 | erot = 1.64449670956111 | epot = -11.0922041680488 | etot = -8.13378367851861 +945000 ekin = 1.30237464540686 | erot = 1.60929976269543 | epot = -11.0454580854524 | etot = -8.13378367735008 +946000 ekin = 1.28506402585559 | erot = 1.56181036928443 | epot = -10.9806580712548 | etot = -8.13378367611474 +947000 ekin = 1.27634123306472 | erot = 1.50774431584928 | epot = -10.9178692241958 | etot = -8.13378367528185 +948000 ekin = 1.28467886384667 | erot = 1.45281196796929 | epot = -10.8712745068834 | etot = -8.13378367506747 +949000 ekin = 1.31037739966444 | erot = 1.4015724009042 | epot = -10.845733475945 | etot = -8.13378367537636 +950000 ekin = 1.34722619730445 | erot = 1.3568868930793 | epot = -10.8378967663129 | etot = -8.13378367592918 +951000 ekin = 1.38650860378931 | erot = 1.31991932975183 | epot = -10.8402116099744 | etot = -8.13378367643326 +952000 ekin = 1.42144708624314 | erot = 1.29081153328224 | epot = -10.8460422961592 | etot = -8.13378367663378 +953000 ekin = 1.44882630067214 | erot = 1.26905801004898 | epot = -10.8516679874738 | etot = -8.13378367675266 +954000 ekin = 1.46839021307718 | erot = 1.25288009019966 | epot = -10.8550539798531 | etot = -8.13378367657631 +955000 ekin = 1.48389177785595 | erot = 1.24071488980735 | epot = -10.8583903439438 | etot = -8.13378367628045 +956000 ekin = 1.50041047950534 | erot = 1.23152279455205 | epot = -10.8657169501392 | etot = -8.1337836760818 +957000 ekin = 1.52124213092013 | erot = 1.2248104773485 | epot = -10.879836284368 | etot = -8.13378367609941 +958000 ekin = 1.54632228820822 | erot = 1.22051885655829 | epot = -10.9006248210289 | etot = -8.13378367626243 +959000 ekin = 1.57324295712668 | erot = 1.21891909920002 | epot = -10.9259457327015 | etot = -8.13378367637477 +960000 ekin = 1.59969207344602 | erot = 1.22060655525412 | epot = -10.9540823050919 | etot = -8.13378367639174 +961000 ekin = 1.62253441996171 | erot = 1.22677322915566 | epot = -10.9830913253843 | etot = -8.13378367626691 +962000 ekin = 1.64127230147935 | erot = 1.23851880603448 | epot = -11.0135747836412 | etot = -8.13378367612736 +963000 ekin = 1.65616191466682 | erot = 1.25678968602508 | epot = -11.0467352768412 | etot = -8.13378367614927 +964000 ekin = 1.66566514854511 | erot = 1.28218253503938 | epot = -11.0816313598357 | etot = -8.13378367625117 +965000 ekin = 1.66770285430116 | erot = 1.31455464298714 | epot = -11.1160411738658 | etot = -8.13378367657753 +966000 ekin = 1.65810694854125 | erot = 1.35314679644672 | epot = -11.1450374218014 | etot = -8.13378367681348 +967000 ekin = 1.63401913508899 | erot = 1.39653020178946 | epot = -11.1643330138152 | etot = -8.13378367693677 +968000 ekin = 1.59493850092154 | erot = 1.44254096564059 | epot = -11.1712631436315 | etot = -8.13378367706939 +969000 ekin = 1.54116623552017 | erot = 1.48830566532219 | epot = -11.1632555781849 | etot = -8.13378367734257 +970000 ekin = 1.47195250632947 | erot = 1.53048571049902 | epot = -11.1362218945415 | etot = -8.13378367771304 +971000 ekin = 1.38571362597403 | erot = 1.56593199201498 | epot = -11.0854292956026 | etot = -8.13378367761359 +972000 ekin = 1.2844612417634 | erot = 1.5927702433258 | epot = -11.0110151625437 | etot = -8.13378367745447 +973000 ekin = 1.17320808893134 | erot = 1.61049478745248 | epot = -10.9174865530745 | etot = -8.13378367669067 +974000 ekin = 1.063134217545 | erot = 1.62023440891558 | epot = -10.8171523018864 | etot = -8.13378367542583 +975000 ekin = 0.970987628511461 | erot = 1.62445058186299 | epot = -10.729221884475 | etot = -8.13378367410056 +976000 ekin = 0.913517833540499 | erot = 1.62592321100425 | epot = -10.6732247178428 | etot = -8.13378367329807 +977000 ekin = 0.900210296810119 | erot = 1.62660680819932 | epot = -10.6606007783876 | etot = -8.13378367337816 +978000 ekin = 0.928774958127715 | erot = 1.62702792958257 | epot = -10.689586561963 | etot = -8.1337836742527 +979000 ekin = 0.986309688868686 | erot = 1.62661906217909 | epot = -10.7467124264037 | etot = -8.13378367535593 +980000 ekin = 1.05604184520662 | erot = 1.62477777714318 | epot = -10.8146032984793 | etot = -8.13378367612947 +981000 ekin = 1.1246974517273 | erot = 1.62193499902994 | epot = -10.8804161270463 | etot = -8.13378367628903 +982000 ekin = 1.18655422477308 | erot = 1.61989865458109 | epot = -10.9402365552591 | etot = -8.13378367590495 +983000 ekin = 1.2432339331173 | erot = 1.62138932845409 | epot = -10.9984069368238 | etot = -8.13378367525236 +984000 ekin = 1.3007289232663 | erot = 1.62917854668228 | epot = -11.0636911445781 | etot = -8.13378367462955 +985000 ekin = 1.36575798905031 | erot = 1.64530549608379 | epot = -11.1448471593989 | etot = -8.13378367426479 +986000 ekin = 1.44269014496135 | erot = 1.67060135311584 | epot = -11.2470751723821 | etot = -8.13378367430487 +987000 ekin = 1.53139017712842 | erot = 1.70450616306297 | epot = -11.3696800150103 | etot = -8.1337836748189 +988000 ekin = 1.62542516993083 | erot = 1.74490462825212 | epot = -11.5041134740412 | etot = -8.13378367585821 +989000 ekin = 1.70973314356223 | erot = 1.78758053837793 | epot = -11.6310973591265 | etot = -8.13378367718631 +990000 ekin = 1.76834990596683 | erot = 1.82854800940128 | epot = -11.7306815937548 | etot = -8.13378367838671 +991000 ekin = 1.78717585114204 | erot = 1.86445265633072 | epot = -11.7854121865501 | etot = -8.13378367907737 +992000 ekin = 1.75808068877046 | erot = 1.89344947238099 | epot = -11.785313840188 | etot = -8.13378367903651 +993000 ekin = 1.68149922524843 | erot = 1.91587779016308 | epot = -11.7311606936924 | etot = -8.13378367828091 +994000 ekin = 1.56634005404157 | erot = 1.93428820638793 | epot = -11.6344119374165 | etot = -8.13378367698701 +995000 ekin = 1.42807354955332 | erot = 1.95281321310297 | epot = -11.5146704380736 | etot = -8.13378367541727 +996000 ekin = 1.28578074304376 | erot = 1.97614374534339 | epot = -11.3957081622749 | etot = -8.13378367388774 +997000 ekin = 1.15849050556427 | erot = 2.00849321106801 | epot = -11.3007673893125 | etot = -8.1337836726802 +998000 ekin = 1.06172554858003 | erot = 2.05288173951555 | epot = -11.2483909600472 | etot = -8.13378367195161 +999000 ekin = 1.00534863971574 | erot = 2.11083351411326 | epot = -11.2499658255692 | etot = -8.13378367174015 +1000000 ekin = 0.992888354298654 | erot = 2.182321071549 | epot = -11.3089930978744 | etot = -8.13378367202676 + 1000000 0.073547286 -1.1520387 0.021139403 -1.0316105 -4.7686302e-05 64000 +Loop time of 17.4426 on 1 procs for 1000000 steps with 10 atoms + +Performance: 49534.033 tau/day, 57331.057 timesteps/s +99.7% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 14.806 | 14.806 | 14.806 | 0.0 | 84.88 +Bond | 0.62301 | 0.62301 | 0.62301 | 0.0 | 3.57 +Neigh | 0.008078 | 0.008078 | 0.008078 | 0.0 | 0.05 +Comm | 0.18244 | 0.18244 | 0.18244 | 0.0 | 1.05 +Output | 0.099253 | 0.099253 | 0.099253 | 0.0 | 0.57 +Modify | 1.4674 | 1.4674 | 1.4674 | 0.0 | 8.41 +Other | | 0.2565 | | | 1.47 + +Nlocal: 10.0000 ave 10 max 10 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 37.0000 ave 37 max 37 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 37 +Ave neighs/atom = 3.7000000 +Ave special neighs/atom = 3.6000000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.3.* nocoeff +System init for write_data ... +Total wall time: 0:00:17 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 new file mode 100644 index 0000000000..735559c643 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 @@ -0,0 +1,1181 @@ +LAMMPS (27 May 2021) +variable number equal 3 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex3 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 10 atoms + reading velocities ... + 10 velocities + scanning bonds ... + 2 = max bonds/atom + 10 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 8 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +set atom * mass 1.0 +Setting atom values ... + 10 settings made for mass + +group all type 1 4 +10 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 2 = max # of 1-4 neighbors + 4 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA2 pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.3.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 1.18025158324274 | erot = 2.17908479136507 | epot = -11.4931199991265 | etot = -8.13378362451868 +Per MPI rank memory allocation (min/avg/max) = 9.444 | 9.445 | 9.446 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.087426043 -1.2259004 0.076588446 -1.0312868 -7.7802026e-06 64000 +1000 ekin = 1.08696491147664 | erot = 2.23197650714075 | epot = -11.452725042513 | etot = -8.13378362389561 +2000 ekin = 1.01265115460251 | erot = 2.29132031278141 | epot = -11.4377550908153 | etot = -8.13378362343136 +3000 ekin = 0.964951920610343 | erot = 2.35614244814783 | epot = -11.4548779921654 | etot = -8.13378362340727 +4000 ekin = 0.94586117922706 | erot = 2.42482489276794 | epot = -11.5044696957622 | etot = -8.13378362376716 +5000 ekin = 0.952186940161506 | erot = 2.49508744948286 | epot = -11.5810580140497 | etot = -8.13378362440531 +6000 ekin = 0.976836955567213 | erot = 2.56435791368455 | epot = -11.6749784943528 | etot = -8.133783625101 +7000 ekin = 1.01151727363089 | erot = 2.63034980765842 | epot = -11.7756507069156 | etot = -8.13378362562625 +8000 ekin = 1.04963768886881 | erot = 2.69159648304405 | epot = -11.8750177977505 | etot = -8.13378362583768 +9000 ekin = 1.0883140648391 | erot = 2.74768757650643 | epot = -11.9697852671577 | etot = -8.13378362581213 +10000 ekin = 1.12769894654421 | erot = 2.79881902231424 | epot = -12.0603015945015 | etot = -8.13378362564302 +11000 ekin = 1.16997706279088 | erot = 2.84539220453508 | epot = -12.1491528928088 | etot = -8.13378362548282 +12000 ekin = 1.2177282540356 | erot = 2.88753582693548 | epot = -12.2390477064188 | etot = -8.13378362544771 +13000 ekin = 1.27247277648631 | erot = 2.92478423931383 | epot = -12.3310406413903 | etot = -8.13378362559016 +14000 ekin = 1.33384628320076 | erot = 2.95599632290769 | epot = -12.4236262320193 | etot = -8.13378362591087 +15000 ekin = 1.39936071611667 | erot = 2.97947113417339 | epot = -12.5126154766851 | etot = -8.13378362639509 +16000 ekin = 1.46443870928025 | erot = 2.99312358077437 | epot = -12.591345917414 | etot = -8.13378362735941 +17000 ekin = 1.52113741921508 | erot = 2.99430260105844 | epot = -12.6492236482456 | etot = -8.13378362797211 +18000 ekin = 1.56143918576785 | erot = 2.98098620608853 | epot = -12.6762090203242 | etot = -8.13378362846786 +19000 ekin = 1.57873438318792 | erot = 2.95206674454566 | epot = -12.6645847564924 | etot = -8.13378362875883 +20000 ekin = 1.56841348053788 | erot = 2.90735147312967 | epot = -12.6095485824457 | etot = -8.13378362877816 +21000 ekin = 1.52886464109305 | erot = 2.84765291368988 | epot = -12.5103011832755 | etot = -8.13378362849259 +22000 ekin = 1.46209217703487 | erot = 2.77478397647209 | epot = -12.3706597813888 | etot = -8.13378362788186 +23000 ekin = 1.37376733102673 | erot = 2.69155728313737 | epot = -12.19910824124 | etot = -8.13378362707587 +24000 ekin = 1.27262109890793 | erot = 2.60118350194767 | epot = -12.007588227 | etot = -8.13378362614441 +25000 ekin = 1.16926502294377 | erot = 2.507036926952 | epot = -11.8100855751045 | etot = -8.13378362520874 +26000 ekin = 1.0747148994514 | erot = 2.41235840152823 | epot = -11.6208569253575 | etot = -8.13378362437787 +27000 ekin = 0.998982995755794 | erot = 2.31997753232684 | epot = -11.4527441518069 | etot = -8.13378362372431 +28000 ekin = 0.950065052892259 | erot = 2.23215621537595 | epot = -11.3160048915419 | etot = -8.13378362327374 +29000 ekin = 0.933483801722481 | erot = 2.1505610010298 | epot = -11.2178284257647 | etot = -8.13378362301241 +30000 ekin = 0.952335164335886 | erot = 2.07633501131226 | epot = -11.1624537985557 | etot = -8.13378362290756 +31000 ekin = 1.00761822011295 | erot = 2.01025995539436 | epot = -11.1516617984317 | etot = -8.13378362292441 +32000 ekin = 1.09859027316454 | erot = 1.95287201474932 | epot = -11.1852459109705 | etot = -8.13378362305664 +33000 ekin = 1.22296348257667 | erot = 1.90442653272443 | epot = -11.2611736386121 | etot = -8.13378362331101 +34000 ekin = 1.37683793249556 | erot = 1.8649833610543 | epot = -11.3756049172808 | etot = -8.13378362373091 +35000 ekin = 1.55422271443431 | erot = 1.83436013830192 | epot = -11.522366477147 | etot = -8.13378362441081 +36000 ekin = 1.7458960704812 | erot = 1.81205442227466 | epot = -11.6917341182486 | etot = -8.13378362549271 +37000 ekin = 1.93777565280843 | erot = 1.79705197600553 | epot = -11.8686112558401 | etot = -8.13378362702609 +38000 ekin = 2.11051089015029 | erot = 1.78782890330241 | epot = -12.0321234221669 | etot = -8.13378362871416 +39000 ekin = 2.243214825885 | erot = 1.78271510837239 | epot = -12.1597135641246 | etot = -8.13378362986721 +40000 ekin = 2.32146151921635 | erot = 1.78073283005133 | epot = -12.2359779791649 | etot = -8.13378362989725 +41000 ekin = 2.34386750101379 | erot = 1.78241563043122 | epot = -12.2600667603299 | etot = -8.13378362888491 +42000 ekin = 2.32118218527084 | erot = 1.78979050959086 | epot = -12.2447563223398 | etot = -8.13378362747809 +43000 ekin = 2.26309111555131 | erot = 1.80539262076481 | epot = -12.2022673943962 | etot = -8.13378365808009 +44000 ekin = 2.15856242114827 | erot = 1.84609032619616 | epot = -12.1384363880308 | etot = -8.13378364068641 +45000 ekin = 2.08936731003506 | erot = 1.88904724563044 | epot = -12.1121981822921 | etot = -8.13378362662662 +46000 ekin = 1.99646115970042 | erot = 1.9350398240043 | epot = -12.0652846104763 | etot = -8.13378362677161 +47000 ekin = 1.89712577412036 | erot = 1.98806984898587 | epot = -12.0189792501524 | etot = -8.13378362704618 +48000 ekin = 1.79036864863095 | erot = 2.04496273496238 | epot = -11.9691150108767 | etot = -8.13378362728336 +49000 ekin = 1.67630116263936 | erot = 2.10216327906911 | epot = -11.9122480690704 | etot = -8.13378362736194 +50000 ekin = 1.55727015247074 | erot = 2.15637892895983 | epot = -11.8474327086504 | etot = -8.13378362721979 +51000 ekin = 1.4381743370916 | erot = 2.20514040032699 | epot = -11.7770983642845 | etot = -8.13378362686595 +52000 ekin = 1.32596547232191 | erot = 2.24710946475012 | epot = -11.7068585634506 | etot = -8.13378362637853 +53000 ekin = 1.22848082922928 | erot = 2.28204759210387 | epot = -11.6443120472109 | etot = -8.1337836258777 +54000 ekin = 1.15295119316279 | erot = 2.31049933939895 | epot = -11.5972341580453 | etot = -8.13378362548353 +55000 ekin = 1.10463170766326 | erot = 2.33334681406847 | epot = -11.571762147013 | etot = -8.13378362528126 +56000 ekin = 1.0859079951732 | erot = 2.35139880092338 | epot = -11.5710904214036 | etot = -8.13378362530697 +57000 ekin = 1.09599893485474 | erot = 2.36511154450539 | epot = -11.5948941049135 | etot = -8.13378362555341 +58000 ekin = 1.1311980347098 | erot = 2.37445830578825 | epot = -11.639439966472 | etot = -8.13378362597399 +59000 ekin = 1.18549837183877 | erot = 2.37891691863242 | epot = -11.6981989169899 | etot = -8.13378362651871 +60000 ekin = 1.25136230662726 | erot = 2.37755306615259 | epot = -11.7626989998984 | etot = -8.13378362711854 +61000 ekin = 1.32065657328768 | erot = 2.36917823379323 | epot = -11.8236184347911 | etot = -8.13378362771015 +62000 ekin = 1.38555350991039 | erot = 2.35258911579065 | epot = -11.8719262538937 | etot = -8.1337836281927 +63000 ekin = 1.43966787267624 | erot = 2.32682848519609 | epot = -11.9002799863547 | etot = -8.13378362848239 +64000 ekin = 1.47909503438153 | erot = 2.2914499371541 | epot = -11.9043286000689 | etot = -8.13378362853327 +65000 ekin = 1.50288049774081 | erot = 2.24670960905127 | epot = -11.88337373515 | etot = -8.13378362835796 +66000 ekin = 1.5127450759901 | erot = 2.1935968418301 | epot = -11.840125545851 | etot = -8.13378362803079 +67000 ekin = 1.5120865963301 | erot = 2.13371356874821 | epot = -11.7795837927185 | etot = -8.13378362764022 +68000 ekin = 1.50462166617942 | erot = 2.06904733139788 | epot = -11.7074526249093 | etot = -8.13378362733198 +69000 ekin = 1.49293889166151 | erot = 2.00167765430528 | epot = -11.6284001731037 | etot = -8.13378362713687 +70000 ekin = 1.47793621174635 | erot = 1.93361210060372 | epot = -11.5453319394055 | etot = -8.13378362705546 +71000 ekin = 1.45891349102844 | erot = 1.86670994694695 | epot = -11.4594070650146 | etot = -8.1337836270392 +72000 ekin = 1.43427842101627 | erot = 1.80270883809017 | epot = -11.3707708861216 | etot = -8.13378362701516 +73000 ekin = 1.40258583891037 | erot = 1.74331039193086 | epot = -11.2796798577521 | etot = -8.13378362691083 +74000 ekin = 1.36359371155289 | erot = 1.69025647754913 | epot = -11.1876338157821 | etot = -8.13378362668012 +75000 ekin = 1.31886252565222 | erot = 1.64533820718021 | epot = -11.0979843591717 | etot = -8.13378362633925 +76000 ekin = 1.27181692773762 | erot = 1.61030043593585 | epot = -11.0159009896014 | etot = -8.13378362592789 +77000 ekin = 1.2276733892201 | erot = 1.586709525556 | epot = -10.9481665402834 | etot = -8.1337836255073 +78000 ekin = 1.19187425881975 | erot = 1.57555521121122 | epot = -10.9012130952116 | etot = -8.1337836251806 +79000 ekin = 1.16922470588819 | erot = 1.57716601534079 | epot = -10.880174346204 | etot = -8.13378362497497 +80000 ekin = 1.16351312193731 | erot = 1.59112852775407 | epot = -10.8884252746032 | etot = -8.13378362491183 +81000 ekin = 1.17709123428935 | erot = 1.61633850893085 | epot = -10.9272133682118 | etot = -8.13378362499165 +82000 ekin = 1.21064005584018 | erot = 1.65118762576684 | epot = -10.9956113068159 | etot = -8.13378362520884 +83000 ekin = 1.26297331742729 | erot = 1.69382675572838 | epot = -11.0905836987107 | etot = -8.13378362555501 +84000 ekin = 1.33092648687661 | erot = 1.74243133123666 | epot = -11.207141444114 | etot = -8.13378362600077 +85000 ekin = 1.4096121842737 | erot = 1.79540640337815 | epot = -11.3388022141302 | etot = -8.13378362647838 +86000 ekin = 1.49330005467931 | erot = 1.85150064414006 | epot = -11.4785843257051 | etot = -8.13378362688569 +87000 ekin = 1.57653380716712 | erot = 1.90982169886825 | epot = -11.6201391333937 | etot = -8.13378362735829 +88000 ekin = 1.65416408678862 | erot = 1.96971725895487 | epot = -11.7576649732583 | etot = -8.13378362751478 +89000 ekin = 1.72360216634183 | erot = 2.03055934337538 | epot = -11.8879451373047 | etot = -8.13378362758746 +90000 ekin = 1.78500984589396 | erot = 2.09126219979616 | epot = -12.0100556734365 | etot = -8.13378362774636 +91000 ekin = 1.83789001415883 | erot = 2.15001837237375 | epot = -12.121692014542 | etot = -8.13378362800938 +92000 ekin = 1.8751780932285 | erot = 2.20985483887587 | epot = -12.2188165602804 | etot = -8.13378362817606 +93000 ekin = 1.90356384535079 | erot = 2.26204903048023 | epot = -12.2993965046582 | etot = -8.13378362882718 +94000 ekin = 1.91566641673066 | erot = 2.30892488078343 | epot = -12.3583749263618 | etot = -8.13378362884772 +95000 ekin = 1.91095769384044 | erot = 2.34997522030068 | epot = -12.3947165431019 | etot = -8.13378362896078 +96000 ekin = 1.88948402498952 | erot = 2.38411475951123 | epot = -12.4073824132816 | etot = -8.13378362878085 +97000 ekin = 1.8534381113396 | erot = 2.41133046292278 | epot = -12.3985522027176 | etot = -8.13378362845527 +98000 ekin = 1.80684275230345 | erot = 2.43203206054872 | epot = -12.3726584408924 | etot = -8.13378362804021 +99000 ekin = 1.7547864112325 | erot = 2.4469297773688 | epot = -12.3354998162081 | etot = -8.13378362760676 +100000 ekin = 1.69590911435722 | erot = 2.45386958409528 | epot = -12.2835623848863 | etot = -8.13378368643375 +101000 ekin = 1.68113249375524 | erot = 2.36572534112416 | epot = -12.1806414642163 | etot = -8.13378362933686 +102000 ekin = 1.72678565900262 | erot = 2.35051337712511 | epot = -12.2110826965915 | etot = -8.13378366046378 +103000 ekin = 1.68338599487791 | erot = 2.35411811039612 | epot = -12.1712877656958 | etot = -8.13378366042172 +104000 ekin = 1.6432358641293 | erot = 2.35701648102723 | epot = -12.1340360056527 | etot = -8.1337836604962 +105000 ekin = 1.6058411347212 | erot = 2.35932964102249 | epot = -12.0989544363537 | etot = -8.13378366061004 +106000 ekin = 1.57044138011859 | erot = 2.36092776943221 | epot = -12.0651528102267 | etot = -8.13378366067593 +107000 ekin = 1.5370540025101 | erot = 2.36166253248189 | epot = -12.0325001956583 | etot = -8.13378366066631 +108000 ekin = 1.50696391591148 | erot = 2.36128557349189 | epot = -12.0020331499846 | etot = -8.13378366058128 +109000 ekin = 1.48244426546661 | erot = 2.35938088270993 | epot = -11.9756088087051 | etot = -8.13378366052851 +110000 ekin = 1.46539913148061 | erot = 2.35530683146147 | epot = -11.9544896235792 | etot = -8.13378366063714 +111000 ekin = 1.45548748017583 | erot = 2.34818065606079 | epot = -11.9374517972402 | etot = -8.13378366100358 +112000 ekin = 1.44872729612902 | erot = 2.33695548266938 | epot = -11.9194664403743 | etot = -8.13378366157592 +113000 ekin = 1.43805495586433 | erot = 2.32068695509387 | epot = -11.8925255730866 | etot = -8.13378366212841 +114000 ekin = 1.41640788690808 | erot = 2.29883886662102 | epot = -11.8490304158899 | etot = -8.13378366236083 +115000 ekin = 1.38063781822016 | erot = 2.27153218573294 | epot = -11.7859536655149 | etot = -8.13378366156184 +116000 ekin = 1.33630540308359 | erot = 2.23942220246119 | epot = -11.7095112666467 | etot = -8.13378366110188 +117000 ekin = 1.29001229198269 | erot = 2.20380811829898 | epot = -11.6276040708676 | etot = -8.13378366058597 +118000 ekin = 1.24711548834697 | erot = 2.16635124019897 | epot = -11.5472503887772 | etot = -8.13378366023123 +119000 ekin = 1.21073685469419 | erot = 2.12872161390261 | epot = -11.4732421286709 | etot = -8.13378366007414 +120000 ekin = 1.18115748419447 | erot = 2.09256534610066 | epot = -11.40750649033 | etot = -8.13378366003488 +121000 ekin = 1.15688642101108 | erot = 2.05947511288399 | epot = -11.350145193931 | etot = -8.1337836600359 +122000 ekin = 1.13593168276781 | erot = 2.03084061403911 | epot = -11.3005559568653 | etot = -8.1337836600584 +123000 ekin = 1.11638811965957 | erot = 2.00761097209071 | epot = -11.2577827519201 | etot = -8.13378366016986 +124000 ekin = 1.09616325371759 | erot = 1.99019695902089 | epot = -11.2201438730114 | etot = -8.13378366027295 +125000 ekin = 1.07358508996147 | erot = 1.97820026039384 | epot = -11.1855690107828 | etot = -8.13378366042751 +126000 ekin = 1.04712198978511 | erot = 1.97030937007256 | epot = -11.1512150205173 | etot = -8.13378366065958 +127000 ekin = 1.01560359550535 | erot = 1.96476336054367 | epot = -11.1141506168024 | etot = -8.13378366075333 +128000 ekin = 0.979281846652257 | erot = 1.95990906194977 | epot = -11.0729745693072 | etot = -8.1337836607052 +129000 ekin = 0.940294043229777 | erot = 1.9542877292158 | epot = -11.028365432901 | etot = -8.13378366045539 +130000 ekin = 0.902735823607082 | erot = 1.94710047764785 | epot = -10.9836199613548 | etot = -8.13378366009992 +131000 ekin = 0.87232975913947 | erot = 1.9382057552685 | epot = -10.9443191739567 | etot = -8.13378365954875 +132000 ekin = 0.855045600562003 | erot = 1.92803271303706 | epot = -10.9168619728692 | etot = -8.1337836592701 +133000 ekin = 0.854775562822287 | erot = 1.91694878880983 | epot = -10.9055080107082 | etot = -8.13378365907605 +134000 ekin = 0.873981086378638 | erot = 1.9054952248947 | epot = -10.9132599702529 | etot = -8.13378365897953 +135000 ekin = 0.913690181741534 | erot = 1.89429118508535 | epot = -10.9417650257939 | etot = -8.13378365896698 +136000 ekin = 0.973734451665314 | erot = 1.88395321784257 | epot = -10.991471328535 | etot = -8.13378365902709 +137000 ekin = 1.05255313135912 | erot = 1.8748880008039 | epot = -11.0612247920053 | etot = -8.13378365984223 +138000 ekin = 1.1443524994851 | erot = 1.8662689721207 | epot = -11.1444051316849 | etot = -8.1337836600791 +139000 ekin = 1.24448357091316 | erot = 1.85821435006776 | epot = -11.2364815813232 | etot = -8.13378366034227 +140000 ekin = 1.34860347563737 | erot = 1.85113522079146 | epot = -11.333522357093 | etot = -8.13378366066415 +141000 ekin = 1.45162669266307 | erot = 1.84534635451955 | epot = -11.430756708267 | etot = -8.13378366108439 +142000 ekin = 1.54663919844515 | erot = 1.84103156950942 | epot = -11.5214544297492 | etot = -8.13378366179463 +143000 ekin = 1.6247011023943 | erot = 1.83813053702651 | epot = -11.5966153018866 | etot = -8.13378366246583 +144000 ekin = 1.67710589256313 | erot = 1.83622813336458 | epot = -11.6471176890263 | etot = -8.13378366309863 +145000 ekin = 1.69650852159075 | erot = 1.83477115527506 | epot = -11.6650633403353 | etot = -8.13378366346953 +146000 ekin = 1.6799825027068 | erot = 1.83334306418742 | epot = -11.6471092301929 | etot = -8.13378366329869 +147000 ekin = 1.63255928725536 | erot = 1.83204496823063 | epot = -11.5983879178788 | etot = -8.13378366239283 +148000 ekin = 1.56926257377477 | erot = 1.83182914755862 | epot = -11.534875382189 | etot = -8.13378366085557 +149000 ekin = 1.51300824977771 | erot = 1.83452727994399 | epot = -11.4813191889261 | etot = -8.13378365920442 +150000 ekin = 1.48724963784764 | erot = 1.84235837448654 | epot = -11.4633916705185 | etot = -8.13378365818431 +151000 ekin = 1.50619323823056 | erot = 1.85697474830062 | epot = -11.4969516448368 | etot = -8.13378365830567 +152000 ekin = 1.5685599260268 | erot = 1.87847282638604 | epot = -11.5808164119028 | etot = -8.13378365948999 +153000 ekin = 1.65914489646706 | erot = 1.90493735116026 | epot = -11.6978659087732 | etot = -8.13378366114592 +154000 ekin = 1.75680978950874 | erot = 1.93282846213674 | epot = -11.8234219142234 | etot = -8.13378366257792 +155000 ekin = 1.84344901658567 | erot = 1.95802697046954 | epot = -11.9352596504351 | etot = -8.13378366337988 +156000 ekin = 1.90893795388549 | erot = 1.97697594926185 | epot = -12.019697566723 | etot = -8.1337836635757 +157000 ekin = 1.95061494386007 | erot = 1.98738512433609 | epot = -12.0717837316326 | etot = -8.13378366343647 +158000 ekin = 1.96976178337765 | erot = 1.98837447181577 | epot = -12.0919199183621 | etot = -8.13378366316872 +159000 ekin = 1.96892634677244 | erot = 1.98033790354907 | epot = -12.0830479131022 | etot = -8.13378366278067 +160000 ekin = 1.95167601805922 | erot = 1.96478101830043 | epot = -12.0502406985809 | etot = -8.13378366222127 +161000 ekin = 1.92323849263725 | erot = 1.94408396543573 | epot = -12.0011061196165 | etot = -8.13378366154349 +162000 ekin = 1.89012785139811 | erot = 1.92106669306998 | epot = -11.944978205359 | etot = -8.1337836608909 +163000 ekin = 1.85873206626248 | erot = 1.89844726529971 | epot = -11.8909629919512 | etot = -8.13378366038902 +164000 ekin = 1.83396756863798 | erot = 1.87841814938259 | epot = -11.8461693781064 | etot = -8.13378366008578 +165000 ekin = 1.81873657813931 | erot = 1.86247026312324 | epot = -11.8149905012188 | etot = -8.1337836599562 +166000 ekin = 1.81415764355162 | erot = 1.8514412879533 | epot = -11.79938259145 | etot = -8.13378365994511 +167000 ekin = 1.82014338462659 | erot = 1.84569577974767 | epot = -11.799622824365 | etot = -8.13378365999075 +168000 ekin = 1.83604973591181 | erot = 1.84534918673609 | epot = -11.815182582692 | etot = -8.1337836600441 +169000 ekin = 1.86118807803888 | erot = 1.85047766429992 | epot = -11.8454494024144 | etot = -8.13378366007557 +170000 ekin = 1.89508209491993 | erot = 1.86127600745116 | epot = -11.8901417624546 | etot = -8.13378366008347 +171000 ekin = 1.93739070093696 | erot = 1.87813927221236 | epot = -11.9493136332457 | etot = -8.13378366009642 +172000 ekin = 1.98746465492602 | erot = 1.9016569956626 | epot = -12.0229053107598 | etot = -8.13378366017114 +173000 ekin = 2.04358732260644 | erot = 1.93252470914556 | epot = -12.1098956921176 | etot = -8.13378366036558 +174000 ekin = 2.10212586880609 | erot = 1.97139111366216 | epot = -12.2073006432558 | etot = -8.13378366078754 +175000 ekin = 2.15653164019835 | erot = 2.01868623997525 | epot = -12.3090015416374 | etot = -8.13378366146383 +176000 ekin = 2.19700590631248 | erot = 2.07444517694631 | epot = -12.4052347456345 | etot = -8.13378366237571 +177000 ekin = 2.21275117726687 | erot = 2.13809655452346 | epot = -12.4846313951107 | etot = -8.13378366332033 +178000 ekin = 2.1910308413777 | erot = 2.20849637361908 | epot = -12.533310879452 | etot = -8.13378366445528 +179000 ekin = 2.05002958755748 | erot = 2.27647492405926 | epot = -12.4602881626281 | etot = -8.1337836510114 +180000 ekin = 2.00100366281097 | erot = 2.36086155180617 | epot = -12.4956488860904 | etot = -8.13378367147329 +181000 ekin = 1.8288534450285 | erot = 2.44444025932766 | epot = -12.4070773745343 | etot = -8.1337836701781 +182000 ekin = 1.62724610560642 | erot = 2.53221325513927 | epot = -12.2932430288224 | etot = -8.13378366807668 +183000 ekin = 1.42880501135731 | erot = 2.62540058534394 | epot = -12.1879892625426 | etot = -8.13378366584134 +184000 ekin = 1.26714962832189 | erot = 2.7256198185048 | epot = -12.1265531111187 | etot = -8.133783664292 +185000 ekin = 1.16606552758033 | erot = 2.83366450732284 | epot = -12.1335136988427 | etot = -8.13378366393954 +186000 ekin = 1.13327188784956 | erot = 2.94811459460555 | epot = -12.215170147212 | etot = -8.13378366475687 +187000 ekin = 1.16127663962627 | erot = 3.06454091657723 | epot = -12.3596012225476 | etot = -8.13378366634412 +188000 ekin = 1.23275799228683 | erot = 3.17578119614163 | epot = -12.5423228566627 | etot = -8.13378366823427 +189000 ekin = 1.32637276316102 | erot = 3.27316596760488 | epot = -12.7333224008233 | etot = -8.13378367005736 +190000 ekin = 1.42100795808828 | erot = 3.34817980173588 | epot = -12.9029714313696 | etot = -8.13378367154549 +191000 ekin = 1.49794111549855 | erot = 3.39410379075288 | epot = -13.025828578861 | etot = -8.13378367260959 +192000 ekin = 1.54262156679657 | erot = 3.40720165429168 | epot = -13.0836068940659 | etot = -8.13378367297767 +193000 ekin = 1.54797240883491 | erot = 3.3871523146608 | epot = -13.0689083961187 | etot = -8.133783672623 +194000 ekin = 1.51467582661431 | erot = 3.33705387754678 | epot = -12.9855133757553 | etot = -8.13378367159417 +195000 ekin = 1.45101621748205 | erot = 3.26269312885163 | epot = -12.847493016446 | etot = -8.13378367011236 +196000 ekin = 1.37083042970726 | erot = 3.17132041678842 | epot = -12.6759345149995 | etot = -8.1337836685038 +197000 ekin = 1.29009120536666 | erot = 3.07036265935732 | epot = -12.4942375317737 | etot = -8.13378366704976 +198000 ekin = 1.223641966439 | erot = 2.9665238264393 | epot = -12.3239494587818 | etot = -8.1337836659035 +199000 ekin = 1.18307710083203 | erot = 2.86542144217683 | epot = -12.1822822081286 | etot = -8.13378366511975 +200000 ekin = 1.17564340951886 | erot = 2.77158698378664 | epot = -12.0810140580287 | etot = -8.13378366472323 +201000 ekin = 1.2035961939173 | erot = 2.68856918537094 | epot = -12.0259490440284 | etot = -8.13378366474019 +202000 ekin = 1.26374726413794 | erot = 2.61894189739966 | epot = -12.0164728267157 | etot = -8.13378366517807 +203000 ekin = 1.34751597563135 | erot = 2.56419616426354 | epot = -12.0454958058701 | etot = -8.13378366597518 +204000 ekin = 1.44203337890026 | erot = 2.52468734318829 | epot = -12.1005043890636 | etot = -8.13378366697502 +205000 ekin = 1.53246038205374 | erot = 2.49972903140407 | epot = -12.1659730814057 | etot = -8.13378366794789 +206000 ekin = 1.60510558525676 | erot = 2.48793425280172 | epot = -12.2268235067207 | etot = -8.13378366866227 +207000 ekin = 1.65039556723151 | erot = 2.48771410987631 | epot = -12.271893346076 | etot = -8.13378366896816 +208000 ekin = 1.66471924263836 | erot = 2.49772662877094 | epot = -12.2962295402568 | etot = -8.1337836688475 +209000 ekin = 1.65060780281935 | erot = 2.5170617877379 | epot = -12.3014532589726 | etot = -8.13378366841534 +210000 ekin = 1.6152961353011 | erot = 2.54506818372014 | epot = -12.294147986901 | etot = -8.13378366787973 +211000 ekin = 1.56815998339925 | erot = 2.58088870847204 | epot = -12.2828323593483 | etot = -8.13378366747702 +212000 ekin = 1.51779769211988 | erot = 2.62289115839936 | epot = -12.2744725179128 | etot = -8.13378366739357 +213000 ekin = 1.4697069778648 | erot = 2.66822787294276 | epot = -12.2717185184987 | etot = -8.13378366769114 +214000 ekin = 1.42551121612053 | erot = 2.71271314915528 | epot = -12.272008033447 | etot = -8.13378366817117 +215000 ekin = 1.38449526701928 | erot = 2.75113858809809 | epot = -12.2694175238349 | etot = -8.13378366871753 +216000 ekin = 1.34611450510848 | erot = 2.778189054446 | epot = -12.2580872284529 | etot = -8.13378366889846 +217000 ekin = 1.31348152812132 | erot = 2.78964053187646 | epot = -12.2369057285569 | etot = -8.13378366855912 +218000 ekin = 1.29458639919669 | erot = 2.78319145109128 | epot = -12.211561518241 | etot = -8.13378366795307 +219000 ekin = 1.29978448123297 | erot = 2.75785865494222 | epot = -12.1914268036092 | etot = -8.133783667434 +220000 ekin = 1.33694784981916 | erot = 2.71363634301958 | epot = -12.1843678601791 | etot = -8.13378366734038 +221000 ekin = 1.40745643921217 | erot = 2.65092088134261 | epot = -12.1921609882724 | etot = -8.13378366771768 +222000 ekin = 1.50572252626058 | erot = 2.5702947695228 | epot = -12.2098009641044 | etot = -8.13378366832106 +223000 ekin = 1.622108433758 | erot = 2.4728900733409 | epot = -12.2287821759283 | etot = -8.13378366882938 +224000 ekin = 1.74679393022895 | erot = 2.36097135919323 | epot = -12.2415489584549 | etot = -8.13378366903269 +225000 ekin = 1.87205636329869 | erot = 2.23842454190499 | epot = -12.2442645742122 | etot = -8.13378366900852 +226000 ekin = 1.99134598106539 | erot = 2.11064622098381 | epot = -12.2357758711276 | etot = -8.13378366907843 +227000 ekin = 2.09586639151506 | erot = 1.98364704051147 | epot = -12.2132971015561 | etot = -8.13378366952953 +228000 ekin = 2.17197666667235 | erot = 1.86293503717753 | epot = -12.168695374189 | etot = -8.13378367033911 +229000 ekin = 2.20263173192425 | erot = 1.75265294154687 | epot = -12.0890683445883 | etot = -8.13378367111721 +230000 ekin = 2.17321554606717 | erot = 1.65532359970834 | epot = -11.9623228171274 | etot = -8.13378367135191 +231000 ekin = 2.0785492057305 | erot = 1.57213281486692 | epot = -11.7844656913344 | etot = -8.13378367073699 +232000 ekin = 1.9267119502183 | erot = 1.50340464294821 | epot = -11.5639002625312 | etot = -8.13378366936465 +233000 ekin = 1.73729705955979 | erot = 1.44896834770243 | epot = -11.3200490749316 | etot = -8.13378366766943 +234000 ekin = 1.5355695335478 | erot = 1.408340459375 | epot = -11.077693659003 | etot = -8.13378366608018 +235000 ekin = 1.34558700580171 | erot = 1.38078818073892 | epot = -10.860158851475 | etot = -8.13378366493441 +236000 ekin = 1.18525206422635 | erot = 1.36570263210389 | epot = -10.684738360547 | etot = -8.13378366421678 +237000 ekin = 1.06637029724387 | erot = 1.36251012102835 | epot = -10.5626640820872 | etot = -8.13378366381498 +238000 ekin = 0.995491212021447 | erot = 1.370704297714 | epot = -10.4999791733999 | etot = -8.13378366366447 +239000 ekin = 0.975031518631871 | erot = 1.38971384126898 | epot = -10.4985290236702 | etot = -8.13378366376935 +240000 ekin = 1.00352423904712 | erot = 1.41866034024249 | epot = -10.5559682434632 | etot = -8.13378366417361 +241000 ekin = 1.07556704774174 | erot = 1.45612900246833 | epot = -10.6654797151281 | etot = -8.133783664918 +242000 ekin = 1.18122375067251 | erot = 1.49994629855497 | epot = -10.8149537152524 | etot = -8.13378366602495 +243000 ekin = 1.30634294707366 | erot = 1.54703331020094 | epot = -10.9871599246158 | etot = -8.13378366734116 +244000 ekin = 1.43466609576071 | erot = 1.59374373480257 | epot = -11.1621934990188 | etot = -8.13378366845551 +245000 ekin = 1.5509194417116 | erot = 1.63606515904686 | epot = -11.3207682704725 | etot = -8.13378366971408 +246000 ekin = 1.63963426714502 | erot = 1.67091688012785 | epot = -11.4443348179099 | etot = -8.13378367063702 +247000 ekin = 1.68912292676034 | erot = 1.69643192578669 | epot = -11.519338523587 | etot = -8.13378367104001 +248000 ekin = 1.6941862336644 | erot = 1.71223298155104 | epot = -11.5402028860527 | etot = -8.13378367083729 +249000 ekin = 1.65708464249924 | erot = 1.71943097162712 | epot = -11.5102992843213 | etot = -8.13378367019498 +250000 ekin = 1.58639864685249 | erot = 1.72015982289489 | epot = -11.4403421388616 | etot = -8.13378366911425 +251000 ekin = 1.49555936407676 | erot = 1.71716072440176 | epot = -11.3465037564433 | etot = -8.13378366796475 +252000 ekin = 1.39930346630719 | erot = 1.71298107622756 | epot = -11.246068209527 | etot = -8.13378366699228 +253000 ekin = 1.3103489835937 | erot = 1.70949093459635 | epot = -11.1536235845411 | etot = -8.13378366635106 +254000 ekin = 1.23716194123169 | erot = 1.70776552340202 | epot = -11.0787111307326 | etot = -8.13378366609892 +255000 ekin = 1.18305733845105 | erot = 1.70821467485162 | epot = -11.0250556794503 | etot = -8.13378366614759 +256000 ekin = 1.14729363432645 | erot = 1.71063275158254 | epot = -10.9917100522912 | etot = -8.13378366638218 +257000 ekin = 1.12650460108559 | erot = 1.71454195552869 | epot = -10.9748302232647 | etot = -8.13378366665042 +258000 ekin = 1.11669715917833 | erot = 1.71938873503377 | epot = -10.9698695610666 | etot = -8.1337836668545 +259000 ekin = 1.11461746403845 | erot = 1.72463904931154 | epot = -10.9730401803378 | etot = -8.13378366698779 +260000 ekin = 1.11796213299299 | erot = 1.72976096814025 | epot = -10.9815067682361 | etot = -8.13378366710283 +261000 ekin = 1.12495929560849 | erot = 1.73429797646884 | epot = -10.9930409392109 | etot = -8.13378366713357 +262000 ekin = 1.13415334886889 | erot = 1.73799782227262 | epot = -11.0059348383777 | etot = -8.13378366723624 +263000 ekin = 1.14419248657879 | erot = 1.74014341284042 | epot = -11.0181195666665 | etot = -8.13378366724733 +264000 ekin = 1.15486713033172 | erot = 1.74014049676802 | epot = -11.0287912942192 | etot = -8.13378366711944 +265000 ekin = 1.16757148072562 | erot = 1.73774643956244 | epot = -11.039101587165 | etot = -8.13378366687698 +266000 ekin = 1.18492523334795 | erot = 1.73313774545462 | epot = -11.0518466454031 | etot = -8.13378366660057 +267000 ekin = 1.20976553808811 | erot = 1.72682085390455 | epot = -11.0703700583738 | etot = -8.13378366638118 +268000 ekin = 1.24403111905913 | erot = 1.71946869065513 | epot = -11.0972834759989 | etot = -8.13378366628467 +269000 ekin = 1.28796807043274 | erot = 1.71176934564142 | epot = -11.1335210824109 | etot = -8.1337836663367 +270000 ekin = 1.33984072253569 | erot = 1.70434119615681 | epot = -11.1779655852158 | etot = -8.13378366652329 +271000 ekin = 1.39615730896389 | erot = 1.69774776464927 | epot = -11.2276887403894 | etot = -8.13378366677628 +272000 ekin = 1.45234426470736 | erot = 1.69276715684625 | epot = -11.2788950886277 | etot = -8.13378366707408 +273000 ekin = 1.50368133070088 | erot = 1.6899254699141 | epot = -11.3273904679296 | etot = -8.13378366731462 +274000 ekin = 1.54639996326 | erot = 1.68983337629059 | epot = -11.370017006963 | etot = -8.13378366741239 +275000 ekin = 1.57877490149118 | erot = 1.69332235277519 | epot = -11.4058809215982 | etot = -8.13378366733188 +276000 ekin = 1.60168052283697 | erot = 1.70138855155645 | epot = -11.4368527414914 | etot = -8.13378366709803 +277000 ekin = 1.61832490283356 | erot = 1.71502642603421 | epot = -11.4671349956708 | etot = -8.13378366680302 +278000 ekin = 1.63311060675523 | erot = 1.73495415768231 | epot = -11.5018484310168 | etot = -8.13378366657925 +279000 ekin = 1.64995273995076 | erot = 1.76130541528063 | epot = -11.5450418217764 | etot = -8.13378366654497 +280000 ekin = 1.67073877093535 | erot = 1.79339849893338 | epot = -11.5979209366138 | etot = -8.13378366674507 +281000 ekin = 1.69438407985013 | erot = 1.82970064438665 | epot = -11.6578683914582 | etot = -8.13378366722143 +282000 ekin = 1.71376506080739 | erot = 1.86795891950377 | epot = -11.7155076481303 | etot = -8.13378366781918 +283000 ekin = 1.72224450525141 | erot = 1.90529068548223 | epot = -11.7613188590744 | etot = -8.13378366834076 +284000 ekin = 1.71505262177035 | erot = 1.93881515489586 | epot = -11.7876514453522 | etot = -8.13378366868602 +285000 ekin = 1.68954869056281 | erot = 1.96608819497556 | epot = -11.7894205543605 | etot = -8.13378366882217 +286000 ekin = 1.6455513774747 | erot = 1.98537597121301 | epot = -11.7647110174613 | etot = -8.13378366877358 +287000 ekin = 1.58495470812897 | erot = 1.9957898988245 | epot = -11.7145282755451 | etot = -8.13378366859164 +288000 ekin = 1.51101761585275 | erot = 1.99729776792806 | epot = -11.6420990521107 | etot = -8.13378366832988 +289000 ekin = 1.42766231980656 | erot = 1.99063899576466 | epot = -11.5520849836047 | etot = -8.13378366803348 +290000 ekin = 1.338945014859 | erot = 1.97716758999172 | epot = -11.4498962725825 | etot = -8.13378366773178 +291000 ekin = 1.24881721187693 | erot = 1.95864649303019 | epot = -11.3412473723294 | etot = -8.13378366742226 +292000 ekin = 1.16137515575313 | erot = 1.93702958191795 | epot = -11.2321884047267 | etot = -8.13378366705556 +293000 ekin = 1.08169833470348 | erot = 1.9142773845531 | epot = -11.1297593858137 | etot = -8.13378366655716 +294000 ekin = 1.01689863825985 | erot = 1.89223243581211 | epot = -11.0429147399692 | etot = -8.13378366589725 +295000 ekin = 0.976377352946778 | erot = 1.87253324956461 | epot = -10.9826942676899 | etot = -8.13378366517849 +296000 ekin = 0.970182395976462 | erot = 1.85650679550437 | epot = -10.9604728561375 | etot = -8.13378366465669 +297000 ekin = 1.00537151816906 | erot = 1.84499118418766 | epot = -10.9841463669825 | etot = -8.13378366462574 +298000 ekin = 1.0820053414681 | erot = 1.83812417715831 | epot = -11.0539131838607 | etot = -8.13378366523425 +299000 ekin = 1.19125189129924 | erot = 1.83519410294432 | epot = -11.1602296606202 | etot = -8.1337836663766 +300000 ekin = 1.31698721061554 | erot = 1.83465168975606 | epot = -11.2854225681191 | etot = -8.13378366774752 +301000 ekin = 1.44008784809517 | erot = 1.83433803115701 | epot = -11.4082095482453 | etot = -8.13378366899308 +302000 ekin = 1.54329548540448 | erot = 1.8319000019698 | epot = -11.5089791572141 | etot = -8.13378366983984 +303000 ekin = 1.61484992407372 | erot = 1.82529439832958 | epot = -11.5739279925579 | etot = -8.13378367015465 +304000 ekin = 1.6501104781044 | erot = 1.81324433416795 | epot = -11.5971384822055 | etot = -8.1337836699332 +305000 ekin = 1.65140814366674 | erot = 1.79549497030301 | epot = -11.5806867832603 | etot = -8.13378366929059 +306000 ekin = 1.62643416627266 | erot = 1.77280218913836 | epot = -11.5330200238207 | etot = -8.13378366840971 +307000 ekin = 1.58577500467047 | erot = 1.7466850070814 | epot = -11.466243679247 | etot = -8.13378366749516 +308000 ekin = 1.54030424866547 | erot = 1.7190380162455 | epot = -11.3931259316263 | etot = -8.13378366671535 +309000 ekin = 1.49900091050368 | erot = 1.69173690591768 | epot = -11.3245214826107 | etot = -8.13378366618935 +310000 ekin = 1.46747597212359 | erot = 1.66636932779436 | epot = -11.2676289658602 | etot = -8.13378366594223 +311000 ekin = 1.44771419446125 | erot = 1.6441044887669 | epot = -11.2256023491812 | etot = -8.13378366595302 +312000 ekin = 1.43839141863299 | erot = 1.62568199896102 | epot = -11.1978570837369 | etot = -8.13378366614285 +313000 ekin = 1.43594352565172 | erot = 1.61150443049414 | epot = -11.1812316225564 | etot = -8.13378366641055 +314000 ekin = 1.43595255617426 | erot = 1.60177116104733 | epot = -11.1715073838784 | etot = -8.13378366665676 +315000 ekin = 1.43500742741075 | erot = 1.59648896098848 | epot = -11.1652800551081 | etot = -8.13378366670885 +316000 ekin = 1.43108473245964 | erot = 1.59565804393782 | epot = -11.1605264431215 | etot = -8.13378366672408 +317000 ekin = 1.42390336284279 | erot = 1.59957952106374 | epot = -11.1572665504365 | etot = -8.13378366652995 +318000 ekin = 1.41631295379013 | erot = 1.60866819207335 | epot = -11.1587648120253 | etot = -8.1337836661618 +319000 ekin = 1.41381426233217 | erot = 1.62334142232427 | epot = -11.1709393503794 | etot = -8.13378366572294 +320000 ekin = 1.42315030252318 | erot = 1.64384116840432 | epot = -11.2007751362921 | etot = -8.13378366536455 +321000 ekin = 1.4502484549416 | erot = 1.67003325940262 | epot = -11.2540653795816 | etot = -8.13378366523739 +322000 ekin = 1.49815500536739 | erot = 1.70123818171541 | epot = -11.333176852525 | etot = -8.13378366544223 +323000 ekin = 1.56569352501793 | erot = 1.73609284126728 | epot = -11.435570032302 | etot = -8.13378366601681 +324000 ekin = 1.64679224020953 | erot = 1.77264010660174 | epot = -11.5532160138053 | etot = -8.13378366699399 +325000 ekin = 1.73163775630582 | erot = 1.80818795205706 | epot = -11.673609376406 | etot = -8.13378366804313 +326000 ekin = 1.80750329207855 | erot = 1.83980749295788 | epot = -11.7810944543838 | etot = -8.1337836693474 +327000 ekin = 1.85797659456065 | erot = 1.86537346542197 | epot = -11.8571337303088 | etot = -8.13378367032619 +328000 ekin = 1.87027520748334 | erot = 1.88392315073408 | epot = -11.8879820288766 | etot = -8.1337836706592 +329000 ekin = 1.83949589054195 | erot = 1.89597309718977 | epot = -11.8692526579103 | etot = -8.13378367017855 +330000 ekin = 1.77117100868406 | erot = 1.90323589019568 | epot = -11.8081905678758 | etot = -8.13378366899602 +331000 ekin = 1.68023517872834 | erot = 1.90771959425569 | epot = -11.7217384405291 | etot = -8.13378366754505 +332000 ekin = 1.58599656571047 | erot = 1.91066851347226 | epot = -11.630448745533 | etot = -8.13378366635028 +333000 ekin = 1.50566649891299 | erot = 1.91203797343779 | epot = -11.5514881380494 | etot = -8.13378366569858 +334000 ekin = 1.44997196058755 | erot = 1.91073772769942 | epot = -11.4944933538478 | etot = -8.13378366556085 +335000 ekin = 1.42175053140652 | erot = 1.9051560562899 | epot = -11.4606902539305 | etot = -8.13378366623405 +336000 ekin = 1.41662531058297 | erot = 1.89330033651289 | epot = -11.4437093137209 | etot = -8.13378366662504 +337000 ekin = 1.42902342419778 | erot = 1.87459660541321 | epot = -11.437403696558 | etot = -8.13378366694704 +338000 ekin = 1.45347553473981 | erot = 1.84924982278916 | epot = -11.4365090247012 | etot = -8.13378366717226 +339000 ekin = 1.48532648332114 | erot = 1.81789825388429 | epot = -11.4370084045391 | etot = -8.13378366733368 +340000 ekin = 1.52068113212375 | erot = 1.78131054290074 | epot = -11.4357753424987 | etot = -8.13378366747424 +341000 ekin = 1.55606070128761 | erot = 1.74019406298195 | epot = -11.4300384318839 | etot = -8.13378366761432 +342000 ekin = 1.58819693536347 | erot = 1.69515176482589 | epot = -11.4171323679297 | etot = -8.1337836677403 +343000 ekin = 1.61415529814656 | erot = 1.64675903934792 | epot = -11.3946980053091 | etot = -8.13378366781461 +344000 ekin = 1.63171879307223 | erot = 1.59569319794067 | epot = -11.3611956588139 | etot = -8.13378366780101 +345000 ekin = 1.63976605961484 | erot = 1.54282704208847 | epot = -11.3163767693982 | etot = -8.13378366769487 +346000 ekin = 1.63837200138306 | erot = 1.48918714016547 | epot = -11.2613428090693 | etot = -8.13378366752076 +347000 ekin = 1.62852754177416 | erot = 1.43587351564653 | epot = -11.1981847247515 | etot = -8.13378366733081 +348000 ekin = 1.61158889283619 | erot = 1.38392546940151 | epot = -11.1292980294103 | etot = -8.13378366717258 +349000 ekin = 1.58873557439522 | erot = 1.3342285052023 | epot = -11.056747746671 | etot = -8.13378366707351 +350000 ekin = 1.56064786721489 | erot = 1.28749851959581 | epot = -10.9819300538427 | etot = -8.13378366703198 +351000 ekin = 1.52754191191417 | erot = 1.24434620359135 | epot = -10.9056717825192 | etot = -8.13378366701369 +352000 ekin = 1.48960299204036 | erot = 1.20538641997798 | epot = -10.8287730789784 | etot = -8.13378366696006 +353000 ekin = 1.44778264503061 | erot = 1.171343997089 | epot = -10.7529103089073 | etot = -8.13378366678773 +354000 ekin = 1.40533100953429 | erot = 1.14324844922355 | epot = -10.6823631252439 | etot = -8.13378366648608 +355000 ekin = 1.36869095863523 | erot = 1.12250242069097 | epot = -10.624977045381 | etot = -8.1337836660548 +356000 ekin = 1.34490175995588 | erot = 1.10992990777971 | epot = -10.5886153331823 | etot = -8.13378366544672 +357000 ekin = 1.34315796276068 | erot = 1.10621719879485 | epot = -10.583158826382 | etot = -8.13378366482642 +358000 ekin = 1.37283801207963 | erot = 1.11171347587629 | epot = -10.618335152412 | etot = -8.13378366445607 +359000 ekin = 1.43996759058429 | erot = 1.12612871057334 | epot = -10.6998799657449 | etot = -8.13378366458728 +360000 ekin = 1.54388445914205 | erot = 1.14830381564056 | epot = -10.8259719401007 | etot = -8.13378366531803 +361000 ekin = 1.67586531509345 | erot = 1.17618905419133 | epot = -10.9858380358555 | etot = -8.13378366657067 +362000 ekin = 1.82005627455731 | erot = 1.20703160753369 | epot = -11.1608715500468 | etot = -8.13378366795576 +363000 ekin = 1.95850583937509 | erot = 1.23798141777763 | epot = -11.3302709261667 | etot = -8.13378366901394 +364000 ekin = 2.07580017664631 | erot = 1.26672677095189 | epot = -11.4763106177203 | etot = -8.13378367012209 +365000 ekin = 2.15891662517649 | erot = 1.2917362149566 | epot = -11.5844365106038 | etot = -8.13378367047072 +366000 ekin = 2.20238380195972 | erot = 1.31262064914741 | epot = -11.6487881213393 | etot = -8.13378367023221 +367000 ekin = 2.20851727275469 | erot = 1.33022857587836 | epot = -11.6725295182434 | etot = -8.13378366961035 +368000 ekin = 2.18513118770655 | erot = 1.34632721319968 | epot = -11.6652420696044 | etot = -8.13378366869816 +369000 ekin = 2.14321144646706 | erot = 1.36315448463277 | epot = -11.6401495989035 | etot = -8.13378366780372 +370000 ekin = 2.09388282413385 | erot = 1.3829685872038 | epot = -11.6106350785146 | etot = -8.13378366717694 +371000 ekin = 2.04539161606724 | erot = 1.40758201280237 | epot = -11.5867572956937 | etot = -8.13378366682407 +372000 ekin = 2.00261126514749 | erot = 1.43827057512703 | epot = -11.5746655069406 | etot = -8.13378366666604 +373000 ekin = 1.96798302472978 | erot = 1.47584503943867 | epot = -11.5776117307488 | etot = -8.13378366658035 +374000 ekin = 1.94276422015114 | erot = 1.52074221163633 | epot = -11.5972900983356 | etot = -8.13378366654817 +375000 ekin = 1.92741631545308 | erot = 1.57302624843858 | epot = -11.6342262305094 | etot = -8.13378366661773 +376000 ekin = 1.92110841836944 | erot = 1.63232320681393 | epot = -11.6872152920323 | etot = -8.13378366684892 +377000 ekin = 1.92083197490068 | erot = 1.69770894533905 | epot = -11.7523245875422 | etot = -8.13378366730247 +378000 ekin = 1.92097158012548 | erot = 1.76763055654398 | epot = -11.8223858045424 | etot = -8.13378366787295 +379000 ekin = 1.91438056917346 | erot = 1.8396431871319 | epot = -11.8878074249562 | etot = -8.13378366865082 +380000 ekin = 1.89241520119971 | erot = 1.91106138177138 | epot = -11.9372602523288 | etot = -8.13378366935769 +381000 ekin = 1.84711843121782 | erot = 1.97933543814791 | epot = -11.9602375392315 | etot = -8.13378366986578 +382000 ekin = 1.77364821789102 | erot = 2.04210934440318 | epot = -11.9495412323511 | etot = -8.13378367005693 +383000 ekin = 1.67178472399957 | erot = 2.09754562137053 | epot = -11.9031140151933 | etot = -8.1337836698232 +384000 ekin = 1.5470955648157 | erot = 2.14438708234687 | epot = -11.8252663163821 | etot = -8.1337836692195 +385000 ekin = 1.41093432867773 | erot = 2.18184182145426 | epot = -11.7265598182878 | etot = -8.13378366815581 +386000 ekin = 1.27958936994476 | erot = 2.2105134023135 | epot = -11.6238864391471 | etot = -8.13378366688884 +387000 ekin = 1.17137861198395 | erot = 2.23163165240068 | epot = -11.5367939301748 | etot = -8.13378366579022 +388000 ekin = 1.10179780402381 | erot = 2.24634754527801 | epot = -11.4819290145291 | etot = -8.13378366522729 +389000 ekin = 1.0788214896871 | erot = 2.25505587957633 | epot = -11.4676610376637 | etot = -8.13378366840031 +390000 ekin = 1.0705157013643 | erot = 2.26936424220645 | epot = -11.4736636037199 | etot = -8.13378366014919 +391000 ekin = 1.12513305991339 | erot = 2.2855798798748 | epot = -11.5444966077406 | etot = -8.13378366795243 +392000 ekin = 1.21295440172158 | erot = 2.27063670340333 | epot = -11.6173747716302 | etot = -8.13378366650531 +393000 ekin = 1.30924312365224 | erot = 2.24076930893604 | epot = -11.6837960997163 | etot = -8.13378366712804 +394000 ekin = 1.40561895760406 | erot = 2.19794335034459 | epot = -11.7373459753389 | etot = -8.13378366739026 +395000 ekin = 1.49662707239142 | erot = 2.14293675801952 | epot = -11.7733474977458 | etot = -8.1337836673349 +396000 ekin = 1.58077727991405 | erot = 2.07761988891095 | epot = -11.7921808358742 | etot = -8.13378366704919 +397000 ekin = 1.65955042581825 | erot = 2.0046983719103 | epot = -11.7980324643568 | etot = -8.13378366662829 +398000 ekin = 1.73622447988656 | erot = 1.9274307725286 | epot = -11.7974389185606 | etot = -8.13378366614548 +399000 ekin = 1.81471876942306 | erot = 1.84941455049466 | epot = -11.7979169856368 | etot = -8.13378366571907 +400000 ekin = 1.8983134508337 | erot = 1.77428869309176 | epot = -11.8063858093358 | etot = -8.1337836654103 +401000 ekin = 1.98857882165182 | erot = 1.70555701947582 | epot = -11.8279195064049 | etot = -8.13378366527722 +402000 ekin = 2.08469272454841 | erot = 1.64640053761235 | epot = -11.8648769274935 | etot = -8.13378366533273 +403000 ekin = 2.18333492883605 | erot = 1.59947809827627 | epot = -11.9165966926826 | etot = -8.13378366557027 +404000 ekin = 2.27899469657427 | erot = 1.56671457666619 | epot = -11.9794929390981 | etot = -8.13378366585767 +405000 ekin = 2.36506409046445 | erot = 1.54904572147219 | epot = -12.0478934783852 | etot = -8.13378366644859 +406000 ekin = 2.43306193249475 | erot = 1.546304344122 | epot = -12.1131499437743 | etot = -8.13378366715758 +407000 ekin = 2.4736418638006 | erot = 1.55689186413037 | epot = -12.1643173959494 | etot = -8.13378366801846 +408000 ekin = 2.47760299471968 | erot = 1.57810641384436 | epot = -12.1894930773271 | etot = -8.13378366876308 +409000 ekin = 2.43822850842007 | erot = 1.60664113475445 | epot = -12.1786533122524 | etot = -8.1337836690779 +410000 ekin = 2.35516301279646 | erot = 1.63934184028347 | epot = -12.1282885218097 | etot = -8.13378366872976 +411000 ekin = 2.23661952276616 | erot = 1.67408087730609 | epot = -12.0444840678173 | etot = -8.13378366774505 +412000 ekin = 2.09851267461395 | erot = 1.71012170017572 | epot = -11.9424180412093 | etot = -8.1337836664196 +413000 ekin = 1.96056484793519 | erot = 1.74778804011123 | epot = -11.8421365532004 | etot = -8.13378366515394 +414000 ekin = 1.84128090481262 | erot = 1.78771082122138 | epot = -11.7627753903042 | etot = -8.13378366427025 +415000 ekin = 1.75390442336068 | erot = 1.83009103154498 | epot = -11.7177791188318 | etot = -8.1337836639261 +416000 ekin = 1.70439570487926 | erot = 1.87425008285701 | epot = -11.7124294518636 | etot = -8.13378366412739 +417000 ekin = 1.69131554253175 | erot = 1.91850147883749 | epot = -11.743600686186 | etot = -8.13378366481675 +418000 ekin = 1.70689490032135 | erot = 1.96025799788817 | epot = -11.8009365639669 | etot = -8.13378366575739 +419000 ekin = 1.73962222230745 | erot = 1.99637255840753 | epot = -11.8697784475041 | etot = -8.13378366678912 +420000 ekin = 1.77669286262858 | erot = 2.02357619715018 | epot = -11.9340527274824 | etot = -8.13378366770368 +421000 ekin = 1.80657824083284 | erot = 2.0390304955572 | epot = -11.9793924047177 | etot = -8.13378366832764 +422000 ekin = 1.82111290086208 | erot = 2.04088419799593 | epot = -11.9957807674312 | etot = -8.1337836685732 +423000 ekin = 1.81648584568944 | erot = 2.02865244729818 | epot = -11.9789219614471 | etot = -8.13378366845947 +424000 ekin = 1.79301691785358 | erot = 2.00326876348541 | epot = -11.930069349413 | etot = -8.13378366807404 +425000 ekin = 1.7542404696839 | erot = 1.96680784722109 | epot = -11.8548319844133 | etot = -8.13378366750828 +426000 ekin = 1.70601392329575 | erot = 1.92202692836949 | epot = -11.7618245184928 | etot = -8.13378366682755 +427000 ekin = 1.65580906013395 | erot = 1.87186985441023 | epot = -11.6614625806825 | etot = -8.13378366613827 +428000 ekin = 1.61207963969974 | erot = 1.81905558542117 | epot = -11.5649188905573 | etot = -8.13378366543637 +429000 ekin = 1.58339999423441 | erot = 1.76579893171643 | epot = -11.4829825908618 | etot = -8.13378366491091 +430000 ekin = 1.57646033948071 | erot = 1.71346152699261 | epot = -11.4237055311749 | etot = -8.13378366470161 +431000 ekin = 1.59418488211472 | erot = 1.66239892772815 | epot = -11.3903674747328 | etot = -8.13378366488997 +432000 ekin = 1.63452809772422 | erot = 1.61205574803984 | epot = -11.3803675111975 | etot = -8.13378366543346 +433000 ekin = 1.69077410977618 | erot = 1.56136635610516 | epot = -11.3859241320224 | etot = -8.13378366614102 +434000 ekin = 1.75368500743292 | erot = 1.50939558466323 | epot = -11.3968642588314 | etot = -8.13378366673528 +435000 ekin = 1.81477188941735 | erot = 1.45598133799836 | epot = -11.4045368944183 | etot = -8.13378366700259 +436000 ekin = 1.86895151228505 | erot = 1.40204530897968 | epot = -11.404780488101 | etot = -8.13378366683627 +437000 ekin = 1.91551323813655 | erot = 1.34941425923463 | epot = -11.3987111639599 | etot = -8.13378366658874 +438000 ekin = 1.95545357706127 | erot = 1.30011080733677 | epot = -11.3893480508785 | etot = -8.13378366648046 +439000 ekin = 1.98811153075382 | erot = 1.25557284833865 | epot = -11.3774680457389 | etot = -8.13378366664641 +440000 ekin = 2.00986623435756 | erot = 1.21630204161131 | epot = -11.3599519429641 | etot = -8.13378366699526 +441000 ekin = 2.01530350765493 | erot = 1.18202297032947 | epot = -11.3311101452728 | etot = -8.13378366728836 +442000 ekin = 1.9993634967869 | erot = 1.15207873138354 | epot = -11.2852258960248 | etot = -8.13378366785433 +443000 ekin = 1.95696749681392 | erot = 1.12547607064215 | epot = -11.2162272349849 | etot = -8.1337836675288 +444000 ekin = 1.89166490098825 | erot = 1.10194461448165 | epot = -11.1273931823305 | etot = -8.13378366686056 +445000 ekin = 1.81328868644756 | erot = 1.08168732032795 | epot = -11.0287596725697 | etot = -8.13378366579416 +446000 ekin = 1.7357789947487 | erot = 1.06505071493094 | epot = -10.9346133747261 | etot = -8.1337836650465 +447000 ekin = 1.67093185589145 | erot = 1.05239705127173 | epot = -10.8571125714753 | etot = -8.13378366431213 +448000 ekin = 1.62911856820013 | erot = 1.04409603312877 | epot = -10.8069982651763 | etot = -8.13378366384744 +449000 ekin = 1.61731626297624 | erot = 1.04041489697374 | epot = -10.7915148237116 | etot = -8.13378366376162 +450000 ekin = 1.6371169760635 | erot = 1.04135992229854 | epot = -10.8122605627073 | etot = -8.13378366434522 +451000 ekin = 1.68320258142863 | erot = 1.04620824656701 | epot = -10.8631944930294 | etot = -8.13378366503374 +452000 ekin = 1.74581668012429 | erot = 1.05391169410258 | epot = -10.9335120400066 | etot = -8.13378366577969 +453000 ekin = 1.81457146101262 | erot = 1.06335165863559 | epot = -11.0117067861272 | etot = -8.13378366647896 +454000 ekin = 1.87975957939155 | erot = 1.07317402238584 | epot = -11.0867172689134 | etot = -8.13378366713605 +455000 ekin = 1.9325187758859 | erot = 1.0817162332551 | epot = -11.1480186769514 | etot = -8.13378366781045 +456000 ekin = 1.96415416827458 | erot = 1.08704156958786 | epot = -11.1849794063639 | etot = -8.13378366850143 +457000 ekin = 1.96605348077707 | erot = 1.08723394294108 | epot = -11.1870710927892 | etot = -8.13378366907104 +458000 ekin = 1.93127523761404 | erot = 1.08096076790283 | epot = -11.1460196747808 | etot = -8.13378366926398 +459000 ekin = 1.85771594839407 | erot = 1.06809531780543 | epot = -11.0595949350247 | etot = -8.13378366882522 +460000 ekin = 1.75147188083469 | erot = 1.05009293158145 | epot = -10.9353484800619 | etot = -8.13378366764577 +461000 ekin = 1.62834142733422 | erot = 1.02990811326217 | epot = -10.7920332064989 | etot = -8.13378366590246 +462000 ekin = 1.51195360647266 | erot = 1.01153881174185 | epot = -10.6572760811912 | etot = -8.13378366297672 +463000 ekin = 1.43011910143164 | erot = 1.00022578453557 | epot = -10.5641285481427 | etot = -8.13378366217548 +464000 ekin = 1.39582910826903 | erot = 0.998198432074986 | epot = -10.5278112021952 | etot = -8.1337836618512 +465000 ekin = 1.41007554849745 | erot = 1.00592009003026 | epot = -10.5497793012316 | etot = -8.13378366270389 +466000 ekin = 1.46251969360414 | erot = 1.02219738030375 | epot = -10.6185007378594 | etot = -8.13378366395154 +467000 ekin = 1.49627186619546 | erot = 1.05472101824476 | epot = -10.6847765487641 | etot = -8.13378366432389 +468000 ekin = 1.51725853676646 | erot = 1.12479885666538 | epot = -10.7758410579682 | etot = -8.13378366453633 +469000 ekin = 1.58140637754108 | erot = 1.16828828958057 | epot = -10.8834783316039 | etot = -8.13378366448221 +470000 ekin = 1.60068578297537 | erot = 1.1811414102052 | epot = -10.9156108575306 | etot = -8.13378366435 +471000 ekin = 1.59076368324978 | erot = 1.18707237246534 | epot = -10.911619719416 | etot = -8.13378366370092 +472000 ekin = 1.56124060598129 | erot = 1.18572143100842 | epot = -10.8807456997834 | etot = -8.1337836627937 +473000 ekin = 1.5250209740962 | erot = 1.17792025680898 | epot = -10.8367248927409 | etot = -8.13378366183571 +474000 ekin = 1.49533177224124 | erot = 1.16544446213364 | epot = -10.7945598953308 | etot = -8.1337836609559 +475000 ekin = 1.48386630174459 | erot = 1.15068540215452 | epot = -10.768335364138 | etot = -8.13378366023887 +476000 ekin = 1.49971334631653 | erot = 1.13623821677884 | epot = -10.7697352228395 | etot = -8.13378365974411 +477000 ekin = 1.5487111876888 | erot = 1.12448433352661 | epot = -10.8069791813277 | etot = -8.13378366011226 +478000 ekin = 1.62953491120247 | erot = 1.1176426890345 | epot = -10.8809612604774 | etot = -8.13378366024041 +479000 ekin = 1.73735741644254 | erot = 1.117006208111 | epot = -10.9881472852204 | etot = -8.13378366066682 +480000 ekin = 1.86556210288884 | erot = 1.12262064774855 | epot = -11.1219664120706 | etot = -8.13378366143325 +481000 ekin = 2.00121026336288 | erot = 1.1336486002113 | epot = -11.2686425499408 | etot = -8.13378368636666 +482000 ekin = 2.04617329753799 | erot = 1.1625692617215 | epot = -11.3425262237474 | etot = -8.1337836644879 +483000 ekin = 2.14335261837481 | erot = 1.2147627313197 | epot = -11.4918990326043 | etot = -8.13378368290979 +484000 ekin = 2.20270995355674 | erot = 1.23147381806447 | epot = -11.5679674446405 | etot = -8.13378367301928 +485000 ekin = 2.20682939440538 | erot = 1.23835798981609 | epot = -11.5789710574745 | etot = -8.13378367325297 +486000 ekin = 2.16589682793847 | erot = 1.24300370551386 | epot = -11.5426842062817 | etot = -8.13378367282935 +487000 ekin = 2.08668888864475 | erot = 1.24625551751706 | epot = -11.4667280780089 | etot = -8.13378367184709 +488000 ekin = 1.98386509124435 | erot = 1.24977318046269 | epot = -11.3674219422309 | etot = -8.1337836705239 +489000 ekin = 1.8770793102991 | erot = 1.255470127734 | epot = -11.2663331071942 | etot = -8.13378366916115 +490000 ekin = 1.78677596316064 | erot = 1.26490338721773 | epot = -11.1854630185056 | etot = -8.13378366812726 +491000 ekin = 1.72903831213024 | erot = 1.27867004038023 | epot = -11.1414920203099 | etot = -8.13378366779945 +492000 ekin = 1.71039979056745 | erot = 1.2959176810728 | epot = -11.1401011400604 | etot = -8.13378366842019 +493000 ekin = 1.72454317155255 | erot = 1.31423280426937 | epot = -11.1725596457264 | etot = -8.13378366990446 +494000 ekin = 1.75332785014951 | erot = 1.33022406247028 | epot = -11.2173355843427 | etot = -8.13378367172286 +495000 ekin = 1.77349565825601 | erot = 1.34086561473764 | epot = -11.248144946032 | etot = -8.13378367303834 +496000 ekin = 1.76725059668319 | erot = 1.34512484287368 | epot = -11.2461591127086 | etot = -8.1337836731517 +497000 ekin = 1.73127637990569 | erot = 1.34494708213011 | epot = -11.2100071339989 | etot = -8.13378367196309 +498000 ekin = 1.67855000909753 | erot = 1.34489121265361 | epot = -11.1572248917884 | etot = -8.13378367003722 +499000 ekin = 1.63191747121451 | erot = 1.35056727534129 | epot = -11.1162684147704 | etot = -8.13378366821463 +500000 ekin = 1.6137835999163 | erot = 1.36676364682263 | epot = -11.1143309138908 | etot = -8.13378366715187 +501000 ekin = 1.6375810198933 | erot = 1.39609850677296 | epot = -11.1674631937686 | etot = -8.13378366710232 +502000 ekin = 1.70413807541648 | erot = 1.43847493669639 | epot = -11.2763966800811 | etot = -8.13378366796824 +503000 ekin = 1.80268297747067 | erot = 1.49115460254022 | epot = -11.4276212495033 | etot = -8.13378366949244 +504000 ekin = 1.9141954977774 | erot = 1.54914693964006 | epot = -11.5971261088452 | etot = -8.13378367142778 +505000 ekin = 2.01490443996074 | erot = 1.6057640650419 | epot = -11.7544521785436 | etot = -8.13378367354096 +506000 ekin = 2.07966541468552 | erot = 1.65345439353817 | epot = -11.8669034836636 | etot = -8.13378367543991 +507000 ekin = 2.08700353894391 | erot = 1.68517460629184 | epot = -11.9059618217143 | etot = -8.13378367647857 +508000 ekin = 2.0266335266071 | erot = 1.69625747623332 | epot = -11.8566746789094 | etot = -8.13378367606896 +509000 ekin = 1.9058906413155 | erot = 1.68599529702425 | epot = -11.725669612527 | etot = -8.13378367418728 +510000 ekin = 1.74959091230051 | erot = 1.65787688253056 | epot = -11.5412514662974 | etot = -8.13378367146631 +511000 ekin = 1.59231955656842 | erot = 1.6182626673137 | epot = -11.3443658926589 | etot = -8.13378366877683 +512000 ekin = 1.46755856058655 | erot = 1.574346623802 | epot = -11.1756888512705 | etot = -8.13378366688192 +513000 ekin = 1.3983991609166 | erot = 1.53234768377425 | epot = -11.0645305108004 | etot = -8.13378366610958 +514000 ekin = 1.39338903685241 | erot = 1.49706258344285 | epot = -11.0242352864508 | etot = -8.13378366615559 +515000 ekin = 1.44495159060737 | erot = 1.47110271002737 | epot = -11.0498379681962 | etot = -8.13378366756146 +516000 ekin = 1.53288312820279 | erot = 1.45357064724177 | epot = -11.1202374448314 | etot = -8.1337836693868 +517000 ekin = 1.63159033311232 | erot = 1.44224294472549 | epot = -11.2076169492165 | etot = -8.13378367137872 +518000 ekin = 1.71409401454596 | erot = 1.43408399435521 | epot = -11.2819616821398 | etot = -8.13378367323862 +519000 ekin = 1.75665192755708 | erot = 1.42579002916576 | epot = -11.3162256317207 | etot = -8.13378367499789 +520000 ekin = 1.74187345946909 | erot = 1.41504839774624 | epot = -11.290705532421 | etot = -8.13378367520563 +521000 ekin = 1.66871703040042 | erot = 1.40071550595596 | epot = -11.2032162101062 | etot = -8.13378367374984 +522000 ekin = 1.55952182855679 | erot = 1.3833998364993 | epot = -11.0767053361963 | etot = -8.13378367114018 +523000 ekin = 1.45114556551102 | erot = 1.36568308064865 | epot = -10.9506123146175 | etot = -8.13378366845782 +524000 ekin = 1.38091842212155 | erot = 1.35134919390993 | epot = -10.8660512824778 | etot = -8.13378366644636 +525000 ekin = 1.37601425590438 | erot = 1.34456662956207 | epot = -10.8543645508773 | etot = -8.13378366541088 +526000 ekin = 1.44870428483712 | erot = 1.3490974017969 | epot = -10.9315853521455 | etot = -8.13378366551144 +527000 ekin = 1.5945986354535 | erot = 1.36714947552606 | epot = -11.0955317778941 | etot = -8.13378366691456 +528000 ekin = 1.7918340547974 | erot = 1.39841904593992 | epot = -11.3240367701565 | etot = -8.13378366941917 +529000 ekin = 2.00478978695404 | erot = 1.43972835788573 | epot = -11.5783018172113 | etot = -8.13378367237151 +530000 ekin = 2.19333795598997 | erot = 1.48552207658974 | epot = -11.8126437074694 | etot = -8.13378367488965 +531000 ekin = 2.32431476963038 | erot = 1.52928747156722 | epot = -11.9873859174876 | etot = -8.13378367629003 +532000 ekin = 2.37971447235942 | erot = 1.56539257219217 | epot = -12.078890721007 | etot = -8.1337836764554 +533000 ekin = 2.35771666713876 | erot = 1.59048999441718 | epot = -12.0819903372205 | etot = -8.13378367566452 +534000 ekin = 2.26899715447946 | erot = 1.60407394360566 | epot = -12.0068547722183 | etot = -8.13378367413313 +535000 ekin = 2.13365177459504 | erot = 1.60831072463745 | epot = -11.8757461712559 | etot = -8.13378367202338 +536000 ekin = 1.97886376168026 | erot = 1.60719127869265 | epot = -11.7198387101024 | etot = -8.13378366972953 +537000 ekin = 1.83421887316433 | erot = 1.6052389830352 | epot = -11.5732415239645 | etot = -8.13378366776499 +538000 ekin = 1.7253172089481 | erot = 1.60632519291408 | epot = -11.465426068374 | etot = -8.13378366651184 +539000 ekin = 1.66856519908309 | erot = 1.61301472932345 | epot = -11.4153635945303 | etot = -8.13378366612373 +540000 ekin = 1.66907056570911 | erot = 1.62662968766944 | epot = -11.429483919541 | etot = -8.13378366616247 +541000 ekin = 1.72153495930239 | erot = 1.64788745987798 | epot = -11.5032060865291 | etot = -8.13378366734877 +542000 ekin = 1.80903650499997 | erot = 1.67547869681539 | epot = -11.6182988707279 | etot = -8.13378366891259 +543000 ekin = 1.90894616838506 | erot = 1.7073450894897 | epot = -11.7500749284098 | etot = -8.13378367053506 +544000 ekin = 1.99777842842207 | erot = 1.74125357781803 | epot = -11.8728156781595 | etot = -8.13378367191943 +545000 ekin = 2.05546409376853 | erot = 1.7752100003717 | epot = -11.9644577669752 | etot = -8.13378367283499 +546000 ekin = 2.06867595315502 | erot = 1.80779483609561 | epot = -12.0102544624071 | etot = -8.13378367315649 +547000 ekin = 2.03267806246845 | erot = 1.83838588998399 | epot = -12.0048476253203 | etot = -8.13378367286789 +548000 ekin = 1.95148731421714 | erot = 1.8671839088262 | epot = -11.9524548951466 | etot = -8.13378367210323 +549000 ekin = 1.83645042329733 | erot = 1.89487456519778 | epot = -11.865108659532 | etot = -8.13378367103693 +550000 ekin = 1.7037313049418 | erot = 1.92233248820263 | epot = -11.7598474630215 | etot = -8.13378366987706 +551000 ekin = 1.57139422779038 | erot = 1.95024291867484 | epot = -11.6554208152766 | etot = -8.13378366881139 +552000 ekin = 1.45663332554879 | erot = 1.97878558862137 | epot = -11.5692025821639 | etot = -8.13378366799371 +553000 ekin = 1.37337409016338 | erot = 2.00744335364772 | epot = -11.5146011113573 | etot = -8.13378366754621 +554000 ekin = 1.33029485859016 | erot = 2.03496657144412 | epot = -11.4990450975783 | etot = -8.13378366754399 +555000 ekin = 1.32945359622626 | erot = 2.05953157375239 | epot = -11.5227688379757 | etot = -8.1337836679971 +556000 ekin = 1.36589068754812 | erot = 2.0790983760863 | epot = -11.5787727324453 | etot = -8.13378366881089 +557000 ekin = 1.42857577082434 | erot = 2.09193210846441 | epot = -11.6542915490903 | etot = -8.13378366980157 +558000 ekin = 1.50275359963621 | erot = 2.09715314139738 | epot = -11.7336904117649 | etot = -8.13378367073132 +559000 ekin = 1.57321830908012 | erot = 2.0951186218922 | epot = -11.8021206023679 | etot = -8.13378367139556 +560000 ekin = 1.62740172364614 | erot = 2.08745496893088 | epot = -11.8486403643047 | etot = -8.13378367172764 +561000 ekin = 1.65692416189542 | erot = 2.07666092047267 | epot = -11.8673687541756 | etot = -8.13378367180753 +562000 ekin = 1.65737426357432 | erot = 2.06544534214174 | epot = -11.8566032774488 | etot = -8.13378367173272 +563000 ekin = 1.62727808429362 | erot = 2.05615555037707 | epot = -11.8172173064581 | etot = -8.13378367178738 +564000 ekin = 1.56679933057649 | erot = 2.05047511799079 | epot = -11.7510581199199 | etot = -8.13378367135264 +565000 ekin = 1.48206055330475 | erot = 2.04917576858042 | epot = -11.6650199925319 | etot = -8.13378367064677 +566000 ekin = 1.38423866545304 | erot = 2.05221850149694 | epot = -11.5702408367336 | etot = -8.1337836697836 +567000 ekin = 1.28749391779484 | erot = 2.05873429504791 | epot = -11.4800118818287 | etot = -8.13378366898596 +568000 ekin = 1.20570431101636 | erot = 2.06705692033373 | epot = -11.4065448998072 | etot = -8.1337836684571 +569000 ekin = 1.14918558020451 | erot = 2.07495244465527 | epot = -11.3579216931492 | etot = -8.13378366828941 +570000 ekin = 1.12276449642623 | erot = 2.08007272961832 | epot = -11.3366208944897 | etot = -8.13378366844511 +571000 ekin = 1.12567595867963 | erot = 2.08050218013247 | epot = -11.3399618076128 | etot = -8.13378366880073 +572000 ekin = 1.15294903406445 | erot = 2.07519259344742 | epot = -11.361925296714 | etot = -8.13378366920215 +573000 ekin = 1.19838854914769 | erot = 2.06451015558314 | epot = -11.3966823739592 | etot = -8.13378366922832 +574000 ekin = 1.25460427385581 | erot = 2.04968889738443 | epot = -11.4380768407668 | etot = -8.13378366952656 +575000 ekin = 1.31454735692382 | erot = 2.03199549862628 | epot = -11.4803265250831 | etot = -8.13378366953303 +576000 ekin = 1.37512583608875 | erot = 2.01319845741096 | epot = -11.5221079628052 | etot = -8.13378366930547 +577000 ekin = 1.43682760501221 | erot = 1.99528982934614 | epot = -11.5659011033237 | etot = -8.13378366896538 +578000 ekin = 1.50235588200393 | erot = 1.98017269182714 | epot = -11.6163122424572 | etot = -8.13378366862608 +579000 ekin = 1.57520818415661 | erot = 1.96938672247192 | epot = -11.6783785749882 | etot = -8.13378366835971 +580000 ekin = 1.6586846249208 | erot = 1.96390249857434 | epot = -11.7563707921358 | etot = -8.13378366864064 +581000 ekin = 1.75247311825855 | erot = 1.96419308534606 | epot = -11.8504498724693 | etot = -8.13378366886464 +582000 ekin = 1.85283782857132 | erot = 1.96967477641428 | epot = -11.9562962743649 | etot = -8.13378366937934 +583000 ekin = 1.95429754597 | erot = 1.9782640549526 | epot = -12.0663452712483 | etot = -8.13378367032571 +584000 ekin = 2.04662916571846 | erot = 1.98631443704129 | epot = -12.1667272745317 | etot = -8.13378367177197 +585000 ekin = 2.11419694671339 | erot = 1.98862566441979 | epot = -12.2366062846731 | etot = -8.1337836735399 +586000 ekin = 2.13871236988187 | erot = 1.97915340581082 | epot = -12.2516494507752 | etot = -8.13378367508249 +587000 ekin = 2.10465783247742 | erot = 1.95256271522648 | epot = -12.191004223596 | etot = -8.13378367589215 +588000 ekin = 2.00543191749115 | erot = 1.90599988276949 | epot = -12.0452154755398 | etot = -8.13378367527917 +589000 ekin = 1.85115446104203 | erot = 1.84021509335382 | epot = -11.8251532276741 | etot = -8.13378367327826 +590000 ekin = 1.66921622808237 | erot = 1.75933351103099 | epot = -11.5623334095068 | etot = -8.13378367039345 +591000 ekin = 1.49774854838706 | erot = 1.66961531491678 | epot = -11.3011475307928 | etot = -8.13378366748897 +592000 ekin = 1.37418208601279 | erot = 1.57786762198314 | epot = -11.0858333735172 | etot = -8.13378366552125 +593000 ekin = 1.32230765435156 | erot = 1.49017042366288 | epot = -10.9462617430931 | etot = -8.1337836650787 +594000 ekin = 1.3443358458271 | erot = 1.41110289035714 | epot = -10.8892224022215 | etot = -8.13378366603731 +595000 ekin = 1.42313762142491 | erot = 1.34352894993738 | epot = -10.9004502389466 | etot = -8.13378366758431 +596000 ekin = 1.53140640357788 | erot = 1.28905714162215 | epot = -10.9542472149259 | etot = -8.13378366972589 +597000 ekin = 1.63793776665174 | erot = 1.24822708397561 | epot = -11.0199485217695 | etot = -8.13378367114217 +598000 ekin = 1.7185336949688 | erot = 1.22042305583814 | epot = -11.0727404229591 | etot = -8.13378367215213 +599000 ekin = 1.75676579671706 | erot = 1.20417119497698 | epot = -11.0947206644308 | etot = -8.1337836727368 +600000 ekin = 1.74415562350487 | erot = 1.19748501257288 | epot = -11.075424308894 | etot = -8.13378367281625 +601000 ekin = 1.68078686627226 | erot = 1.19842786467237 | epot = -11.0129984032328 | etot = -8.13378367228817 +602000 ekin = 1.5759276846428 | erot = 1.20571835983063 | epot = -10.915429715615 | etot = -8.13378367114156 +603000 ekin = 1.44736021988183 | erot = 1.2190655666565 | epot = -10.8002094561103 | etot = -8.133783669572 +604000 ekin = 1.31829530124237 | erot = 1.23900632720145 | epot = -10.6910852964292 | etot = -8.1337836679854 +605000 ekin = 1.21203583247901 | erot = 1.26625018195725 | epot = -10.6120696811993 | etot = -8.13378366676304 +606000 ekin = 1.14717881944628 | erot = 1.30114918573216 | epot = -10.5821116711632 | etot = -8.13378366598476 +607000 ekin = 1.13493137971139 | erot = 1.34344256501163 | epot = -10.6121576106362 | etot = -8.13378366591323 +608000 ekin = 1.17769398076198 | erot = 1.39211398655642 | epot = -10.7035916336253 | etot = -8.1337836663069 +609000 ekin = 1.27083042498511 | erot = 1.44572829442914 | epot = -10.8503423864968 | etot = -8.13378366708251 +610000 ekin = 1.4035930895439 | erot = 1.50241692808088 | epot = -11.0397936861368 | etot = -8.133783668512 +611000 ekin = 1.55996607947597 | erot = 1.55982171139495 | epot = -11.2535714606409 | etot = -8.13378366976994 +612000 ekin = 1.72323074886001 | erot = 1.61567444068074 | epot = -11.4726888606367 | etot = -8.13378367109591 +613000 ekin = 1.87623356286641 | erot = 1.66732234624289 | epot = -11.6773395815026 | etot = -8.1337836723933 +614000 ekin = 2.00332542688057 | erot = 1.71185786770914 | epot = -11.8489669679118 | etot = -8.13378367332208 +615000 ekin = 2.0938447106977 | erot = 1.74706892485965 | epot = -11.9746973091568 | etot = -8.13378367359943 +616000 ekin = 2.14582652013177 | erot = 1.77208418550972 | epot = -12.0516943786639 | etot = -8.13378367302244 +617000 ekin = 2.1676403255335 | erot = 1.78786476154915 | epot = -12.0892887588858 | etot = -8.1337836718031 +618000 ekin = 2.17543321837801 | erot = 1.79702594194235 | epot = -12.1062428306753 | etot = -8.13378367035489 +619000 ekin = 2.18765015126267 | erot = 1.80309631575683 | epot = -12.1245301362433 | etot = -8.13378366922382 +620000 ekin = 2.21827388576719 | erot = 1.80941579610045 | epot = -12.1614733506294 | etot = -8.13378366876175 +621000 ekin = 2.27256724286326 | erot = 1.81817906105047 | epot = -12.2245299729476 | etot = -8.13378366903384 +622000 ekin = 2.34686215368134 | erot = 1.82980019932889 | epot = -12.3104460228997 | etot = -8.13378366988947 +623000 ekin = 2.43079483960718 | erot = 1.84272954677985 | epot = -12.4073080574858 | etot = -8.13378367109877 +624000 ekin = 2.51074859397889 | erot = 1.85365912853719 | epot = -12.4981913948604 | etot = -8.13378367234431 +625000 ekin = 2.57376014757354 | erot = 1.85839628628492 | epot = -12.5659401070518 | etot = -8.13378367319335 +626000 ekin = 2.61178608743946 | erot = 1.85335246049266 | epot = -12.5989222212652 | etot = -8.13378367333303 +627000 ekin = 2.62439666915714 | erot = 1.83675929859779 | epot = -12.5949396405965 | etot = -8.13378367284157 +628000 ekin = 2.61715143116747 | erot = 1.80883297814572 | epot = -12.5597680815351 | etot = -8.13378367222192 +629000 ekin = 2.59614002780212 | erot = 1.77076928022058 | epot = -12.5006929799608 | etot = -8.13378367193806 +630000 ekin = 2.56316564608822 | erot = 1.72368862272812 | epot = -12.4206379408613 | etot = -8.13378367204495 +631000 ekin = 2.51545670840333 | erot = 1.66841938705302 | epot = -12.3176597677069 | etot = -8.13378367225056 +632000 ekin = 2.44898106284665 | erot = 1.60594586086193 | epot = -12.1887105959618 | etot = -8.13378367225321 +633000 ekin = 2.36287257798604 | erot = 1.537824267385 | epot = -12.0344805167293 | etot = -8.13378367135829 +634000 ekin = 2.26405242525212 | erot = 1.46623278031259 | epot = -11.86406887615 | etot = -8.13378367058526 +635000 ekin = 2.16101755721672 | erot = 1.39475566088742 | epot = -11.6895568878161 | etot = -8.13378366971194 +636000 ekin = 2.06475253332858 | erot = 1.32686506234682 | epot = -11.5254012642715 | etot = -8.13378366859611 +637000 ekin = 1.98973271037813 | erot = 1.26596624429403 | epot = -11.3894826221305 | etot = -8.1337836674583 +638000 ekin = 1.95146778323019 | erot = 1.21514985243814 | epot = -11.3004013023028 | etot = -8.13378366663451 +639000 ekin = 1.96182069136402 | erot = 1.17695161175762 | epot = -11.2725559693077 | etot = -8.13378366618603 +640000 ekin = 2.02679898932753 | erot = 1.15239183902456 | epot = -11.3129744949284 | etot = -8.13378366657635 +641000 ekin = 2.14199910312467 | erot = 1.14071086555715 | epot = -11.4164936363299 | etot = -8.13378366764812 +642000 ekin = 2.29285046318574 | erot = 1.13915186810496 | epot = -11.5657860007499 | etot = -8.13378366945922 +643000 ekin = 2.45552552113058 | erot = 1.14338828232168 | epot = -11.7326974750682 | etot = -8.13378367161592 +644000 ekin = 2.60133752584275 | erot = 1.1483536748964 | epot = -11.8834748743298 | etot = -8.1337836735906 +645000 ekin = 2.70371430393708 | erot = 1.14938437135862 | epot = -11.9868823501752 | etot = -8.13378367487955 +646000 ekin = 2.74463607559762 | erot = 1.14332224209485 | epot = -12.0217419929081 | etot = -8.13378367521562 +647000 ekin = 2.7181778723776 | erot = 1.12915792946955 | epot = -11.9811194764816 | etot = -8.13378367463448 +648000 ekin = 2.6302824606665 | erot = 1.10798613626309 | epot = -11.8720522703252 | etot = -8.13378367339563 +649000 ekin = 2.49559189348067 | erot = 1.08245328245142 | epot = -11.7118288477976 | etot = -8.1337836718655 +650000 ekin = 2.33293161555247 | erot = 1.05592857135991 | epot = -11.5226438572844 | etot = -8.13378367037205 +651000 ekin = 2.16312160403983 | erot = 1.03179243269255 | epot = -11.3286977053836 | etot = -8.13378366865123 +652000 ekin = 2.00437764472495 | erot = 1.01263346476082 | epot = -11.1507947776185 | etot = -8.13378366813275 +653000 ekin = 1.86320148187958 | erot = 0.999771298675487 | epot = -10.9967564485141 | etot = -8.13378366795902 +654000 ekin = 1.74159938814837 | erot = 0.993638993407277 | epot = -10.8690220495764 | etot = -8.13378366802077 +655000 ekin = 1.63877614369373 | erot = 0.993961110616547 | epot = -10.7665209224976 | etot = -8.13378366818728 +656000 ekin = 1.55293696393759 | erot = 0.999977751480608 | epot = -10.6866983837479 | etot = -8.1337836683297 +657000 ekin = 1.48301105565139 | erot = 1.01069155839246 | epot = -10.6274862823934 | etot = -8.13378366834955 +658000 ekin = 1.42991653833484 | erot = 1.02511295992719 | epot = -10.5888131664623 | etot = -8.13378366820028 +659000 ekin = 1.3970356213419 | erot = 1.04246417554468 | epot = -10.5732834647976 | etot = -8.13378366791104 +660000 ekin = 1.38964145712432 | erot = 1.06228082949086 | epot = -10.5857059541847 | etot = -8.13378366756947 +661000 ekin = 1.41337783441102 | erot = 1.08434723258998 | epot = -10.6315087344007 | etot = -8.13378366739969 +662000 ekin = 1.47169034618963 | erot = 1.10850483084535 | epot = -10.7139788445909 | etot = -8.13378366755594 +663000 ekin = 1.56097330114159 | erot = 1.13389735845462 | epot = -10.8286543283891 | etot = -8.13378366879291 +664000 ekin = 1.66624490139917 | erot = 1.15850228668423 | epot = -10.9585308578117 | etot = -8.13378366972827 +665000 ekin = 1.77303863683395 | erot = 1.18152952433998 | epot = -11.0883518319917 | etot = -8.13378367081779 +666000 ekin = 1.86640057269615 | erot = 1.20258304575748 | epot = -11.2027672900465 | etot = -8.13378367159284 +667000 ekin = 1.93466412848282 | erot = 1.22193419208053 | epot = -11.2903819923707 | etot = -8.13378367180735 +668000 ekin = 1.97306030166492 | erot = 1.24062017116914 | epot = -11.347464144264 | etot = -8.13378367142997 +669000 ekin = 1.98443783022521 | erot = 1.2600420212363 | epot = -11.3782635221481 | etot = -8.13378367068662 +670000 ekin = 1.97652861969381 | erot = 1.28134194903916 | epot = -11.3916542389172 | etot = -8.1337836701842 +671000 ekin = 1.95649579517304 | erot = 1.30490078082103 | epot = -11.3951802457702 | etot = -8.13378366977615 +672000 ekin = 1.92875532535182 | erot = 1.3306566086166 | epot = -11.3931956035327 | etot = -8.13378366956423 +673000 ekin = 1.89553670245284 | erot = 1.35854540533994 | epot = -11.3878657772639 | etot = -8.13378366947109 +674000 ekin = 1.85764904381115 | erot = 1.38884570044011 | epot = -11.3802784136 | etot = -8.13378366934874 +675000 ekin = 1.81704545025592 | erot = 1.42228413603649 | epot = -11.3731132555571 | etot = -8.13378366926472 +676000 ekin = 1.77505031309368 | erot = 1.45971003521918 | epot = -11.3685440174128 | etot = -8.13378366909995 +677000 ekin = 1.73347451742991 | erot = 1.50191216831867 | epot = -11.3691703547045 | etot = -8.13378366895589 +678000 ekin = 1.69449339360285 | erot = 1.5492260635729 | epot = -11.3775031260965 | etot = -8.1337836689207 +679000 ekin = 1.65969071094786 | erot = 1.60118456836937 | epot = -11.3946589483532 | etot = -8.13378366903597 +680000 ekin = 1.62957005383035 | erot = 1.6563411685726 | epot = -11.4196948916937 | etot = -8.1337836692907 +681000 ekin = 1.6036225257807 | erot = 1.71228358651525 | epot = -11.4496897819273 | etot = -8.1337836696313 +682000 ekin = 1.58083074253663 | erot = 1.76582826438537 | epot = -11.4804426769066 | etot = -8.13378366998463 +683000 ekin = 1.56032431136006 | erot = 1.81338479148306 | epot = -11.5074927731268 | etot = -8.13378367028371 +684000 ekin = 1.54183455724641 | erot = 1.85142632172379 | epot = -11.527044549801 | etot = -8.13378367083076 +685000 ekin = 1.52410759948571 | erot = 1.87642082986575 | epot = -11.5343121004891 | etot = -8.1337836711376 +686000 ekin = 1.50494379428818 | erot = 1.88570070117793 | epot = -11.5244281668713 | etot = -8.13378367140519 +687000 ekin = 1.48208036601428 | erot = 1.87831367882373 | epot = -11.4941777164487 | etot = -8.13378367161066 +688000 ekin = 1.45289287171131 | erot = 1.85497856864079 | epot = -11.4416551119996 | etot = -8.13378367164753 +689000 ekin = 1.41601907826408 | erot = 1.81811437346443 | epot = -11.3679171230719 | etot = -8.13378367134343 +690000 ekin = 1.3739477559924 | erot = 1.77166312489352 | epot = -11.2793945514479 | etot = -8.13378367056194 +691000 ekin = 1.33508615021621 | erot = 1.72071496353143 | epot = -11.1895847830839 | etot = -8.13378366933627 +692000 ekin = 1.31344376453929 | erot = 1.6709415974687 | epot = -11.1181690299597 | etot = -8.13378366795173 +693000 ekin = 1.32488046341621 | erot = 1.6278369743497 | epot = -11.0865011046549 | etot = -8.13378366688903 +694000 ekin = 1.38078608502381 | erot = 1.59583179970301 | epot = -11.1104015513567 | etot = -8.13378366662985 +695000 ekin = 1.48192861179444 | erot = 1.57745304979668 | epot = -11.1931653290032 | etot = -8.13378366741211 +696000 ekin = 1.61569966766342 | erot = 1.57278041420816 | epot = -11.3222637509667 | etot = -8.13378366909513 +697000 ekin = 1.75843097209587 | erot = 1.57943520714015 | epot = -11.471649850455 | etot = -8.13378367121893 +698000 ekin = 1.88185215227674 | erot = 1.59316882056648 | epot = -11.6088046460315 | etot = -8.13378367318828 +699000 ekin = 1.96106579209253 | erot = 1.60896306334644 | epot = -11.7038125299065 | etot = -8.1337836744675 +700000 ekin = 1.98131680917595 | erot = 1.62236339274118 | epot = -11.7374638766487 | etot = -8.13378367473154 +701000 ekin = 1.94164145671725 | erot = 1.63062825684615 | epot = -11.7060533875187 | etot = -8.13378367395526 +702000 ekin = 1.85450233234931 | erot = 1.63328569353363 | epot = -11.6215716983054 | etot = -8.13378367242241 +703000 ekin = 1.74181404905167 | erot = 1.63189519930867 | epot = -11.5074929188062 | etot = -8.13378367044582 +704000 ekin = 1.62890053400173 | erot = 1.62932624842263 | epot = -11.3920104513182 | etot = -8.13378366889386 +705000 ekin = 1.53704055732152 | erot = 1.62828297748911 | epot = -11.2991072025728 | etot = -8.13378366776214 +706000 ekin = 1.48137553858694 | erot = 1.63090498232315 | epot = -11.2460641880462 | etot = -8.13378366713615 +707000 ekin = 1.47012654293868 | erot = 1.63856880542399 | epot = -11.2424790153117 | etot = -8.13378366694904 +708000 ekin = 1.50545482966234 | erot = 1.65189802611907 | epot = -11.2911365228536 | etot = -8.13378366707216 +709000 ekin = 1.58434919620347 | erot = 1.67079586462247 | epot = -11.3889287285478 | etot = -8.13378366772188 +710000 ekin = 1.69830399765655 | erot = 1.69420639277746 | epot = -11.5262940589424 | etot = -8.13378366850841 +711000 ekin = 1.83638650821732 | erot = 1.72024670594232 | epot = -11.6904168836774 | etot = -8.13378366951779 +712000 ekin = 1.98510691893256 | erot = 1.74609277609515 | epot = -11.8649833658443 | etot = -8.13378367081663 +713000 ekin = 2.12899307615404 | erot = 1.76804611046095 | epot = -12.0308228586673 | etot = -8.13378367205227 +714000 ekin = 2.25375007876413 | erot = 1.78243264230489 | epot = -12.1699663938949 | etot = -8.13378367282586 +715000 ekin = 2.34975342438314 | erot = 1.7863212221056 | epot = -12.2698583197923 | etot = -8.13378367330359 +716000 ekin = 2.41256025258607 | erot = 1.77808812751119 | epot = -12.324432053273 | etot = -8.13378367317579 +717000 ekin = 2.44474770543516 | erot = 1.75804788170564 | epot = -12.3365792596854 | etot = -8.13378367254461 +718000 ekin = 2.45412216706064 | erot = 1.72831089164106 | epot = -12.3162167307368 | etot = -8.13378367203513 +719000 ekin = 2.44845378809372 | erot = 1.69204638289133 | epot = -12.2742838421606 | etot = -8.13378367117554 +720000 ekin = 2.4365668243011 | erot = 1.65329012907094 | epot = -12.2236406239461 | etot = -8.13378367057407 +721000 ekin = 2.42365620513951 | erot = 1.61605001925601 | epot = -12.1734898947767 | etot = -8.13378367038118 +722000 ekin = 2.40904119941647 | erot = 1.58378410656369 | epot = -12.126608976579 | etot = -8.13378367059884 +723000 ekin = 2.38647146994653 | erot = 1.55915433550815 | epot = -12.0794094765258 | etot = -8.13378367107115 +724000 ekin = 2.34659231003132 | erot = 1.54397640926854 | epot = -12.0243523908409 | etot = -8.13378367154106 +725000 ekin = 2.28077035581261 | erot = 1.5393197301854 | epot = -11.953873757743 | etot = -8.13378367174497 +726000 ekin = 2.18489434273461 | erot = 1.54571264603448 | epot = -11.8643906602776 | etot = -8.13378367150856 +727000 ekin = 2.06179491776454 | erot = 1.56339646493188 | epot = -11.7589750535044 | etot = -8.13378367080798 +728000 ekin = 1.92142302768548 | erot = 1.59252552387787 | epot = -11.6477322213536 | etot = -8.13378366979028 +729000 ekin = 1.7786316146333 | erot = 1.63318133798207 | epot = -11.5455966213522 | etot = -8.13378366873683 +730000 ekin = 1.64935549789658 | erot = 1.68520345517394 | epot = -11.4683426210542 | etot = -8.1337836679837 +731000 ekin = 1.54617340801248 | erot = 1.74777370762701 | epot = -11.4277307834108 | etot = -8.13378366777128 +732000 ekin = 1.47444012326489 | erot = 1.81876025838008 | epot = -11.4269840497947 | etot = -8.13378366814974 +733000 ekin = 1.43189319815119 | erot = 1.89484027033745 | epot = -11.4605171374918 | etot = -8.13378366900312 +734000 ekin = 1.41017780822952 | erot = 1.97174677425593 | epot = -11.515708252553 | etot = -8.13378367006758 +735000 ekin = 1.39820849327891 | erot = 2.04483940823585 | epot = -11.5768315725272 | etot = -8.13378367101241 +736000 ekin = 1.38628872347329 | erot = 2.10985363402772 | epot = -11.6299260290509 | etot = -8.13378367154989 +737000 ekin = 1.36961596697469 | erot = 2.16355925928076 | epot = -11.6669588978069 | etot = -8.1337836715514 +738000 ekin = 1.34981044649482 | erot = 2.20404797657308 | epot = -11.6876420941816 | etot = -8.13378367111375 +739000 ekin = 1.33372653206523 | erot = 2.23055395775731 | epot = -11.6980641603267 | etot = -8.13378367050419 +740000 ekin = 1.33016419302877 | erot = 2.24303198932584 | epot = -11.7069798523447 | etot = -8.13378366999008 +741000 ekin = 1.34641052653915 | erot = 2.24189336876696 | epot = -11.7220875649847 | etot = -8.13378366967855 +742000 ekin = 1.38645577652113 | erot = 2.22809836950686 | epot = -11.7483378155588 | etot = -8.13378366953076 +743000 ekin = 1.45103879196968 | erot = 2.20332817128998 | epot = -11.7881506327682 | etot = -8.13378366950853 +744000 ekin = 1.53803120218894 | erot = 2.16985299830534 | epot = -11.8416678701986 | etot = -8.1337836697043 +745000 ekin = 1.64150939163791 | erot = 2.12988595976026 | epot = -11.9051790216565 | etot = -8.13378367025834 +746000 ekin = 1.75074962763977 | erot = 2.08470317830661 | epot = -11.9692364772144 | etot = -8.13378367126806 +747000 ekin = 1.84985303110134 | erot = 2.03398729133258 | epot = -12.0176239950761 | etot = -8.13378367264215 +748000 ekin = 1.91944439122471 | erot = 1.97579729238774 | epot = -12.0290253576875 | etot = -8.13378367407507 +749000 ekin = 1.94080211585096 | erot = 1.90728805392296 | epot = -11.9818738448736 | etot = -8.13378367509966 +750000 ekin = 1.90175708673251 | erot = 1.8260222740119 | epot = -11.8615630358885 | etot = -8.13378367514405 +751000 ekin = 1.80442251326083 | erot = 1.7321012366723 | epot = -11.6703074242644 | etot = -8.13378367433124 +752000 ekin = 1.66438096324402 | erot = 1.62791173826492 | epot = -11.4260763737911 | etot = -8.13378367228214 +753000 ekin = 1.50959112389811 | erot = 1.51791168438835 | epot = -11.1612864778701 | etot = -8.13378366958362 +754000 ekin = 1.37530205550533 | erot = 1.40846180210589 | epot = -10.917547524855 | etot = -8.13378366724374 +755000 ekin = 1.29223158169242 | erot = 1.30628357859801 | epot = -10.7322988261735 | etot = -8.13378366588307 +756000 ekin = 1.27251368858831 | erot = 1.21592403404739 | epot = -10.6222213890963 | etot = -8.1337836664606 +757000 ekin = 1.30634776755577 | erot = 1.13861892043144 | epot = -10.5787503559206 | etot = -8.13378366793342 +758000 ekin = 1.37185376249201 | erot = 1.0735107377254 | epot = -10.5791481697082 | etot = -8.1337836694908 +759000 ekin = 1.44617278826226 | erot = 1.01897341844238 | epot = -10.5989298771843 | etot = -8.13378367047969 +760000 ekin = 1.51270256474667 | erot = 0.973207034231458 | epot = -10.6196932700991 | etot = -8.13378367112099 +761000 ekin = 1.56039612698439 | erot = 0.934439072339188 | epot = -10.6286188703577 | etot = -8.13378367103413 +762000 ekin = 1.58948756760659 | erot = 0.901622731991555 | epot = -10.6248939700583 | etot = -8.13378367046012 +763000 ekin = 1.60810008599209 | erot = 0.874391507900133 | epot = -10.6162752635686 | etot = -8.13378366967635 +764000 ekin = 1.62768531420419 | erot = 0.852689319812726 | epot = -10.6141583029822 | etot = -8.13378366896532 +765000 ekin = 1.65693698087077 | erot = 0.836745239166437 | epot = -10.6274658896172 | etot = -8.13378366957998 +766000 ekin = 1.70304081020932 | erot = 0.827639758125284 | epot = -10.6644642390852 | etot = -8.13378367075062 +767000 ekin = 1.76603010803272 | erot = 0.819745786965237 | epot = -10.7195595663275 | etot = -8.13378367132959 +768000 ekin = 1.83976621726717 | erot = 0.813915606792437 | epot = -10.7874654957648 | etot = -8.13378367170522 +769000 ekin = 1.91953928654938 | erot = 0.809315266629025 | epot = -10.8626382251792 | etot = -8.13378367200083 +770000 ekin = 2.00068337350057 | erot = 0.805269377227097 | epot = -10.9397364229589 | etot = -8.13378367223121 +771000 ekin = 2.0793260708523 | erot = 0.801470015569381 | epot = -11.0145797587935 | etot = -8.13378367237182 +772000 ekin = 2.1521825875434 | erot = 0.797728511870749 | epot = -11.0836947719903 | etot = -8.13378367257613 +773000 ekin = 2.21516346365885 | erot = 0.79376993219047 | epot = -11.1427170687754 | etot = -8.13378367292605 +774000 ekin = 2.26234547293474 | erot = 0.789120208349194 | epot = -11.1852493546944 | etot = -8.13378367341045 +775000 ekin = 2.28747439993112 | erot = 0.782940858144436 | epot = -11.2041989315872 | etot = -8.1337836735116 +776000 ekin = 2.28487294049721 | erot = 0.774236455855788 | epot = -11.1928930694262 | etot = -8.1337836730732 +777000 ekin = 2.25459623252881 | erot = 0.763986238623204 | epot = -11.1523661446638 | etot = -8.13378367351182 +778000 ekin = 2.19483848045462 | erot = 0.752926118502415 | epot = -11.0815482726156 | etot = -8.1337836736586 +779000 ekin = 2.10207554485975 | erot = 0.741428699363432 | epot = -10.977287917923 | etot = -8.13378367369983 +780000 ekin = 1.97507844670437 | erot = 0.730439747684415 | epot = -10.839301867892 | etot = -8.13378367350323 +781000 ekin = 1.81624237988655 | erot = 0.720681720747203 | epot = -10.6707077732028 | etot = -8.13378367256909 +782000 ekin = 1.63737679993151 | erot = 0.713965531378914 | epot = -10.4851260027838 | etot = -8.13378367147338 +783000 ekin = 1.45327094395388 | erot = 0.712334775546466 | epot = -10.299389389848 | etot = -8.13378367034762 +784000 ekin = 1.27931304186831 | erot = 0.717795316557748 | epot = -10.1308920277526 | etot = -8.13378366932659 +785000 ekin = 1.12953341827248 | erot = 0.732133377047915 | epot = -9.99545046385378 | etot = -8.13378366853338 +786000 ekin = 1.01482431815091 | erot = 0.756760281199438 | epot = -9.90536826740749 | etot = -8.13378366805715 +787000 ekin = 0.941643963920365 | erot = 0.792599099784704 | epot = -9.86802673163984 | etot = -8.13378366793477 +788000 ekin = 0.911510796402161 | erot = 0.840020856539554 | epot = -9.88531532108117 | etot = -8.13378366813946 +789000 ekin = 0.921376349382508 | erot = 0.898827357286732 | epot = -9.9539873752705 | etot = -8.13378366860126 +790000 ekin = 0.964654482904705 | erot = 0.968273092072525 | epot = -10.0667112442043 | etot = -8.13378366922705 +791000 ekin = 1.03261133422105 | erot = 1.04710148107955 | epot = -10.2134964852264 | etot = -8.13378366992578 +792000 ekin = 1.11580285051107 | erot = 1.13356945354994 | epot = -10.3831559746686 | etot = -8.13378367060757 +793000 ekin = 1.20528065130039 | erot = 1.22546277763586 | epot = -10.5645271001932 | etot = -8.13378367125697 +794000 ekin = 1.29310700791179 | erot = 1.32020213137025 | epot = -10.7470928111131 | etot = -8.13378367183103 +795000 ekin = 1.37238467376563 | erot = 1.41513363966636 | epot = -10.9213019889784 | etot = -8.13378367554645 +796000 ekin = 1.40835913094464 | erot = 1.52971390309507 | epot = -11.0718567046913 | etot = -8.13378367065162 +797000 ekin = 1.45167190325502 | erot = 1.62512604237465 | epot = -11.2105816179835 | etot = -8.1337836723538 +798000 ekin = 1.48145722831986 | erot = 1.70064689495533 | epot = -11.3158877957562 | etot = -8.13378367248102 +799000 ekin = 1.49559633326916 | erot = 1.76394329939395 | epot = -11.3933233050878 | etot = -8.13378367242471 +800000 ekin = 1.49744893756291 | erot = 1.81327291257607 | epot = -11.4445055223126 | etot = -8.13378367217361 +801000 ekin = 1.4925127928165 | erot = 1.84780559274298 | epot = -11.4741020572645 | etot = -8.13378367170498 +802000 ekin = 1.48820480026872 | erot = 1.86779013865565 | epot = -11.4897786100407 | etot = -8.13378367111629 +803000 ekin = 1.49253566038604 | erot = 1.87451451169078 | epot = -11.5008338426672 | etot = -8.13378367059038 +804000 ekin = 1.5116603542654 | erot = 1.86997050314383 | epot = -11.5154145277467 | etot = -8.13378367033752 +805000 ekin = 1.54725262768863 | erot = 1.85635941634179 | epot = -11.5373957145262 | etot = -8.13378367049577 +806000 ekin = 1.59533620631248 | erot = 1.83572111155184 | epot = -11.5648409885109 | etot = -8.13378367064658 +807000 ekin = 1.6492567216019 | erot = 1.81037056529609 | epot = -11.5934109582812 | etot = -8.13378367138325 +808000 ekin = 1.69787116905193 | erot = 1.78132459588751 | epot = -11.6129794370381 | etot = -8.13378367209867 +809000 ekin = 1.73004744223407 | erot = 1.74897468678149 | epot = -11.6128058015999 | etot = -8.13378367258439 +810000 ekin = 1.73831051792634 | erot = 1.71353607858809 | epot = -11.5856302702831 | etot = -8.13378367376865 +811000 ekin = 1.71623548890969 | erot = 1.67428462342296 | epot = -11.5243037858513 | etot = -8.13378367351866 +812000 ekin = 1.66416936448352 | erot = 1.63115164436062 | epot = -11.4291046816975 | etot = -8.13378367285341 +813000 ekin = 1.59176171306476 | erot = 1.5851340624486 | epot = -11.3106794473577 | etot = -8.13378367184436 +814000 ekin = 1.51369575694116 | erot = 1.53752063412976 | epot = -11.185000061704 | etot = -8.13378367063305 +815000 ekin = 1.4473542138359 | erot = 1.48989097526249 | epot = -11.071028858532 | etot = -8.13378366943365 +816000 ekin = 1.40949972401625 | erot = 1.44406671643194 | epot = -10.9873501089399 | etot = -8.13378366849166 +817000 ekin = 1.41268037624944 | erot = 1.40200084694995 | epot = -10.9484648912197 | etot = -8.13378366802026 +818000 ekin = 1.46212175583528 | erot = 1.36558649857364 | epot = -10.9614919225423 | etot = -8.13378366813339 +819000 ekin = 1.55434977589193 | erot = 1.33645466073199 | epot = -11.0245881053519 | etot = -8.13378366872802 +820000 ekin = 1.67879137040365 | erot = 1.3159014691983 | epot = -11.1284765091853 | etot = -8.13378366958337 +821000 ekin = 1.8210793588883 | erot = 1.30489182429338 | epot = -11.2597548536272 | etot = -8.13378367044556 +822000 ekin = 1.95294466894243 | erot = 1.31620699056062 | epot = -11.4029353290708 | etot = -8.13378366956775 +823000 ekin = 2.07449183352999 | erot = 1.34466437750312 | epot = -11.5529398817757 | etot = -8.13378367074255 +824000 ekin = 2.19907919152842 | erot = 1.36469015595358 | epot = -11.6975530184672 | etot = -8.13378367098524 +825000 ekin = 2.30563380779614 | erot = 1.39476757325172 | epot = -11.8341850522566 | etot = -8.13378367120878 +826000 ekin = 2.39103700978203 | erot = 1.43354131807091 | epot = -11.9583619996733 | etot = -8.13378367182033 +827000 ekin = 2.44908730472448 | erot = 1.47824975058638 | epot = -12.0611207277197 | etot = -8.1337836724088 +828000 ekin = 2.47400495228172 | erot = 1.52536858827836 | epot = -12.1331572136283 | etot = -8.13378367306817 +829000 ekin = 2.46026919562926 | erot = 1.57083290009567 | epot = -12.1648857693273 | etot = -8.13378367360242 +830000 ekin = 2.40417117584961 | erot = 1.61070673330611 | epot = -12.1486615829487 | etot = -8.13378367379299 +831000 ekin = 2.30626797420833 | erot = 1.64206892730812 | epot = -12.082120574964 | etot = -8.13378367344755 +832000 ekin = 2.17314973498884 | erot = 1.66378895298214 | epot = -11.9707223605709 | etot = -8.13378367259988 +833000 ekin = 2.01667883041885 | erot = 1.67684011561105 | epot = -11.8273026174356 | etot = -8.13378367140569 +834000 ekin = 1.85232718484326 | erot = 1.6837083286893 | epot = -11.669819183625 | etot = -8.13378367009244 +835000 ekin = 1.69616282533365 | erot = 1.68768571743463 | epot = -11.5176322118581 | etot = -8.13378366908985 +836000 ekin = 1.56059049333663 | erot = 1.6917613599148 | epot = -11.3861355306928 | etot = -8.13378367744136 +837000 ekin = 1.46494691499539 | erot = 1.67922598579464 | epot = -11.2779565658979 | etot = -8.13378366510789 +838000 ekin = 1.41623376476066 | erot = 1.68359587919538 | epot = -11.2336133182129 | etot = -8.13378367425683 +839000 ekin = 1.38164226028356 | erot = 1.69827238726399 | epot = -11.2136983221637 | etot = -8.13378367461619 +840000 ekin = 1.37281419732257 | erot = 1.71791872241606 | epot = -11.2245165948427 | etot = -8.13378367510411 +841000 ekin = 1.38251849215683 | erot = 1.74222357837012 | epot = -11.2585257461201 | etot = -8.13378367559319 +842000 ekin = 1.40440815973695 | erot = 1.77053653190186 | epot = -11.3087283676889 | etot = -8.13378367605013 +843000 ekin = 1.4328888997214 | erot = 1.80208713637578 | epot = -11.3687597125817 | etot = -8.13378367648452 +844000 ekin = 1.46337505878993 | erot = 1.83581425244069 | epot = -11.4329729881578 | etot = -8.13378367692717 +845000 ekin = 1.49225139044737 | erot = 1.87011931167681 | epot = -11.4961543795242 | etot = -8.13378367739996 +846000 ekin = 1.51675477556962 | erot = 1.90271354946231 | epot = -11.5532520029064 | etot = -8.13378367787448 +847000 ekin = 1.53514567668399 | erot = 1.93076451195713 | epot = -11.5996938668658 | etot = -8.13378367822471 +848000 ekin = 1.54758817225819 | erot = 1.95149729791815 | epot = -11.6328691484332 | etot = -8.13378367825685 +849000 ekin = 1.55740275371988 | erot = 1.96313933264541 | epot = -11.6543257642248 | etot = -8.13378367785951 +850000 ekin = 1.57132389451444 | erot = 1.9657229907227 | epot = -11.6708305624224 | etot = -8.13378367718527 +851000 ekin = 1.59707563447027 | erot = 1.96110149868453 | epot = -11.6919608097966 | etot = -8.13378367664177 +852000 ekin = 1.6386535077721 | erot = 1.95197424577221 | epot = -11.72441143022 | etot = -8.13378367667571 +853000 ekin = 1.69191652752201 | erot = 1.94037118765013 | epot = -11.7660713926443 | etot = -8.13378367747215 +854000 ekin = 1.74370784077224 | erot = 1.92645693844536 | epot = -11.803948457929 | etot = -8.13378367871136 +855000 ekin = 1.77620146887526 | erot = 1.90847432039789 | epot = -11.8184594692267 | etot = -8.13378367995357 +856000 ekin = 1.7743327314448 | erot = 1.88315818008924 | epot = -11.791274592039 | etot = -8.13378368050492 +857000 ekin = 1.73346273135248 | erot = 1.84735528731315 | epot = -11.714601698667 | etot = -8.1337836800014 +858000 ekin = 1.6631790333149 | erot = 1.79946643687439 | epot = -11.596429148727 | etot = -8.13378367853774 +859000 ekin = 1.58513293510716 | erot = 1.74007953867264 | epot = -11.4589961504007 | etot = -8.13378367662088 +860000 ekin = 1.5258194179029 | erot = 1.67168470765396 | epot = -11.3312878004617 | etot = -8.13378367490488 +861000 ekin = 1.50775028734954 | erot = 1.59782760931762 | epot = -11.239361570536 | etot = -8.13378367386888 +862000 ekin = 1.54306866378402 | erot = 1.52225954428065 | epot = -11.1991118817142 | etot = -8.13378367364952 +863000 ekin = 1.63171594681372 | erot = 1.44845127744695 | epot = -11.2139508983507 | etot = -8.13378367408998 +864000 ekin = 1.7636787077053 | erot = 1.37946094070234 | epot = -11.2769233233229 | etot = -8.1337836749153 +865000 ekin = 1.92306453040411 | erot = 1.31796433767429 | epot = -11.3748125439504 | etot = -8.13378367587202 +866000 ekin = 2.09215456445401 | erot = 1.2662892603518 | epot = -11.4922275013692 | etot = -8.13378367656337 +867000 ekin = 2.25558706712198 | erot = 1.22649711170717 | epot = -11.6158678561259 | etot = -8.13378367729673 +868000 ekin = 2.40057443662018 | erot = 1.2001770656327 | epot = -11.7345351800524 | etot = -8.1337836777995 +869000 ekin = 2.51819395293292 | erot = 1.18842551948431 | epot = -11.8404031504931 | etot = -8.13378367807583 +870000 ekin = 2.60380767700172 | erot = 1.19178595681351 | epot = -11.9293773120374 | etot = -8.13378367822217 +871000 ekin = 2.65597330603714 | erot = 1.21008900143108 | epot = -11.999845985796 | etot = -8.13378367832775 +872000 ekin = 2.67413391847168 | erot = 1.24223617431289 | epot = -12.0501537715192 | etot = -8.13378367873459 +873000 ekin = 2.65523813387417 | erot = 1.28590823732328 | epot = -12.0749300505625 | etot = -8.13378367936499 +874000 ekin = 2.59426343785597 | erot = 1.3376962816123 | epot = -12.0657433994964 | etot = -8.13378368002815 +875000 ekin = 2.48661885040575 | erot = 1.39359938744305 | epot = -12.0140019182113 | etot = -8.13378368036251 +876000 ekin = 2.33257163439157 | erot = 1.44985984501243 | epot = -11.9162151594034 | etot = -8.13378367999943 +877000 ekin = 2.14151731710631 | erot = 1.50380376796496 | epot = -11.7791047639004 | etot = -8.13378367882911 +878000 ekin = 1.93283200474647 | erot = 1.55419737713025 | epot = -11.6208130590663 | etot = -8.1337836771896 +879000 ekin = 1.73117573728214 | erot = 1.60084517505821 | epot = -11.4658045880898 | etot = -8.13378367574944 +880000 ekin = 1.55787151426872 | erot = 1.64373016601548 | epot = -11.3353853553398 | etot = -8.13378367505562 +881000 ekin = 1.42384142259606 | erot = 1.68244604662897 | epot = -11.2400711443575 | etot = -8.13378367513249 +882000 ekin = 1.32893688605674 | erot = 1.71640874279729 | epot = -11.1791293044113 | etot = -8.13378367555726 +883000 ekin = 1.26714280224094 | erot = 1.74554143027494 | epot = -11.1464679082473 | etot = -8.13378367573147 +884000 ekin = 1.23268823959077 | erot = 1.77071758387158 | epot = -11.1371894994132 | etot = -8.13378367595084 +885000 ekin = 1.2200884959747 | erot = 1.79312166820982 | epot = -11.1469938402947 | etot = -8.13378367611014 +886000 ekin = 1.2253247992956 | erot = 1.81382116029493 | epot = -11.1729296358337 | etot = -8.13378367624318 +887000 ekin = 1.24494548116712 | erot = 1.83336039623945 | epot = -11.2120895538739 | etot = -8.13378367646731 +888000 ekin = 1.27500212888999 | erot = 1.85168867098856 | epot = -11.2604744766324 | etot = -8.13378367675389 +889000 ekin = 1.31152735227747 | erot = 1.86844690127931 | epot = -11.3137579306641 | etot = -8.13378367710729 +890000 ekin = 1.34986317553329 | erot = 1.88304641058093 | epot = -11.3666932636424 | etot = -8.1337836775282 +891000 ekin = 1.3839053046424 | erot = 1.89468392913635 | epot = -11.4123729118684 | etot = -8.13378367808963 +892000 ekin = 1.40569396013053 | erot = 1.90226748652322 | epot = -11.4417451256677 | etot = -8.13378367901394 +893000 ekin = 1.40448288986801 | erot = 1.90432470778369 | epot = -11.4425912773581 | etot = -8.1337836797064 +894000 ekin = 1.37144289403929 | erot = 1.89954369049505 | epot = -11.4047702645262 | etot = -8.13378367999191 +895000 ekin = 1.30348485930664 | erot = 1.88750422983047 | epot = -11.3247727653154 | etot = -8.13378367617827 +896000 ekin = 1.22187337029835 | erot = 1.87071061670689 | epot = -11.2263676625211 | etot = -8.1337836755159 +897000 ekin = 1.14754845825448 | erot = 1.85263803839011 | epot = -11.1339701711517 | etot = -8.13378367450711 +898000 ekin = 1.08944016694904 | erot = 1.83653761327092 | epot = -11.0597614541448 | etot = -8.13378367392484 +899000 ekin = 1.05403951209273 | erot = 1.82413022625773 | epot = -11.011953411943 | etot = -8.13378367359249 +900000 ekin = 1.0450020339404 | erot = 1.81619426313996 | epot = -10.9949799706824 | etot = -8.13378367360205 +901000 ekin = 1.06222206974345 | erot = 1.8123440307995 | epot = -11.00834977447 | etot = -8.13378367392702 +902000 ekin = 1.10209713964134 | erot = 1.81111462891651 | epot = -11.0469954430113 | etot = -8.13378367445343 +903000 ekin = 1.1587603092597 | erot = 1.81037876556507 | epot = -11.1029227498551 | etot = -8.13378367503028 +904000 ekin = 1.22532881870644 | erot = 1.80797942304733 | epot = -11.167091917722 | etot = -8.13378367596823 +905000 ekin = 1.29206809093687 | erot = 1.80250391191856 | epot = -11.2283556793212 | etot = -8.13378367646575 +906000 ekin = 1.35183435800544 | erot = 1.79300035919407 | epot = -11.2786183939573 | etot = -8.13378367675781 +907000 ekin = 1.39979991792567 | erot = 1.77946415980363 | epot = -11.3130477546914 | etot = -8.13378367696207 +908000 ekin = 1.43268044740622 | erot = 1.76253539571741 | epot = -11.3289995201354 | etot = -8.13378367701179 +909000 ekin = 1.44897967288155 | erot = 1.74341748056142 | epot = -11.3261808303301 | etot = -8.1337836768871 +910000 ekin = 1.44937912369356 | erot = 1.7239058043588 | epot = -11.3070686046106 | etot = -8.1337836765582 +911000 ekin = 1.43727653845976 | erot = 1.70617572409734 | epot = -11.2772359386082 | etot = -8.13378367605113 +912000 ekin = 1.41843448457386 | erot = 1.69263823251178 | epot = -11.2448563925333 | etot = -8.13378367544766 +913000 ekin = 1.40006194335826 | erot = 1.68549440996254 | epot = -11.219340028189 | etot = -8.13378367486818 +914000 ekin = 1.38958826340962 | erot = 1.68634774665863 | epot = -11.2097196845425 | etot = -8.13378367447423 +915000 ekin = 1.39244841715371 | erot = 1.69595180443263 | epot = -11.2221838960024 | etot = -8.13378367441611 +916000 ekin = 1.41015014542681 | erot = 1.71401831969293 | epot = -11.2579521398906 | etot = -8.13378367477087 +917000 ekin = 1.43929629472159 | erot = 1.73916764013911 | epot = -11.3122476103546 | etot = -8.13378367549387 +918000 ekin = 1.47227942648434 | erot = 1.76903078852711 | epot = -11.3750938914124 | etot = -8.13378367640095 +919000 ekin = 1.49986621630205 | erot = 1.80052098852101 | epot = -11.4341708820097 | etot = -8.13378367718661 +920000 ekin = 1.51501277028694 | erot = 1.83027923246248 | epot = -11.4790756803414 | etot = -8.13378367759202 +921000 ekin = 1.50567012615991 | erot = 1.85806253090208 | epot = -11.4975163339096 | etot = -8.13378367684761 +922000 ekin = 1.50530570245739 | erot = 1.88405749181968 | epot = -11.5231468708985 | etot = -8.13378367662144 +923000 ekin = 1.51005072244233 | erot = 1.89398296760205 | epot = -11.5378173658999 | etot = -8.1337836758555 +924000 ekin = 1.52928061195711 | erot = 1.89561779694766 | epot = -11.5586820843414 | etot = -8.13378367543667 +925000 ekin = 1.56873673302537 | erot = 1.88910082632994 | epot = -11.5916212350735 | etot = -8.13378367571823 +926000 ekin = 1.62371911834086 | erot = 1.8742965074208 | epot = -11.6317993024452 | etot = -8.13378367668352 +927000 ekin = 1.6795236866305 | erot = 1.85068760891983 | epot = -11.6639949735082 | etot = -8.1337836779579 +928000 ekin = 1.71651231952588 | erot = 1.81783745817294 | epot = -11.6681334567321 | etot = -8.13378367903323 +929000 ekin = 1.71702543069574 | erot = 1.77614095715146 | epot = -11.6269500673553 | etot = -8.13378367950806 +930000 ekin = 1.67099557389431 | erot = 1.72742889140267 | epot = -11.5322081445003 | etot = -8.13378367920327 +931000 ekin = 1.57874462156784 | erot = 1.67513458192321 | epot = -11.3876628816592 | etot = -8.13378367816811 +932000 ekin = 1.45079207958407 | erot = 1.62392798648941 | epot = -11.2085037426999 | etot = -8.1337836766264 +933000 ekin = 1.30531755780527 | erot = 1.57894109373394 | epot = -11.0180423264354 | etot = -8.13378367489618 +934000 ekin = 1.16422088428368 | erot = 1.544858025167 | epot = -10.8428625827474 | etot = -8.13378367329673 +935000 ekin = 1.04864497491883 | erot = 1.52509208962212 | epot = -10.7075207367029 | etot = -8.13378367216191 +936000 ekin = 0.974709277892456 | erot = 1.52116327886444 | epot = -10.6296562284413 | etot = -8.13378367168442 +937000 ekin = 0.950462282699206 | erot = 1.53244919527065 | epot = -10.6166951499291 | etot = -8.13378367195924 +938000 ekin = 0.97442129434101 | erot = 1.55616007066893 | epot = -10.6643650379523 | etot = -8.13378367294238 +939000 ekin = 1.03606886860143 | erot = 1.5875544961391 | epot = -10.7574070391953 | etot = -8.13378367445473 +940000 ekin = 1.11826841072441 | erot = 1.62042989086924 | epot = -10.87248197779 | etot = -8.13378367619637 +941000 ekin = 1.20122028646586 | erot = 1.64794232140889 | epot = -10.9829462856615 | etot = -8.1337836777867 +942000 ekin = 1.26717763757466 | erot = 1.66371923923732 | epot = -11.0646805556957 | etot = -8.1337836788837 +943000 ekin = 1.30509212517541 | erot = 1.66314531275945 | epot = -11.1020211170585 | etot = -8.1337836791236 +944000 ekin = 1.31392377909568 | erot = 1.6444967095031 | epot = -11.0922041671166 | etot = -8.13378367851778 +945000 ekin = 1.30237464447606 | erot = 1.60929976289052 | epot = -11.0454580847159 | etot = -8.1337836773493 +946000 ekin = 1.28506402487981 | erot = 1.56181036971556 | epot = -10.9806580707093 | etot = -8.13378367611393 +947000 ekin = 1.27634123210311 | erot = 1.50774431650837 | epot = -10.9178692238925 | etot = -8.13378367528105 +948000 ekin = 1.28467886299738 | erot = 1.45281196885876 | epot = -10.8712745069228 | etot = -8.13378367506665 +949000 ekin = 1.31037739903363 | erot = 1.40157240203181 | epot = -10.8457334764408 | etot = -8.13378367537539 +950000 ekin = 1.34722619695783 | erot = 1.35688689444993 | epot = -10.8378967673358 | etot = -8.13378367592802 +951000 ekin = 1.38650860370093 | erot = 1.31991933135893 | epot = -10.840211611492 | etot = -8.13378367643213 +952000 ekin = 1.42144708622155 | erot = 1.29081153506588 | epot = -10.8460422979201 | etot = -8.13378367663271 +953000 ekin = 1.44882630051411 | erot = 1.26905801196778 | epot = -10.8516679892333 | etot = -8.13378367675142 +954000 ekin = 1.46839021254268 | erot = 1.25288009220816 | epot = -10.8550539813261 | etot = -8.13378367657522 +955000 ekin = 1.48389177673435 | erot = 1.24071489184941 | epot = -10.8583903448629 | etot = -8.13378367627912 +956000 ekin = 1.50041047770887 | erot = 1.23152279657232 | epot = -10.8657169503619 | etot = -8.1337836760807 +957000 ekin = 1.52124212852808 | erot = 1.22481047930208 | epot = -10.8798362839283 | etot = -8.13378367609813 +958000 ekin = 1.54632228543432 | erot = 1.22051885841469 | epot = -10.9006248201102 | etot = -8.13378367626118 +959000 ekin = 1.57324295423106 | erot = 1.21891910094093 | epot = -10.9259457315457 | etot = -8.13378367637367 +960000 ekin = 1.5996920706753 | erot = 1.22060655686446 | epot = -10.9540823039303 | etot = -8.13378367639055 +961000 ekin = 1.62253441756759 | erot = 1.22677323061705 | epot = -10.9830913244504 | etot = -8.13378367626578 +962000 ekin = 1.64127229965138 | erot = 1.23851880733041 | epot = -11.0135747831078 | etot = -8.13378367612602 +963000 ekin = 1.65616191357312 | erot = 1.25678968713549 | epot = -11.0467352768565 | etot = -8.13378367614791 +964000 ekin = 1.66566514829256 | erot = 1.28218253594424 | epot = -11.0816313604864 | etot = -8.13378367624964 +965000 ekin = 1.66770285490424 | erot = 1.31455464366941 | epot = -11.1160411751496 | etot = -8.13378367657597 +966000 ekin = 1.65810694994359 | erot = 1.35314679688918 | epot = -11.1450374236447 | etot = -8.13378367681196 +967000 ekin = 1.63401913713073 | erot = 1.39653020198003 | epot = -11.1643330160459 | etot = -8.13378367693513 +968000 ekin = 1.59493850339227 | erot = 1.442540965575 | epot = -11.1712631460351 | etot = -8.1337836770678 +969000 ekin = 1.54116623821902 | erot = 1.4883056650043 | epot = -11.1632555805643 | etot = -8.13378367734103 +970000 ekin = 1.47195250910058 | erot = 1.53048570994046 | epot = -11.1362218967524 | etot = -8.13378367771134 +971000 ekin = 1.38571362870499 | erot = 1.56593199123071 | epot = -11.0854292975477 | etot = -8.13378367761201 +972000 ekin = 1.28446124437413 | erot = 1.59277024233188 | epot = -11.0110151641592 | etot = -8.13378367745316 +973000 ekin = 1.17320809137327 | erot = 1.61049478627213 | epot = -10.9174865543348 | etot = -8.13378367668943 +974000 ekin = 1.06313421977885 | erot = 1.62023440757555 | epot = -10.817152302779 | etot = -8.13378367542463 +975000 ekin = 0.970987630503308 | erot = 1.62445058039491 | epot = -10.7292218849975 | etot = -8.13378367409932 +976000 ekin = 0.91351783525621 | erot = 1.62592320944562 | epot = -10.6732247179988 | etot = -8.13378367329698 +977000 ekin = 0.90021029821643 | erot = 1.62660680659273 | epot = -10.6606007781862 | etot = -8.13378367337705 +978000 ekin = 0.928774959207787 | erot = 1.62702792797415 | epot = -10.6895865614336 | etot = -8.13378367425169 +979000 ekin = 0.986309689641714 | erot = 1.62661906061945 | epot = -10.7467124256161 | etot = -8.1337836753549 +980000 ekin = 1.05604184570295 | erot = 1.62477777568304 | epot = -10.8146032975143 | etot = -8.13378367612831 +981000 ekin = 1.12469745200008 | erot = 1.62193499771681 | epot = -10.8804161260049 | etot = -8.13378367628802 +982000 ekin = 1.1865542248926 | erot = 1.61989865345784 | epot = -10.9402365542545 | etot = -8.13378367590405 +983000 ekin = 1.2432339331634 | erot = 1.62138932755866 | epot = -10.9984069359734 | etot = -8.13378367525139 +984000 ekin = 1.30072892332128 | erot = 1.62917854604782 | epot = -11.0636911439975 | etot = -8.13378367462839 +985000 ekin = 1.36575798919194 | erot = 1.64530549573791 | epot = -11.1448471591936 | etot = -8.13378367426372 +986000 ekin = 1.44269014525417 | erot = 1.67060135307792 | epot = -11.2470751726359 | etot = -8.13378367430377 +987000 ekin = 1.53139017761193 | erot = 1.70450616333784 | epot = -11.3696800157676 | etot = -8.13378367481778 +988000 ekin = 1.62542517056574 | erot = 1.74490462881329 | epot = -11.5041134752362 | etot = -8.13378367585715 +989000 ekin = 1.70973314425248 | erot = 1.78758053917274 | epot = -11.6310973606104 | etot = -8.1337836771852 +990000 ekin = 1.7683499066011 | erot = 1.82854801036223 | epot = -11.730681595349 | etot = -8.13378367838571 +991000 ekin = 1.78717585158857 | erot = 1.86445265737343 | epot = -11.7854121880384 | etot = -8.1337836790764 +992000 ekin = 1.75808068891151 | erot = 1.8934494734163 | epot = -11.7853138413634 | etot = -8.13378367903559 +993000 ekin = 1.68149922501318 | erot = 1.91587779110949 | epot = -11.7311606944026 | etot = -8.13378367827992 +994000 ekin = 1.56634005341962 | erot = 1.93428820717938 | epot = -11.6344119375849 | etot = -8.1337836769859 +995000 ekin = 1.42807354858172 | erot = 1.95281321369039 | epot = -11.5146704376883 | etot = -8.13378367541617 +996000 ekin = 1.28578074178168 | erot = 1.9761437456925 | epot = -11.3957081613606 | etot = -8.13378367388646 +997000 ekin = 1.15849050407734 | erot = 2.00849321115735 | epot = -11.3007673879136 | etot = -8.13378367267886 +998000 ekin = 1.06172554694373 | erot = 2.05288173933644 | epot = -11.2483909582305 | etot = -8.13378367195033 +999000 ekin = 1.00534863803133 | erot = 2.11083351367153 | epot = -11.2499658234416 | etot = -8.13378367173879 +1000000 ekin = 0.992888352708612 | erot = 2.18232107086661 | epot = -11.3089930956005 | etot = -8.13378367202523 + 1000000 0.073547285 -1.1520387 0.021139403 -1.0316105 -4.7686302e-05 64000 +Loop time of 13.2492 on 4 procs for 1000000 steps with 10 atoms + +Performance: 65211.686 tau/day, 75476.489 timesteps/s +99.6% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 6.234 | 7.2237 | 8.1618 | 32.7 | 54.52 +Bond | 0.27885 | 0.32412 | 0.37417 | 6.6 | 2.45 +Neigh | 0.006904 | 0.0069348 | 0.006978 | 0.0 | 0.05 +Comm | 1.795 | 1.9335 | 2.0915 | 8.3 | 14.59 +Output | 0.079751 | 0.082404 | 0.086249 | 0.8 | 0.62 +Modify | 0.58647 | 0.6283 | 0.66943 | 4.6 | 4.74 +Other | | 3.05 | | | 23.02 + +Nlocal: 2.50000 ave 3 max 2 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Nghost: 7.50000 ave 8 max 7 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Neighs: 17.5000 ave 21 max 14 min +Histogram: 1 1 0 0 0 0 0 0 1 1 + +Total # of neighbors = 70 +Ave neighs/atom = 7.0000000 +Ave special neighs/atom = 3.6000000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.3.* nocoeff +System init for write_data ... +Total wall time: 0:00:13 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.1 deleted file mode 100644 index 77a368a50b..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.1 +++ /dev/null @@ -1,1182 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 3 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex3 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 10 atoms - reading velocities ... - 10 velocities - 10 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 8 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.002 seconds - -set atom * mass 1.0 - 10 settings made for mass - -group all type 1 4 -10 atoms in group all - -# oxDNA2 bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA2 pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 -pair_coeff * * oxdna2/dh 0.1 1.0 0.815 - -# NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 2.6274048 - ghost atom cutoff = 2.6274048 - binsize = 1.3137024, bins = 31 31 31 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 2.627404783947349 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -14.6249037416652 | etot = -14.6249037416652 -Per MPI rank memory allocation (min/avg/max) = 8.021 | 8.021 | 8.021 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.4720158 0.009525411 -1.4624904 3.1370518e-06 -1000 ekin = 0.00366431201929618 | erot = 0.00193726360267488 | epot = -14.630505317301 | etot = -14.624903741679 -2000 ekin = 0.0144775076075466 | erot = 0.00770914672938582 | epot = -14.6470903960565 | etot = -14.6249037417196 -3000 ekin = 0.0319122186081549 | erot = 0.0171972328649101 | epot = -14.6740131932573 | etot = -14.6249037417842 -4000 ekin = 0.0551283043509704 | erot = 0.0302085305548002 | epot = -14.7102405767754 | etot = -14.6249037418696 -5000 ekin = 0.0830285165715823 | erot = 0.0464820547541705 | epot = -14.7544143132963 | etot = -14.6249037419705 -6000 ekin = 0.114331121546757 | erot = 0.0656980211282096 | epot = -14.8049328847556 | etot = -14.6249037420806 -7000 ekin = 0.147653866561892 | erot = 0.0874894888755386 | epot = -14.860047097631 | etot = -14.6249037421936 -8000 ekin = 0.181602099560207 | erot = 0.111456095727703 | epot = -14.9179619375911 | etot = -14.6249037423032 -9000 ekin = 0.214852894725919 | erot = 0.137179311245174 | epot = -14.9769359483746 | etot = -14.6249037424035 -10000 ekin = 0.246227151956033 | erot = 0.164238435218395 | epot = -15.0353693296648 | etot = -14.6249037424904 -11000 ekin = 0.274743080419051 | erot = 0.192226420003239 | epot = -15.0918732429829 | etot = -14.6249037425607 -12000 ekin = 0.2996471417657 | erot = 0.220764512146651 | epot = -15.1453153965252 | etot = -14.6249037426128 -13000 ekin = 0.320421918860966 | erot = 0.249514690530541 | epot = -15.1948403520385 | etot = -14.624903742647 -14000 ekin = 0.33677373488436 | erot = 0.27818893373049 | epot = -15.2398664112793 | etot = -14.6249037426645 -15000 ekin = 0.348605413762901 | erot = 0.306554508009418 | epot = -15.2800636644399 | etot = -14.6249037426675 -16000 ekin = 0.355980829097854 | erot = 0.334434770083744 | epot = -15.3153193418402 | etot = -14.6249037426586 -17000 ekin = 0.35908770105941 | erot = 0.361705441666512 | epot = -15.3456968853664 | etot = -14.6249037426405 -18000 ekin = 0.358203710992239 | erot = 0.388286889516313 | epot = -15.3713943431242 | etot = -14.6249037426156 -19000 ekin = 0.353668912555234 | erot = 0.414133518537107 | epot = -15.3927061736788 | etot = -14.6249037425864 -20000 ekin = 0.345865220775291 | erot = 0.439221805285432 | epot = -15.4099907686153 | etot = -14.6249037425546 -21000 ekin = 0.335201981146472 | erot = 0.463538642606515 | epot = -15.4236443662748 | etot = -14.6249037425218 -22000 ekin = 0.322105588834903 | erot = 0.487071492273063 | epot = -15.4340808235971 | etot = -14.6249037424892 -23000 ekin = 0.307010918596165 | erot = 0.509801406229371 | epot = -15.4417160672832 | etot = -14.6249037424577 -24000 ekin = 0.290352786033169 | erot = 0.531699400501692 | epot = -15.446955928963 | etot = -14.6249037424281 -25000 ekin = 0.272556500902037 | erot = 0.552726088759198 | epot = -15.4501863320622 | etot = -14.624903742401 -26000 ekin = 0.254027484079049 | erot = 0.572834017299018 | epot = -15.4517652437547 | etot = -14.6249037423766 -27000 ekin = 0.23514066521633 | erot = 0.591971851501221 | epot = -15.4520162590729 | etot = -14.6249037423553 -28000 ekin = 0.216230835846198 | erot = 0.610089455964333 | epot = -15.4512240341478 | etot = -14.6249037423373 -29000 ekin = 0.197585285158555 | erot = 0.627142960082633 | epot = -15.4496319875635 | etot = -14.6249037423223 -30000 ekin = 0.179439940173318 | erot = 0.643099062793407 | epot = -15.4474427452769 | etot = -14.6249037423102 -31000 ekin = 0.161979935826124 | erot = 0.657938056392308 | epot = -15.4448217345186 | etot = -14.6249037423001 -32000 ekin = 0.145345108983022 | erot = 0.671655297433962 | epot = -15.4419041487086 | etot = -14.6249037422916 -33000 ekin = 0.12964040034519 | erot = 0.684261083518556 | epot = -15.4388052261475 | etot = -14.6249037422838 -34000 ekin = 0.114950474500008 | erot = 0.695779112936504 | epot = -15.4356333297121 | etot = -14.6249037422756 -35000 ekin = 0.10135710346033 | erot = 0.706243888527894 | epot = -15.4325047342544 | etot = -14.6249037422662 -36000 ekin = 0.088957633457107 | erot = 0.715697403164625 | epot = -15.4295587788764 | etot = -14.6249037422546 -37000 ekin = 0.0778817390290652 | erot = 0.72418563863568 | epot = -15.4269711199052 | etot = -14.6249037422404 -38000 ekin = 0.068303709154812 | erot = 0.731755309647473 | epot = -15.4249627610255 | etot = -14.6249037422232 -39000 ekin = 0.0604476327394706 | erot = 0.738451228922909 | epot = -15.4238026038659 | etot = -14.6249037422035 -40000 ekin = 0.0545835914676979 | erot = 0.7443145576821 | epot = -15.4238018913318 | etot = -14.624903742182 -41000 ekin = 0.0510142787133839 | erot = 0.749382063190735 | epot = -15.4253000840641 | etot = -14.6249037421599 -42000 ekin = 0.0500531571157636 | erot = 0.753686350478931 | epot = -15.428643249734 | etot = -14.6249037421393 -43000 ekin = 0.0519969858278391 | erot = 0.757256889238991 | epot = -15.4341576171885 | etot = -14.6249037421217 -44000 ekin = 0.0570968352184469 | erot = 0.760121540481399 | epot = -15.4421221178085 | etot = -14.6249037421087 -45000 ekin = 0.065532155346979 | erot = 0.762308219230476 | epot = -15.4527441166789 | etot = -14.6249037421014 -46000 ekin = 0.077391880036746 | erot = 0.763846321567568 | epot = -15.4661419437049 | etot = -14.6249037421006 -47000 ekin = 0.0926650518887463 | erot = 0.764767599959976 | epot = -15.4823363939546 | etot = -14.6249037421059 -48000 ekin = 0.111241466891021 | erot = 0.76510628368957 | epot = -15.5012514926977 | etot = -14.6249037421171 -49000 ekin = 0.132920935183101 | erot = 0.764898395951945 | epot = -15.5227230732685 | etot = -14.6249037421334 -50000 ekin = 0.157428432862297 | erot = 0.764180392178817 | epot = -15.5465125671951 | etot = -14.624903742154 -51000 ekin = 0.184431879186394 | erot = 0.762987403181186 | epot = -15.5723230245453 | etot = -14.6249037421777 -52000 ekin = 0.213559336999611 | erot = 0.761351471408957 | epot = -15.5998145506125 | etot = -14.6249037422039 -53000 ekin = 0.244412677541745 | erot = 0.759300175100897 | epot = -15.6286165948748 | etot = -14.6249037422322 -54000 ekin = 0.276574826726797 | erot = 0.756855909736049 | epot = -15.6583344787255 | etot = -14.6249037422626 -55000 ekin = 0.30960770869724 | erot = 0.754035838659133 | epot = -15.6885472896526 | etot = -14.6249037422962 -56000 ekin = 0.343038597242155 | erot = 0.750852192167397 | epot = -15.7187945317444 | etot = -14.6249037423348 -57000 ekin = 0.376334705011604 | erot = 0.747312289063754 | epot = -15.7485507364561 | etot = -14.6249037423808 -58000 ekin = 0.408870193943412 | erot = 0.743417624903535 | epot = -15.7771915612832 | etot = -14.6249037424363 -59000 ekin = 0.439895666476021 | erot = 0.739161690570186 | epot = -15.803961099549 | etot = -14.6249037425028 -60000 ekin = 0.468524372325726 | erot = 0.734526514748657 | epot = -15.8279546296536 | etot = -14.6249037425792 -61000 ekin = 0.493750804630799 | erot = 0.729479048550173 | epot = -15.8481335958428 | etot = -14.6249037426618 -62000 ekin = 0.514511417905549 | erot = 0.723968952963015 | epot = -15.8633841136119 | etot = -14.6249037427433 -63000 ekin = 0.529785687820656 | erot = 0.717929490923262 | epot = -15.8726189215586 | etot = -14.6249037428146 -64000 ekin = 0.538722043349821 | erot = 0.711282639870032 | epot = -15.874908426086 | etot = -14.6249037428661 -65000 ekin = 0.540763046401741 | erot = 0.703948378732647 | epot = -15.8696151680245 | etot = -14.6249037428901 -66000 ekin = 0.535742115226795 | erot = 0.69585678068686 | epot = -15.856502638796 | etot = -14.6249037428824 -67000 ekin = 0.523930969354056 | erot = 0.686960578434575 | epot = -15.8357952906315 | etot = -14.6249037428429 -68000 ekin = 0.506029704478054 | erot = 0.677245632040232 | epot = -15.8081790792936 | etot = -14.6249037427753 -69000 ekin = 0.483104826199992 | erot = 0.666737270644537 | epot = -15.774745839531 | etot = -14.6249037426865 -70000 ekin = 0.456490218293252 | erot = 0.655501536743317 | epot = -15.7368954976212 | etot = -14.6249037425847 -71000 ekin = 0.427669918862549 | erot = 0.643641521526345 | epot = -15.6962151828672 | etot = -14.6249037424783 -72000 ekin = 0.398160338931557 | erot = 0.631289876691081 | epot = -15.654353957998 | etot = -14.6249037423754 -73000 ekin = 0.369405258276815 | erot = 0.618599034382849 | epot = -15.6129080349415 | etot = -14.6249037422819 -74000 ekin = 0.342691749042209 | erot = 0.605730669564501 | epot = -15.5733261608092 | etot = -14.6249037422025 -75000 ekin = 0.31909052680686 | erot = 0.59284563490598 | epot = -15.5368399038529 | etot = -14.62490374214 -76000 ekin = 0.299420611427412 | erot = 0.580095163563671 | epot = -15.5044195170868 | etot = -14.6249037420957 -77000 ekin = 0.284235504574989 | erot = 0.567613716752661 | epot = -15.4767529633973 | etot = -14.6249037420697 -78000 ekin = 0.273826140866561 | erot = 0.555513536864305 | epot = -15.454243419792 | etot = -14.6249037420611 -79000 ekin = 0.268234635497613 | erot = 0.54388078034572 | epot = -15.4370191579124 | etot = -14.624903742069 -80000 ekin = 0.267272602906451 | erot = 0.532773036269929 | epot = -15.4249493812687 | etot = -14.6249037420923 -81000 ekin = 0.270538934182559 | erot = 0.522218059775773 | epot = -15.4176607360884 | etot = -14.6249037421301 -82000 ekin = 0.277434574359295 | erot = 0.512213638248342 | epot = -15.4145519547894 | etot = -14.6249037421818 -83000 ekin = 0.287175732620333 | erot = 0.50272864056942 | epot = -15.414808115436 | etot = -14.6249037422462 -84000 ekin = 0.298811175848678 | erot = 0.493705451301681 | epot = -15.4174203694717 | etot = -14.6249037423214 -85000 ekin = 0.311252369949697 | erot = 0.485064122067565 | epot = -15.4212202344211 | etot = -14.6249037424038 -86000 ekin = 0.323325626375984 | erot = 0.476708618161036 | epot = -15.424937987025 | etot = -14.624903742488 -87000 ekin = 0.333851795518747 | erot = 0.468535420697862 | epot = -15.4272909587828 | etot = -14.6249037425662 -88000 ekin = 0.341751109758396 | erot = 0.460444399763919 | epot = -15.427099252152 | etot = -14.6249037426296 -89000 ekin = 0.346159825920001 | erot = 0.452351304178873 | epot = -15.4234148727693 | etot = -14.6249037426704 -90000 ekin = 0.346534667470265 | erot = 0.444200535918399 | epot = -15.4156389460718 | etot = -14.6249037426831 -91000 ekin = 0.342715665475867 | erot = 0.435976333753397 | epot = -15.4035957418967 | etot = -14.6249037426674 -92000 ekin = 0.3349227158513 | erot = 0.427710377227648 | epot = -15.3875368357071 | etot = -14.6249037426282 -93000 ekin = 0.323677844433752 | erot = 0.419484336039963 | epot = -15.3680659230484 | etot = -14.6249037425747 -94000 ekin = 0.30966978292125 | erot = 0.411426964072553 | epot = -15.3460004895119 | etot = -14.6249037425181 -95000 ekin = 0.293600014861622 | erot = 0.403706586473099 | epot = -15.3222103438021 | etot = -14.6249037424674 -96000 ekin = 0.276058284884091 | erot = 0.396520701306161 | epot = -15.2974827286175 | etot = -14.6249037424272 -97000 ekin = 0.25746445629565 | erot = 0.390084510982946 | epot = -15.2724527096753 | etot = -14.6249037423967 -98000 ekin = 0.238086767082953 | erot = 0.384619533405539 | epot = -15.2476100428595 | etot = -14.624903742371 -99000 ekin = 0.218116994125883 | erot = 0.380342481668092 | epot = -15.2233632181382 | etot = -14.6249037423442 -100000 ekin = 0.197764845956536 | erot = 0.377453964065333 | epot = -15.2001225523339 | etot = -14.624903742312 -101000 ekin = 0.177333852671335 | erot = 0.376126621697227 | epot = -15.1783642166414 | etot = -14.6249037422728 -102000 ekin = 0.157255732179445 | erot = 0.376493003927733 | epot = -15.1586524783356 | etot = -14.6249037422284 -103000 ekin = 0.138079925448889 | erot = 0.378634329970018 | epot = -15.1416179976015 | etot = -14.6249037421826 -104000 ekin = 0.120430234291316 | erot = 0.382571791335251 | epot = -15.1279057677665 | etot = -14.6249037421399 -105000 ekin = 0.10494672239352 | erot = 0.388261944551333 | epot = -15.118112409049 | etot = -14.6249037421041 -106000 ekin = 0.0922291289493497 | erot = 0.395597086392468 | epot = -15.11272995742 | etot = -14.6249037420782 -107000 ekin = 0.0827918191991084 | erot = 0.404410579138465 | epot = -15.112106140401 | etot = -14.6249037420634 -108000 ekin = 0.0770336430609741 | erot = 0.414486225075992 | epot = -15.116423610197 | etot = -14.62490374206 -109000 ekin = 0.075221312117861 | erot = 0.425570202879186 | epot = -15.1256952570646 | etot = -14.6249037420675 -110000 ekin = 0.0774826364247882 | erot = 0.437383858086522 | epot = -15.1397702365965 | etot = -14.6249037420852 -111000 ekin = 0.0838057148048547 | erot = 0.449635759436015 | epot = -15.1583452163526 | etot = -14.6249037421117 -112000 ekin = 0.0940411317710077 | erot = 0.462031808376879 | epot = -15.1809766822946 | etot = -14.6249037421467 -113000 ekin = 0.107905661684195 | erot = 0.474282718869093 | epot = -15.2070921227426 | etot = -14.6249037421893 -114000 ekin = 0.124987416380568 | erot = 0.486108767327343 | epot = -15.2359999259468 | etot = -14.6249037422389 -115000 ekin = 0.14475347442169 | erot = 0.497242253023055 | epot = -15.2668994697394 | etot = -14.6249037422947 -116000 ekin = 0.166561593123301 | erot = 0.507428522971045 | epot = -15.2988938584499 | etot = -14.6249037423555 -117000 ekin = 0.189677527330859 | erot = 0.516426638198687 | epot = -15.3310079079495 | etot = -14.6249037424199 -118000 ekin = 0.213298790897302 | erot = 0.524010758771369 | epot = -15.3622132921543 | etot = -14.6249037424857 -119000 ekin = 0.23658457696156 | erot = 0.529973112381439 | epot = -15.3914614318934 | etot = -14.6249037425504 -120000 ekin = 0.25869030185824 | erot = 0.534129034925715 | epot = -15.4177230793952 | etot = -14.6249037426113 -121000 ekin = 0.278804196532859 | erot = 0.536324108799716 | epot = -15.4400320479982 | etot = -14.6249037426656 -122000 ekin = 0.296182819519396 | erot = 0.536442962870823 | epot = -15.4575295251008 | etot = -14.6249037427106 -123000 ekin = 0.310182446405815 | erot = 0.534418915104236 | epot = -15.4695051042542 | etot = -14.6249037427442 -124000 ekin = 0.320283972930007 | erot = 0.530243389137678 | epot = -15.4754311048322 | etot = -14.6249037427645 -125000 ekin = 0.326110081462184 | erot = 0.523973945236141 | epot = -15.474987769469 | etot = -14.6249037427707 -126000 ekin = 0.327434709614433 | erot = 0.515739832556637 | epot = -15.4680782849335 | etot = -14.6249037427625 -127000 ekin = 0.324186046690112 | erot = 0.505744172152634 | epot = -15.4548339615826 | etot = -14.6249037427399 -128000 ekin = 0.316445106703942 | erot = 0.49426218578474 | epot = -15.4356110351922 | etot = -14.6249037427035 -129000 ekin = 0.304442167762443 | erot = 0.481635256753056 | epot = -15.4109811671698 | etot = -14.6249037426543 -130000 ekin = 0.288552887156219 | erot = 0.468261006625427 | epot = -15.381717636375 | etot = -14.6249037425933 -131000 ekin = 0.269294696165104 | erot = 0.454579955598623 | epot = -15.3487783942857 | etot = -14.624903742522 -132000 ekin = 0.247322351785515 | erot = 0.44105966132284 | epot = -15.3132857555502 | etot = -14.6249037424419 -133000 ekin = 0.223419723871429 | erot = 0.428177456066543 | epot = -15.276500922293 | etot = -14.6249037423551 -134000 ekin = 0.198483666316777 | erot = 0.416402982921072 | epot = -15.2397903915022 | etot = -14.6249037422644 -135000 ekin = 0.173495806295108 | erot = 0.40618164100245 | epot = -15.2045811894712 | etot = -14.6249037421736 -136000 ekin = 0.149479658252647 | erot = 0.397919790440824 | epot = -15.1723031907806 | etot = -14.6249037420871 -137000 ekin = 0.127443476996608 | erot = 0.391972186713592 | epot = -15.1443194057199 | etot = -14.6249037420097 -138000 ekin = 0.10831297052536 | erot = 0.388631700836367 | epot = -15.1218484133082 | etot = -14.6249037419464 -139000 ekin = 0.0928612988418002 | erot = 0.388121053034821 | epot = -15.1058860937783 | etot = -14.6249037419017 -140000 ekin = 0.0816456573910084 | erot = 0.390586148388801 | epot = -15.0971355476587 | etot = -14.6249037418789 -141000 ekin = 0.0749596349872437 | erot = 0.396090706683564 | epot = -15.0959540835505 | etot = -14.6249037418797 -142000 ekin = 0.0728085537690405 | erot = 0.404612196534891 | epot = -15.1023244922084 | etot = -14.6249037419044 -143000 ekin = 0.0749117535383842 | erot = 0.416039504837645 | epot = -15.1158550003269 | etot = -14.6249037419509 -144000 ekin = 0.0807320498020964 | erot = 0.43017313668478 | epot = -15.1358089285024 | etot = -14.6249037420156 -145000 ekin = 0.08952902558338 | erot = 0.446728893938156 | epot = -15.1611616616151 | etot = -14.6249037420935 -146000 ekin = 0.100429851263191 | erot = 0.465345829669622 | epot = -15.1906794231115 | etot = -14.6249037421787 -147000 ekin = 0.112509264558581 | erot = 0.485598823528122 | epot = -15.2230118303515 | etot = -14.6249037422648 -148000 ekin = 0.124869425792591 | erot = 0.507015469189552 | epot = -15.2567886373282 | etot = -14.6249037423461 -149000 ekin = 0.136710750658436 | erot = 0.529096273051187 | epot = -15.290710766127 | etot = -14.6249037424174 -150000 ekin = 0.147386480806171 | erot = 0.551336607352345 | epot = -15.323626830634 | etot = -14.6249037424755 -151000 ekin = 0.156436378416032 | erot = 0.573248570645276 | epot = -15.3545886915794 | etot = -14.6249037425181 -152000 ekin = 0.163597998371653 | erot = 0.594380933602923 | epot = -15.3828826745196 | etot = -14.624903742545 -153000 ekin = 0.168796920199611 | erot = 0.614335653334474 | epot = -15.4080363160912 | etot = -14.6249037425571 -154000 ekin = 0.172119667637745 | erot = 0.63277992909172 | epot = -15.4298033392862 | etot = -14.6249037425567 -155000 ekin = 0.173774602206285 | erot = 0.649453329865168 | epot = -15.448131674618 | etot = -14.6249037425466 -156000 ekin = 0.174046854480021 | erot = 0.664170048550552 | epot = -15.4631206455605 | etot = -14.62490374253 -157000 ekin = 0.173253451016122 | erot = 0.676816762702534 | epot = -15.4749739562284 | etot = -14.6249037425097 -158000 ekin = 0.171704281293749 | erot = 0.687346881268012 | epot = -15.48395490505 | etot = -14.6249037424883 -159000 ekin = 0.169673443699862 | erot = 0.695772131173121 | epot = -15.4903493173403 | etot = -14.6249037424673 -160000 ekin = 0.167383826014546 | erot = 0.702152502586509 | epot = -15.4944400710487 | etot = -14.6249037424476 -161000 ekin = 0.165005624031702 | erot = 0.706585545944493 | epot = -15.4964949124054 | etot = -14.6249037424292 -162000 ekin = 0.162667154471752 | erot = 0.709195914790859 | epot = -15.4967668116741 | etot = -14.6249037424115 -163000 ekin = 0.160474189581485 | erot = 0.710125892129829 | epot = -15.4955038241048 | etot = -14.6249037423935 -164000 ekin = 0.158532578972596 | erot = 0.709527441008927 | epot = -15.4929637623557 | etot = -14.6249037423742 -165000 ekin = 0.156968465370669 | erot = 0.707556101121189 | epot = -15.4894283088449 | etot = -14.624903742353 -166000 ekin = 0.155941053191124 | erot = 0.704366832058078 | epot = -15.4852116275794 | etot = -14.6249037423302 -167000 ekin = 0.155644496809548 | erot = 0.700111698658369 | epot = -15.4806599377741 | etot = -14.6249037423062 -168000 ekin = 0.156297672988182 | erot = 0.694939119112873 | epot = -15.4761405343834 | etot = -14.6249037422823 -169000 ekin = 0.158122923325456 | erot = 0.688994262094025 | epot = -15.4720209276801 | etot = -14.6249037422606 -170000 ekin = 0.161316852937676 | erot = 0.682420091513849 | epot = -15.4686406866943 | etot = -14.6249037422428 -171000 ekin = 0.166017619146822 | erot = 0.675358520304806 | epot = -15.4662798816825 | etot = -14.6249037422309 -172000 ekin = 0.172273671159511 | erot = 0.667951149520835 | epot = -15.4651285629069 | etot = -14.6249037422266 -173000 ekin = 0.180018623556049 | erot = 0.660339136127854 | epot = -15.4652615019149 | etot = -14.624903742231 -174000 ekin = 0.189056055744924 | erot = 0.65266185183192 | epot = -15.4666216498214 | etot = -14.6249037422445 -175000 ekin = 0.199056860650113 | erot = 0.645054167286172 | epot = -15.4690147702031 | etot = -14.6249037422668 -176000 ekin = 0.209570701317552 | erot = 0.637642422787005 | epot = -15.4721168664013 | etot = -14.6249037422967 -177000 ekin = 0.220052442974625 | erot = 0.630539423737628 | epot = -15.4754956090443 | etot = -14.6249037423321 -178000 ekin = 0.229904071991194 | erot = 0.623839102439311 | epot = -15.4786469168001 | etot = -14.6249037423696 -179000 ekin = 0.238532114427982 | erot = 0.617611757777875 | epot = -15.4810476146108 | etot = -14.624903742405 -180000 ekin = 0.245419064060292 | erot = 0.611900922402653 | epot = -15.4822237288957 | etot = -14.6249037424328 -181000 ekin = 0.250203926055771 | erot = 0.606722796615248 | epot = -15.4818304651186 | etot = -14.6249037424476 -182000 ekin = 0.252761402919565 | erot = 0.602068750131856 | epot = -15.4797338954959 | etot = -14.6249037424445 -183000 ekin = 0.253262634974054 | erot = 0.597910660168588 | epot = -15.4760770375641 | etot = -14.6249037424214 -184000 ekin = 0.252195762131878 | erot = 0.594208023726969 | epot = -15.4713075282387 | etot = -14.6249037423799 -185000 ekin = 0.250326113306321 | erot = 0.59091517967259 | epot = -15.4661450353052 | etot = -14.6249037423263 -186000 ekin = 0.248586758541649 | erot = 0.587986907734566 | epot = -15.4614774085478 | etot = -14.6249037422716 -187000 ekin = 0.247909630265846 | erot = 0.585381224303701 | epot = -15.4581945967982 | etot = -14.6249037422286 -188000 ekin = 0.2490290523945 | erot = 0.583059148733781 | epot = -15.4569919433378 | etot = -14.6249037422095 -189000 ekin = 0.252303803181127 | erot = 0.580982165409763 | epot = -15.4581897108128 | etot = -14.6249037422219 -190000 ekin = 0.25760376351551 | erot = 0.579108718145144 | epot = -15.4616162239281 | etot = -14.6249037422675 -191000 ekin = 0.264292655598098 | erot = 0.577391223758838 | epot = -15.4665876216975 | etot = -14.6249037423406 -192000 ekin = 0.271315385056409 | erot = 0.575774831089113 | epot = -15.4719939585751 | etot = -14.6249037424296 -193000 ekin = 0.277374539132748 | erot = 0.574198584868256 | epot = -15.4764768665202 | etot = -14.6249037425192 -194000 ekin = 0.281161076019677 | erot = 0.572598913484698 | epot = -15.478663732098 | etot = -14.6249037425936 -195000 ekin = 0.281592637347121 | erot = 0.570914645865623 | epot = -15.4774110258523 | etot = -14.6249037426396 -196000 ekin = 0.278011867235596 | erot = 0.569092314484759 | epot = -15.4720079243693 | etot = -14.624903742649 -197000 ekin = 0.270307527592762 | erot = 0.567090473639989 | epot = -15.4623017438531 | etot = -14.6249037426204 -198000 ekin = 0.258940359975855 | erot = 0.564882125458807 | epot = -15.4487262279927 | etot = -14.6249037425581 -199000 ekin = 0.244877476699234 | erot = 0.562454912721902 | epot = -15.4322361318925 | etot = -14.6249037424713 -200000 ekin = 0.229456931018641 | erot = 0.559809284042077 | epot = -15.4141699574324 | etot = -14.6249037423716 -201000 ekin = 0.214214012278847 | erot = 0.556955381706859 | epot = -15.3960731362566 | etot = -14.6249037422709 -202000 ekin = 0.200701376135036 | erot = 0.553909032488863 | epot = -15.3795141508034 | etot = -14.6249037421795 -203000 ekin = 0.190329688710817 | erot = 0.550687503827512 | epot = -15.3659209346435 | etot = -14.6249037421052 -204000 ekin = 0.184246973275337 | erot = 0.547306655840007 | epot = -15.356457371168 | etot = -14.6249037420527 -205000 ekin = 0.183262973705813 | erot = 0.543779043729278 | epot = -15.3519457594592 | etot = -14.6249037420241 -206000 ekin = 0.187816949073515 | erot = 0.540113432736619 | epot = -15.3528341238291 | etot = -14.624903742019 -207000 ekin = 0.197980929490512 | erot = 0.536315658388676 | epot = -15.3592003299145 | etot = -14.6249037420353 -208000 ekin = 0.213487612677366 | erot = 0.53239049820727 | epot = -15.3707818529549 | etot = -14.6249037420703 -209000 ekin = 0.233772362712521 | erot = 0.528344018725095 | epot = -15.3870201235584 | etot = -14.6249037421208 -210000 ekin = 0.258021408692355 | erot = 0.524185756556833 | epot = -15.4071109074329 | etot = -14.6249037421837 -211000 ekin = 0.285222208429996 | erot = 0.519930104708342 | epot = -15.4300560553942 | etot = -14.6249037422558 -212000 ekin = 0.314215813604987 | erot = 0.515596398128489 | epot = -15.454715954067 | etot = -14.6249037423335 -213000 ekin = 0.343753634043937 | erot = 0.511207450608882 | epot = -15.4798648270658 | etot = -14.624903742413 -214000 ekin = 0.372561594270316 | erot = 0.506786560075337 | epot = -15.5042518968352 | etot = -14.6249037424895 -215000 ekin = 0.399412456462858 | erot = 0.502353347158712 | epot = -15.5266695461799 | etot = -14.6249037425583 -216000 ekin = 0.423202666203616 | erot = 0.497919155944113 | epot = -15.5460255647623 | etot = -14.6249037426146 -217000 ekin = 0.443025226540025 | erot = 0.493483013679004 | epot = -15.5614119828738 | etot = -14.6249037426548 -218000 ekin = 0.458227302378849 | erot = 0.489029294856436 | epot = -15.5721603399122 | etot = -14.6249037426769 -219000 ekin = 0.46844301918404 | erot = 0.484528125251435 | epot = -15.5778748871159 | etot = -14.6249037426804 -220000 ekin = 0.473598483116685 | erot = 0.479939108990801 | epot = -15.5784413347739 | etot = -14.6249037426664 -221000 ekin = 0.473894168318713 | erot = 0.475218183432529 | epot = -15.5740160943878 | etot = -14.6249037426366 -222000 ekin = 0.46977401404952 | erot = 0.470326483973494 | epot = -15.565004240616 | etot = -14.624903742593 -223000 ekin = 0.461887320397438 | erot = 0.465239349169368 | epot = -15.552030412105 | etot = -14.6249037425382 -224000 ekin = 0.45104133642262 | erot = 0.459953336121611 | epot = -15.5358984150202 | etot = -14.624903742476 -225000 ekin = 0.438137198422833 | erot = 0.454489515561399 | epot = -15.5175304563959 | etot = -14.6249037424116 -226000 ekin = 0.424086332826247 | erot = 0.448892294163513 | epot = -15.4978823693413 | etot = -14.6249037423516 -227000 ekin = 0.409717105195145 | erot = 0.443224250669953 | epot = -15.4778450981665 | etot = -14.6249037423014 -228000 ekin = 0.395692916861505 | erot = 0.437558473222737 | epot = -15.4581551323492 | etot = -14.6249037422649 -229000 ekin = 0.382463318564619 | erot = 0.431970318931211 | epot = -15.4393373797385 | etot = -14.6249037422426 -230000 ekin = 0.370258116730603 | erot = 0.426530223272752 | epot = -15.421692082236 | etot = -14.6249037422326 -231000 ekin = 0.359118625017489 | erot = 0.421298440292615 | epot = -15.4053208075415 | etot = -14.6249037422314 -232000 ekin = 0.348949729121418 | erot = 0.416321816462733 | epot = -15.3901752878198 | etot = -14.6249037422357 -233000 ekin = 0.339575284188205 | erot = 0.411632247273789 | epot = -15.3761112737045 | etot = -14.6249037422425 -234000 ekin = 0.330784909163314 | erot = 0.407246384303571 | epot = -15.362935035717 | etot = -14.6249037422501 -235000 ekin = 0.322367248495157 | erot = 0.403166248673602 | epot = -15.350437239426 | etot = -14.6249037422572 -236000 ekin = 0.314129851889501 | erot = 0.399380677843556 | epot = -15.3384142719966 | etot = -14.6249037422635 -237000 ekin = 0.305908300164827 | erot = 0.395867600047935 | epot = -15.3266796424818 | etot = -14.624903742269 -238000 ekin = 0.297568064657773 | erot = 0.39259715720464 | epot = -15.3150689641361 | etot = -14.6249037422737 -239000 ekin = 0.289002756414808 | erot = 0.389535643317172 | epot = -15.3034421420093 | etot = -14.6249037422773 -240000 ekin = 0.280132201614557 | erot = 0.386650129641611 | epot = -15.291686073536 | etot = -14.6249037422798 -241000 ekin = 0.270903172980175 | erot = 0.383913574227223 | epot = -15.2797204894877 | etot = -14.6249037422803 -242000 ekin = 0.261294311101929 | erot = 0.381310019034114 | epot = -15.2675080724141 | etot = -14.624903742278 -243000 ekin = 0.251325265433967 | erot = 0.378839435319614 | epot = -15.255068443025 | etot = -14.6249037422714 -244000 ekin = 0.241068460184099 | erot = 0.376521662813181 | epot = -15.2424938652571 | etot = -14.6249037422598 -245000 ekin = 0.230660579660543 | erot = 0.374398842117411 | epot = -15.2299631640205 | etot = -14.6249037422425 -246000 ekin = 0.220310176855077 | erot = 0.372535772164605 | epot = -15.2177496912391 | etot = -14.6249037422194 -247000 ekin = 0.21029792040831 | erot = 0.371017759432739 | epot = -15.2062194220324 | etot = -14.6249037421913 -248000 ekin = 0.200966973970282 | erot = 0.369945779906298 | epot = -15.1958164960366 | etot = -14.62490374216 -249000 ekin = 0.19270275205643 | erot = 0.369429135338942 | epot = -15.1870356295232 | etot = -14.6249037421279 -250000 ekin = 0.18590352409262 | erot = 0.369576201101644 | epot = -15.1803834672921 | etot = -14.6249037420978 -251000 ekin = 0.180945546219597 | erot = 0.370484246994953 | epot = -15.1763335352872 | etot = -14.6249037420727 -252000 ekin = 0.178147956309677 | erot = 0.372229589272508 | epot = -15.1752812876371 | etot = -14.624903742055 -253000 ekin = 0.177743031465493 | erot = 0.374859230993345 | epot = -15.1775060045052 | etot = -14.6249037420463 -254000 ekin = 0.179856300055144 | erot = 0.378385037101541 | epot = -15.1831450792041 | etot = -14.6249037420475 -255000 ekin = 0.184498455786623 | erot = 0.382781080046676 | epot = -15.1921832778916 | etot = -14.6249037420583 -256000 ekin = 0.191568141873245 | erot = 0.387983970946509 | epot = -15.2044558548979 | etot = -14.6249037420781 -257000 ekin = 0.200862084874684 | erot = 0.39389562099413 | epot = -15.2196614479746 | etot = -14.6249037421058 -258000 ekin = 0.212087875567067 | erot = 0.400387498987617 | epot = -15.2373791166953 | etot = -14.6249037421406 -259000 ekin = 0.22487530619229 | erot = 0.407305396776974 | epot = -15.2570844451511 | etot = -14.6249037421818 -260000 ekin = 0.238784314763371 | erot = 0.414473950040919 | epot = -15.2781620070334 | etot = -14.6249037422291 -261000 ekin = 0.253310397642053 | erot = 0.42170059668304 | epot = -15.2999147366073 | etot = -14.6249037422822 -262000 ekin = 0.267890750412286 | erot = 0.428779149459046 | epot = -15.3215736422117 | etot = -14.6249037423403 -263000 ekin = 0.281915541777785 | erot = 0.435493571930371 | epot = -15.3423128561102 | etot = -14.6249037424021 -264000 ekin = 0.294748319449044 | erot = 0.441622773940652 | epot = -15.3612748358547 | etot = -14.624903742465 -265000 ekin = 0.305757851305137 | erot = 0.446947232466447 | epot = -15.3776088262971 | etot = -14.6249037425255 -266000 ekin = 0.314361275702132 | erot = 0.451257984268096 | epot = -15.3905230025497 | etot = -14.6249037425794 -267000 ekin = 0.320075758813841 | erot = 0.454368036195507 | epot = -15.3993475376314 | etot = -14.624903742622 -268000 ekin = 0.322573111285627 | erot = 0.456125517716869 | epot = -15.403602371651 | etot = -14.6249037426485 -269000 ekin = 0.321728949456794 | erot = 0.456427019949868 | epot = -15.403059712062 | etot = -14.6249037426553 -270000 ekin = 0.31765519820333 | erot = 0.45522869606994 | epot = -15.3977876369143 | etot = -14.624903742641 -271000 ekin = 0.310703151367432 | erot = 0.452552178355822 | epot = -15.3881590723309 | etot = -14.6249037426077 -272000 ekin = 0.301426233536413 | erot = 0.448482664562071 | epot = -15.3748126406594 | etot = -14.6249037425609 -273000 ekin = 0.290499502093209 | erot = 0.443158007811074 | epot = -15.3585612524138 | etot = -14.6249037425095 -274000 ekin = 0.278606962226069 | erot = 0.436750209657617 | epot = -15.3402609143468 | etot = -14.6249037424631 -275000 ekin = 0.26632348034077 | erot = 0.429443553158618 | epot = -15.3206707759287 | etot = -14.6249037424293 -276000 ekin = 0.254026977158081 | erot = 0.421415402004818 | epot = -15.3003461215739 | etot = -14.624903742411 -277000 ekin = 0.241871064453538 | erot = 0.412825312322111 | epot = -15.2796001191811 | etot = -14.6249037424054 -278000 ekin = 0.229828041579721 | erot = 0.403815416629946 | epot = -15.2585472006151 | etot = -14.6249037424054 -279000 ekin = 0.217786141146189 | erot = 0.394521119096963 | epot = -15.2372110026452 | etot = -14.624903742402 -280000 ekin = 0.205666064593732 | erot = 0.38508770303191 | epot = -15.2156575100133 | etot = -14.6249037423876 -281000 ekin = 0.19351860427424 | erot = 0.375686870762611 | epot = -15.194109217395 | etot = -14.6249037423581 -282000 ekin = 0.181576720747694 | erot = 0.366527860021383 | epot = -15.1730083230829 | etot = -14.6249037423139 -283000 ekin = 0.170254050626048 | erot = 0.357859944223912 | epot = -15.1530177371086 | etot = -14.6249037422586 -284000 ekin = 0.16009863107041 | erot = 0.349965713705531 | epot = -15.1349680869742 | etot = -14.6249037421982 -285000 ekin = 0.151720356670754 | erot = 0.343146625519695 | epot = -15.1197707243297 | etot = -14.6249037421393 -286000 ekin = 0.145712559183906 | erot = 0.337703485420487 | epot = -15.1083197866921 | etot = -14.6249037420877 -287000 ekin = 0.142584250545045 | erot = 0.33391483609244 | epot = -15.1014028286853 | etot = -14.6249037420479 -288000 ekin = 0.14271294134083 | erot = 0.33201595204223 | epot = -15.0996326354053 | etot = -14.6249037420222 -289000 ekin = 0.146320998448773 | erot = 0.332180585089635 | epot = -15.1034053255502 | etot = -14.6249037420118 -290000 ekin = 0.153472816921521 | erot = 0.334506983378674 | epot = -15.1128835423164 | etot = -14.6249037420162 -291000 ekin = 0.16408646566307 | erot = 0.339009144348004 | epot = -15.1279993520452 | etot = -14.6249037420341 -292000 ekin = 0.177952173600894 | erot = 0.345613807734655 | epot = -15.1484697233998 | etot = -14.6249037420642 -293000 ekin = 0.194750859969321 | erot = 0.354163344443058 | epot = -15.1738179465174 | etot = -14.624903742105 -294000 ekin = 0.214068309159694 | erot = 0.364424408222029 | epot = -15.2033964595369 | etot = -14.6249037421551 -295000 ekin = 0.23540371040359 | erot = 0.376101928511103 | epot = -15.2364093811279 | etot = -14.6249037422133 -296000 ekin = 0.258174229753498 | erot = 0.388857685536646 | epot = -15.2719356575678 | etot = -14.6249037422776 -297000 ekin = 0.281719360135706 | erot = 0.402332315571764 | epot = -15.3089554180538 | etot = -14.6249037423463 -298000 ekin = 0.305309684523697 | erot = 0.416169191335652 | epot = -15.3463826182759 | etot = -14.6249037424165 -299000 ekin = 0.328164426016654 | erot = 0.430038291827268 | epot = -15.3831064603292 | etot = -14.6249037424853 -300000 ekin = 0.349480947255048 | erot = 0.443657997414315 | epot = -15.4180426872181 | etot = -14.6249037425488 -301000 ekin = 0.368477349759193 | erot = 0.456812763608568 | epot = -15.4501938559701 | etot = -14.6249037426023 -302000 ekin = 0.384446573101124 | erot = 0.469364841860938 | epot = -15.4787151576043 | etot = -14.6249037426422 -303000 ekin = 0.396817065634558 | erot = 0.481258609604811 | epot = -15.5029794179039 | etot = -14.6249037426646 -304000 ekin = 0.405211709647007 | erot = 0.492516637287636 | epot = -15.5226320896017 | etot = -14.624903742667 -305000 ekin = 0.409494186865868 | erot = 0.503227368870062 | epot = -15.5376252983853 | etot = -14.6249037426493 -306000 ekin = 0.409791521882642 | erot = 0.513525227982917 | epot = -15.5482204924792 | etot = -14.6249037426137 -307000 ekin = 0.406484029567507 | erot = 0.523565033268454 | epot = -15.5549528054007 | etot = -14.6249037425647 -308000 ekin = 0.400159443093576 | erot = 0.533493670193517 | epot = -15.5585568557963 | etot = -14.6249037425092 -309000 ekin = 0.391535685673409 | erot = 0.543422788904487 | epot = -15.5598622170328 | etot = -14.6249037424549 -310000 ekin = 0.381364662749467 | erot = 0.553406603763533 | epot = -15.559675008922 | etot = -14.624903742409 -311000 ekin = 0.370335174700701 | erot = 0.563428434509133 | epot = -15.5586673515868 | etot = -14.624903742377 -312000 ekin = 0.358994462073939 | erot = 0.573398378860855 | epot = -15.5572965832959 | etot = -14.6249037423611 -313000 ekin = 0.347704062021925 | erot = 0.583162598674903 | epot = -15.5557704030573 | etot = -14.6249037423605 -314000 ekin = 0.33663740290675 | erot = 0.592522528333923 | epot = -15.5540636736116 | etot = -14.6249037423709 -315000 ekin = 0.325816357219143 | erot = 0.601260411441213 | epot = -15.5519805110473 | etot = -14.6249037423869 -316000 ekin = 0.31517501281672 | erot = 0.60916645196768 | epot = -15.5492452071863 | etot = -14.6249037424019 -317000 ekin = 0.304633856553889 | erot = 0.616062831072119 | epot = -15.5456004300365 | etot = -14.6249037424105 -318000 ekin = 0.294167456686821 | erot = 0.621820866636781 | epot = -15.5408920657325 | etot = -14.6249037424089 -319000 ekin = 0.283852816310689 | erot = 0.626369338624031 | epot = -15.5351258973307 | etot = -14.6249037423959 -320000 ekin = 0.273891844373646 | erot = 0.62969394858388 | epot = -15.5284895353295 | etot = -14.624903742372 -321000 ekin = 0.264607615830763 | erot = 0.631829520445007 | epot = -15.5213408786157 | etot = -14.6249037423399 -322000 ekin = 0.256418665980724 | erot = 0.632847556381818 | epot = -15.5141699646656 | etot = -14.6249037423031 -323000 ekin = 0.249797892887888 | erot = 0.632842055921319 | epot = -15.5075436910747 | etot = -14.6249037422655 -324000 ekin = 0.245223011939643 | erot = 0.631916211662829 | epot = -15.5020429658332 | etot = -14.6249037422308 -325000 ekin = 0.243124676660885 | erot = 0.630171930979599 | epot = -15.4982003498433 | etot = -14.6249037422029 -326000 ekin = 0.243837159968202 | erot = 0.62770331019607 | epot = -15.4964442123487 | etot = -14.6249037421844 -327000 ekin = 0.247555458534598 | erot = 0.624594349329564 | epot = -15.4970535500418 | etot = -14.6249037421777 -328000 ekin = 0.254302069317208 | erot = 0.620920422826662 | epot = -15.5001262343276 | etot = -14.6249037421837 -329000 ekin = 0.263906382978448 | erot = 0.616752378549749 | epot = -15.5055625037309 | etot = -14.6249037422027 -330000 ekin = 0.275999298196581 | erot = 0.612161709808553 | epot = -15.513064750239 | etot = -14.6249037422339 -331000 ekin = 0.290024872454518 | erot = 0.6072251384784 | epot = -15.5221537532081 | etot = -14.6249037422752 -332000 ekin = 0.305269328205317 | erot = 0.602027230533175 | epot = -15.5322003010622 | etot = -14.6249037423237 -333000 ekin = 0.32090561137506 | erot = 0.59666030333851 | epot = -15.5424696570894 | etot = -14.6249037423759 -334000 ekin = 0.336049438962957 | erot = 0.59122171045733 | epot = -15.5521748918481 | etot = -14.6249037424278 -335000 ekin = 0.349821102707528 | erot = 0.585809355783074 | epot = -15.5605342009664 | etot = -14.6249037424758 -336000 ekin = 0.361406827299004 | erot = 0.580516763971273 | epot = -15.5668273337865 | etot = -14.6249037425162 -337000 ekin = 0.370114335989199 | erot = 0.575429096256477 | epot = -15.570447174792 | etot = -14.6249037425463 -338000 ekin = 0.375418963131835 | erot = 0.570621177508979 | epot = -15.5709438832047 | etot = -14.6249037425639 -339000 ekin = 0.376998306684161 | erot = 0.566157982091391 | epot = -15.5680600313428 | etot = -14.6249037425673 -340000 ekin = 0.374754278532076 | erot = 0.562097189039027 | epot = -15.561755210127 | etot = -14.6249037425559 -341000 ekin = 0.368821588409674 | erot = 0.558493134368603 | epot = -15.5522184653082 | etot = -14.6249037425299 -342000 ekin = 0.359561251230654 | erot = 0.555400700218385 | epot = -15.5398656939398 | etot = -14.6249037424907 -343000 ekin = 0.347537853254552 | erot = 0.552877785918206 | epot = -15.5253193816135 | etot = -14.6249037424408 -344000 ekin = 0.333480374963866 | erot = 0.5509852684009 | epot = -15.5093693857484 | etot = -14.6249037423837 -345000 ekin = 0.318228359784356 | erot = 0.549783918348281 | epot = -15.4929160204566 | etot = -14.6249037423239 -346000 ekin = 0.302667555547469 | erot = 0.549328430110417 | epot = -15.4768997279243 | etot = -14.6249037422664 -347000 ekin = 0.28766105744341 | erot = 0.549659363310447 | epot = -15.4622241629696 | etot = -14.6249037422157 -348000 ekin = 0.273982878354205 | erot = 0.550794243902763 | epot = -15.4496808644331 | etot = -14.6249037421761 -349000 ekin = 0.262260631617843 | erot = 0.552719272009514 | epot = -15.439883645778 | etot = -14.6249037421507 -350000 ekin = 0.252932884528192 | erot = 0.555383042233133 | epot = -15.4332196689026 | etot = -14.6249037421413 -351000 ekin = 0.246225113234617 | erot = 0.55869341876511 | epot = -15.4298222741477 | etot = -14.624903742148 -352000 ekin = 0.242146418558379 | erot = 0.562518344425243 | epot = -15.4295685051533 | etot = -14.6249037421697 -353000 ekin = 0.240507191582831 | erot = 0.566690733134613 | epot = -15.4321016669209 | etot = -14.6249037422035 -354000 ekin = 0.240955911174275 | erot = 0.571016874087082 | epot = -15.4368765275071 | etot = -14.6249037422458 -355000 ekin = 0.243030568944454 | erot = 0.575286990707861 | epot = -15.4432213019444 | etot = -14.624903742292 -356000 ekin = 0.246218336341954 | erot = 0.579286102670435 | epot = -15.4504081813504 | etot = -14.6249037423381 -357000 ekin = 0.250015504867581 | erot = 0.58280308408374 | epot = -15.4577223313315 | etot = -14.6249037423802 -358000 ekin = 0.253980003728839 | erot = 0.585636256510467 | epot = -15.4645200026551 | etot = -14.6249037424158 -359000 ekin = 0.257771924238821 | erot = 0.587595069854197 | epot = -15.4702707365363 | etot = -14.6249037424433 -360000 ekin = 0.261178006692924 | erot = 0.588498175296143 | epot = -15.4745799244512 | etot = -14.6249037424621 -361000 ekin = 0.264121303804436 | erot = 0.588169931158563 | epot = -15.4771949774355 | etot = -14.6249037424725 -362000 ekin = 0.26665626894814 | erot = 0.586437607933123 | epot = -15.4779976193568 | etot = -14.6249037424755 -363000 ekin = 0.268947338174106 | erot = 0.583131261384995 | epot = -15.4769823420322 | etot = -14.6249037424731 -364000 ekin = 0.271226723299596 | erot = 0.578087502910441 | epot = -15.4742179686788 | etot = -14.6249037424688 -365000 ekin = 0.273728224388818 | erot = 0.571157191000725 | epot = -15.469789157857 | etot = -14.6249037424674 -366000 ekin = 0.27660157052003 | erot = 0.562216266683608 | epot = -15.4637215796777 | etot = -14.624903742474 -367000 ekin = 0.279824898676208 | erot = 0.551178529879214 | epot = -15.4559071710475 | etot = -14.6249037424921 -368000 ekin = 0.283144751011421 | erot = 0.538009090150606 | epot = -15.446057583683 | etot = -14.624903742521 -369000 ekin = 0.286073979195429 | erot = 0.522737270878628 | epot = -15.43371499263 | etot = -14.6249037425559 -370000 ekin = 0.287962637923178 | erot = 0.50546765170011 | epot = -15.4183340322108 | etot = -14.6249037425875 -371000 ekin = 0.288129562576893 | erot = 0.486387667907303 | epot = -15.3994209730894 | etot = -14.6249037426052 -372000 ekin = 0.286016270828215 | erot = 0.465769998081936 | epot = -15.3766900115109 | etot = -14.6249037426008 -373000 ekin = 0.281314492917267 | erot = 0.443968246943336 | epot = -15.3501864824312 | etot = -14.6249037425706 -374000 ekin = 0.274029637541304 | erot = 0.421405384813941 | epot = -15.3203387648723 | etot = -14.6249037425171 -375000 ekin = 0.264468317323927 | erot = 0.398555847613352 | epot = -15.2879279073837 | etot = -14.6249037424464 -376000 ekin = 0.253165169267974 | erot = 0.375923572596667 | epot = -15.2539924842319 | etot = -14.6249037423673 -377000 ekin = 0.240780733674519 | erot = 0.354018931407049 | epot = -15.2197034073693 | etot = -14.6249037422878 -378000 ekin = 0.228003530692849 | erot = 0.333337224177657 | epot = -15.1862444970844 | etot = -14.6249037422138 -379000 ekin = 0.215478669427367 | erot = 0.314340303318035 | epot = -15.1547227148943 | etot = -14.6249037421489 -380000 ekin = 0.203769466320298 | erot = 0.297441561967809 | epot = -15.1261147703827 | etot = -14.6249037420946 -381000 ekin = 0.193344913038602 | erot = 0.282993579610754 | epot = -15.1012422347007 | etot = -14.6249037420513 -382000 ekin = 0.1845790971167 | erot = 0.271277560103436 | epot = -15.0807603992401 | etot = -14.62490374202 -383000 ekin = 0.177749902922622 | erot = 0.26249431847454 | epot = -15.0651479633984 | etot = -14.6249037420012 -384000 ekin = 0.173031383434508 | erot = 0.256757595375745 | epot = -15.0546927208059 | etot = -14.6249037419956 -385000 ekin = 0.170483112154869 | erot = 0.254091341095724 | epot = -15.049478195254 | etot = -14.6249037420034 -386000 ekin = 0.170046361592442 | erot = 0.254432809989109 | epot = -15.0493829136049 | etot = -14.6249037420233 -387000 ekin = 0.171558026227206 | erot = 0.257642587604648 | epot = -15.0541043558835 | etot = -14.6249037420517 -388000 ekin = 0.174787865439128 | erot = 0.263521131370077 | epot = -15.0632127388927 | etot = -14.6249037420835 -389000 ekin = 0.179494526901848 | erot = 0.271829477565643 | epot = -15.0762277465811 | etot = -14.6249037421136 -390000 ekin = 0.185484901052496 | erot = 0.282310127810724 | epot = -15.0926987710012 | etot = -14.624903742138 -391000 ekin = 0.192654775276086 | erot = 0.294703495236184 | epot = -15.1122620126683 | etot = -14.624903742156 -392000 ekin = 0.200990711955861 | erot = 0.308756153372879 | epot = -15.1346506074993 | etot = -14.6249037421705 -393000 ekin = 0.210524629688573 | erot = 0.324219483681282 | epot = -15.1596478555577 | etot = -14.6249037421878 -394000 ekin = 0.22125039811835 | erot = 0.340840530849664 | epot = -15.1869946711827 | etot = -14.6249037422146 -395000 ekin = 0.233028912153826 | erot = 0.358349828151301 | epot = -15.2162824825616 | etot = -14.6249037422565 -396000 ekin = 0.2455168348482 | erot = 0.376452447324096 | epot = -15.2468730244869 | etot = -14.6249037423146 -397000 ekin = 0.25814964628924 | erot = 0.394827815017667 | epot = -15.2778812036919 | etot = -14.624903742385 -398000 ekin = 0.270192540270399 | erot = 0.4131410333725 | epot = -15.3082373161018 | etot = -14.6249037424589 -399000 ekin = 0.280849396853854 | erot = 0.431064534842813 | epot = -15.3368176742223 | etot = -14.6249037425256 -400000 ekin = 0.289399657315509 | erot = 0.448305349545533 | epot = -15.3626087494363 | etot = -14.6249037425752 -401000 ekin = 0.295323233787914 | erot = 0.464631356382232 | epot = -15.3848583327717 | etot = -14.6249037426015 -402000 ekin = 0.298377750401429 | erot = 0.479890206670972 | epot = -15.4031716996757 | etot = -14.6249037426033 -403000 ekin = 0.298608046776847 | erot = 0.494016844836358 | epot = -15.4175286341982 | etot = -14.624903742585 -404000 ekin = 0.296288720276099 | erot = 0.507028747324982 | epot = -15.4282212101551 | etot = -14.624903742554 -405000 ekin = 0.29181945089068 | erot = 0.519011022290344 | epot = -15.4357342157007 | etot = -14.6249037425197 -406000 ekin = 0.285604695316787 | erot = 0.530095491696252 | epot = -15.440603929503 | etot = -14.62490374249 -407000 ekin = 0.27795179501284 | erot = 0.540438449781457 | epot = -15.4432939872644 | etot = -14.6249037424701 -408000 ekin = 0.269015012492725 | erot = 0.550201084797105 | epot = -15.4441198397503 | etot = -14.6249037424605 -409000 ekin = 0.258799683406998 | erot = 0.559535019811799 | epot = -15.4432384456764 | etot = -14.6249037424576 -410000 ekin = 0.247223943172304 | erot = 0.568573648692186 | epot = -15.4407013343195 | etot = -14.624903742455 -411000 ekin = 0.234219542826644 | erot = 0.577428429926533 | epot = -15.4365517151989 | etot = -14.6249037424457 -412000 ekin = 0.219842320368382 | erot = 0.5861883861288 | epot = -15.4309344489209 | etot = -14.6249037424237 -413000 ekin = 0.204359948374925 | erot = 0.594920843620856 | epot = -15.4241845343826 | etot = -14.6249037423868 -414000 ekin = 0.188290368309528 | erot = 0.603671832826723 | epot = -15.4168659434726 | etot = -14.6249037423363 -415000 ekin = 0.17237708181679 | erot = 0.612465324291743 | epot = -15.4097461483867 | etot = -14.6249037422781 -416000 ekin = 0.157503657630917 | erot = 0.621301324615619 | epot = -15.4037087244673 | etot = -14.6249037422208 -417000 ekin = 0.144565276806003 | erot = 0.630153567596961 | epot = -15.3996225865765 | etot = -14.6249037421735 -418000 ekin = 0.134326161306162 | erot = 0.638967960411851 | epot = -15.3981978638625 | etot = -14.6249037421445 -419000 ekin = 0.127295713866961 | erot = 0.647663024756136 | epot = -15.3998624807615 | etot = -14.6249037421384 -420000 ekin = 0.123652074078926 | erot = 0.656133267678405 | epot = -15.404689083913 | etot = -14.6249037421557 -421000 ekin = 0.123230332545423 | erot = 0.664256043547052 | epot = -15.4123901182846 | etot = -14.6249037421921 -422000 ekin = 0.125576493084645 | erot = 0.671901405101299 | epot = -15.4223816404261 | etot = -14.6249037422401 -423000 ekin = 0.130051930466291 | erot = 0.678943694027994 | epot = -15.4338993667851 | etot = -14.6249037422908 -424000 ekin = 0.135961143238941 | erot = 0.68527308622734 | epot = -15.4461379718019 | etot = -14.6249037423356 -425000 ekin = 0.142671659965653 | erot = 0.690804983811737 | epot = -15.4583803861463 | etot = -14.6249037423689 -426000 ekin = 0.149699767318955 | erot = 0.69548556134855 | epot = -15.4700890710557 | etot = -14.6249037423882 -427000 ekin = 0.156747049208564 | erot = 0.699292628464386 | epot = -15.4809434200676 | etot = -14.6249037423947 -428000 ekin = 0.163686553654653 | erot = 0.702231990285693 | epot = -15.4908222863327 | etot = -14.6249037423924 -429000 ekin = 0.170509683514881 | erot = 0.704330315301697 | epot = -15.4997437412031 | etot = -14.6249037423865 -430000 ekin = 0.177252892951705 | erot = 0.705626025883602 | epot = -15.5077826612176 | etot = -14.6249037423823 -431000 ekin = 0.183925691222895 | erot = 0.706159951516283 | epot = -15.5149893851227 | etot = -14.6249037423835 -432000 ekin = 0.19045785108011 | erot = 0.705966883793978 | epot = -15.5213284772661 | etot = -14.624903742392 -433000 ekin = 0.196676887389506 | erot = 0.705069371776843 | epot = -15.5266500015735 | etot = -14.6249037424072 -434000 ekin = 0.202317433899842 | erot = 0.703474477741428 | epot = -15.5306956540681 | etot = -14.6249037424269 -435000 ekin = 0.207056046506956 | erot = 0.701173837003811 | epot = -15.5331336259585 | etot = -14.6249037424477 -436000 ekin = 0.210560164857125 | erot = 0.698146912242933 | epot = -15.5336108195661 | etot = -14.6249037424661 -437000 ekin = 0.212539330538931 | erot = 0.694366864819831 | epot = -15.5318099378377 | etot = -14.624903742479 -438000 ekin = 0.212789433625871 | erot = 0.689808070113593 | epot = -15.5275012462235 | etot = -14.624903742484 -439000 ekin = 0.211224885327214 | erot = 0.684454087056214 | epot = -15.5205827148631 | etot = -14.6249037424797 -440000 ekin = 0.207897417438809 | erot = 0.678304934040255 | epot = -15.5111060939441 | etot = -14.624903742465 -441000 ekin = 0.203002684917561 | erot = 0.671382822496918 | epot = -15.4992892498548 | etot = -14.6249037424403 -442000 ekin = 0.196876783893415 | erot = 0.66373594678721 | epot = -15.4855164730867 | etot = -14.6249037424061 -443000 ekin = 0.189984458135294 | erot = 0.655440346227568 | epot = -15.4703285467262 | etot = -14.6249037423634 -444000 ekin = 0.182899715135625 | erot = 0.646600090308741 | epot = -15.4544035477581 | etot = -14.6249037423138 -445000 ekin = 0.176278659807151 | erot = 0.637346059016373 | epot = -15.4385284610832 | etot = -14.6249037422597 -446000 ekin = 0.170824489262207 | erot = 0.627833490901199 | epot = -15.4235617223673 | etot = -14.6249037422039 -447000 ekin = 0.16724611578148 | erot = 0.618238375507256 | epot = -15.4103882334382 | etot = -14.6249037421495 -448000 ekin = 0.166214016011086 | erot = 0.608752709243579 | epot = -15.3998704673542 | etot = -14.6249037420995 -449000 ekin = 0.1683180025474 | erot = 0.599578546514547 | epot = -15.3928002911186 | etot = -14.6249037420567 -450000 ekin = 0.174030350885976 | erot = 0.590920601688637 | epot = -15.3898546945984 | etot = -14.6249037420238 -451000 ekin = 0.183674309612486 | erot = 0.582976972209394 | epot = -15.3915550238252 | etot = -14.6249037420033 -452000 ekin = 0.197394458885248 | erot = 0.575927582956616 | epot = -15.39822578384 | etot = -14.6249037419981 -453000 ekin = 0.215124290963754 | erot = 0.569920414705972 | epot = -15.4099484476811 | etot = -14.6249037420114 -454000 ekin = 0.236549344238332 | erot = 0.565056494271021 | epot = -15.4265095805559 | etot = -14.6249037420465 -455000 ekin = 0.261070666492934 | erot = 0.561375729612865 | epot = -15.4473501382115 | etot = -14.6249037421057 -456000 ekin = 0.287780783019101 | erot = 0.558846520705115 | epot = -15.4715310459133 | etot = -14.6249037421891 -457000 ekin = 0.315469350479039 | erot = 0.557362227354604 | epot = -15.4977353201268 | etot = -14.6249037422931 -458000 ekin = 0.342675461161211 | erot = 0.556746783054113 | epot = -15.5243259866255 | etot = -14.6249037424101 -459000 ekin = 0.367796771324328 | erot = 0.556770049266128 | epot = -15.5494705631189 | etot = -14.6249037425284 -460000 ekin = 0.3892528364295 | erot = 0.557171234683844 | epot = -15.5713278137471 | etot = -14.6249037426338 -461000 ekin = 0.405683830372718 | erot = 0.557686417732241 | epot = -15.5882739908163 | etot = -14.6249037427113 -462000 ekin = 0.416150509763905 | erot = 0.558074591842708 | epot = -15.5991288443566 | etot = -14.6249037427499 -463000 ekin = 0.420292029665246 | erot = 0.558136338549459 | epot = -15.6033321109587 | etot = -14.624903742744 -464000 ekin = 0.418399545178514 | erot = 0.557720582601952 | epot = -15.6010238704768 | etot = -14.6249037426963 -465000 ekin = 0.411377435968826 | erot = 0.55671776612672 | epot = -15.5929989447132 | etot = -14.6249037426177 -466000 ekin = 0.400588481170777 | erot = 0.555041504869193 | epot = -15.5805337285653 | etot = -14.6249037425253 -467000 ekin = 0.387608315925912 | erot = 0.552604267015981 | epot = -15.5651163253807 | etot = -14.6249037424389 -468000 ekin = 0.373939506071419 | erot = 0.549294716065778 | epot = -15.5481379645134 | etot = -14.6249037423762 -469000 ekin = 0.360748545285941 | erot = 0.544964338611031 | epot = -15.5306166262458 | etot = -14.6249037423488 -470000 ekin = 0.348685397522481 | erot = 0.539428754142283 | epot = -15.5130178940239 | etot = -14.6249037423591 -471000 ekin = 0.33782542530965 | erot = 0.53248528288589 | epot = -15.495214450596 | etot = -14.6249037424005 -472000 ekin = 0.327743216876187 | erot = 0.523944004295118 | epot = -15.4765909636299 | etot = -14.6249037424586 -473000 ekin = 0.317695625905249 | erot = 0.513665869846711 | epot = -15.4562652382675 | etot = -14.6249037425155 -474000 ekin = 0.306866206292903 | erot = 0.501599410558902 | epot = -15.4333693594053 | etot = -14.6249037425535 -475000 ekin = 0.294611572516014 | erot = 0.487807694339925 | epot = -15.4073230094157 | etot = -14.6249037425598 -476000 ekin = 0.280654133645735 | erot = 0.472479343853221 | epot = -15.3780372200274 | etot = -14.6249037425284 -477000 ekin = 0.265182667318346 | erot = 0.455920989277164 | epot = -15.3460073990571 | etot = -14.6249037424615 -478000 ekin = 0.248846579355896 | erot = 0.438532535944716 | epot = -15.3122828576688 | etot = -14.6249037423682 -479000 ekin = 0.232654569020801 | erot = 0.420770062233786 | epot = -15.2783283735167 | etot = -14.6249037422621 -480000 ekin = 0.217807844646274 | erot = 0.403103245642895 | epot = -15.2458148324472 | etot = -14.624903742158 -481000 ekin = 0.205508255202274 | erot = 0.385974572360121 | epot = -15.2163865696318 | etot = -14.6249037420694 -482000 ekin = 0.196781566941766 | erot = 0.36976631024765 | epot = -15.1914516191951 | etot = -14.6249037420057 -483000 ekin = 0.19234694356787 | erot = 0.354778814406374 | epot = -15.1720294999463 | etot = -14.6249037419721 -484000 ekin = 0.192548846646396 | erot = 0.341220938396507 | epot = -15.1586735270111 | etot = -14.6249037419682 -485000 ekin = 0.197351634264796 | erot = 0.329210924265182 | epot = -15.1514663005207 | etot = -14.6249037419907 -486000 ekin = 0.206384571112674 | erot = 0.318784712513058 | epot = -15.1500730256597 | etot = -14.624903742034 -487000 ekin = 0.219018661981128 | erot = 0.309908337315953 | epot = -15.1538307413883 | etot = -14.6249037420912 -488000 ekin = 0.234457053485615 | erot = 0.302491737711597 | epot = -15.1618525333532 | etot = -14.6249037421559 -489000 ekin = 0.251825722282228 | erot = 0.296402451840807 | epot = -15.1731319163449 | etot = -14.6249037422219 -490000 ekin = 0.270257579252373 | erot = 0.291478772534408 | epot = -15.1866400940707 | etot = -14.6249037422839 -491000 ekin = 0.288968023940477 | erot = 0.287542686829702 | epot = -15.2014144531066 | etot = -14.6249037423364 -492000 ekin = 0.307321746939982 | erot = 0.28441316533236 | epot = -15.2166386546473 | etot = -14.624903742375 -493000 ekin = 0.32488919226749 | erot = 0.281920128741024 | epot = -15.2317130634052 | etot = -14.6249037423967 -494000 ekin = 0.341487883386483 | erot = 0.279918789013753 | epot = -15.2463104147992 | etot = -14.624903742399 -495000 ekin = 0.35720080106069 | erot = 0.278303167954071 | epot = -15.2604077113969 | etot = -14.6249037423821 -496000 ekin = 0.372363075866133 | erot = 0.277016625443694 | epot = -15.274283443659 | etot = -14.6249037423491 -497000 ekin = 0.387510424729673 | erot = 0.276056483801325 | epot = -15.288470650837 | etot = -14.624903742306 -498000 ekin = 0.403287744735438 | erot = 0.275469725413168 | epot = -15.3036612124104 | etot = -14.6249037422618 -499000 ekin = 0.42032292393259 | erot = 0.275337682298044 | epot = -15.320564348458 | etot = -14.6249037422274 -500000 ekin = 0.43907820686993 | erot = 0.275749832423184 | epot = -15.3397317815074 | etot = -14.6249037422143 -501000 ekin = 0.459699055393576 | erot = 0.27677002458897 | epot = -15.3613728222153 | etot = -14.6249037422327 -502000 ekin = 0.481887975238202 | erot = 0.278401857022776 | epot = -15.3851935745495 | etot = -14.6249037422885 -503000 ekin = 0.504836001700849 | erot = 0.28056227342693 | epot = -15.410302017509 | etot = -14.6249037423813 -504000 ekin = 0.527242963721984 | erot = 0.283072520273731 | epot = -15.4352192264977 | etot = -14.624903742502 -505000 ekin = 0.547444055756082 | erot = 0.285672032586838 | epot = -15.458019830977 | etot = -14.6249037426341 -506000 ekin = 0.563636138784674 | erot = 0.288055811209927 | epot = -15.47659569275 | etot = -14.6249037427554 -507000 ekin = 0.574166796919909 | erot = 0.289928574131153 | epot = -15.4889991138946 | etot = -14.6249037428436 -508000 ekin = 0.577825151301095 | erot = 0.29106332686132 | epot = -15.4937922210437 | etot = -14.6249037428812 -509000 ekin = 0.574066827021787 | erot = 0.291350176078735 | epot = -15.4903207459605 | etot = -14.6249037428599 -510000 ekin = 0.563118031118052 | erot = 0.290823209378379 | epot = -15.478844983279 | etot = -14.6249037427826 -511000 ekin = 0.545937816053849 | erot = 0.289659846600108 | epot = -15.4605014053159 | etot = -14.624903742662 -512000 ekin = 0.524051924661522 | erot = 0.288153919329358 | epot = -15.4371095865082 | etot = -14.6249037425174 -513000 ekin = 0.49930007419802 | erot = 0.286670443869403 | epot = -15.4108742604374 | etot = -14.6249037423699 -514000 ekin = 0.473556830410389 | erot = 0.285593013544029 | epot = -15.3840535861934 | etot = -14.624903742239 -515000 ekin = 0.448481344234872 | erot = 0.285274677057468 | epot = -15.3586597634305 | etot = -14.6249037421382 -516000 ekin = 0.425336124988155 | erot = 0.286000471485139 | epot = -15.3362403385481 | etot = -14.6249037420748 -517000 ekin = 0.404895133580943 | erot = 0.2879658116616 | epot = -15.3177646872915 | etot = -14.6249037420489 -518000 ekin = 0.38744137195972 | erot = 0.291271247088022 | epot = -15.303616361103 | etot = -14.6249037420552 -519000 ekin = 0.372839035852851 | erot = 0.295931281214127 | epot = -15.2936740591517 | etot = -14.6249037420847 -520000 ekin = 0.360656186943069 | erot = 0.301893194868317 | epot = -15.2874531239377 | etot = -14.6249037421263 -521000 ekin = 0.350310207443456 | erot = 0.30906098360489 | epot = -15.284274933218 | etot = -14.6249037421697 -522000 ekin = 0.341208800539667 | erot = 0.3173194084493 | epot = -15.2834319511953 | etot = -14.6249037422063 -523000 ekin = 0.332862997936835 | erot = 0.326553653087588 | epot = -15.284320393256 | etot = -14.6249037422315 -524000 ekin = 0.324955020060083 | erot = 0.336661144000867 | epot = -15.2865199063051 | etot = -14.6249037422441 -525000 ekin = 0.317352570821523 | erot = 0.347553686772997 | epot = -15.2898099998415 | etot = -14.624903742247 -526000 ekin = 0.310071537936527 | erot = 0.359150063852877 | epot = -15.2941253440357 | etot = -14.6249037422463 -527000 ekin = 0.30319969763022 | erot = 0.371361343285068 | epot = -15.2994647831647 | etot = -14.6249037422494 -528000 ekin = 0.296802852838113 | erot = 0.38407297047912 | epot = -15.3057795655799 | etot = -14.6249037422627 -529000 ekin = 0.290839689447243 | erot = 0.397128838352394 | epot = -15.31287227009 | etot = -14.6249037422904 -530000 ekin = 0.285110822260533 | erot = 0.410322608856898 | epot = -15.3203371734496 | etot = -14.6249037423322 -531000 ekin = 0.279260366287321 | erot = 0.423400398731777 | epot = -15.3275645074024 | etot = -14.6249037423833 -532000 ekin = 0.2728357059054 | erot = 0.436076588369062 | epot = -15.3338160367096 | etot = -14.6249037424351 -533000 ekin = 0.265395406955423 | erot = 0.448061330488706 | epot = -15.3383604799205 | etot = -14.6249037424763 -534000 ekin = 0.25664035180014 | erot = 0.45909504502717 | epot = -15.3406391393241 | etot = -14.6249037424968 -535000 ekin = 0.24653363369425 | erot = 0.468982742180589 | epot = -15.3404201183648 | etot = -14.62490374249 -536000 ekin = 0.235373881374767 | erot = 0.477620282696299 | epot = -15.3378979065254 | etot = -14.6249037424543 -537000 ekin = 0.223795203401825 | erot = 0.485006039595742 | epot = -15.3337049853926 | etot = -14.624903742395 -538000 ekin = 0.212682661997717 | erot = 0.491234540507922 | epot = -15.32882094483 | etot = -14.6249037423243 -539000 ekin = 0.203011536568094 | erot = 0.496472671628212 | epot = -15.324387950454 | etot = -14.6249037422577 -540000 ekin = 0.195638496925756 | erot = 0.500922912276288 | epot = -15.3214651514142 | etot = -14.6249037422122 -541000 ekin = 0.191090437373868 | erot = 0.504781043299473 | epot = -15.3207752228743 | etot = -14.624903742201 -542000 ekin = 0.189407567632351 | erot = 0.508197267609666 | epot = -15.3225085774711 | etot = -14.6249037422291 -543000 ekin = 0.190094034780963 | erot = 0.511249275631094 | epot = -15.3262470527038 | etot = -14.6249037422917 -544000 ekin = 0.192205662500001 | erot = 0.513933300996131 | epot = -15.3310427058706 | etot = -14.6249037423745 -545000 ekin = 0.194562943958398 | erot = 0.516174993404786 | epot = -15.3356416798198 | etot = -14.6249037424566 -546000 ekin = 0.196033343259865 | erot = 0.517857026727595 | epot = -15.3387941125054 | etot = -14.624903742518 -547000 ekin = 0.195801439086576 | erot = 0.518856237019659 | epot = -15.3395614186507 | etot = -14.6249037425445 -548000 ekin = 0.193552178457624 | erot = 0.519081068513043 | epot = -15.3375369895016 | etot = -14.6249037425309 -549000 ekin = 0.189527872077782 | erot = 0.518500763845595 | epot = -15.3329323784042 | etot = -14.6249037424808 -550000 ekin = 0.18446469719282 | erot = 0.517160608016848 | epot = -15.326529047614 | etot = -14.6249037424043 -551000 ekin = 0.17944751961377 | erot = 0.515181377053922 | epot = -15.3195326389815 | etot = -14.6249037423138 -552000 ekin = 0.175731062295071 | erot = 0.512744588095586 | epot = -15.3133793926126 | etot = -14.6249037422219 -553000 ekin = 0.174564310046339 | erot = 0.510067400325356 | epot = -15.3095354525118 | etot = -14.6249037421401 -554000 ekin = 0.177036897101121 | erot = 0.507372062614127 | epot = -15.309312701793 | etot = -14.6249037420777 -555000 ekin = 0.183953653121541 | erot = 0.50485506124058 | epot = -15.3137124564044 | etot = -14.6249037420423 -556000 ekin = 0.195740677804154 | erot = 0.502660902828886 | epot = -15.3233053226714 | etot = -14.6249037420384 -557000 ekin = 0.212389174813395 | erot = 0.500864749566249 | epot = -15.3381576664467 | etot = -14.6249037420671 -558000 ekin = 0.233445020972978 | erot = 0.499466731744177 | epot = -15.3578154948427 | etot = -14.6249037421256 -559000 ekin = 0.258048678278145 | erot = 0.498398734229532 | epot = -15.381351154715 | etot = -14.6249037422073 -560000 ekin = 0.285022157939727 | erot = 0.497541950864641 | epot = -15.4074678511075 | etot = -14.6249037423031 -561000 ekin = 0.312990622171893 | erot = 0.496751658908829 | epot = -15.4346460234834 | etot = -14.6249037424027 -562000 ekin = 0.340519848730057 | erot = 0.495884310852853 | epot = -15.461307902079 | etot = -14.6249037424961 -563000 ekin = 0.366249237356341 | erot = 0.494821962715706 | epot = -15.4859749426471 | etot = -14.6249037425751 -564000 ekin = 0.389003340228864 | erot = 0.493490109026347 | epot = -15.5073971918896 | etot = -14.6249037426344 -565000 ekin = 0.407871381975787 | erot = 0.491866632343088 | epot = -15.5246417569901 | etot = -14.6249037426712 -566000 ekin = 0.422251605413063 | erot = 0.489981232303539 | epot = -15.537136580402 | etot = -14.6249037426854 -567000 ekin = 0.431863045464991 | erot = 0.487906470955931 | epot = -15.5446732590994 | etot = -14.6249037426785 -568000 ekin = 0.436733840918529 | erot = 0.485743252286281 | epot = -15.5473808358582 | etot = -14.6249037426534 -569000 ekin = 0.437172173179269 | erot = 0.483603786385196 | epot = -15.5456797021777 | etot = -14.6249037426133 -570000 ekin = 0.43372713864672 | erot = 0.48159597879343 | epot = -15.5402268600018 | etot = -14.6249037425617 -571000 ekin = 0.42714180814445 | erot = 0.479812578148079 | epot = -15.5318581287948 | etot = -14.6249037425023 -572000 ekin = 0.418294466662065 | erot = 0.478326721683348 | epot = -15.5215249307851 | etot = -14.6249037424397 -573000 ekin = 0.408121101336508 | erot = 0.477193277919927 | epot = -15.5102181216365 | etot = -14.6249037423801 -574000 ekin = 0.397514818218918 | erot = 0.476453234966625 | epot = -15.4988717955165 | etot = -14.624903742331 -575000 ekin = 0.387207144490505 | erot = 0.476137354469736 | epot = -15.4882482412605 | etot = -14.6249037423002 -576000 ekin = 0.377649119218454 | erot = 0.476266044932873 | epot = -15.4788189064457 | etot = -14.6249037422944 -577000 ekin = 0.368920817133122 | erot = 0.476844730976094 | epot = -15.4706692904255 | etot = -14.6249037423163 -578000 ekin = 0.360700785231361 | erot = 0.47785688313413 | epot = -15.4634614107286 | etot = -14.6249037423631 -579000 ekin = 0.352319179858645 | erot = 0.479258927576455 | epot = -15.4564818498607 | etot = -14.6249037424256 -580000 ekin = 0.342901425190256 | erot = 0.480981430412058 | epot = -15.4487865980916 | etot = -14.6249037424893 -581000 ekin = 0.331586894252413 | erot = 0.482939076923234 | epot = -15.4394297137118 | etot = -14.6249037425361 -582000 ekin = 0.317784488003658 | erot = 0.485048781538909 | epot = -15.427737012092 | etot = -14.6249037425495 -583000 ekin = 0.301409490235786 | erot = 0.487252029394123 | epot = -15.4135652621474 | etot = -14.6249037425175 -584000 ekin = 0.283039202393456 | erot = 0.489535511255409 | epot = -15.3974784560865 | etot = -14.6249037424376 -585000 ekin = 0.263933313486932 | erot = 0.491944128119358 | epot = -15.3807811839248 | etot = -14.6249037423185 -586000 ekin = 0.245890887800014 | erot = 0.494582820570716 | epot = -15.36537745055 | etot = -14.6249037421793 -587000 ekin = 0.230956405619767 | erot = 0.497607010278002 | epot = -15.3534671579441 | etot = -14.6249037420464 -588000 ekin = 0.221033841917334 | erot = 0.501205839010304 | epot = -15.3471434228726 | etot = -14.6249037419449 -589000 ekin = 0.217504428503198 | erot = 0.505584588307916 | epot = -15.3479927587054 | etot = -14.6249037418943 -590000 ekin = 0.220953423088802 | erot = 0.510952138425678 | epot = -15.3568093034149 | etot = -14.6249037419004 -591000 ekin = 0.231083134064877 | erot = 0.517515644130037 | epot = -15.3735025201503 | etot = -14.6249037419554 -592000 ekin = 0.246829245753809 | erot = 0.525479282586983 | epot = -15.3972122703829 | etot = -14.6249037420421 -593000 ekin = 0.266628949730648 | erot = 0.535039778666154 | epot = -15.4265724705373 | etot = -14.6249037421405 -594000 ekin = 0.288743434935948 | erot = 0.546371032865159 | epot = -15.4600182100359 | etot = -14.6249037422348 -595000 ekin = 0.311533695301854 | erot = 0.559594229359111 | epot = -15.4960316669784 | etot = -14.6249037423174 -596000 ekin = 0.333624348261494 | erot = 0.574736425374244 | epot = -15.5332645160249 | etot = -14.6249037423892 -597000 ekin = 0.353943370598259 | erot = 0.591686591895167 | epot = -15.5705337049495 | etot = -14.6249037424561 -598000 ekin = 0.371670846224399 | erot = 0.610160828223706 | epot = -15.6067354169733 | etot = -14.6249037425252 -599000 ekin = 0.386151688530232 | erot = 0.629687420924543 | epot = -15.6407428520551 | etot = -14.6249037426004 -600000 ekin = 0.396824670884392 | erot = 0.649618644309618 | epot = -15.6713470578743 | etot = -14.6249037426803 -601000 ekin = 0.403202067553724 | erot = 0.669171693344937 | epot = -15.6972775036568 | etot = -14.6249037427581 -602000 ekin = 0.404908528299605 | erot = 0.687495721385225 | epot = -15.7173079925077 | etot = -14.6249037428229 -603000 ekin = 0.401765041348441 | erot = 0.703757265562351 | epot = -15.7304260497729 | etot = -14.6249037428621 -604000 ekin = 0.393886240081566 | erot = 0.717231476889447 | epot = -15.7360214598369 | etot = -14.6249037428659 -605000 ekin = 0.381750384954784 | erot = 0.727382711583162 | epot = -15.7340368393681 | etot = -14.6249037428302 -606000 ekin = 0.366205114567235 | erot = 0.733917584159895 | epot = -15.725026441486 | etot = -14.6249037427589 -607000 ekin = 0.348389460815329 | erot = 0.736798185090343 | epot = -15.7100913885696 | etot = -14.624903742664 -608000 ekin = 0.329579787369629 | erot = 0.73621262347853 | epot = -15.6906961534103 | etot = -14.6249037425622 -609000 ekin = 0.310994196072014 | erot = 0.732511274794253 | epot = -15.6684092133371 | etot = -14.6249037424709 -610000 ekin = 0.29360483588481 | erot = 0.726125549058504 | epot = -15.644634127347 | etot = -14.6249037424037 -611000 ekin = 0.278004208602607 | erot = 0.717488389874772 | epot = -15.6203963408453 | etot = -14.624903742368 -612000 ekin = 0.264353214553523 | erot = 0.706972008379557 | epot = -15.5962289652967 | etot = -14.6249037423637 -613000 ekin = 0.252415280668682 | erot = 0.694851301360247 | epot = -15.5721703244136 | etot = -14.6249037423847 -614000 ekin = 0.241662201717183 | erot = 0.681294462599197 | epot = -15.5478604067366 | etot = -14.6249037424202 -615000 ekin = 0.231427318529533 | erot = 0.666377599991891 | epot = -15.5227086609789 | etot = -14.6249037424574 -616000 ekin = 0.221078258759054 | erot = 0.650117838828839 | epot = -15.496099840071 | etot = -14.6249037424831 -617000 ekin = 0.21018039046722 | erot = 0.632518274251072 | epot = -15.4676024072045 | etot = -14.6249037424862 -618000 ekin = 0.198621509656023 | erot = 0.613617132100535 | epot = -15.4371423842165 | etot = -14.6249037424599 -619000 ekin = 0.18667044221321 | erot = 0.593532504056809 | epot = -15.405106688674 | etot = -14.624903742404 -620000 ekin = 0.174951539061334 | erot = 0.572493952083576 | epot = -15.3723492334691 | etot = -14.6249037423242 -621000 ekin = 0.164335257151748 | erot = 0.550854196820334 | epot = -15.3400931962044 | etot = -14.6249037422324 -622000 ekin = 0.155768039681223 | erot = 0.529078173717901 | epot = -15.3097499555421 | etot = -14.6249037421429 -623000 ekin = 0.150083571178067 | erot = 0.507711807337581 | epot = -15.2826991205843 | etot = -14.6249037420687 -624000 ekin = 0.147843467415026 | erot = 0.487337070698877 | epot = -15.2600842801327 | etot = -14.6249037420188 -625000 ekin = 0.149245521580685 | erot = 0.468521842126521 | epot = -15.2426711057039 | etot = -14.6249037419967 -626000 ekin = 0.154116108891011 | erot = 0.451772481731706 | epot = -15.230792332623 | etot = -14.6249037420003 -627000 ekin = 0.161979086426243 | erot = 0.437494698740521 | epot = -15.2243775271906 | etot = -14.6249037420239 -628000 ekin = 0.172174902879429 | erot = 0.425965324893993 | epot = -15.2230439698331 | etot = -14.6249037420597 -629000 ekin = 0.183995029152745 | erot = 0.417314987668754 | epot = -15.2262137589225 | etot = -14.624903742101 -630000 ekin = 0.196798066695247 | erot = 0.411519917957055 | epot = -15.2332217267955 | etot = -14.6249037421432 -631000 ekin = 0.210082131922237 | erot = 0.408400457424511 | epot = -15.2433863315318 | etot = -14.6249037421851 -632000 ekin = 0.223500184826661 | erot = 0.407624312389748 | epot = -15.2560282394451 | etot = -14.6249037422287 -633000 ekin = 0.236818662197368 | erot = 0.40871410814115 | epot = -15.2704365126172 | etot = -14.6249037422787 -634000 ekin = 0.249833574953511 | erot = 0.411060882467202 | epot = -15.2857981997609 | etot = -14.6249037423402 -635000 ekin = 0.262270239999869 | erot = 0.413946987960319 | epot = -15.3011209703766 | etot = -14.6249037424164 -636000 ekin = 0.273700147362094 | erot = 0.41658241201687 | epot = -15.3151863018853 | etot = -14.6249037425063 -637000 ekin = 0.283507856899951 | erot = 0.418156955202178 | epot = -15.3265685547055 | etot = -14.6249037426034 -638000 ekin = 0.290930324554581 | erot = 0.417906927432974 | epot = -15.3337409946828 | etot = -14.6249037426952 -639000 ekin = 0.295171730169445 | erot = 0.415189912095163 | epot = -15.3352653850311 | etot = -14.6249037427665 -640000 ekin = 0.295573453214757 | erot = 0.409556450349425 | epot = -15.330033646366 | etot = -14.6249037428018 -641000 ekin = 0.291798784614159 | erot = 0.400805216305592 | epot = -15.3175077437094 | etot = -14.6249037427896 -642000 ekin = 0.283982821763191 | erot = 0.389009767281871 | epot = -15.2978963317709 | etot = -14.6249037427259 -643000 ekin = 0.272803834295014 | erot = 0.374510198235057 | epot = -15.2722177751454 | etot = -14.6249037426153 -644000 ekin = 0.259451287281783 | erot = 0.357870303235152 | epot = -15.242225332988 | etot = -14.6249037424711 -645000 ekin = 0.245490538509252 | erot = 0.339807577758131 | epot = -15.2102018585797 | etot = -14.6249037423123 -646000 ekin = 0.232646751226996 | erot = 0.321107525182603 | epot = -15.1786580185706 | etot = -14.624903742161 -647000 ekin = 0.22254581022401 | erot = 0.302534738054871 | epot = -15.1499842903174 | etot = -14.6249037420385 -648000 ekin = 0.216457466201459 | erot = 0.284752019408104 | epot = -15.1261132275716 | etot = -14.624903741962 -649000 ekin = 0.215087078764693 | erot = 0.268256849270417 | epot = -15.1082476699768 | etot = -14.6249037419417 -650000 ekin = 0.218457489209268 | erot = 0.253342374384922 | epot = -15.0967036055725 | etot = -14.6249037419783 -651000 ekin = 0.225910420497663 | erot = 0.240087663214968 | epot = -15.090901825775 | etot = -14.6249037420623 -652000 ekin = 0.236236377394858 | erot = 0.228379019530766 | epot = -15.0895191391013 | etot = -14.6249037421757 -653000 ekin = 0.247915496412395 | erot = 0.217959688822015 | epot = -15.0907789275287 | etot = -14.6249037422943 -654000 ekin = 0.259425494352476 | erot = 0.208500305716241 | epot = -15.0928295424619 | etot = -14.6249037423932 -655000 ekin = 0.26955455820855 | erot = 0.199677958220202 | epot = -15.0941362588805 | etot = -14.6249037424517 -656000 ekin = 0.277652649609351 | erot = 0.191249336850371 | epot = -15.0938057289177 | etot = -14.624903742458 -657000 ekin = 0.283765747905513 | erot = 0.183104207684416 | epot = -15.0917736980008 | etot = -14.6249037424109 -658000 ekin = 0.288620908153495 | erot = 0.175289536735997 | epot = -15.0888141872111 | etot = -14.6249037423216 -659000 ekin = 0.293459924910638 | erot = 0.168001027405567 | epot = -15.0863646945267 | etot = -14.6249037422105 -660000 ekin = 0.299750121924058 | erot = 0.16154591329551 | epot = -15.0861997773236 | etot = -14.624903742104 -661000 ekin = 0.30882794580118 | erot = 0.15628680849445 | epot = -15.0900184963236 | etot = -14.624903742028 -662000 ekin = 0.321550844182007 | erot = 0.152579955314563 | epot = -15.0990345414996 | etot = -14.624903742003 -663000 ekin = 0.338040404322879 | erot = 0.150721656676574 | epot = -15.1136658030369 | etot = -14.6249037420375 -664000 ekin = 0.357588696379433 | erot = 0.150913925254324 | epot = -15.1334063637592 | etot = -14.6249037421255 -665000 ekin = 0.378766116435926 | erot = 0.153254852725576 | epot = -15.1569247114086 | etot = -14.6249037422471 -666000 ekin = 0.399716130930416 | erot = 0.157752003176736 | epot = -15.1823718764813 | etot = -14.6249037423741 -667000 ekin = 0.418564373573455 | erot = 0.164350192887448 | epot = -15.2078183089391 | etot = -14.6249037424782 -668000 ekin = 0.433827740573898 | erot = 0.172960630436554 | epot = -15.2316921135493 | etot = -14.6249037425388 -669000 ekin = 0.444701001629873 | erot = 0.183478145302767 | epot = -15.2530828894839 | etot = -14.6249037425513 -670000 ekin = 0.451136418416049 | erot = 0.195778468141822 | epot = -15.2718186290842 | etot = -14.6249037425263 -671000 ekin = 0.453701004148981 | erot = 0.209695862328768 | epot = -15.2883006089635 | etot = -14.6249037424857 -672000 ekin = 0.453273827001077 | erot = 0.224990306458558 | epot = -15.3031678759134 | etot = -14.6249037424538 -673000 ekin = 0.450699702661522 | erot = 0.241319095058617 | epot = -15.3169225401686 | etot = -14.6249037424485 -674000 ekin = 0.446523488450417 | erot = 0.258227823778676 | epot = -15.3296550547043 | etot = -14.6249037424752 -675000 ekin = 0.44088962459253 | erot = 0.275170305159689 | epot = -15.3409636722772 | etot = -14.624903742525 -676000 ekin = 0.433624481153454 | erot = 0.291558306506453 | epot = -15.350086530239 | etot = -14.6249037425791 -677000 ekin = 0.424453634856828 | erot = 0.306833290383679 | epot = -15.3561906678562 | etot = -14.6249037426157 -678000 ekin = 0.41326517646593 | erot = 0.320546114279227 | epot = -15.3587150333616 | etot = -14.6249037426165 -679000 ekin = 0.400321537247193 | erot = 0.332428088763687 | epot = -15.3576533685842 | etot = -14.6249037425733 -680000 ekin = 0.386341988793522 | erot = 0.342437977068841 | epot = -15.3536837083529 | etot = -14.6249037424906 -681000 ekin = 0.372417408219175 | erot = 0.350774050474234 | epot = -15.3480952010788 | etot = -14.6249037423854 -682000 ekin = 0.35976964508921 | erot = 0.357847594354926 | epot = -15.342520981727 | etot = -14.6249037422829 -683000 ekin = 0.349419724484302 | erot = 0.364223142873746 | epot = -15.3385466095668 | etot = -14.6249037422088 -684000 ekin = 0.341867426589136 | erot = 0.370539083005818 | epot = -15.3373102517758 | etot = -14.6249037421809 -685000 ekin = 0.336892967752833 | erot = 0.37742728588017 | epot = -15.3392239958362 | etot = -14.6249037422032 -686000 ekin = 0.333560575456658 | erot = 0.385449795148896 | epot = -15.343914112869 | etot = -14.6249037422634 -687000 ekin = 0.330440845244727 | erot = 0.395064019974615 | epot = -15.3504086075565 | etot = -14.6249037423372 -688000 ekin = 0.325996654362847 | erot = 0.406617593545496 | epot = -15.3575179903034 | etot = -14.624903742395 -689000 ekin = 0.319023752377333 | erot = 0.420363991129467 | epot = -15.3642914859188 | etot = -14.624903742412 -690000 ekin = 0.309020969988424 | erot = 0.436483939357874 | epot = -15.3704086517213 | etot = -14.624903742375 -691000 ekin = 0.296388973948975 | erot = 0.455097572739774 | epot = -15.3763902889748 | etot = -14.6249037422861 -692000 ekin = 0.282408410636019 | erot = 0.476257707732204 | epot = -15.3835698605304 | etot = -14.6249037421622 -693000 ekin = 0.269008530851688 | erot = 0.499923033173812 | epot = -15.393835306056 | etot = -14.6249037420305 -694000 ekin = 0.258387685788622 | erot = 0.525918285140571 | epot = -15.4092097128506 | etot = -14.6249037419214 -695000 ekin = 0.25257627520821 | erot = 0.553894058809888 | epot = -15.43137407588 | etot = -14.6249037418619 -696000 ekin = 0.253038186235009 | erot = 0.583300660396584 | epot = -15.4612425885012 | etot = -14.6249037418696 -697000 ekin = 0.260392018277579 | erot = 0.613388418368988 | epot = -15.4986841785954 | etot = -14.6249037419489 -698000 ekin = 0.274304391463509 | erot = 0.64324187918294 | epot = -15.5424500127365 | etot = -14.6249037420901 -699000 ekin = 0.293570250406769 | erot = 0.671848180609457 | epot = -15.5903221732877 | etot = -14.6249037422715 -700000 ekin = 0.316355070233514 | erot = 0.698191700483047 | epot = -15.639450513181 | etot = -14.6249037424644 -701000 ekin = 0.340538337282332 | erot = 0.721359481466447 | epot = -15.6868015613885 | etot = -14.6249037426397 -702000 ekin = 0.364075443764615 | erot = 0.740637254695032 | epot = -15.7296164412337 | etot = -14.6249037427741 -703000 ekin = 0.385294321874606 | erot = 0.75557636945477 | epot = -15.7657744341848 | etot = -14.6249037428555 -704000 ekin = 0.40306671671928 | erot = 0.766018576887906 | epot = -15.7939890364911 | etot = -14.6249037428839 -705000 ekin = 0.416833588997184 | erot = 0.772075474100319 | epot = -15.8138128059668 | etot = -14.6249037428693 -706000 ekin = 0.426510451501955 | erot = 0.774072055032491 | epot = -15.8254862493611 | etot = -14.6249037428266 -707000 ekin = 0.432328070473605 | erot = 0.772470813770598 | epot = -15.8297026270152 | etot = -14.624903742771 -708000 ekin = 0.434671210546145 | erot = 0.767794279505844 | epot = -15.8273692327653 | etot = -14.6249037427133 -709000 ekin = 0.433963855683832 | erot = 0.760560754832635 | epot = -15.8194283531753 | etot = -14.6249037426588 -710000 ekin = 0.430621214402396 | erot = 0.751241421805773 | epot = -15.8067663788157 | etot = -14.6249037426076 -711000 ekin = 0.42506102881634 | erot = 0.740240555545717 | epot = -15.7902053269187 | etot = -14.6249037425567 -712000 ekin = 0.417748693286703 | erot = 0.727895913280697 | epot = -15.7705483490698 | etot = -14.6249037425024 -713000 ekin = 0.409245407745788 | erot = 0.714493617369859 | epot = -15.7486427675576 | etot = -14.624903742442 -714000 ekin = 0.400233112897398 | erot = 0.700290376394005 | epot = -15.7254272316667 | etot = -14.6249037423753 -715000 ekin = 0.391499218630518 | erot = 0.685535269234734 | epot = -15.7019382301705 | etot = -14.6249037423053 -716000 ekin = 0.383874653287396 | erot = 0.67048382480872 | epot = -15.6792622203348 | etot = -14.6249037422387 -717000 ekin = 0.378129665172728 | erot = 0.655399296057203 | epot = -15.6584327034143 | etot = -14.6249037421843 -718000 ekin = 0.374843116814185 | erot = 0.640539821856989 | epot = -15.640286680823 | etot = -14.6249037421519 -719000 ekin = 0.374271424141624 | erot = 0.626134666228549 | epot = -15.6253098325193 | etot = -14.6249037421492 -720000 ekin = 0.376249546442097 | erot = 0.612356169201246 | epot = -15.6135094578233 | etot = -14.62490374218 -721000 ekin = 0.380155783156075 | erot = 0.599295758360148 | epot = -15.6043552837583 | etot = -14.6249037422421 -722000 ekin = 0.38496276143876 | erot = 0.586951574249477 | epot = -15.5968180780148 | etot = -14.6249037423265 -723000 ekin = 0.389379823381561 | erot = 0.57523200329734 | epot = -15.5895155690971 | etot = -14.6249037424182 -724000 ekin = 0.392071125783968 | erot = 0.563975606696704 | epot = -15.5809504749797 | etot = -14.624903742499 -725000 ekin = 0.391913283458913 | erot = 0.552983740178136 | epot = -15.5698007661881 | etot = -14.624903742551 -726000 ekin = 0.388241956532947 | erot = 0.542058916015296 | epot = -15.5552046151089 | etot = -14.6249037425607 -727000 ekin = 0.381032991792247 | erot = 0.531040454531364 | epot = -15.5369771888453 | etot = -14.6249037425217 -728000 ekin = 0.370971903191936 | erot = 0.51982908237483 | epot = -15.5157047280045 | etot = -14.6249037424377 -729000 ekin = 0.359388263612697 | erot = 0.508395729808055 | epot = -15.4926877357429 | etot = -14.6249037423222 -730000 ekin = 0.348057580439693 | erot = 0.496773021024349 | epot = -15.4697343436589 | etot = -14.6249037421949 -731000 ekin = 0.338902689199426 | erot = 0.48503267140759 | epot = -15.4488391026866 | etot = -14.6249037420796 -732000 ekin = 0.333649662945475 | erot = 0.473255762296962 | epot = -15.4318091672413 | etot = -14.6249037419988 -733000 ekin = 0.333505576676606 | erot = 0.461504910073432 | epot = -15.4199142287184 | etot = -14.6249037419684 -734000 ekin = 0.338924758984327 | erot = 0.449807254483215 | epot = -15.4136357554618 | etot = -14.6249037419943 -735000 ekin = 0.349515468577354 | erot = 0.438154711902627 | epot = -15.412573922551 | etot = -14.624903742071 -736000 ekin = 0.364111355274983 | erot = 0.426523255164317 | epot = -15.4155383526214 | etot = -14.6249037421821 -737000 ekin = 0.380995719774913 | erot = 0.414906900972836 | epot = -15.4208063630518 | etot = -14.6249037423041 -738000 ekin = 0.398229414671756 | erot = 0.403356227833025 | epot = -15.4264893849167 | etot = -14.6249037424119 -739000 ekin = 0.41400586007365 | erot = 0.392007798568608 | epot = -15.4309174011284 | etot = -14.6249037424862 -740000 ekin = 0.426948743963044 | erot = 0.381091720704502 | epot = -15.4329442071847 | etot = -14.6249037425172 -741000 ekin = 0.436283647683231 | erot = 0.370910229391922 | epot = -15.4320976195822 | etot = -14.6249037425071 -742000 ekin = 0.441850001827036 | erot = 0.361789064611271 | epot = -15.4285428089074 | etot = -14.6249037424691 -743000 ekin = 0.443963491147379 | erot = 0.354012421291793 | epot = -15.4228796548618 | etot = -14.6249037424227 -744000 ekin = 0.443178108515845 | erot = 0.347758127978261 | epot = -15.4158399788819 | etot = -14.6249037423878 -745000 ekin = 0.440021184885117 | erot = 0.343050543545259 | epot = -15.4079754708099 | etot = -14.6249037423795 -746000 ekin = 0.434779146250806 | erot = 0.339744491074207 | epot = -15.3994273797282 | etot = -14.6249037424032 -747000 ekin = 0.427396883605164 | erot = 0.337545938413876 | epot = -15.3898465644715 | etot = -14.6249037424524 -748000 ekin = 0.417523045840964 | erot = 0.336066252171354 | epot = -15.378493040523 | etot = -14.6249037425106 -749000 ekin = 0.404692764111769 | erot = 0.334898725161342 | epot = -15.3644952318284 | etot = -14.6249037425553 -750000 ekin = 0.38859628761696 | erot = 0.333700338300268 | epot = -15.3472003684814 | etot = -14.6249037425641 -751000 ekin = 0.369348367994352 | erot = 0.332259621152217 | epot = -15.3265117316697 | etot = -14.6249037425232 -752000 ekin = 0.347662572337044 | erot = 0.330533807749388 | epot = -15.3031001225185 | etot = -14.6249037424321 -753000 ekin = 0.32485637347094 | erot = 0.328645172901279 | epot = -15.2784052886778 | etot = -14.6249037423055 -754000 ekin = 0.302664104351826 | erot = 0.326836116135493 | epot = -15.2544039626575 | etot = -14.6249037421702 -755000 ekin = 0.282898405306331 | erot = 0.32539267738901 | epot = -15.2331948247533 | etot = -14.6249037420579 -756000 ekin = 0.267052130149665 | erot = 0.324553861438981 | epot = -15.216509733585 | etot = -14.6249037419963 -757000 ekin = 0.255952872034765 | erot = 0.32442748097694 | epot = -15.2052840950137 | etot = -14.624903742002 -758000 ekin = 0.24956686325818 | erot = 0.324931841855881 | epot = -15.1994024471896 | etot = -14.6249037420755 -759000 ekin = 0.247007285742243 | erot = 0.325777353497121 | epot = -15.1976883814409 | etot = -14.6249037422016 -760000 ekin = 0.246749335490674 | erot = 0.326494279608963 | epot = -15.1981473574513 | etot = -14.6249037423517 -761000 ekin = 0.247004464362755 | erot = 0.32650345690093 | epot = -15.1984116637543 | etot = -14.6249037424906 -762000 ekin = 0.246168267682973 | erot = 0.325217160867496 | epot = -15.196289171135 | etot = -14.6249037425846 -763000 ekin = 0.243236270174414 | erot = 0.32214932288445 | epot = -15.1902893356681 | etot = -14.6249037426092 -764000 ekin = 0.238083572627797 | erot = 0.31701054114624 | epot = -15.1799978563308 | etot = -14.6249037425568 -765000 ekin = 0.231530329805837 | erot = 0.309765883620828 | epot = -15.1661999558649 | etot = -14.6249037424383 -766000 ekin = 0.225163449189513 | erot = 0.300642577937803 | epot = -15.1507097694085 | etot = -14.6249037422812 -767000 ekin = 0.22094703764136 | erot = 0.290087936283322 | epot = -15.1359387160482 | etot = -14.6249037421235 -768000 ekin = 0.220714417705591 | erot = 0.278690999515505 | epot = -15.1243091592243 | etot = -14.6249037420032 -769000 ekin = 0.225674230585282 | erot = 0.267090069999639 | epot = -15.1176680425329 | etot = -14.6249037419479 -770000 ekin = 0.236066860406118 | erot = 0.255889903618327 | epot = -15.1168605059916 | etot = -14.6249037419672 -771000 ekin = 0.251070223471381 | erot = 0.245606888556436 | epot = -15.1215808540782 | etot = -14.6249037420503 -772000 ekin = 0.268985032795184 | erot = 0.236650197272858 | epot = -15.130538972238 | etot = -14.6249037421699 -773000 ekin = 0.287649902236207 | erot = 0.229335047808925 | epot = -15.1418886923348 | etot = -14.6249037422896 -774000 ekin = 0.304971347443521 | erot = 0.223914516380439 | epot = -15.1537896061995 | etot = -14.6249037423755 -775000 ekin = 0.319422560281353 | erot = 0.220611402282044 | epot = -15.1649377049685 | etot = -14.6249037424051 -776000 ekin = 0.330375903029014 | erot = 0.219632840721417 | epot = -15.1749124861243 | etot = -14.6249037423739 -777000 ekin = 0.338182326481318 | erot = 0.221157252264488 | epot = -15.1842433210425 | etot = -14.6249037422967 -778000 ekin = 0.34398099350531 | erot = 0.22529363977163 | epot = -15.1941783754801 | etot = -14.6249037422031 -779000 ekin = 0.349294202147492 | erot = 0.232023926337254 | epot = -15.2062218706139 | etot = -14.6249037421291 -780000 ekin = 0.355517983707864 | erot = 0.241146781675322 | epot = -15.2215685074905 | etot = -14.6249037421074 -781000 ekin = 0.36344584750217 | erot = 0.25224414994015 | epot = -15.2405937395998 | etot = -14.6249037421575 -782000 ekin = 0.372957766808887 | erot = 0.264688770758124 | epot = -15.2625502798461 | etot = -14.6249037422791 -783000 ekin = 0.38296926774882 | erot = 0.277702579812121 | epot = -15.2855755900113 | etot = -14.6249037424504 -784000 ekin = 0.391670514066059 | erot = 0.290462881206425 | epot = -15.3070371379046 | etot = -14.6249037426321 -785000 ekin = 0.397003136152363 | erot = 0.302237882822127 | epot = -15.3241447617524 | etot = -14.6249037427779 -786000 ekin = 0.397244540913185 | erot = 0.312520082335045 | epot = -15.3346683660963 | etot = -14.6249037428481 -787000 ekin = 0.391525061079143 | erot = 0.321121025638669 | epot = -15.33754982954 | etot = -14.6249037428222 -788000 ekin = 0.380116514494114 | erot = 0.328198366844194 | epot = -15.3332186240437 | etot = -14.6249037427054 -789000 ekin = 0.364402868102804 | erot = 0.334204933643257 | epot = -15.323511544273 | etot = -14.6249037425269 -790000 ekin = 0.346547882835914 | erot = 0.339772664564402 | epot = -15.3112242897307 | etot = -14.6249037423304 -791000 ekin = 0.328969533926533 | erot = 0.345562661329726 | epot = -15.2994359374168 | etot = -14.6249037421606 -792000 ekin = 0.313783234687151 | erot = 0.352120250332853 | epot = -15.290807227072 | etot = -14.624903742052 -793000 ekin = 0.302371973145348 | erot = 0.359769001653092 | epot = -15.2870447168183 | etot = -14.6249037420198 -794000 ekin = 0.295192752069156 | erot = 0.368565036951925 | epot = -15.2886615310787 | etot = -14.6249037420576 -795000 ekin = 0.291854072001083 | erot = 0.378316728407065 | epot = -15.2950745425492 | etot = -14.624903742141 -796000 ekin = 0.291420477240231 | erot = 0.388659220599418 | epot = -15.3049834400759 | etot = -14.6249037422363 -797000 ekin = 0.292835767594049 | erot = 0.399160677915359 | epot = -15.3169001878201 | etot = -14.6249037423107 -798000 ekin = 0.295321690655136 | erot = 0.40942991973209 | epot = -15.3296553527312 | etot = -14.624903742344 -799000 ekin = 0.298615606685619 | erot = 0.419195269464138 | epot = -15.3427146184843 | etot = -14.6249037423346 -800000 ekin = 0.302963113079283 | erot = 0.428333265393292 | epot = -15.3562001207729 | etot = -14.6249037423003 -801000 ekin = 0.308869807419017 | erot = 0.436842111958073 | epot = -15.3706156616482 | etot = -14.6249037422711 -802000 ekin = 0.316711643346418 | erot = 0.444773620895252 | epot = -15.3863890065178 | etot = -14.6249037422762 -803000 ekin = 0.326365730602249 | erot = 0.452151664704984 | epot = -15.403421137639 | etot = -14.6249037423317 -804000 ekin = 0.337019280358016 | erot = 0.458909057451227 | epot = -15.4208320802433 | etot = -14.6249037424341 -805000 ekin = 0.347244531512768 | erot = 0.464865921886024 | epot = -15.4370141959588 | etot = -14.62490374256 -806000 ekin = 0.355321558015419 | erot = 0.469755825324061 | epot = -15.449981126015 | etot = -14.6249037426755 -807000 ekin = 0.359699244804511 | erot = 0.473288399899576 | epot = -15.457891387451 | etot = -14.6249037427469 -808000 ekin = 0.35944291943687 | erot = 0.475225772200724 | epot = -15.4595724343888 | etot = -14.6249037427512 -809000 ekin = 0.354532149711152 | erot = 0.475448148012716 | epot = -15.4548840404063 | etot = -14.6249037426824 -810000 ekin = 0.34592712151575 | erot = 0.473990365430488 | epot = -15.4448212294989 | etot = -14.6249037425527 -811000 ekin = 0.335391497319932 | erot = 0.47104235524006 | epot = -15.4313375949483 | etot = -14.6249037423883 -812000 ekin = 0.325122479809716 | erot = 0.466917662640269 | epot = -15.4169438846729 | etot = -14.624903742223 -813000 ekin = 0.317281832618796 | erot = 0.462001954841414 | epot = -15.4041875295496 | etot = -14.6249037420894 -814000 ekin = 0.313538689251802 | erot = 0.456696276151744 | epot = -15.3951387074161 | etot = -14.6249037420126 -815000 ekin = 0.314725301427551 | erot = 0.451368238943745 | epot = -15.3909972823755 | etot = -14.6249037420042 -816000 ekin = 0.320674745952841 | erot = 0.446320054204994 | epot = -15.3918985422197 | etot = -14.6249037420619 -817000 ekin = 0.330264402530169 | erot = 0.441777145070237 | epot = -15.3969452897705 | etot = -14.6249037421701 -818000 ekin = 0.341643112116294 | erot = 0.437896324121931 | epot = -15.4044431785426 | etot = -14.6249037423044 -819000 ekin = 0.352584467965985 | erot = 0.434788688971306 | epot = -15.4122768993744 | etot = -14.6249037424371 -820000 ekin = 0.360890006680584 | erot = 0.432549774287109 | epot = -15.4183435235104 | etot = -14.6249037425427 -821000 ekin = 0.364764924967109 | erot = 0.43128829359489 | epot = -15.420956961164 | etot = -14.624903742602 -822000 ekin = 0.363101323048021 | erot = 0.431144612410221 | epot = -15.419149678064 | etot = -14.6249037426058 -823000 ekin = 0.355627506071419 | erot = 0.43229307921143 | epot = -15.4128243278382 | etot = -14.6249037425554 -824000 ekin = 0.342909507999076 | erot = 0.434926118199362 | epot = -15.4027393686599 | etot = -14.6249037424615 -825000 ekin = 0.326218347990279 | erot = 0.439222871854997 | epot = -15.390344962187 | etot = -14.6249037423417 -826000 ekin = 0.307298067026364 | erot = 0.445309293137064 | epot = -15.3775111023799 | etot = -14.6249037422164 -827000 ekin = 0.288081469809457 | erot = 0.453218819733404 | epot = -15.3662040316486 | etot = -14.6249037421057 -828000 ekin = 0.270403517643933 | erot = 0.462862712071296 | epot = -15.358169971741 | etot = -14.6249037420258 -829000 ekin = 0.255756724313351 | erot = 0.474017347276038 | epot = -15.3546778135762 | etot = -14.6249037419868 -830000 ekin = 0.245120383539822 | erot = 0.48633201659407 | epot = -15.3563561421258 | etot = -14.624903741992 -831000 ekin = 0.238883956789673 | erot = 0.499357971990034 | epot = -15.3631456708166 | etot = -14.6249037420369 -832000 ekin = 0.236868645663221 | erot = 0.512595315427615 | epot = -15.3743677032019 | etot = -14.6249037421111 -833000 ekin = 0.238435989569064 | erot = 0.525550909042522 | epot = -15.3888906408114 | etot = -14.6249037421998 -834000 ekin = 0.242658569128244 | erot = 0.537797737790336 | epot = -15.405360049206 | etot = -14.6249037422874 -835000 ekin = 0.248518315376458 | erot = 0.549024910269567 | epot = -15.4224469680061 | etot = -14.62490374236 -836000 ekin = 0.255095050223297 | erot = 0.559068449138061 | epot = -15.4390672417691 | etot = -14.6249037424078 -837000 ekin = 0.261712817640754 | erot = 0.567916383627862 | epot = -15.4545329436951 | etot = -14.6249037424265 -838000 ekin = 0.268023056778799 | erot = 0.575686784519135 | epot = -15.468613583716 | etot = -14.6249037424181 -839000 ekin = 0.274018270323247 | erot = 0.582582979366575 | epot = -15.481504992079 | etot = -14.6249037423892 -840000 ekin = 0.279983100774044 | erot = 0.588834754839254 | epot = -15.493721597963 | etot = -14.6249037423497 -841000 ekin = 0.286398274628748 | erot = 0.594637024330571 | epot = -15.5059390412695 | etot = -14.6249037423102 -842000 ekin = 0.293816650983671 | erot = 0.600098453280244 | epot = -15.5188188465455 | etot = -14.6249037422816 -843000 ekin = 0.302726774569864 | erot = 0.605208920748267 | epot = -15.5328394375906 | etot = -14.6249037422725 -844000 ekin = 0.313421069061913 | erot = 0.609833296484503 | epot = -15.5481581078352 | etot = -14.6249037422888 -845000 ekin = 0.325887895395929 | erot = 0.613733577818103 | epot = -15.5645252155455 | etot = -14.6249037423314 -846000 ekin = 0.33975240096389 | erot = 0.616615984720062 | epot = -15.5812721280797 | etot = -14.6249037423957 -847000 ekin = 0.354292335350613 | erot = 0.618194079532099 | epot = -15.5973901573538 | etot = -14.624903742471 -848000 ekin = 0.368542667425734 | erot = 0.618254639141467 | epot = -15.6117010491094 | etot = -14.6249037425422 -849000 ekin = 0.381474241846711 | erot = 0.616711095272622 | epot = -15.6230890797133 | etot = -14.624903742594 -850000 ekin = 0.392198266664605 | erot = 0.613631554978577 | epot = -15.6307335642585 | etot = -14.6249037426153 -851000 ekin = 0.400129367739792 | erot = 0.609234588534973 | epot = -15.6342676988789 | etot = -14.6249037426041 -852000 ekin = 0.405049998800082 | erot = 0.603854451145949 | epot = -15.6338081925133 | etot = -14.6249037425673 -853000 ekin = 0.407056563943438 | erot = 0.597885334647268 | epot = -15.6298456411094 | etot = -14.6249037425187 -854000 ekin = 0.406415158940066 | erot = 0.591718979209663 | epot = -15.623037880623 | etot = -14.6249037424732 -855000 ekin = 0.403390043513582 | erot = 0.585690332508252 | epot = -15.6139841184641 | etot = -14.6249037424422 -856000 ekin = 0.398116166002876 | erot = 0.580042463524147 | epot = -15.6030623719562 | etot = -14.6249037424292 -857000 ekin = 0.39056801615961 | erot = 0.574915889724005 | epot = -15.5903876483121 | etot = -14.6249037424285 -858000 ekin = 0.380638245095305 | erot = 0.570361176879803 | epot = -15.5759031644036 | etot = -14.6249037424285 -859000 ekin = 0.368297168913566 | erot = 0.566367903414504 | epot = -15.5595688147431 | etot = -14.624903742415 -860000 ekin = 0.353771484485059 | erot = 0.56289933566622 | epot = -15.5415745625294 | etot = -14.6249037423781 -861000 ekin = 0.33766818907467 | erot = 0.559921190515333 | epot = -15.5224931219057 | etot = -14.6249037423157 -862000 ekin = 0.320982687533336 | erot = 0.557415114411014 | epot = -15.5033015441806 | etot = -14.6249037422363 -863000 ekin = 0.304965814690107 | erot = 0.555372641471618 | epot = -15.485242198319 | etot = -14.6249037421573 -864000 ekin = 0.290872653002407 | erot = 0.5537720825734 | epot = -15.4695484776756 | etot = -14.6249037420998 -865000 ekin = 0.27966077424891 | erot = 0.552546988654679 | epot = -15.4571115049861 | etot = -14.6249037420825 -866000 ekin = 0.271730646598884 | erot = 0.551558423385933 | epot = -15.4481928120997 | etot = -14.6249037421148 -867000 ekin = 0.266795961580335 | erot = 0.550582916185739 | epot = -15.442282619959 | etot = -14.6249037421929 -868000 ekin = 0.263936467175558 | erot = 0.549323573879739 | epot = -15.4381637833552 | etot = -14.6249037422999 -869000 ekin = 0.261831470221842 | erot = 0.547444696243082 | epot = -15.4341799088743 | etot = -14.6249037424094 -870000 ekin = 0.259116433169414 | erot = 0.544622620095275 | epot = -15.4286427957584 | etot = -14.6249037424937 -871000 ekin = 0.254766113418661 | erot = 0.540599894777671 | epot = -15.4202697507265 | etot = -14.6249037425302 -872000 ekin = 0.248397230691804 | erot = 0.535228153627548 | epot = -15.4085291268285 | etot = -14.6249037425092 -873000 ekin = 0.240403953826285 | erot = 0.528487826572583 | epot = -15.3937955228344 | etot = -14.6249037424355 -874000 ekin = 0.231884125783745 | erot = 0.520479317821078 | epot = -15.3772671859334 | etot = -14.6249037423285 -875000 ekin = 0.224371090313998 | erot = 0.511388489700788 | epot = -15.3606633222313 | etot = -14.6249037422165 -876000 ekin = 0.219440883380304 | erot = 0.501436812694108 | epot = -15.3457814382033 | etot = -14.6249037421289 -877000 ekin = 0.218302972736541 | erot = 0.490831150818269 | epot = -15.3340378656425 | etot = -14.6249037420877 -878000 ekin = 0.221492456263516 | erot = 0.479728387736696 | epot = -15.3261245861012 | etot = -14.624903742101 -879000 ekin = 0.228756262275047 | erot = 0.468225594693746 | epot = -15.3218855991288 | etot = -14.62490374216 -880000 ekin = 0.23916916008879 | erot = 0.456378166082174 | epot = -15.3204510684128 | etot = -14.6249037422418 -881000 ekin = 0.251443176614632 | erot = 0.444238659513065 | epot = -15.3205855784454 | etot = -14.6249037423177 -882000 ekin = 0.264330844663881 | erot = 0.43190128969608 | epot = -15.3211358767216 | etot = -14.6249037423616 -883000 ekin = 0.276992343361879 | erot = 0.419534292632584 | epot = -15.3214303783539 | etot = -14.6249037423594 -884000 ekin = 0.289210952362963 | erot = 0.407386172192775 | epot = -15.3215008668683 | etot = -14.6249037423126 -885000 ekin = 0.301394205511005 | erot = 0.395760928443894 | epot = -15.3220588761927 | etot = -14.6249037422378 -886000 ekin = 0.31436859920589 | erot = 0.384968165379889 | epot = -15.3242405067469 | etot = -14.6249037421611 -887000 ekin = 0.329038341775477 | erot = 0.375262338090619 | epot = -15.3292044219764 | etot = -14.6249037421103 -888000 ekin = 0.346015111155314 | erot = 0.366788650328168 | epot = -15.3377075035892 | etot = -14.6249037421057 -889000 ekin = 0.365329693883282 | erot = 0.35955094737734 | epot = -15.3497843834164 | etot = -14.6249037421558 -890000 ekin = 0.386310696216818 | erot = 0.353410826838142 | epot = -15.3646252653079 | etot = -14.6249037422529 -891000 ekin = 0.407668087054666 | erot = 0.348119126036796 | epot = -15.3806909554674 | etot = -14.6249037423759 -892000 ekin = 0.427761236102702 | erot = 0.343372786942168 | epot = -15.396037765541 | etot = -14.6249037424962 -893000 ekin = 0.444977236018704 | erot = 0.338883525692821 | epot = -15.4087645042964 | etot = -14.6249037425849 -894000 ekin = 0.458112158679596 | erot = 0.334441343917346 | epot = -15.4174572452184 | etot = -14.6249037426214 -895000 ekin = 0.466648008330968 | erot = 0.329956933565266 | epot = -15.4215086844955 | etot = -14.6249037425992 -896000 ekin = 0.470850232518833 | erot = 0.325472374552695 | epot = -15.421226349598 | etot = -14.6249037425264 -897000 ekin = 0.471664510487189 | erot = 0.321137893833246 | epot = -15.4177061467443 | etot = -14.6249037424239 -898000 ekin = 0.470447771985121 | erot = 0.31716128210791 | epot = -15.4125127964118 | etot = -14.6249037423187 -899000 ekin = 0.468609320535131 | erot = 0.31374324783162 | epot = -15.4072563106044 | etot = -14.6249037422377 -900000 ekin = 0.467255363896452 | erot = 0.311015004595572 | epot = -15.4031741106926 | etot = -14.6249037422006 -901000 ekin = 0.466923299456765 | erot = 0.308993431077939 | epot = -15.4008204727507 | etot = -14.624903742216 -902000 ekin = 0.467466399705909 | erot = 0.307564919774022 | epot = -15.3999350617589 | etot = -14.624903742279 -903000 ekin = 0.468112799245423 | erot = 0.30650258938551 | epot = -15.3995191310034 | etot = -14.6249037423724 -904000 ekin = 0.467682260081114 | erot = 0.305513914729626 | epot = -15.3980999172821 | etot = -14.6249037424714 -905000 ekin = 0.464906903208319 | erot = 0.304308207539406 | epot = -15.3941188532968 | etot = -14.6249037425491 -906000 ekin = 0.458775313350499 | erot = 0.302667437698498 | epot = -15.3863464936332 | etot = -14.6249037425842 -907000 ekin = 0.448811106797387 | erot = 0.300501710925559 | epot = -15.3742165602889 | etot = -14.624903742566 -908000 ekin = 0.435212888278633 | erot = 0.297873922704189 | epot = -15.3579905534804 | etot = -14.6249037424975 -909000 ekin = 0.418821166579361 | erot = 0.294986492955396 | epot = -15.3387114019291 | etot = -14.6249037423944 -910000 ekin = 0.400928155652502 | erot = 0.292134043124591 | epot = -15.3179659410567 | etot = -14.6249037422796 -911000 ekin = 0.38299073131904 | erot = 0.289635345607532 | epot = -15.2975298191036 | etot = -14.624903742177 -912000 ekin = 0.366329155570265 | erot = 0.287762457046 | epot = -15.2789953547218 | etot = -14.6249037421055 -913000 ekin = 0.351888443631644 | erot = 0.286683662572436 | epot = -15.263475848279 | etot = -14.6249037420749 -914000 ekin = 0.340111462795988 | erot = 0.286431278414276 | epot = -15.2514464832956 | etot = -14.6249037420854 -915000 ekin = 0.330936398540546 | erot = 0.286898247266849 | epot = -15.2427383879358 | etot = -14.6249037421284 -916000 ekin = 0.32389927160205 | erot = 0.287861143478129 | epot = -15.2366641572708 | etot = -14.6249037421907 -917000 ekin = 0.318302399047882 | erot = 0.289022784864801 | epot = -15.2322289261694 | etot = -14.6249037422567 -918000 ekin = 0.313403328232211 | erot = 0.290065205370544 | epot = -15.2283722759156 | etot = -14.6249037423128 -919000 ekin = 0.308582994047746 | erot = 0.290702987753655 | epot = -15.2241897241503 | etot = -14.6249037423489 -920000 ekin = 0.303462620955297 | erot = 0.290727692024701 | epot = -15.2190940553404 | etot = -14.6249037423604 -921000 ekin = 0.297952758523176 | erot = 0.290036267627134 | epot = -15.2128927684984 | etot = -14.624903742348 -922000 ekin = 0.292232329167479 | erot = 0.288639696922892 | epot = -15.2057757684081 | etot = -14.6249037423177 -923000 ekin = 0.286668877938219 | erot = 0.286652137103033 | epot = -15.1982247573198 | etot = -14.6249037422785 -924000 ekin = 0.281701868658443 | erot = 0.284264668755385 | epot = -15.1908702796542 | etot = -14.6249037422404 -925000 ekin = 0.277717553237889 | erot = 0.281710557644916 | epot = -15.1843318530949 | etot = -14.6249037422121 -926000 ekin = 0.274945509179126 | erot = 0.279230091666523 | epot = -15.1790793430443 | etot = -14.6249037421987 -927000 ekin = 0.273402631519641 | erot = 0.277042382113033 | epot = -15.1753487558335 | etot = -14.6249037422009 -928000 ekin = 0.272900230271313 | erot = 0.27532923254522 | epot = -15.1731332050308 | etot = -14.6249037422143 -929000 ekin = 0.273115271900815 | erot = 0.274232799537056 | epot = -15.1722518136686 | etot = -14.6249037422307 -930000 ekin = 0.273710515355576 | erot = 0.273865029643896 | epot = -15.1724792872395 | etot = -14.6249037422401 -931000 ekin = 0.274474107139751 | erot = 0.274323617228769 | epot = -15.1737014666023 | etot = -14.6249037422338 -932000 ekin = 0.275440857683152 | erot = 0.275707340216854 | epot = -15.176051940107 | etot = -14.624903742207 -933000 ekin = 0.276957575781874 | erot = 0.278123705988361 | epot = -15.1799850239313 | etot = -14.6249037421611 -934000 ekin = 0.279664435383878 | erot = 0.281683992543418 | epot = -15.1862521700318 | etot = -14.6249037421045 -935000 ekin = 0.284382433296915 | erot = 0.286484503522641 | epot = -15.1957706788708 | etot = -14.6249037420512 -936000 ekin = 0.291920557579979 | erot = 0.292577187598074 | epot = -15.2094014871964 | etot = -14.6249037420184 -937000 ekin = 0.302840159169775 | erot = 0.299936553990588 | epot = -15.2276804551825 | etot = -14.6249037420221 -938000 ekin = 0.317231541763407 | erot = 0.308432066638773 | epot = -15.2505673504752 | etot = -14.6249037420731 -939000 ekin = 0.334562734704664 | erot = 0.317815317270636 | epot = -15.2772817941479 | etot = -14.6249037421726 -940000 ekin = 0.353649521805238 | erot = 0.327729086105133 | epot = -15.3062823502217 | etot = -14.6249037423114 -941000 ekin = 0.372770367646981 | erot = 0.337741122003566 | epot = -15.3354152321204 | etot = -14.6249037424699 -942000 ekin = 0.389915662531947 | erot = 0.347399749799135 | epot = -15.3622191549531 | etot = -14.6249037426221 -943000 ekin = 0.403126345739486 | erot = 0.356302369934052 | epot = -15.3843324584141 | etot = -14.6249037427406 -944000 ekin = 0.410851754406517 | erot = 0.364163156178947 | epot = -15.3999186533885 | etot = -14.624903742803 -945000 ekin = 0.412247920960694 | erot = 0.370864511414574 | epot = -15.4080161751724 | etot = -14.6249037427972 -946000 ekin = 0.407348747780355 | erot = 0.376479254457633 | epot = -15.4087317449614 | etot = -14.6249037427235 -947000 ekin = 0.397071124217177 | erot = 0.381256899558804 | epot = -15.4032317663713 | etot = -14.6249037425953 -948000 ekin = 0.383053455726579 | erot = 0.385576026491136 | epot = -15.3935332246539 | etot = -14.6249037424362 -949000 ekin = 0.367364810070546 | erot = 0.389872987609663 | epot = -15.382141539954 | etot = -14.6249037422738 -950000 ekin = 0.352149150211141 | erot = 0.394562514443112 | epot = -15.371615406789 | etot = -14.6249037421348 -951000 ekin = 0.339280178143099 | erot = 0.399966938641359 | epot = -15.3641508588234 | etot = -14.6249037420389 -952000 ekin = 0.330096120379237 | erot = 0.406268489131811 | epot = -15.3612683515071 | etot = -14.6249037419961 -953000 ekin = 0.325261831669684 | erot = 0.413492937870729 | epot = -15.3636585115451 | etot = -14.6249037420047 -954000 ekin = 0.324774911929383 | erot = 0.421526046053159 | epot = -15.3712047000361 | etot = -14.6249037420535 -955000 ekin = 0.328098170459405 | erot = 0.43015685816017 | epot = -15.3831587707447 | etot = -14.6249037421252 -956000 ekin = 0.334370903123805 | erot = 0.439135698166764 | epot = -15.3984103434923 | etot = -14.6249037422018 -957000 ekin = 0.342633913360331 | erot = 0.448231239799098 | epot = -15.415768895429 | etot = -14.6249037422696 -958000 ekin = 0.352004139469646 | erot = 0.457271615167415 | epot = -15.4341794969597 | etot = -14.6249037423226 -959000 ekin = 0.361755395785228 | erot = 0.466159587643494 | epot = -15.4528187257923 | etot = -14.6249037423635 -960000 ekin = 0.371296348402955 | erot = 0.474860087932416 | epot = -15.4710601787363 | etot = -14.6249037424009 -961000 ekin = 0.380073790912418 | erot = 0.483367158174937 | epot = -15.4883446915324 | etot = -14.624903742445 -962000 ekin = 0.387455548950117 | erot = 0.491663490520803 | epot = -15.5040227819739 | etot = -14.624903742503 -963000 ekin = 0.392654097311874 | erot = 0.49968729563245 | epot = -15.5172451355191 | etot = -14.6249037425748 -964000 ekin = 0.394737939559185 | erot = 0.507318071995981 | epot = -15.5269597542072 | etot = -14.624903742652 -965000 ekin = 0.392748486467115 | erot = 0.514386334667554 | epot = -15.5320385638537 | etot = -14.6249037427191 -966000 ekin = 0.38590547325284 | erot = 0.520705106527849 | epot = -15.5315143225377 | etot = -14.624903742757 -967000 ekin = 0.373852021645421 | erot = 0.526114369234909 | epot = -15.5248701336288 | etot = -14.6249037427485 -968000 ekin = 0.356869417135994 | erot = 0.530525868585158 | epot = -15.5122990284054 | etot = -14.6249037426842 -969000 ekin = 0.335986889834556 | erot = 0.533955228284217 | epot = -15.4948458606857 | etot = -14.624903742567 -970000 ekin = 0.312927788672648 | erot = 0.536531428461786 | epot = -15.4743629595477 | etot = -14.6249037424133 -971000 ekin = 0.289872105907182 | erot = 0.538479668129509 | epot = -15.4532555162878 | etot = -14.6249037422511 -972000 ekin = 0.269070232407033 | erot = 0.540080898361602 | epot = -15.4340548728818 | etot = -14.6249037421131 -973000 ekin = 0.252397022945933 | erot = 0.54161782723094 | epot = -15.4189185922051 | etot = -14.6249037420282 -974000 ekin = 0.240964852823081 | erot = 0.543321042152107 | epot = -15.4091896369882 | etot = -14.624903742013 -975000 ekin = 0.23490216482483 | erot = 0.545328986458791 | epot = -15.4051348933517 | etot = -14.6249037420681 -976000 ekin = 0.233353466622718 | erot = 0.547671994180028 | epot = -15.4059292029808 | etot = -14.624903742178 -977000 ekin = 0.23469220109011 | erot = 0.550284513867316 | epot = -15.4098804572738 | etot = -14.6249037423163 -978000 ekin = 0.236887903181319 | erot = 0.553043053342949 | epot = -15.4148346989756 | etot = -14.6249037424513 -979000 ekin = 0.237945797132614 | erot = 0.555821040963938 | epot = -15.4186705806485 | etot = -14.624903742552 -980000 ekin = 0.236334546964098 | erot = 0.558547250125554 | epot = -15.4197855396836 | etot = -14.624903742594 -981000 ekin = 0.231322843924842 | erot = 0.561252158433111 | epot = -15.4174787449233 | etot = -14.6249037425653 -982000 ekin = 0.223154169545187 | erot = 0.564087592075058 | epot = -15.4121455040898 | etot = -14.6249037424696 -983000 ekin = 0.213008719539848 | erot = 0.567310103887051 | epot = -15.405222565754 | etot = -14.6249037423271 -984000 ekin = 0.202740628548823 | erot = 0.571227590062905 | epot = -15.3988719607832 | etot = -14.6249037421715 -985000 ekin = 0.19443566515497 | erot = 0.576119771488149 | epot = -15.395459178685 | etot = -14.6249037420419 -986000 ekin = 0.189894304519326 | erot = 0.582152858152867 | epot = -15.3969509046438 | etot = -14.6249037419716 -987000 ekin = 0.190182835425093 | erot = 0.589313613953994 | epot = -15.4044001913574 | etot = -14.6249037419783 -988000 ekin = 0.195390213187501 | erot = 0.597385005524193 | epot = -15.4176789607687 | etot = -14.624903742057 -989000 ekin = 0.204671362362471 | erot = 0.605974905403898 | epot = -15.4355500099488 | etot = -14.6249037421824 -990000 ekin = 0.216563394578787 | erot = 0.614593273597699 | epot = -15.4560604104926 | etot = -14.6249037423161 -991000 ekin = 0.229465191862139 | erot = 0.622757127490779 | epot = -15.4771260617733 | etot = -14.6249037424204 -992000 ekin = 0.242114271128949 | erot = 0.630092599917091 | epot = -15.4971106135164 | etot = -14.6249037424704 -993000 ekin = 0.253902581480084 | erot = 0.636403793831659 | epot = -15.5152101177729 | etot = -14.6249037424612 -994000 ekin = 0.264939510335902 | erot = 0.641689105048086 | epot = -15.5315323577919 | etot = -14.6249037424079 -995000 ekin = 0.275864888579236 | erot = 0.646102898208602 | epot = -15.5468715291263 | etot = -14.6249037423384 -996000 ekin = 0.287497820770256 | erot = 0.649877086441226 | epot = -15.5622786494954 | etot = -14.6249037422839 -997000 ekin = 0.300450307467438 | erot = 0.65322742357329 | epot = -15.5785814733092 | etot = -14.6249037422685 -998000 ekin = 0.314829914377602 | erot = 0.656270894957618 | epot = -15.5960045516385 | etot = -14.6249037423033 -999000 ekin = 0.330110494517114 | erot = 0.658973630822449 | epot = -15.6139878677246 | etot = -14.624903742385 -1000000 ekin = 0.345190458650495 | erot = 0.661138339466907 | epot = -15.6312325406154 | etot = -14.624903742498 - 1000000 0.025569664 -1.5839232 0.020799898 -1.5286042 -3.5789082e-06 -Loop time of 16.5683 on 1 procs for 1000000 steps with 10 atoms - -Performance: 52147.644 tau/day, 60356.069 timesteps/s -99.7% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 12.734 | 12.734 | 12.734 | 0.0 | 76.86 -Bond | 0.62259 | 0.62259 | 0.62259 | 0.0 | 3.76 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 0.18386 | 0.18386 | 0.18386 | 0.0 | 1.11 -Output | 7e-06 | 7e-06 | 7e-06 | 0.0 | 0.00 -Modify | 2.7788 | 2.7788 | 2.7788 | 0.0 | 16.77 -Other | | 0.2491 | | | 1.50 - -Nlocal: 10.0 ave 10.0 max 10.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 37.0 ave 37.0 max 37.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 37 -Ave neighs/atom = 3.7 -Ave special neighs/atom = 3.6 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:16 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.4 deleted file mode 100644 index f798b331e4..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.30Jun20.duplex3.g++.4 +++ /dev/null @@ -1,1182 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 3 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex3 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 10 atoms - reading velocities ... - 10 velocities - 10 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 8 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.004 seconds - -set atom * mass 1.0 - 10 settings made for mass - -group all type 1 4 -10 atoms in group all - -# oxDNA2 bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 2 = max # of 1-4 neighbors - 4 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA2 pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 1.0 0.815 -pair_coeff * * oxdna2/dh 0.1 1.0 0.815 - -# NVE ensemble -fix 1 all nve/dot -#fix 1 all nve/dotc/langevin ${T} ${T} 0.03 457145 angmom 10 -#fix 1 all nve/asphere -#fix 2 all langevin ${T} ${T} 0.03 457145 angmom 10 - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 2.6274048 - ghost atom cutoff = 2.6274048 - binsize = 1.3137024, bins = 31 31 31 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 2.627404783947349 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -14.6249037416652 | etot = -14.6249037416652 -Per MPI rank memory allocation (min/avg/max) = 7.903 | 7.96 | 8.018 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.4720158 0.009525411 -1.4624904 3.1370518e-06 -1000 ekin = 0.00366431201929595 | erot = 0.00193726360268106 | epot = -14.630505317301 | etot = -14.624903741679 -2000 ekin = 0.0144775076075461 | erot = 0.00770914672939826 | epot = -14.6470903960565 | etot = -14.6249037417196 -3000 ekin = 0.0319122186081537 | erot = 0.017197232864929 | epot = -14.6740131932573 | etot = -14.6249037417842 -4000 ekin = 0.055128304350968 | erot = 0.0302085305548261 | epot = -14.7102405767754 | etot = -14.6249037418696 -5000 ekin = 0.0830285165715777 | erot = 0.0464820547542036 | epot = -14.7544143132963 | etot = -14.6249037419705 -6000 ekin = 0.11433112154675 | erot = 0.0656980211282502 | epot = -14.8049328847556 | etot = -14.6249037420806 -7000 ekin = 0.14765386656188 | erot = 0.0874894888755877 | epot = -14.8600470976311 | etot = -14.6249037421936 -8000 ekin = 0.18160209956019 | erot = 0.111456095727761 | epot = -14.9179619375912 | etot = -14.6249037423032 -9000 ekin = 0.214852894725897 | erot = 0.137179311245239 | epot = -14.9769359483746 | etot = -14.6249037424035 -10000 ekin = 0.246227151956005 | erot = 0.164238435218469 | epot = -15.0353693296649 | etot = -14.6249037424904 -11000 ekin = 0.274743080419017 | erot = 0.192226420003323 | epot = -15.091873242983 | etot = -14.6249037425607 -12000 ekin = 0.299647141765663 | erot = 0.220764512146746 | epot = -15.1453153965252 | etot = -14.6249037426128 -13000 ekin = 0.320421918860927 | erot = 0.249514690530647 | epot = -15.1948403520386 | etot = -14.624903742647 -14000 ekin = 0.336773734884323 | erot = 0.278188933730603 | epot = -15.2398664112794 | etot = -14.6249037426645 -15000 ekin = 0.34860541376287 | erot = 0.306554508009539 | epot = -15.2800636644399 | etot = -14.6249037426675 -16000 ekin = 0.355980829097832 | erot = 0.334434770083873 | epot = -15.3153193418403 | etot = -14.6249037426586 -17000 ekin = 0.359087701059401 | erot = 0.361705441666651 | epot = -15.3456968853665 | etot = -14.6249037426405 -18000 ekin = 0.358203710992248 | erot = 0.388286889516457 | epot = -15.3713943431244 | etot = -14.6249037426157 -19000 ekin = 0.353668912555266 | erot = 0.414133518537258 | epot = -15.3927061736789 | etot = -14.6249037425864 -20000 ekin = 0.345865220775347 | erot = 0.439221805285588 | epot = -15.4099907686155 | etot = -14.6249037425546 -21000 ekin = 0.335201981146553 | erot = 0.463538642606666 | epot = -15.423644366275 | etot = -14.6249037425218 -22000 ekin = 0.322105588835009 | erot = 0.487071492273222 | epot = -15.4340808235974 | etot = -14.6249037424892 -23000 ekin = 0.307010918596293 | erot = 0.509801406229522 | epot = -15.4417160672835 | etot = -14.6249037424577 -24000 ekin = 0.290352786033317 | erot = 0.53169940050183 | epot = -15.4469559289633 | etot = -14.6249037424281 -25000 ekin = 0.272556500902201 | erot = 0.552726088759337 | epot = -15.4501863320625 | etot = -14.624903742401 -26000 ekin = 0.254027484079225 | erot = 0.572834017299149 | epot = -15.451765243755 | etot = -14.6249037423766 -27000 ekin = 0.235140665216512 | erot = 0.591971851501351 | epot = -15.4520162590732 | etot = -14.6249037423553 -28000 ekin = 0.216230835846381 | erot = 0.610089455964456 | epot = -15.4512240341482 | etot = -14.6249037423373 -29000 ekin = 0.197585285158732 | erot = 0.627142960082751 | epot = -15.4496319875638 | etot = -14.6249037423223 -30000 ekin = 0.179439940173485 | erot = 0.643099062793524 | epot = -15.4474427452772 | etot = -14.6249037423102 -31000 ekin = 0.161979935826275 | erot = 0.657938056392414 | epot = -15.4448217345188 | etot = -14.6249037423001 -32000 ekin = 0.145345108983154 | erot = 0.671655297434073 | epot = -15.4419041487088 | etot = -14.6249037422916 -33000 ekin = 0.129640400345301 | erot = 0.684261083518649 | epot = -15.4388052261477 | etot = -14.6249037422838 -34000 ekin = 0.114950474500096 | erot = 0.695779112936577 | epot = -15.4356333297123 | etot = -14.6249037422756 -35000 ekin = 0.101357103460395 | erot = 0.706243888527945 | epot = -15.4325047342545 | etot = -14.6249037422661 -36000 ekin = 0.0889576334571495 | erot = 0.715697403164658 | epot = -15.4295587788764 | etot = -14.6249037422546 -37000 ekin = 0.0778817390290869 | erot = 0.724185638635694 | epot = -15.4269711199052 | etot = -14.6249037422404 -38000 ekin = 0.0683037091548152 | erot = 0.731755309647459 | epot = -15.4249627610255 | etot = -14.6249037422232 -39000 ekin = 0.0604476327394574 | erot = 0.738451228922887 | epot = -15.4238026038658 | etot = -14.6249037422035 -40000 ekin = 0.0545835914676698 | erot = 0.744314557682062 | epot = -15.4238018913317 | etot = -14.624903742182 -41000 ekin = 0.0510142787133431 | erot = 0.749382063190686 | epot = -15.425300084064 | etot = -14.6249037421599 -42000 ekin = 0.0500531571157122 | erot = 0.753686350478873 | epot = -15.4286432497339 | etot = -14.6249037421393 -43000 ekin = 0.0519969858277791 | erot = 0.757256889238925 | epot = -15.4341576171884 | etot = -14.6249037421217 -44000 ekin = 0.0570968352183795 | erot = 0.760121540481331 | epot = -15.4421221178083 | etot = -14.6249037421086 -45000 ekin = 0.0655321553469052 | erot = 0.762308219230389 | epot = -15.4527441166787 | etot = -14.6249037421014 -46000 ekin = 0.077391880036667 | erot = 0.763846321567477 | epot = -15.4661419437046 | etot = -14.6249037421005 -47000 ekin = 0.0926650518886644 | erot = 0.764767599959881 | epot = -15.4823363939543 | etot = -14.6249037421058 -48000 ekin = 0.111241466890937 | erot = 0.765106283689481 | epot = -15.5012514926974 | etot = -14.624903742117 -49000 ekin = 0.132920935183018 | erot = 0.764898395951864 | epot = -15.5227230732682 | etot = -14.6249037421333 -50000 ekin = 0.157428432862217 | erot = 0.764180392178735 | epot = -15.5465125671948 | etot = -14.6249037421538 -51000 ekin = 0.184431879186323 | erot = 0.762987403181098 | epot = -15.572323024545 | etot = -14.6249037421776 -52000 ekin = 0.213559336999553 | erot = 0.761351471408863 | epot = -15.5998145506122 | etot = -14.6249037422038 -53000 ekin = 0.244412677541706 | erot = 0.759300175100794 | epot = -15.6286165948746 | etot = -14.6249037422321 -54000 ekin = 0.276574826726782 | erot = 0.756855909735936 | epot = -15.6583344787253 | etot = -14.6249037422625 -55000 ekin = 0.309607708697251 | erot = 0.754035838659022 | epot = -15.6885472896524 | etot = -14.6249037422961 -56000 ekin = 0.343038597242195 | erot = 0.750852192167276 | epot = -15.7187945317442 | etot = -14.6249037423347 -57000 ekin = 0.376334705011675 | erot = 0.747312289063632 | epot = -15.748550736456 | etot = -14.6249037423806 -58000 ekin = 0.408870193943514 | erot = 0.743417624903406 | epot = -15.7771915612831 | etot = -14.6249037424361 -59000 ekin = 0.439895666476151 | erot = 0.739161690570044 | epot = -15.8039610995489 | etot = -14.6249037425027 -60000 ekin = 0.468524372325882 | erot = 0.734526514748492 | epot = -15.8279546296535 | etot = -14.6249037425791 -61000 ekin = 0.493750804630977 | erot = 0.729479048549992 | epot = -15.8481335958426 | etot = -14.6249037426617 -62000 ekin = 0.514511417905742 | erot = 0.723968952962828 | epot = -15.8633841136118 | etot = -14.6249037427432 -63000 ekin = 0.529785687820863 | erot = 0.717929490923054 | epot = -15.8726189215585 | etot = -14.6249037428146 -64000 ekin = 0.538722043350041 | erot = 0.711282639869802 | epot = -15.8749084260858 | etot = -14.624903742866 -65000 ekin = 0.540763046401972 | erot = 0.703948378732391 | epot = -15.8696151680244 | etot = -14.62490374289 -66000 ekin = 0.535742115227036 | erot = 0.695856780686584 | epot = -15.8565026387959 | etot = -14.6249037428823 -67000 ekin = 0.523930969354304 | erot = 0.68696057843429 | epot = -15.8357952906313 | etot = -14.6249037428428 -68000 ekin = 0.506029704478312 | erot = 0.677245632039928 | epot = -15.8081790792934 | etot = -14.6249037427752 -69000 ekin = 0.483104826200259 | erot = 0.666737270644213 | epot = -15.7747458395309 | etot = -14.6249037426864 -70000 ekin = 0.456490218293525 | erot = 0.655501536742973 | epot = -15.7368954976211 | etot = -14.6249037425846 -71000 ekin = 0.427669918862827 | erot = 0.643641521525979 | epot = -15.696215182867 | etot = -14.6249037424782 -72000 ekin = 0.398160338931837 | erot = 0.631289876690699 | epot = -15.6543539579978 | etot = -14.6249037423753 -73000 ekin = 0.369405258277091 | erot = 0.618599034382457 | epot = -15.6129080349413 | etot = -14.6249037422818 -74000 ekin = 0.342691749042478 | erot = 0.605730669564096 | epot = -15.573326160809 | etot = -14.6249037422024 -75000 ekin = 0.319090526807116 | erot = 0.592845634905565 | epot = -15.5368399038526 | etot = -14.6249037421399 -76000 ekin = 0.299420611427649 | erot = 0.580095163563256 | epot = -15.5044195170865 | etot = -14.6249037420956 -77000 ekin = 0.284235504575202 | erot = 0.567613716752232 | epot = -15.476752963397 | etot = -14.6249037420696 -78000 ekin = 0.273826140866745 | erot = 0.555513536863883 | epot = -15.4542434197916 | etot = -14.624903742061 -79000 ekin = 0.268234635497765 | erot = 0.54388078034531 | epot = -15.437019157912 | etot = -14.6249037420689 -80000 ekin = 0.267272602906572 | erot = 0.532773036269537 | epot = -15.4249493812683 | etot = -14.6249037420922 -81000 ekin = 0.270538934182649 | erot = 0.522218059775401 | epot = -15.417660736088 | etot = -14.62490374213 -82000 ekin = 0.27743457435936 | erot = 0.512213638247992 | epot = -15.414551954789 | etot = -14.6249037421817 -83000 ekin = 0.287175732620383 | erot = 0.502728640569106 | epot = -15.4148081154356 | etot = -14.6249037422461 -84000 ekin = 0.298811175848726 | erot = 0.493705451301405 | epot = -15.4174203694714 | etot = -14.6249037423213 -85000 ekin = 0.311252369949757 | erot = 0.485064122067327 | epot = -15.4212202344208 | etot = -14.6249037424038 -86000 ekin = 0.323325626376074 | erot = 0.476708618160845 | epot = -15.4249379870248 | etot = -14.6249037424879 -87000 ekin = 0.33385179551888 | erot = 0.468535420697723 | epot = -15.4272909587828 | etot = -14.6249037425662 -88000 ekin = 0.341751109758587 | erot = 0.460444399763838 | epot = -15.427099252152 | etot = -14.6249037426296 -89000 ekin = 0.346159825920252 | erot = 0.452351304178841 | epot = -15.4234148727694 | etot = -14.6249037426704 -90000 ekin = 0.346534667470577 | erot = 0.444200535918418 | epot = -15.4156389460721 | etot = -14.6249037426831 -91000 ekin = 0.342715665476236 | erot = 0.435976333753466 | epot = -15.4035957418971 | etot = -14.6249037426674 -92000 ekin = 0.334922715851711 | erot = 0.427710377227768 | epot = -15.3875368357076 | etot = -14.6249037426281 -93000 ekin = 0.323677844434189 | erot = 0.419484336040122 | epot = -15.368065923049 | etot = -14.6249037425747 -94000 ekin = 0.309669782921695 | erot = 0.411426964072737 | epot = -15.3460004895125 | etot = -14.624903742518 -95000 ekin = 0.293600014862055 | erot = 0.403706586473305 | epot = -15.3222103438027 | etot = -14.6249037424673 -96000 ekin = 0.2760582848845 | erot = 0.396520701306389 | epot = -15.297482728618 | etot = -14.6249037424272 -97000 ekin = 0.257464456296026 | erot = 0.390084510983188 | epot = -15.2724527096758 | etot = -14.6249037423966 -98000 ekin = 0.238086767083294 | erot = 0.384619533405776 | epot = -15.24761004286 | etot = -14.6249037423709 -99000 ekin = 0.218116994126189 | erot = 0.380342481668315 | epot = -15.2233632181387 | etot = -14.6249037423442 -100000 ekin = 0.197764845956813 | erot = 0.377453964065525 | epot = -15.2001225523343 | etot = -14.6249037423119 -101000 ekin = 0.177333852671588 | erot = 0.37612662169739 | epot = -15.1783642166417 | etot = -14.6249037422727 -102000 ekin = 0.157255732179676 | erot = 0.376493003927858 | epot = -15.1586524783359 | etot = -14.6249037422283 -103000 ekin = 0.138079925449103 | erot = 0.378634329970109 | epot = -15.1416179976017 | etot = -14.6249037421825 -104000 ekin = 0.120430234291513 | erot = 0.38257179133531 | epot = -15.1279057677667 | etot = -14.6249037421398 -105000 ekin = 0.104946722393699 | erot = 0.388261944551355 | epot = -15.1181124090491 | etot = -14.6249037421041 -106000 ekin = 0.0922291289495077 | erot = 0.395597086392455 | epot = -15.1127299574201 | etot = -14.6249037420781 -107000 ekin = 0.0827918191992449 | erot = 0.404410579138415 | epot = -15.112106140401 | etot = -14.6249037420633 -108000 ekin = 0.0770336430610872 | erot = 0.414486225075909 | epot = -15.116423610197 | etot = -14.62490374206 -109000 ekin = 0.0752213121179505 | erot = 0.425570202879076 | epot = -15.1256952570645 | etot = -14.6249037420675 -110000 ekin = 0.077482636424855 | erot = 0.437383858086389 | epot = -15.1397702365963 | etot = -14.6249037420851 -111000 ekin = 0.0838057148049012 | erot = 0.449635759435866 | epot = -15.1583452163524 | etot = -14.6249037421117 -112000 ekin = 0.094041131771038 | erot = 0.462031808376727 | epot = -15.1809766822944 | etot = -14.6249037421466 -113000 ekin = 0.107905661684216 | erot = 0.47428271886895 | epot = -15.2070921227424 | etot = -14.6249037421893 -114000 ekin = 0.124987416380585 | erot = 0.486108767327206 | epot = -15.2359999259466 | etot = -14.6249037422388 -115000 ekin = 0.144753474421712 | erot = 0.497242253022929 | epot = -15.2668994697393 | etot = -14.6249037422947 -116000 ekin = 0.166561593123338 | erot = 0.507428522970937 | epot = -15.2988938584497 | etot = -14.6249037423555 -117000 ekin = 0.189677527330919 | erot = 0.516426638198595 | epot = -15.3310079079494 | etot = -14.6249037424199 -118000 ekin = 0.213298790897393 | erot = 0.524010758771299 | epot = -15.3622132921543 | etot = -14.6249037424856 -119000 ekin = 0.236584576961686 | erot = 0.529973112381402 | epot = -15.3914614318934 | etot = -14.6249037425503 -120000 ekin = 0.258690301858407 | erot = 0.5341290349257 | epot = -15.4177230793954 | etot = -14.6249037426112 -121000 ekin = 0.278804196533067 | erot = 0.536324108799723 | epot = -15.4400320479983 | etot = -14.6249037426655 -122000 ekin = 0.296182819519644 | erot = 0.536442962870851 | epot = -15.4575295251011 | etot = -14.6249037427106 -123000 ekin = 0.310182446406097 | erot = 0.534418915104283 | epot = -15.4695051042545 | etot = -14.6249037427441 -124000 ekin = 0.320283972930319 | erot = 0.530243389137748 | epot = -15.4754311048325 | etot = -14.6249037427644 -125000 ekin = 0.326110081462518 | erot = 0.523973945236228 | epot = -15.4749877694694 | etot = -14.6249037427707 -126000 ekin = 0.32743470961478 | erot = 0.515739832556742 | epot = -15.468078284934 | etot = -14.6249037427624 -127000 ekin = 0.324186046690464 | erot = 0.505744172152755 | epot = -15.4548339615831 | etot = -14.6249037427398 -128000 ekin = 0.316445106704291 | erot = 0.494262185784872 | epot = -15.4356110351926 | etot = -14.6249037427034 -129000 ekin = 0.304442167762781 | erot = 0.481635256753188 | epot = -15.4109811671702 | etot = -14.6249037426542 -130000 ekin = 0.288552887156539 | erot = 0.468261006625544 | epot = -15.3817176363753 | etot = -14.6249037425933 -131000 ekin = 0.269294696165401 | erot = 0.45457995559872 | epot = -15.3487783942861 | etot = -14.6249037425219 -132000 ekin = 0.247322351785784 | erot = 0.441059661322916 | epot = -15.3132857555505 | etot = -14.6249037424418 -133000 ekin = 0.223419723871666 | erot = 0.428177456066593 | epot = -15.2765009222933 | etot = -14.624903742355 -134000 ekin = 0.19848366631698 | erot = 0.416402982921093 | epot = -15.2397903915024 | etot = -14.6249037422643 -135000 ekin = 0.173495806295277 | erot = 0.406181641002432 | epot = -15.2045811894713 | etot = -14.6249037421736 -136000 ekin = 0.149479658252776 | erot = 0.397919790440761 | epot = -15.1723031907806 | etot = -14.6249037420871 -137000 ekin = 0.127443476996694 | erot = 0.391972186713497 | epot = -15.1443194057198 | etot = -14.6249037420096 -138000 ekin = 0.108312970525399 | erot = 0.38863170083623 | epot = -15.121848413308 | etot = -14.6249037419464 -139000 ekin = 0.0928612988417865 | erot = 0.388121053034643 | epot = -15.1058860937781 | etot = -14.6249037419017 -140000 ekin = 0.0816456573909381 | erot = 0.390586148388578 | epot = -15.0971355476584 | etot = -14.6249037418789 -141000 ekin = 0.074959634987115 | erot = 0.396090706683305 | epot = -15.0959540835502 | etot = -14.6249037418797 -142000 ekin = 0.072808553768854 | erot = 0.404612196534598 | epot = -15.1023244922079 | etot = -14.6249037419044 -143000 ekin = 0.0749117535381453 | erot = 0.416039504837322 | epot = -15.1158550003263 | etot = -14.6249037419509 -144000 ekin = 0.0807320498018154 | erot = 0.430173136684429 | epot = -15.1358089285018 | etot = -14.6249037420155 -145000 ekin = 0.0895290255830711 | erot = 0.44672889393778 | epot = -15.1611616616143 | etot = -14.6249037420935 -146000 ekin = 0.100429851262872 | erot = 0.46534582966922 | epot = -15.1906794231108 | etot = -14.6249037421787 -147000 ekin = 0.112509264558272 | erot = 0.485598823527704 | epot = -15.2230118303508 | etot = -14.6249037422648 -148000 ekin = 0.124869425792311 | erot = 0.507015469189125 | epot = -15.2567886373275 | etot = -14.6249037423461 -149000 ekin = 0.136710750658201 | erot = 0.529096273050756 | epot = -15.2907107661264 | etot = -14.6249037424174 -150000 ekin = 0.147386480805994 | erot = 0.551336607351909 | epot = -15.3236268306334 | etot = -14.6249037424755 -151000 ekin = 0.156436378415923 | erot = 0.573248570644847 | epot = -15.3545886915789 | etot = -14.6249037425181 -152000 ekin = 0.163597998371616 | erot = 0.594380933602504 | epot = -15.3828826745191 | etot = -14.624903742545 -153000 ekin = 0.168796920199645 | erot = 0.614335653334077 | epot = -15.4080363160909 | etot = -14.6249037425571 -154000 ekin = 0.172119667637843 | erot = 0.632779929091333 | epot = -15.4298033392859 | etot = -14.6249037425567 -155000 ekin = 0.173774602206439 | erot = 0.649453329864798 | epot = -15.4481316746178 | etot = -14.6249037425466 -156000 ekin = 0.174046854480218 | erot = 0.664170048550206 | epot = -15.4631206455604 | etot = -14.62490374253 -157000 ekin = 0.17325345101635 | erot = 0.67681676270221 | epot = -15.4749739562283 | etot = -14.6249037425097 -158000 ekin = 0.171704281293994 | erot = 0.687346881267705 | epot = -15.48395490505 | etot = -14.6249037424883 -159000 ekin = 0.169673443700116 | erot = 0.695772131172833 | epot = -15.4903493173403 | etot = -14.6249037424673 -160000 ekin = 0.167383826014799 | erot = 0.702152502586226 | epot = -15.4944400710487 | etot = -14.6249037424476 -161000 ekin = 0.165005624031947 | erot = 0.706585545944227 | epot = -15.4964949124054 | etot = -14.6249037424292 -162000 ekin = 0.162667154471987 | erot = 0.7091959147906 | epot = -15.4967668116741 | etot = -14.6249037424115 -163000 ekin = 0.160474189581708 | erot = 0.710125892129571 | epot = -15.4955038241048 | etot = -14.6249037423935 -164000 ekin = 0.158532578972808 | erot = 0.709527441008673 | epot = -15.4929637623557 | etot = -14.6249037423742 -165000 ekin = 0.156968465370873 | erot = 0.707556101120943 | epot = -15.4894283088449 | etot = -14.624903742353 -166000 ekin = 0.155941053191322 | erot = 0.704366832057858 | epot = -15.4852116275794 | etot = -14.6249037423302 -167000 ekin = 0.15564449680974 | erot = 0.700111698658167 | epot = -15.4806599377741 | etot = -14.6249037423062 -168000 ekin = 0.156297672988367 | erot = 0.694939119112688 | epot = -15.4761405343834 | etot = -14.6249037422823 -169000 ekin = 0.158122923325633 | erot = 0.688994262093866 | epot = -15.4720209276801 | etot = -14.6249037422606 -170000 ekin = 0.161316852937839 | erot = 0.682420091513715 | epot = -15.4686406866943 | etot = -14.6249037422428 -171000 ekin = 0.166017619146964 | erot = 0.675358520304694 | epot = -15.4662798816826 | etot = -14.6249037422309 -172000 ekin = 0.172273671159624 | erot = 0.667951149520755 | epot = -15.465128562907 | etot = -14.6249037422266 -173000 ekin = 0.180018623556126 | erot = 0.660339136127817 | epot = -15.465261501915 | etot = -14.624903742231 -174000 ekin = 0.189056055744959 | erot = 0.652661851831919 | epot = -15.4666216498214 | etot = -14.6249037422446 -175000 ekin = 0.199056860650102 | erot = 0.645054167286212 | epot = -15.4690147702031 | etot = -14.6249037422668 -176000 ekin = 0.209570701317496 | erot = 0.637642422787083 | epot = -15.4721168664013 | etot = -14.6249037422968 -177000 ekin = 0.220052442974529 | erot = 0.630539423737744 | epot = -15.4754956090444 | etot = -14.6249037423321 -178000 ekin = 0.229904071991068 | erot = 0.623839102439468 | epot = -15.4786469168001 | etot = -14.6249037423696 -179000 ekin = 0.238532114427838 | erot = 0.617611757778078 | epot = -15.4810476146109 | etot = -14.624903742405 -180000 ekin = 0.245419064060145 | erot = 0.611900922402911 | epot = -15.4822237288958 | etot = -14.6249037424328 -181000 ekin = 0.250203926055637 | erot = 0.606722796615544 | epot = -15.4818304651187 | etot = -14.6249037424476 -182000 ekin = 0.252761402919458 | erot = 0.602068750132192 | epot = -15.4797338954962 | etot = -14.6249037424445 -183000 ekin = 0.253262634973987 | erot = 0.597910660168958 | epot = -15.4760770375644 | etot = -14.6249037424214 -184000 ekin = 0.252195762131854 | erot = 0.594208023727366 | epot = -15.4713075282391 | etot = -14.6249037423799 -185000 ekin = 0.250326113306337 | erot = 0.590915179672999 | epot = -15.4661450353057 | etot = -14.6249037423263 -186000 ekin = 0.248586758541696 | erot = 0.587986907734991 | epot = -15.4614774085483 | etot = -14.6249037422716 -187000 ekin = 0.247909630265907 | erot = 0.585381224304124 | epot = -15.4581945967987 | etot = -14.6249037422287 -188000 ekin = 0.249029052394555 | erot = 0.583059148734203 | epot = -15.4569919433383 | etot = -14.6249037422095 -189000 ekin = 0.25230380318116 | erot = 0.580982165410166 | epot = -15.4581897108133 | etot = -14.624903742222 -190000 ekin = 0.257603763515512 | erot = 0.579108718145525 | epot = -15.4616162239286 | etot = -14.6249037422675 -191000 ekin = 0.264292655598072 | erot = 0.577391223759195 | epot = -15.4665876216979 | etot = -14.6249037423406 -192000 ekin = 0.271315385056371 | erot = 0.575774831089445 | epot = -15.4719939585754 | etot = -14.6249037424296 -193000 ekin = 0.277374539132726 | erot = 0.574198584868558 | epot = -15.4764768665205 | etot = -14.6249037425192 -194000 ekin = 0.281161076019698 | erot = 0.572598913484966 | epot = -15.4786637320983 | etot = -14.6249037425936 -195000 ekin = 0.28159263734721 | erot = 0.570914645865857 | epot = -15.4774110258526 | etot = -14.6249037426396 -196000 ekin = 0.278011867235767 | erot = 0.569092314484949 | epot = -15.4720079243697 | etot = -14.624903742649 -197000 ekin = 0.270307527593016 | erot = 0.567090473640134 | epot = -15.4623017438535 | etot = -14.6249037426204 -198000 ekin = 0.258940359976181 | erot = 0.564882125458909 | epot = -15.4487262279932 | etot = -14.6249037425581 -199000 ekin = 0.244877476699608 | erot = 0.562454912721969 | epot = -15.432236131893 | etot = -14.6249037424714 -200000 ekin = 0.229456931019031 | erot = 0.559809284042109 | epot = -15.4141699574328 | etot = -14.6249037423717 -201000 ekin = 0.214214012279214 | erot = 0.556955381706857 | epot = -15.396073136257 | etot = -14.6249037422709 -202000 ekin = 0.200701376135343 | erot = 0.553909032488835 | epot = -15.3795141508038 | etot = -14.6249037421796 -203000 ekin = 0.190329688711031 | erot = 0.550687503827458 | epot = -15.3659209346438 | etot = -14.6249037421053 -204000 ekin = 0.184246973275431 | erot = 0.547306655839924 | epot = -15.3564573711681 | etot = -14.6249037420528 -205000 ekin = 0.183262973705765 | erot = 0.543779043729182 | epot = -15.3519457594592 | etot = -14.6249037420242 -206000 ekin = 0.187816949073314 | erot = 0.5401134327365 | epot = -15.3528341238289 | etot = -14.6249037420191 -207000 ekin = 0.197980929490155 | erot = 0.536315658388532 | epot = -15.3592003299141 | etot = -14.6249037420354 -208000 ekin = 0.213487612676859 | erot = 0.532390498207104 | epot = -15.3707818529543 | etot = -14.6249037420704 -209000 ekin = 0.23377236271188 | erot = 0.528344018724915 | epot = -15.3870201235577 | etot = -14.6249037421209 -210000 ekin = 0.258021408691598 | erot = 0.524185756556645 | epot = -15.4071109074321 | etot = -14.6249037421838 -211000 ekin = 0.285222208429149 | erot = 0.519930104708152 | epot = -15.4300560553932 | etot = -14.6249037422559 -212000 ekin = 0.314215813604078 | erot = 0.515596398128299 | epot = -15.454715954066 | etot = -14.6249037423336 -213000 ekin = 0.343753634042999 | erot = 0.511207450608694 | epot = -15.4798648270648 | etot = -14.6249037424131 -214000 ekin = 0.372561594269383 | erot = 0.506786560075164 | epot = -15.5042518968341 | etot = -14.6249037424896 -215000 ekin = 0.399412456461965 | erot = 0.502353347158559 | epot = -15.5266695461789 | etot = -14.6249037425584 -216000 ekin = 0.423202666202795 | erot = 0.497919155943979 | epot = -15.5460255647614 | etot = -14.6249037426146 -217000 ekin = 0.443025226539309 | erot = 0.49348301367888 | epot = -15.561411982873 | etot = -14.6249037426548 -218000 ekin = 0.458227302378268 | erot = 0.48902929485633 | epot = -15.5721603399116 | etot = -14.624903742677 -219000 ekin = 0.468443019183614 | erot = 0.484528125251351 | epot = -15.5778748871154 | etot = -14.6249037426804 -220000 ekin = 0.473598483116428 | erot = 0.479939108990727 | epot = -15.5784413347736 | etot = -14.6249037426664 -221000 ekin = 0.473894168318623 | erot = 0.475218183432471 | epot = -15.5740160943877 | etot = -14.6249037426366 -222000 ekin = 0.469774014049581 | erot = 0.470326483973439 | epot = -15.5650042406161 | etot = -14.6249037425931 -223000 ekin = 0.461887320397625 | erot = 0.465239349169327 | epot = -15.5520304121052 | etot = -14.6249037425383 -224000 ekin = 0.451041336422898 | erot = 0.459953336121568 | epot = -15.5358984150205 | etot = -14.6249037424761 -225000 ekin = 0.438137198423164 | erot = 0.454489515561359 | epot = -15.5175304563962 | etot = -14.6249037424117 -226000 ekin = 0.424086332826599 | erot = 0.448892294163476 | epot = -15.4978823693417 | etot = -14.6249037423516 -227000 ekin = 0.409717105195494 | erot = 0.443224250669919 | epot = -15.4778450981669 | etot = -14.6249037423015 -228000 ekin = 0.395692916861841 | erot = 0.437558473222699 | epot = -15.4581551323495 | etot = -14.624903742265 -229000 ekin = 0.382463318564939 | erot = 0.431970318931165 | epot = -15.4393373797388 | etot = -14.6249037422427 -230000 ekin = 0.37025811673091 | erot = 0.426530223272703 | epot = -15.4216920822363 | etot = -14.6249037422326 -231000 ekin = 0.359118625017792 | erot = 0.42129844029256 | epot = -15.4053208075418 | etot = -14.6249037422314 -232000 ekin = 0.348949729121723 | erot = 0.416321816462675 | epot = -15.3901752878201 | etot = -14.6249037422357 -233000 ekin = 0.339575284188518 | erot = 0.411632247273729 | epot = -15.3761112737048 | etot = -14.6249037422426 -234000 ekin = 0.330784909163637 | erot = 0.407246384303507 | epot = -15.3629350357173 | etot = -14.6249037422502 -235000 ekin = 0.322367248495492 | erot = 0.403166248673538 | epot = -15.3504372394263 | etot = -14.6249037422572 -236000 ekin = 0.314129851889848 | erot = 0.399380677843492 | epot = -15.3384142719969 | etot = -14.6249037422636 -237000 ekin = 0.305908300165184 | erot = 0.395867600047875 | epot = -15.3266796424821 | etot = -14.624903742269 -238000 ekin = 0.297568064658136 | erot = 0.392597157204584 | epot = -15.3150689641364 | etot = -14.6249037422737 -239000 ekin = 0.289002756415172 | erot = 0.389535643317114 | epot = -15.3034421420096 | etot = -14.6249037422774 -240000 ekin = 0.280132201614914 | erot = 0.386650129641556 | epot = -15.2916860735363 | etot = -14.6249037422798 -241000 ekin = 0.270903172980511 | erot = 0.383913574227165 | epot = -15.2797204894881 | etot = -14.6249037422804 -242000 ekin = 0.261294311102232 | erot = 0.381310019034049 | epot = -15.2675080724143 | etot = -14.6249037422781 -243000 ekin = 0.251325265434219 | erot = 0.378839435319532 | epot = -15.2550684430252 | etot = -14.6249037422715 -244000 ekin = 0.241068460184283 | erot = 0.376521662813082 | epot = -15.2424938652572 | etot = -14.6249037422598 -245000 ekin = 0.230660579660644 | erot = 0.374398842117291 | epot = -15.2299631640205 | etot = -14.6249037422425 -246000 ekin = 0.220310176855083 | erot = 0.372535772164452 | epot = -15.217749691239 | etot = -14.6249037422195 -247000 ekin = 0.210297920408214 | erot = 0.371017759432552 | epot = -15.2062194220322 | etot = -14.6249037421914 -248000 ekin = 0.200966973970082 | erot = 0.36994577990608 | epot = -15.1958164960362 | etot = -14.6249037421601 -249000 ekin = 0.192702752056133 | erot = 0.369429135338683 | epot = -15.1870356295227 | etot = -14.6249037421279 -250000 ekin = 0.185903524092239 | erot = 0.369576201101353 | epot = -15.1803834672915 | etot = -14.6249037420979 -251000 ekin = 0.180945546219151 | erot = 0.370484246994623 | epot = -15.1763335352865 | etot = -14.6249037420727 -252000 ekin = 0.178147956309189 | erot = 0.372229589272153 | epot = -15.1752812876364 | etot = -14.624903742055 -253000 ekin = 0.177743031464987 | erot = 0.374859230992971 | epot = -15.1775060045044 | etot = -14.6249037420464 -254000 ekin = 0.179856300054645 | erot = 0.378385037101156 | epot = -15.1831450792033 | etot = -14.6249037420475 -255000 ekin = 0.184498455786156 | erot = 0.382781080046288 | epot = -15.1921832778908 | etot = -14.6249037420584 -256000 ekin = 0.191568141872831 | erot = 0.387983970946124 | epot = -15.2044558548971 | etot = -14.6249037420782 -257000 ekin = 0.20086208487434 | erot = 0.39389562099376 | epot = -15.2196614479739 | etot = -14.6249037421058 -258000 ekin = 0.212087875566807 | erot = 0.400387498987271 | epot = -15.2373791166947 | etot = -14.6249037421406 -259000 ekin = 0.224875306192123 | erot = 0.407305396776656 | epot = -15.2570844451507 | etot = -14.6249037421819 -260000 ekin = 0.238784314763303 | erot = 0.414473950040634 | epot = -15.2781620070332 | etot = -14.6249037422292 -261000 ekin = 0.253310397642086 | erot = 0.421700596682803 | epot = -15.2999147366071 | etot = -14.6249037422822 -262000 ekin = 0.26789075041242 | erot = 0.428779149458854 | epot = -15.3215736422117 | etot = -14.6249037423404 -263000 ekin = 0.281915541778016 | erot = 0.435493571930236 | epot = -15.3423128561104 | etot = -14.6249037424021 -264000 ekin = 0.294748319449364 | erot = 0.441622773940569 | epot = -15.3612748358549 | etot = -14.624903742465 -265000 ekin = 0.305757851305535 | erot = 0.446947232466421 | epot = -15.3776088262975 | etot = -14.6249037425255 -266000 ekin = 0.314361275702592 | erot = 0.451257984268131 | epot = -15.3905230025502 | etot = -14.6249037425794 -267000 ekin = 0.320075758814341 | erot = 0.454368036195608 | epot = -15.399347537632 | etot = -14.624903742622 -268000 ekin = 0.322573111286139 | erot = 0.456125517717021 | epot = -15.4036023716517 | etot = -14.6249037426486 -269000 ekin = 0.321728949457285 | erot = 0.456427019950081 | epot = -15.4030597120627 | etot = -14.6249037426554 -270000 ekin = 0.317655198203759 | erot = 0.455228696070215 | epot = -15.397787636915 | etot = -14.624903742641 -271000 ekin = 0.310703151367757 | erot = 0.452552178356157 | epot = -15.3881590723317 | etot = -14.6249037426077 -272000 ekin = 0.3014262335366 | erot = 0.448482664562447 | epot = -15.37481264066 | etot = -14.624903742561 -273000 ekin = 0.290499502093233 | erot = 0.443158007811504 | epot = -15.3585612524143 | etot = -14.6249037425096 -274000 ekin = 0.278606962225926 | erot = 0.436750209658098 | epot = -15.3402609143472 | etot = -14.6249037424632 -275000 ekin = 0.266323480340475 | erot = 0.429443553159133 | epot = -15.320670775929 | etot = -14.6249037424294 -276000 ekin = 0.254026977157675 | erot = 0.421415402005373 | epot = -15.3003461215741 | etot = -14.6249037424111 -277000 ekin = 0.241871064453077 | erot = 0.412825312322701 | epot = -15.2796001191813 | etot = -14.6249037424055 -278000 ekin = 0.229828041579266 | erot = 0.403815416630584 | epot = -15.2585472006154 | etot = -14.6249037424055 -279000 ekin = 0.217786141145793 | erot = 0.394521119097645 | epot = -15.2372110026455 | etot = -14.6249037424021 -280000 ekin = 0.205666064593437 | erot = 0.385087703032635 | epot = -15.2156575100138 | etot = -14.6249037423877 -281000 ekin = 0.193518604274061 | erot = 0.375686870763365 | epot = -15.1941092173957 | etot = -14.6249037423582 -282000 ekin = 0.18157672074763 | erot = 0.366527860022155 | epot = -15.1730083230837 | etot = -14.624903742314 -283000 ekin = 0.170254050626075 | erot = 0.357859944224688 | epot = -15.1530177371095 | etot = -14.6249037422587 -284000 ekin = 0.160098631070491 | erot = 0.349965713706295 | epot = -15.1349680869751 | etot = -14.6249037421983 -285000 ekin = 0.151720356670846 | erot = 0.34314662552044 | epot = -15.1197707243306 | etot = -14.6249037421394 -286000 ekin = 0.145712559183964 | erot = 0.337703485421193 | epot = -15.1083197866929 | etot = -14.6249037420878 -287000 ekin = 0.142584250545026 | erot = 0.333914836093095 | epot = -15.1014028286861 | etot = -14.624903742048 -288000 ekin = 0.1427129413407 | erot = 0.33201595204283 | epot = -15.0996326354059 | etot = -14.6249037420224 -289000 ekin = 0.146320998448507 | erot = 0.332180585090171 | epot = -15.1034053255506 | etot = -14.6249037420119 -290000 ekin = 0.153472816921105 | erot = 0.334506983379138 | epot = -15.1128835423165 | etot = -14.6249037420163 -291000 ekin = 0.164086465662505 | erot = 0.339009144348392 | epot = -15.1279993520451 | etot = -14.6249037420342 -292000 ekin = 0.177952173600193 | erot = 0.345613807734964 | epot = -15.1484697233995 | etot = -14.6249037420643 -293000 ekin = 0.194750859968512 | erot = 0.354163344443286 | epot = -15.1738179465169 | etot = -14.6249037421051 -294000 ekin = 0.214068309158811 | erot = 0.364424408222176 | epot = -15.2033964595362 | etot = -14.6249037421552 -295000 ekin = 0.235403710402673 | erot = 0.376101928511166 | epot = -15.2364093811272 | etot = -14.6249037422133 -296000 ekin = 0.258174229752594 | erot = 0.388857685536638 | epot = -15.2719356575669 | etot = -14.6249037422777 -297000 ekin = 0.28171936013486 | erot = 0.402332315571688 | epot = -15.308955418053 | etot = -14.6249037423465 -298000 ekin = 0.30530968452295 | erot = 0.416169191335505 | epot = -15.3463826182751 | etot = -14.6249037424166 -299000 ekin = 0.328164426016042 | erot = 0.430038291827055 | epot = -15.3831064603285 | etot = -14.6249037424854 -300000 ekin = 0.349480947254597 | erot = 0.443657997414049 | epot = -15.4180426872175 | etot = -14.6249037425489 -301000 ekin = 0.368477349758915 | erot = 0.456812763608253 | epot = -15.4501938559697 | etot = -14.6249037426025 -302000 ekin = 0.384446573101029 | erot = 0.469364841860584 | epot = -15.478715157604 | etot = -14.6249037426423 -303000 ekin = 0.396817065634643 | erot = 0.481258609604428 | epot = -15.5029794179037 | etot = -14.6249037426647 -304000 ekin = 0.405211709647263 | erot = 0.492516637287232 | epot = -15.5226320896016 | etot = -14.6249037426671 -305000 ekin = 0.409494186866275 | erot = 0.503227368869637 | epot = -15.5376252983854 | etot = -14.6249037426495 -306000 ekin = 0.409791521883174 | erot = 0.513525227982492 | epot = -15.5482204924795 | etot = -14.6249037426138 -307000 ekin = 0.406484029568133 | erot = 0.523565033268022 | epot = -15.554952805401 | etot = -14.6249037425649 -308000 ekin = 0.400159443094258 | erot = 0.533493670193094 | epot = -15.5585568557967 | etot = -14.6249037425093 -309000 ekin = 0.391535685674106 | erot = 0.543422788904079 | epot = -15.5598622170332 | etot = -14.624903742455 -310000 ekin = 0.381364662750139 | erot = 0.553406603763137 | epot = -15.5596750089224 | etot = -14.6249037424091 -311000 ekin = 0.370335174701307 | erot = 0.563428434508751 | epot = -15.5586673515872 | etot = -14.6249037423771 -312000 ekin = 0.358994462074446 | erot = 0.573398378860501 | epot = -15.5572965832962 | etot = -14.6249037423613 -313000 ekin = 0.347704062022306 | erot = 0.583162598674582 | epot = -15.5557704030575 | etot = -14.6249037423606 -314000 ekin = 0.336637402906986 | erot = 0.592522528333631 | epot = -15.5540636736117 | etot = -14.624903742371 -315000 ekin = 0.325816357219225 | erot = 0.601260411440956 | epot = -15.5519805110472 | etot = -14.624903742387 -316000 ekin = 0.315175012816655 | erot = 0.609166451967456 | epot = -15.5492452071862 | etot = -14.6249037424021 -317000 ekin = 0.304633856553691 | erot = 0.616062831071924 | epot = -15.5456004300362 | etot = -14.6249037424106 -318000 ekin = 0.294167456686513 | erot = 0.62182086663663 | epot = -15.5408920657322 | etot = -14.624903742409 -319000 ekin = 0.283852816310304 | erot = 0.626369338623922 | epot = -15.5351258973303 | etot = -14.624903742396 -320000 ekin = 0.273891844373217 | erot = 0.629693948583815 | epot = -15.5284895353292 | etot = -14.6249037423721 -321000 ekin = 0.264607615830326 | erot = 0.631829520444979 | epot = -15.5213408786153 | etot = -14.62490374234 -322000 ekin = 0.256418665980307 | erot = 0.632847556381831 | epot = -15.5141699646654 | etot = -14.6249037423032 -323000 ekin = 0.249797892887523 | erot = 0.632842055921361 | epot = -15.5075436910745 | etot = -14.6249037422657 -324000 ekin = 0.245223011939351 | erot = 0.631916211662891 | epot = -15.5020429658331 | etot = -14.6249037422309 -325000 ekin = 0.243124676660684 | erot = 0.630171930979688 | epot = -15.4982003498434 | etot = -14.624903742203 -326000 ekin = 0.243837159968099 | erot = 0.627703310196172 | epot = -15.4964442123488 | etot = -14.6249037421845 -327000 ekin = 0.247555458534595 | erot = 0.624594349329669 | epot = -15.4970535500421 | etot = -14.6249037421778 -328000 ekin = 0.254302069317299 | erot = 0.620920422826771 | epot = -15.5001262343279 | etot = -14.6249037421838 -329000 ekin = 0.263906382978619 | erot = 0.616752378549859 | epot = -15.5055625037313 | etot = -14.6249037422028 -330000 ekin = 0.275999298196813 | erot = 0.612161709808654 | epot = -15.5130647502395 | etot = -14.624903742234 -331000 ekin = 0.290024872454789 | erot = 0.607225138478484 | epot = -15.5221537532086 | etot = -14.6249037422753 -332000 ekin = 0.305269328205604 | erot = 0.602027230533244 | epot = -15.5322003010627 | etot = -14.6249037423238 -333000 ekin = 0.320905611375339 | erot = 0.596660303338559 | epot = -15.5424696570899 | etot = -14.624903742376 -334000 ekin = 0.33604943896321 | erot = 0.591221710457376 | epot = -15.5521748918485 | etot = -14.6249037424279 -335000 ekin = 0.349821102707738 | erot = 0.585809355783106 | epot = -15.5605342009668 | etot = -14.624903742476 -336000 ekin = 0.361406827299164 | erot = 0.580516763971287 | epot = -15.5668273337868 | etot = -14.6249037425163 -337000 ekin = 0.370114335989308 | erot = 0.575429096256479 | epot = -15.5704471747923 | etot = -14.6249037425465 -338000 ekin = 0.375418963131897 | erot = 0.570621177508977 | epot = -15.5709438832049 | etot = -14.624903742564 -339000 ekin = 0.37699830668418 | erot = 0.566157982091382 | epot = -15.568060031343 | etot = -14.6249037425674 -340000 ekin = 0.374754278532065 | erot = 0.562097189039008 | epot = -15.5617552101272 | etot = -14.6249037425561 -341000 ekin = 0.368821588409643 | erot = 0.558493134368575 | epot = -15.5522184653083 | etot = -14.62490374253 -342000 ekin = 0.359561251230613 | erot = 0.555400700218343 | epot = -15.5398656939398 | etot = -14.6249037424909 -343000 ekin = 0.34753785325451 | erot = 0.55287778591816 | epot = -15.5253193816136 | etot = -14.6249037424409 -344000 ekin = 0.33348037496383 | erot = 0.55098526840084 | epot = -15.5093693857485 | etot = -14.6249037423838 -345000 ekin = 0.318228359784329 | erot = 0.549783918348214 | epot = -15.4929160204567 | etot = -14.6249037423241 -346000 ekin = 0.302667555547452 | erot = 0.54932843011035 | epot = -15.4768997279244 | etot = -14.6249037422666 -347000 ekin = 0.287661057443402 | erot = 0.549659363310377 | epot = -15.4622241629697 | etot = -14.6249037422159 -348000 ekin = 0.273982878354199 | erot = 0.550794243902694 | epot = -15.4496808644332 | etot = -14.6249037421763 -349000 ekin = 0.262260631617831 | erot = 0.552719272009444 | epot = -15.4398836457781 | etot = -14.6249037421509 -350000 ekin = 0.252932884528162 | erot = 0.555383042233064 | epot = -15.4332196689026 | etot = -14.6249037421414 -351000 ekin = 0.246225113234554 | erot = 0.558693418765032 | epot = -15.4298222741477 | etot = -14.6249037421482 -352000 ekin = 0.242146418558272 | erot = 0.56251834442516 | epot = -15.4295685051533 | etot = -14.6249037421699 -353000 ekin = 0.240507191582667 | erot = 0.566690733134521 | epot = -15.4321016669209 | etot = -14.6249037422037 -354000 ekin = 0.240955911174045 | erot = 0.571016874086999 | epot = -15.436876527507 | etot = -14.6249037422459 -355000 ekin = 0.243030568944153 | erot = 0.575286990707781 | epot = -15.4432213019441 | etot = -14.6249037422922 -356000 ekin = 0.246218336341581 | erot = 0.579286102670368 | epot = -15.4504081813502 | etot = -14.6249037423382 -357000 ekin = 0.250015504867143 | erot = 0.582803084083675 | epot = -15.4577223313313 | etot = -14.6249037423804 -358000 ekin = 0.253980003728345 | erot = 0.585636256510411 | epot = -15.4645200026548 | etot = -14.6249037424161 -359000 ekin = 0.257771924238285 | erot = 0.587595069854159 | epot = -15.470270736536 | etot = -14.6249037424435 -360000 ekin = 0.261178006692362 | erot = 0.588498175296126 | epot = -15.4745799244509 | etot = -14.6249037424624 -361000 ekin = 0.264121303803865 | erot = 0.588169931158578 | epot = -15.4771949774352 | etot = -14.6249037424728 -362000 ekin = 0.266656268947586 | erot = 0.586437607933159 | epot = -15.4779976193564 | etot = -14.6249037424757 -363000 ekin = 0.268947338173594 | erot = 0.583131261385069 | epot = -15.4769823420319 | etot = -14.6249037424733 -364000 ekin = 0.271226723299151 | erot = 0.578087502910549 | epot = -15.4742179686787 | etot = -14.624903742469 -365000 ekin = 0.273728224388467 | erot = 0.571157191000871 | epot = -15.4697891578569 | etot = -14.6249037424676 -366000 ekin = 0.276601570519792 | erot = 0.562216266683795 | epot = -15.4637215796778 | etot = -14.6249037424742 -367000 ekin = 0.279824898676098 | erot = 0.551178529879434 | epot = -15.4559071710478 | etot = -14.6249037424923 -368000 ekin = 0.283144751011445 | erot = 0.538009090150866 | epot = -15.4460575836835 | etot = -14.6249037425212 -369000 ekin = 0.286073979195581 | erot = 0.522737270878923 | epot = -15.4337149926306 | etot = -14.6249037425561 -370000 ekin = 0.287962637923446 | erot = 0.505467651700438 | epot = -15.4183340322116 | etot = -14.6249037425877 -371000 ekin = 0.288129562577258 | erot = 0.486387667907668 | epot = -15.3994209730903 | etot = -14.6249037426054 -372000 ekin = 0.286016270828658 | erot = 0.46576999808234 | epot = -15.3766900115119 | etot = -14.6249037426009 -373000 ekin = 0.28131449291777 | erot = 0.44396824694377 | epot = -15.3501864824323 | etot = -14.6249037425708 -374000 ekin = 0.274029637541844 | erot = 0.421405384814399 | epot = -15.3203387648735 | etot = -14.6249037425173 -375000 ekin = 0.264468317324484 | erot = 0.398555847613824 | epot = -15.2879279073849 | etot = -14.6249037424466 -376000 ekin = 0.253165169268526 | erot = 0.375923572597148 | epot = -15.2539924842331 | etot = -14.6249037423675 -377000 ekin = 0.240780733675043 | erot = 0.354018931407531 | epot = -15.2197034073705 | etot = -14.6249037422879 -378000 ekin = 0.228003530693319 | erot = 0.333337224178132 | epot = -15.1862444970855 | etot = -14.624903742214 -379000 ekin = 0.215478669427759 | erot = 0.314340303318484 | epot = -15.1547227148953 | etot = -14.624903742149 -380000 ekin = 0.203769466320592 | erot = 0.297441561968215 | epot = -15.1261147703835 | etot = -14.6249037420947 -381000 ekin = 0.193344913038784 | erot = 0.28299357961111 | epot = -15.1012422347014 | etot = -14.6249037420515 -382000 ekin = 0.184579097116762 | erot = 0.271277560103732 | epot = -15.0807603992407 | etot = -14.6249037420202 -383000 ekin = 0.177749902922565 | erot = 0.262494318474771 | epot = -15.0651479633987 | etot = -14.6249037420014 -384000 ekin = 0.173031383434342 | erot = 0.256757595375907 | epot = -15.0546927208061 | etot = -14.6249037419958 -385000 ekin = 0.170483112154611 | erot = 0.254091341095815 | epot = -15.049478195254 | etot = -14.6249037420036 -386000 ekin = 0.170046361592112 | erot = 0.254432809989126 | epot = -15.0493829136047 | etot = -14.6249037420235 -387000 ekin = 0.171558026226825 | erot = 0.257642587604582 | epot = -15.0541043558832 | etot = -14.6249037420518 -388000 ekin = 0.174787865438713 | erot = 0.263521131369935 | epot = -15.0632127388923 | etot = -14.6249037420836 -389000 ekin = 0.179494526901415 | erot = 0.271829477565432 | epot = -15.0762277465806 | etot = -14.6249037421138 -390000 ekin = 0.185484901052056 | erot = 0.282310127810448 | epot = -15.0926987710007 | etot = -14.6249037421382 -391000 ekin = 0.192654775275645 | erot = 0.294703495235847 | epot = -15.1122620126676 | etot = -14.6249037421561 -392000 ekin = 0.200990711955422 | erot = 0.308756153372483 | epot = -15.1346506074986 | etot = -14.6249037421707 -393000 ekin = 0.210524629688135 | erot = 0.324219483680835 | epot = -15.1596478555569 | etot = -14.624903742188 -394000 ekin = 0.221250398117909 | erot = 0.340840530849171 | epot = -15.1869946711819 | etot = -14.6249037422148 -395000 ekin = 0.233028912153377 | erot = 0.358349828150776 | epot = -15.2162824825608 | etot = -14.6249037422566 -396000 ekin = 0.24551683484774 | erot = 0.376452447323546 | epot = -15.246873024486 | etot = -14.6249037423147 -397000 ekin = 0.258149646288765 | erot = 0.394827815017102 | epot = -15.277881203691 | etot = -14.6249037423851 -398000 ekin = 0.270192540269911 | erot = 0.413141033371924 | epot = -15.3082373161009 | etot = -14.624903742459 -399000 ekin = 0.280849396853359 | erot = 0.431064534842246 | epot = -15.3368176742213 | etot = -14.6249037425257 -400000 ekin = 0.289399657315015 | erot = 0.448305349544995 | epot = -15.3626087494354 | etot = -14.6249037425754 -401000 ekin = 0.295323233787434 | erot = 0.464631356381723 | epot = -15.3848583327708 | etot = -14.6249037426017 -402000 ekin = 0.298377750400983 | erot = 0.479890206670516 | epot = -15.403171699675 | etot = -14.6249037426035 -403000 ekin = 0.298608046776455 | erot = 0.49401684483596 | epot = -15.4175286341975 | etot = -14.6249037425851 -404000 ekin = 0.296288720275777 | erot = 0.507028747324647 | epot = -15.4282212101546 | etot = -14.6249037425541 -405000 ekin = 0.291819450890444 | erot = 0.519011022290083 | epot = -15.4357342157004 | etot = -14.6249037425198 -406000 ekin = 0.285604695316647 | erot = 0.530095491696055 | epot = -15.4406039295028 | etot = -14.6249037424901 -407000 ekin = 0.2779517950128 | erot = 0.540438449781317 | epot = -15.4432939872644 | etot = -14.6249037424703 -408000 ekin = 0.269015012492784 | erot = 0.550201084797022 | epot = -15.4441198397505 | etot = -14.6249037424607 -409000 ekin = 0.258799683407146 | erot = 0.559535019811769 | epot = -15.4432384456767 | etot = -14.6249037424578 -410000 ekin = 0.247223943172528 | erot = 0.568573648692213 | epot = -15.4407013343199 | etot = -14.6249037424552 -411000 ekin = 0.234219542826923 | erot = 0.577428429926601 | epot = -15.4365517151993 | etot = -14.6249037424458 -412000 ekin = 0.219842320368698 | erot = 0.586188386128906 | epot = -15.4309344489214 | etot = -14.6249037424238 -413000 ekin = 0.20435994837526 | erot = 0.594920843620994 | epot = -15.4241845343832 | etot = -14.6249037423869 -414000 ekin = 0.188290368309867 | erot = 0.603671832826878 | epot = -15.4168659434732 | etot = -14.6249037423364 -415000 ekin = 0.17237708181712 | erot = 0.6124653242919 | epot = -15.4097461483873 | etot = -14.6249037422783 -416000 ekin = 0.157503657631228 | erot = 0.621301324615769 | epot = -15.4037087244679 | etot = -14.6249037422209 -417000 ekin = 0.144565276806289 | erot = 0.630153567597092 | epot = -15.399622586577 | etot = -14.6249037421736 -418000 ekin = 0.134326161306418 | erot = 0.638967960411968 | epot = -15.398197863863 | etot = -14.6249037421446 -419000 ekin = 0.127295713867183 | erot = 0.647663024756225 | epot = -15.3998624807619 | etot = -14.6249037421385 -420000 ekin = 0.123652074079106 | erot = 0.656133267678458 | epot = -15.4046890839134 | etot = -14.6249037421558 -421000 ekin = 0.123230332545554 | erot = 0.664256043547071 | epot = -15.4123901182848 | etot = -14.6249037421922 -422000 ekin = 0.125576493084721 | erot = 0.671901405101286 | epot = -15.4223816404263 | etot = -14.6249037422402 -423000 ekin = 0.130051930466301 | erot = 0.678943694027942 | epot = -15.4338993667852 | etot = -14.6249037422909 -424000 ekin = 0.135961143238876 | erot = 0.685273086227244 | epot = -15.4461379718019 | etot = -14.6249037423358 -425000 ekin = 0.142671659965505 | erot = 0.69080498381162 | epot = -15.4583803861461 | etot = -14.624903742369 -426000 ekin = 0.149699767318722 | erot = 0.695485561348404 | epot = -15.4700890710554 | etot = -14.6249037423883 -427000 ekin = 0.156747049208244 | erot = 0.699292628464214 | epot = -15.4809434200673 | etot = -14.6249037423948 -428000 ekin = 0.163686553654253 | erot = 0.702231990285515 | epot = -15.4908222863323 | etot = -14.6249037423925 -429000 ekin = 0.170509683514413 | erot = 0.70433031530151 | epot = -15.4997437412025 | etot = -14.6249037423866 -430000 ekin = 0.177252892951188 | erot = 0.705626025883397 | epot = -15.507782661217 | etot = -14.6249037423824 -431000 ekin = 0.183925691222352 | erot = 0.706159951516081 | epot = -15.5149893851221 | etot = -14.6249037423836 -432000 ekin = 0.190457851079565 | erot = 0.70596688379378 | epot = -15.5213284772654 | etot = -14.6249037423921 -433000 ekin = 0.196676887388984 | erot = 0.705069371776661 | epot = -15.5266500015729 | etot = -14.6249037424073 -434000 ekin = 0.202317433899364 | erot = 0.703474477741261 | epot = -15.5306956540676 | etot = -14.624903742427 -435000 ekin = 0.207056046506538 | erot = 0.701173837003675 | epot = -15.533133625958 | etot = -14.6249037424478 -436000 ekin = 0.210560164856777 | erot = 0.698146912242834 | epot = -15.5336108195658 | etot = -14.6249037424662 -437000 ekin = 0.212539330538657 | erot = 0.69436686481977 | epot = -15.5318099378375 | etot = -14.6249037424791 -438000 ekin = 0.212789433625669 | erot = 0.689808070113577 | epot = -15.5275012462234 | etot = -14.6249037424842 -439000 ekin = 0.211224885327081 | erot = 0.684454087056256 | epot = -15.5205827148631 | etot = -14.6249037424798 -440000 ekin = 0.207897417438738 | erot = 0.678304934040362 | epot = -15.5111060939442 | etot = -14.6249037424651 -441000 ekin = 0.203002684917544 | erot = 0.671382822497087 | epot = -15.4992892498551 | etot = -14.6249037424404 -442000 ekin = 0.196876783893444 | erot = 0.663735946787442 | epot = -15.485516473087 | etot = -14.6249037424062 -443000 ekin = 0.189984458135359 | erot = 0.655440346227863 | epot = -15.4703285467267 | etot = -14.6249037423634 -444000 ekin = 0.182899715135716 | erot = 0.646600090309095 | epot = -15.4544035477587 | etot = -14.6249037423138 -445000 ekin = 0.176278659807256 | erot = 0.637346059016788 | epot = -15.4385284610839 | etot = -14.6249037422598 -446000 ekin = 0.170824489262319 | erot = 0.627833490901675 | epot = -15.4235617223679 | etot = -14.6249037422039 -447000 ekin = 0.167246115781588 | erot = 0.618238375507795 | epot = -15.4103882334389 | etot = -14.6249037421495 -448000 ekin = 0.166214016011178 | erot = 0.608752709244163 | epot = -15.3998704673549 | etot = -14.6249037420996 -449000 ekin = 0.168318002547464 | erot = 0.599578546515158 | epot = -15.3928002911194 | etot = -14.6249037420568 -450000 ekin = 0.174030350885997 | erot = 0.590920601689278 | epot = -15.3898546945991 | etot = -14.6249037420239 -451000 ekin = 0.183674309612449 | erot = 0.582976972210044 | epot = -15.3915550238259 | etot = -14.6249037420034 -452000 ekin = 0.197394458885136 | erot = 0.575927582957288 | epot = -15.3982257838406 | etot = -14.6249037419982 -453000 ekin = 0.21512429096355 | erot = 0.569920414706644 | epot = -15.4099484476817 | etot = -14.6249037420115 -454000 ekin = 0.236549344238021 | erot = 0.565056494271684 | epot = -15.4265095805563 | etot = -14.6249037420466 -455000 ekin = 0.26107066649251 | erot = 0.561375729613514 | epot = -15.4473501382118 | etot = -14.6249037421058 -456000 ekin = 0.287780783018564 | erot = 0.558846520705737 | epot = -15.4715310459135 | etot = -14.6249037421892 -457000 ekin = 0.315469350478398 | erot = 0.557362227355198 | epot = -15.4977353201268 | etot = -14.6249037422932 -458000 ekin = 0.342675461160486 | erot = 0.556746783054669 | epot = -15.5243259866254 | etot = -14.6249037424102 -459000 ekin = 0.367796771323547 | erot = 0.556770049266648 | epot = -15.5494705631187 | etot = -14.6249037425286 -460000 ekin = 0.389252836428699 | erot = 0.557171234684316 | epot = -15.5713278137469 | etot = -14.6249037426338 -461000 ekin = 0.405683830371934 | erot = 0.557686417732654 | epot = -15.588273990816 | etot = -14.6249037427114 -462000 ekin = 0.41615050976317 | erot = 0.558074591843087 | epot = -15.5991288443563 | etot = -14.62490374275 -463000 ekin = 0.420292029664587 | erot = 0.558136338549784 | epot = -15.6033321109585 | etot = -14.6249037427441 -464000 ekin = 0.418399545177946 | erot = 0.557720582602229 | epot = -15.6010238704766 | etot = -14.6249037426964 -465000 ekin = 0.411377435968348 | erot = 0.556717766126943 | epot = -15.592998944713 | etot = -14.6249037426177 -466000 ekin = 0.400588481170385 | erot = 0.555041504869352 | epot = -15.5805337285651 | etot = -14.6249037425254 -467000 ekin = 0.387608315925592 | erot = 0.552604267016079 | epot = -15.5651163253806 | etot = -14.6249037424389 -468000 ekin = 0.373939506071155 | erot = 0.549294716065804 | epot = -15.5481379645132 | etot = -14.6249037423763 -469000 ekin = 0.360748545285724 | erot = 0.544964338610985 | epot = -15.5306166262455 | etot = -14.6249037423488 -470000 ekin = 0.348685397522308 | erot = 0.539428754142175 | epot = -15.5130178940236 | etot = -14.6249037423592 -471000 ekin = 0.337825425309533 | erot = 0.532485282885717 | epot = -15.4952144505958 | etot = -14.6249037424005 -472000 ekin = 0.327743216876142 | erot = 0.523944004294882 | epot = -15.4765909636297 | etot = -14.6249037424587 -473000 ekin = 0.317695625905302 | erot = 0.513665869846428 | epot = -15.4562652382673 | etot = -14.6249037425156 -474000 ekin = 0.306866206293077 | erot = 0.501599410558585 | epot = -15.4333693594052 | etot = -14.6249037425536 -475000 ekin = 0.294611572516325 | erot = 0.487807694339578 | epot = -15.4073230094157 | etot = -14.6249037425598 -476000 ekin = 0.280654133646186 | erot = 0.472479343852861 | epot = -15.3780372200275 | etot = -14.6249037425285 -477000 ekin = 0.265182667318923 | erot = 0.45592098927681 | epot = -15.3460073990573 | etot = -14.6249037424616 -478000 ekin = 0.248846579356572 | erot = 0.438532535944384 | epot = -15.3122828576692 | etot = -14.6249037423683 -479000 ekin = 0.232654569021534 | erot = 0.420770062233477 | epot = -15.2783283735172 | etot = -14.6249037422622 -480000 ekin = 0.217807844647013 | erot = 0.403103245642619 | epot = -15.2458148324477 | etot = -14.6249037421581 -481000 ekin = 0.205508255202962 | erot = 0.385974572359883 | epot = -15.2163865696323 | etot = -14.6249037420695 -482000 ekin = 0.19678156694235 | erot = 0.369766310247464 | epot = -15.1914516191956 | etot = -14.6249037420058 -483000 ekin = 0.192346943568308 | erot = 0.354778814406232 | epot = -15.1720294999467 | etot = -14.6249037419722 -484000 ekin = 0.192548846646656 | erot = 0.341220938396417 | epot = -15.1586735270114 | etot = -14.6249037419683 -485000 ekin = 0.197351634264863 | erot = 0.329210924265139 | epot = -15.1514663005208 | etot = -14.6249037419908 -486000 ekin = 0.20638457111255 | erot = 0.318784712513067 | epot = -15.1500730256597 | etot = -14.6249037420341 -487000 ekin = 0.219018661980825 | erot = 0.30990833731601 | epot = -15.1538307413881 | etot = -14.6249037420913 -488000 ekin = 0.234457053485159 | erot = 0.302491737711703 | epot = -15.1618525333529 | etot = -14.624903742156 -489000 ekin = 0.251825722281652 | erot = 0.296402451840958 | epot = -15.1731319163445 | etot = -14.6249037422219 -490000 ekin = 0.270257579251709 | erot = 0.291478772534598 | epot = -15.1866400940702 | etot = -14.6249037422839 -491000 ekin = 0.288968023939754 | erot = 0.287542686829926 | epot = -15.2014144531061 | etot = -14.6249037423365 -492000 ekin = 0.307321746939228 | erot = 0.284413165332613 | epot = -15.2166386546469 | etot = -14.6249037423751 -493000 ekin = 0.324889192266724 | erot = 0.281920128741297 | epot = -15.2317130634048 | etot = -14.6249037423968 -494000 ekin = 0.34148788338571 | erot = 0.279918789014045 | epot = -15.2463104147988 | etot = -14.6249037423991 -495000 ekin = 0.357200801059907 | erot = 0.27830316795437 | epot = -15.2604077113965 | etot = -14.6249037423822 -496000 ekin = 0.372363075865331 | erot = 0.277016625443997 | epot = -15.2742834436586 | etot = -14.6249037423492 -497000 ekin = 0.387510424728836 | erot = 0.276056483801624 | epot = -15.2884706508366 | etot = -14.6249037423061 -498000 ekin = 0.40328774473455 | erot = 0.275469725413449 | epot = -15.3036612124099 | etot = -14.6249037422619 -499000 ekin = 0.420322923931638 | erot = 0.275337682298311 | epot = -15.3205643484574 | etot = -14.6249037422275 -500000 ekin = 0.439078206868906 | erot = 0.275749832423424 | epot = -15.3397317815068 | etot = -14.6249037422144 -501000 ekin = 0.459699055392479 | erot = 0.27677002458918 | epot = -15.3613728222145 | etot = -14.6249037422328 -502000 ekin = 0.481887975237045 | erot = 0.278401857022953 | epot = -15.3851935745487 | etot = -14.6249037422887 -503000 ekin = 0.504836001699661 | erot = 0.280562273427077 | epot = -15.4103020175081 | etot = -14.6249037423814 -504000 ekin = 0.527242963720809 | erot = 0.283072520273854 | epot = -15.4352192264968 | etot = -14.6249037425021 -505000 ekin = 0.547444055754969 | erot = 0.285672032586941 | epot = -15.4580198309761 | etot = -14.6249037426342 -506000 ekin = 0.563636138783675 | erot = 0.288055811210013 | epot = -15.4765956927492 | etot = -14.6249037427555 -507000 ekin = 0.574166796919079 | erot = 0.289928574131231 | epot = -15.488999113894 | etot = -14.6249037428437 -508000 ekin = 0.57782515130048 | erot = 0.291063326861402 | epot = -15.4937922210432 | etot = -14.6249037428813 -509000 ekin = 0.574066827021413 | erot = 0.291350176078827 | epot = -15.4903207459603 | etot = -14.6249037428601 -510000 ekin = 0.563118031117931 | erot = 0.290823209378486 | epot = -15.4788449832791 | etot = -14.6249037427827 -511000 ekin = 0.545937816053972 | erot = 0.289659846600232 | epot = -15.4605014053163 | etot = -14.6249037426621 -512000 ekin = 0.52405192466186 | erot = 0.2881539193295 | epot = -15.4371095865088 | etot = -14.6249037425175 -513000 ekin = 0.499300074198536 | erot = 0.28667044386956 | epot = -15.4108742604381 | etot = -14.62490374237 -514000 ekin = 0.473556830411034 | erot = 0.285593013544196 | epot = -15.3840535861943 | etot = -14.6249037422391 -515000 ekin = 0.448481344235602 | erot = 0.285274677057636 | epot = -15.3586597634315 | etot = -14.6249037421383 -516000 ekin = 0.425336124988924 | erot = 0.286000471485298 | epot = -15.3362403385491 | etot = -14.6249037420749 -517000 ekin = 0.404895133581714 | erot = 0.287965811661741 | epot = -15.3177646872924 | etot = -14.624903742049 -518000 ekin = 0.387441371960463 | erot = 0.29127124708814 | epot = -15.3036163611039 | etot = -14.6249037420553 -519000 ekin = 0.372839035853544 | erot = 0.295931281214217 | epot = -15.2936740591526 | etot = -14.6249037420848 -520000 ekin = 0.360656186943702 | erot = 0.301893194868378 | epot = -15.2874531239385 | etot = -14.6249037421264 -521000 ekin = 0.350310207444023 | erot = 0.30906098360492 | epot = -15.2842749332187 | etot = -14.6249037421697 -522000 ekin = 0.341208800540165 | erot = 0.317319408449295 | epot = -15.2834319511959 | etot = -14.6249037422064 -523000 ekin = 0.332862997937259 | erot = 0.326553653087547 | epot = -15.2843203932564 | etot = -14.6249037422316 -524000 ekin = 0.324955020060425 | erot = 0.336661144000779 | epot = -15.2865199063054 | etot = -14.6249037422442 -525000 ekin = 0.317352570821777 | erot = 0.347553686772866 | epot = -15.2898099998417 | etot = -14.6249037422471 -526000 ekin = 0.310071537936686 | erot = 0.359150063852697 | epot = -15.2941253440357 | etot = -14.6249037422464 -527000 ekin = 0.30319969763028 | erot = 0.371361343284829 | epot = -15.2994647831646 | etot = -14.6249037422495 -528000 ekin = 0.296802852838071 | erot = 0.384072970478812 | epot = -15.3057795655796 | etot = -14.6249037422627 -529000 ekin = 0.290839689447108 | erot = 0.397128838352017 | epot = -15.3128722700896 | etot = -14.6249037422905 -530000 ekin = 0.285110822260319 | erot = 0.410322608856454 | epot = -15.320337173449 | etot = -14.6249037423323 -531000 ekin = 0.279260366287054 | erot = 0.423400398731268 | epot = -15.3275645074017 | etot = -14.6249037423834 -532000 ekin = 0.272835705905111 | erot = 0.4360765883685 | epot = -15.3338160367088 | etot = -14.6249037424352 -533000 ekin = 0.265395406955148 | erot = 0.448061330488109 | epot = -15.3383604799197 | etot = -14.6249037424764 -534000 ekin = 0.256640351799918 | erot = 0.459095045026538 | epot = -15.3406391393234 | etot = -14.6249037424969 -535000 ekin = 0.246533633694114 | erot = 0.46898274217995 | epot = -15.3404201183641 | etot = -14.62490374249 -536000 ekin = 0.235373881374739 | erot = 0.477620282695672 | epot = -15.3378979065248 | etot = -14.6249037424544 -537000 ekin = 0.223795203401919 | erot = 0.485006039595133 | epot = -15.3337049853922 | etot = -14.6249037423951 -538000 ekin = 0.212682661997928 | erot = 0.491234540507361 | epot = -15.3288209448297 | etot = -14.6249037423244 -539000 ekin = 0.203011536568405 | erot = 0.496472671627705 | epot = -15.3243879504539 | etot = -14.6249037422578 -540000 ekin = 0.195638496926135 | erot = 0.50092291227584 | epot = -15.3214651514142 | etot = -14.6249037422123 -541000 ekin = 0.191090437374276 | erot = 0.504781043299091 | epot = -15.3207752228744 | etot = -14.624903742201 -542000 ekin = 0.189407567632742 | erot = 0.508197267609352 | epot = -15.3225085774713 | etot = -14.6249037422292 -543000 ekin = 0.190094034781292 | erot = 0.511249275630852 | epot = -15.326247052704 | etot = -14.6249037422918 -544000 ekin = 0.192205662500225 | erot = 0.513933300995961 | epot = -15.3310427058708 | etot = -14.6249037423746 -545000 ekin = 0.194562943958487 | erot = 0.516174993404676 | epot = -15.3356416798199 | etot = -14.6249037424567 -546000 ekin = 0.196033343259802 | erot = 0.517857026727554 | epot = -15.3387941125054 | etot = -14.624903742518 -547000 ekin = 0.19580143908636 | erot = 0.518856237019682 | epot = -15.3395614186506 | etot = -14.6249037425445 -548000 ekin = 0.193552178457268 | erot = 0.519081068513129 | epot = -15.3375369895014 | etot = -14.624903742531 -549000 ekin = 0.189527872077315 | erot = 0.518500763845738 | epot = -15.332932378404 | etot = -14.6249037424809 -550000 ekin = 0.184464697192282 | erot = 0.517160608017039 | epot = -15.3265290476137 | etot = -14.6249037424044 -551000 ekin = 0.179447519613205 | erot = 0.515181377054168 | epot = -15.3195326389812 | etot = -14.6249037423139 -552000 ekin = 0.175731062294521 | erot = 0.512744588095886 | epot = -15.3133793926124 | etot = -14.624903742222 -553000 ekin = 0.174564310045835 | erot = 0.510067400325703 | epot = -15.3095354525117 | etot = -14.6249037421402 -554000 ekin = 0.177036897100683 | erot = 0.507372062614515 | epot = -15.309312701793 | etot = -14.6249037420778 -555000 ekin = 0.183953653121175 | erot = 0.504855061241007 | epot = -15.3137124564046 | etot = -14.6249037420424 -556000 ekin = 0.195740677803854 | erot = 0.502660902829331 | epot = -15.3233053226717 | etot = -14.6249037420385 -557000 ekin = 0.212389174813147 | erot = 0.500864749566708 | epot = -15.338157666447 | etot = -14.6249037420672 -558000 ekin = 0.23344502097276 | erot = 0.499466731744655 | epot = -15.357815494843 | etot = -14.6249037421256 -559000 ekin = 0.258048678277938 | erot = 0.498398734230019 | epot = -15.3813511547153 | etot = -14.6249037422074 -560000 ekin = 0.285022157939512 | erot = 0.49754195086514 | epot = -15.4074678511078 | etot = -14.6249037423032 -561000 ekin = 0.312990622171654 | erot = 0.496751658909336 | epot = -15.4346460234837 | etot = -14.6249037424027 -562000 ekin = 0.340519848729776 | erot = 0.495884310853372 | epot = -15.4613079020793 | etot = -14.6249037424961 -563000 ekin = 0.366249237356 | erot = 0.494821962716246 | epot = -15.4859749426474 | etot = -14.6249037425751 -564000 ekin = 0.389003340228442 | erot = 0.493490109026911 | epot = -15.5073971918898 | etot = -14.6249037426344 -565000 ekin = 0.407871381975258 | erot = 0.491866632343677 | epot = -15.5246417569902 | etot = -14.6249037426713 -566000 ekin = 0.422251605412405 | erot = 0.489981232304148 | epot = -15.537136580402 | etot = -14.6249037426854 -567000 ekin = 0.431863045464181 | erot = 0.48790647095657 | epot = -15.5446732590993 | etot = -14.6249037426785 -568000 ekin = 0.436733840917554 | erot = 0.485743252286935 | epot = -15.5473808358579 | etot = -14.6249037426534 -569000 ekin = 0.437172173178126 | erot = 0.483603786385869 | epot = -15.5456797021773 | etot = -14.6249037426133 -570000 ekin = 0.433727138645419 | erot = 0.481595978794116 | epot = -15.5402268600013 | etot = -14.6249037425617 -571000 ekin = 0.427141808143026 | erot = 0.479812578148763 | epot = -15.5318581287941 | etot = -14.6249037425023 -572000 ekin = 0.418294466660563 | erot = 0.478326721684033 | epot = -15.5215249307844 | etot = -14.6249037424398 -573000 ekin = 0.408121101334992 | erot = 0.477193277920611 | epot = -15.5102181216358 | etot = -14.6249037423802 -574000 ekin = 0.397514818217457 | erot = 0.476453234967311 | epot = -15.4988717955158 | etot = -14.6249037423311 -575000 ekin = 0.387207144489171 | erot = 0.476137354470425 | epot = -15.4882482412599 | etot = -14.6249037423003 -576000 ekin = 0.377649119217314 | erot = 0.476266044933562 | epot = -15.4788189064453 | etot = -14.6249037422944 -577000 ekin = 0.368920817132226 | erot = 0.476844730976786 | epot = -15.4706692904254 | etot = -14.6249037423164 -578000 ekin = 0.360700785230741 | erot = 0.477856883134822 | epot = -15.4634614107288 | etot = -14.6249037423632 -579000 ekin = 0.352319179858308 | erot = 0.479258927577157 | epot = -15.4564818498611 | etot = -14.6249037424256 -580000 ekin = 0.342901425190187 | erot = 0.480981430412776 | epot = -15.4487865980922 | etot = -14.6249037424893 -581000 ekin = 0.331586894252575 | erot = 0.482939076923953 | epot = -15.4394297137127 | etot = -14.6249037425362 -582000 ekin = 0.317784488003998 | erot = 0.485048781539638 | epot = -15.4277370120932 | etot = -14.6249037425495 -583000 ekin = 0.301409490236239 | erot = 0.487252029394849 | epot = -15.4135652621486 | etot = -14.6249037425175 -584000 ekin = 0.283039202393957 | erot = 0.489535511256142 | epot = -15.3974784560878 | etot = -14.6249037424377 -585000 ekin = 0.263933313487419 | erot = 0.491944128120081 | epot = -15.380781183926 | etot = -14.6249037423185 -586000 ekin = 0.245890887800433 | erot = 0.494582820571413 | epot = -15.3653774505512 | etot = -14.6249037421793 -587000 ekin = 0.230956405620081 | erot = 0.497607010278675 | epot = -15.3534671579451 | etot = -14.6249037420464 -588000 ekin = 0.221033841917523 | erot = 0.501205839010948 | epot = -15.3471434228734 | etot = -14.624903741945 -589000 ekin = 0.21750442850326 | erot = 0.505584588308524 | epot = -15.3479927587061 | etot = -14.6249037418943 -590000 ekin = 0.220953423088753 | erot = 0.510952138426249 | epot = -15.3568093034155 | etot = -14.6249037419005 -591000 ekin = 0.231083134064746 | erot = 0.517515644130575 | epot = -15.3735025201508 | etot = -14.6249037419554 -592000 ekin = 0.246829245753635 | erot = 0.525479282587494 | epot = -15.3972122703833 | etot = -14.6249037420422 -593000 ekin = 0.26662894973047 | erot = 0.535039778666637 | epot = -15.4265724705377 | etot = -14.6249037421406 -594000 ekin = 0.288743434935807 | erot = 0.546371032865614 | epot = -15.4600182100362 | etot = -14.6249037422348 -595000 ekin = 0.311533695301779 | erot = 0.559594229359546 | epot = -15.4960316669788 | etot = -14.6249037423175 -596000 ekin = 0.3336243482615 | erot = 0.574736425374656 | epot = -15.5332645160253 | etot = -14.6249037423892 -597000 ekin = 0.353943370598348 | erot = 0.591686591895555 | epot = -15.57053370495 | etot = -14.6249037424561 -598000 ekin = 0.371670846224556 | erot = 0.610160828224063 | epot = -15.6067354169738 | etot = -14.6249037425252 -599000 ekin = 0.386151688530433 | erot = 0.629687420924883 | epot = -15.6407428520557 | etot = -14.6249037426004 -600000 ekin = 0.396824670884606 | erot = 0.649618644309941 | epot = -15.6713470578748 | etot = -14.6249037426803 -601000 ekin = 0.403202067553919 | erot = 0.669171693345246 | epot = -15.6972775036573 | etot = -14.6249037427582 -602000 ekin = 0.40490852829975 | erot = 0.687495721385519 | epot = -15.7173079925082 | etot = -14.6249037428229 -603000 ekin = 0.401765041348506 | erot = 0.703757265562631 | epot = -15.7304260497733 | etot = -14.6249037428622 -604000 ekin = 0.393886240081525 | erot = 0.717231476889702 | epot = -15.7360214598372 | etot = -14.624903742866 -605000 ekin = 0.38175038495462 | erot = 0.727382711583425 | epot = -15.7340368393683 | etot = -14.6249037428302 -606000 ekin = 0.366205114566941 | erot = 0.733917584160155 | epot = -15.725026441486 | etot = -14.6249037427589 -607000 ekin = 0.348389460814908 | erot = 0.736798185090599 | epot = -15.7100913885695 | etot = -14.624903742664 -608000 ekin = 0.329579787369096 | erot = 0.736212623478789 | epot = -15.6906961534101 | etot = -14.6249037425622 -609000 ekin = 0.310994196071395 | erot = 0.73251127479451 | epot = -15.6684092133368 | etot = -14.6249037424709 -610000 ekin = 0.293604835884145 | erot = 0.726125549058765 | epot = -15.6446341273466 | etot = -14.6249037424037 -611000 ekin = 0.278004208601941 | erot = 0.717488389875027 | epot = -15.620396340845 | etot = -14.624903742368 -612000 ekin = 0.264353214552908 | erot = 0.706972008379807 | epot = -15.5962289652964 | etot = -14.6249037423637 -613000 ekin = 0.252415280668165 | erot = 0.694851301360494 | epot = -15.5721703244133 | etot = -14.6249037423847 -614000 ekin = 0.241662201716805 | erot = 0.681294462599433 | epot = -15.5478604067365 | etot = -14.6249037424203 -615000 ekin = 0.231427318529322 | erot = 0.666377599992121 | epot = -15.5227086609789 | etot = -14.6249037424574 -616000 ekin = 0.221078258759027 | erot = 0.650117838829056 | epot = -15.4960998400712 | etot = -14.6249037424831 -617000 ekin = 0.210180390467373 | erot = 0.632518274251274 | epot = -15.4676024072048 | etot = -14.6249037424862 -618000 ekin = 0.19862150965634 | erot = 0.61361713210071 | epot = -15.437142384217 | etot = -14.6249037424599 -619000 ekin = 0.186670442213662 | erot = 0.593532504056955 | epot = -15.4051066886746 | etot = -14.6249037424039 -620000 ekin = 0.174951539061879 | erot = 0.572493952083693 | epot = -15.3723492334697 | etot = -14.6249037423241 -621000 ekin = 0.164335257152339 | erot = 0.550854196820419 | epot = -15.3400931962051 | etot = -14.6249037422323 -622000 ekin = 0.15576803968181 | erot = 0.529078173717942 | epot = -15.3097499555427 | etot = -14.6249037421429 -623000 ekin = 0.150083571178598 | erot = 0.507711807337566 | epot = -15.2826991205848 | etot = -14.6249037420687 -624000 ekin = 0.147843467415458 | erot = 0.487337070698791 | epot = -15.2600842801331 | etot = -14.6249037420188 -625000 ekin = 0.149245521580975 | erot = 0.468521842126362 | epot = -15.242671105704 | etot = -14.6249037419967 -626000 ekin = 0.154116108891131 | erot = 0.451772481731462 | epot = -15.2307923326229 | etot = -14.6249037420003 -627000 ekin = 0.161979086426179 | erot = 0.437494698740194 | epot = -15.2243775271902 | etot = -14.6249037420239 -628000 ekin = 0.172174902879175 | erot = 0.425965324893585 | epot = -15.2230439698325 | etot = -14.6249037420598 -629000 ekin = 0.183995029152314 | erot = 0.417314987668265 | epot = -15.2262137589216 | etot = -14.624903742101 -630000 ekin = 0.196798066694665 | erot = 0.411519917956496 | epot = -15.2332217267944 | etot = -14.6249037421432 -631000 ekin = 0.210082131921541 | erot = 0.408400457423892 | epot = -15.2433863315305 | etot = -14.6249037421851 -632000 ekin = 0.223500184825895 | erot = 0.407624312389087 | epot = -15.2560282394437 | etot = -14.6249037422287 -633000 ekin = 0.236818662196578 | erot = 0.408714108140466 | epot = -15.2704365126158 | etot = -14.6249037422787 -634000 ekin = 0.249833574952738 | erot = 0.411060882466515 | epot = -15.2857981997594 | etot = -14.6249037423402 -635000 ekin = 0.262270239999152 | erot = 0.413946987959646 | epot = -15.3011209703752 | etot = -14.6249037424164 -636000 ekin = 0.273700147361468 | erot = 0.416582412016232 | epot = -15.315186301884 | etot = -14.6249037425063 -637000 ekin = 0.283507856899438 | erot = 0.418156955201586 | epot = -15.3265685547044 | etot = -14.6249037426034 -638000 ekin = 0.290930324554196 | erot = 0.417906927432445 | epot = -15.3337409946819 | etot = -14.6249037426952 -639000 ekin = 0.295171730169193 | erot = 0.415189912094696 | epot = -15.3352653850304 | etot = -14.6249037427665 -640000 ekin = 0.29557345321463 | erot = 0.409556450349033 | epot = -15.3300336463655 | etot = -14.6249037428018 -641000 ekin = 0.291798784614145 | erot = 0.400805216305268 | epot = -15.3175077437091 | etot = -14.6249037427896 -642000 ekin = 0.283982821763269 | erot = 0.389009767281603 | epot = -15.2978963317707 | etot = -14.6249037427259 -643000 ekin = 0.272803834295158 | erot = 0.374510198234827 | epot = -15.2722177751453 | etot = -14.6249037426153 -644000 ekin = 0.259451287281963 | erot = 0.35787030323495 | epot = -15.242225332988 | etot = -14.6249037424711 -645000 ekin = 0.24549053850944 | erot = 0.339807577757951 | epot = -15.2102018585798 | etot = -14.6249037423124 -646000 ekin = 0.232646751227162 | erot = 0.321107525182429 | epot = -15.1786580185707 | etot = -14.6249037421611 -647000 ekin = 0.222545810224123 | erot = 0.302534738054695 | epot = -15.1499842903174 | etot = -14.6249037420386 -648000 ekin = 0.216457466201495 | erot = 0.28475201940792 | epot = -15.1261132275715 | etot = -14.624903741962 -649000 ekin = 0.215087078764636 | erot = 0.268256849270223 | epot = -15.1082476699766 | etot = -14.6249037419418 -650000 ekin = 0.218457489209105 | erot = 0.253342374384717 | epot = -15.0967036055721 | etot = -14.6249037419783 -651000 ekin = 0.225910420497396 | erot = 0.240087663214758 | epot = -15.0909018257745 | etot = -14.6249037420624 -652000 ekin = 0.236236377394498 | erot = 0.228379019530553 | epot = -15.0895191391008 | etot = -14.6249037421757 -653000 ekin = 0.247915496411967 | erot = 0.217959688821804 | epot = -15.0907789275281 | etot = -14.6249037422943 -654000 ekin = 0.259425494352017 | erot = 0.20850030571605 | epot = -15.0928295424613 | etot = -14.6249037423932 -655000 ekin = 0.269554558208103 | erot = 0.199677958220037 | epot = -15.0941362588799 | etot = -14.6249037424518 -656000 ekin = 0.277652649608963 | erot = 0.191249336850249 | epot = -15.0938057289172 | etot = -14.624903742458 -657000 ekin = 0.283765747905228 | erot = 0.183104207684344 | epot = -15.0917736980005 | etot = -14.6249037424109 -658000 ekin = 0.288620908153343 | erot = 0.175289536735983 | epot = -15.088814187211 | etot = -14.6249037423216 -659000 ekin = 0.293459924910629 | erot = 0.16800102740562 | epot = -15.0863646945268 | etot = -14.6249037422106 -660000 ekin = 0.299750121924184 | erot = 0.161545913295631 | epot = -15.0861997773238 | etot = -14.624903742104 -661000 ekin = 0.30882794580141 | erot = 0.156286808494636 | epot = -15.0900184963241 | etot = -14.624903742028 -662000 ekin = 0.321550844182293 | erot = 0.152579955314811 | epot = -15.0990345415002 | etot = -14.6249037420031 -663000 ekin = 0.338040404323162 | erot = 0.150721656676881 | epot = -15.1136658030376 | etot = -14.6249037420375 -664000 ekin = 0.35758869637966 | erot = 0.150913925254683 | epot = -15.1334063637598 | etot = -14.6249037421255 -665000 ekin = 0.378766116436051 | erot = 0.153254852725981 | epot = -15.1569247114091 | etot = -14.6249037422471 -666000 ekin = 0.399716130930405 | erot = 0.157752003177184 | epot = -15.1823718764818 | etot = -14.6249037423742 -667000 ekin = 0.418564373573293 | erot = 0.16435019288794 | epot = -15.2078183089394 | etot = -14.6249037424782 -668000 ekin = 0.433827740573583 | erot = 0.172960630437096 | epot = -15.2316921135496 | etot = -14.6249037425389 -669000 ekin = 0.444701001629416 | erot = 0.183478145303361 | epot = -15.2530828894841 | etot = -14.6249037425513 -670000 ekin = 0.451136418415458 | erot = 0.195778468142474 | epot = -15.2718186290843 | etot = -14.6249037425264 -671000 ekin = 0.453701004148267 | erot = 0.209695862329476 | epot = -15.2883006089635 | etot = -14.6249037424858 -672000 ekin = 0.453273827000247 | erot = 0.224990306459319 | epot = -15.3031678759134 | etot = -14.6249037424539 -673000 ekin = 0.450699702660583 | erot = 0.241319095059427 | epot = -15.3169225401685 | etot = -14.6249037424485 -674000 ekin = 0.446523488449384 | erot = 0.258227823779524 | epot = -15.3296550547041 | etot = -14.6249037424752 -675000 ekin = 0.440889624591433 | erot = 0.275170305160563 | epot = -15.3409636722771 | etot = -14.6249037425251 -676000 ekin = 0.43362448115233 | erot = 0.29155830650734 | epot = -15.3500865302388 | etot = -14.6249037425792 -677000 ekin = 0.424453634855728 | erot = 0.306833290384575 | epot = -15.356190667856 | etot = -14.6249037426157 -678000 ekin = 0.413265176464919 | erot = 0.320546114280114 | epot = -15.3587150333616 | etot = -14.6249037426165 -679000 ekin = 0.400321537246337 | erot = 0.33242808876456 | epot = -15.3576533685843 | etot = -14.6249037425734 -680000 ekin = 0.386341988792883 | erot = 0.342437977069693 | epot = -15.3536837083532 | etot = -14.6249037424906 -681000 ekin = 0.372417408218802 | erot = 0.350774050475061 | epot = -15.3480952010793 | etot = -14.6249037423855 -682000 ekin = 0.359769645089127 | erot = 0.357847594355724 | epot = -15.3425209817278 | etot = -14.624903742283 -683000 ekin = 0.349419724484513 | erot = 0.364223142874507 | epot = -15.3385466095678 | etot = -14.6249037422088 -684000 ekin = 0.341867426589617 | erot = 0.370539083006542 | epot = -15.3373102517771 | etot = -14.6249037421809 -685000 ekin = 0.336892967753541 | erot = 0.377427285880855 | epot = -15.3392239958376 | etot = -14.6249037422032 -686000 ekin = 0.333560575457532 | erot = 0.385449795149527 | epot = -15.3439141128706 | etot = -14.6249037422635 -687000 ekin = 0.330440845245698 | erot = 0.395064019975185 | epot = -15.3504086075581 | etot = -14.6249037423373 -688000 ekin = 0.325996654363842 | erot = 0.406617593545993 | epot = -15.3575179903049 | etot = -14.6249037423951 -689000 ekin = 0.31902375237829 | erot = 0.420363991129875 | epot = -15.3642914859202 | etot = -14.6249037424121 -690000 ekin = 0.309020969989285 | erot = 0.436483939358184 | epot = -15.3704086517225 | etot = -14.624903742375 -691000 ekin = 0.296388973949697 | erot = 0.455097572739975 | epot = -15.3763902889758 | etot = -14.6249037422861 -692000 ekin = 0.282408410636572 | erot = 0.476257707732277 | epot = -15.383569860531 | etot = -14.6249037421622 -693000 ekin = 0.26900853085206 | erot = 0.499923033173746 | epot = -15.3938353060564 | etot = -14.6249037420305 -694000 ekin = 0.258387685788816 | erot = 0.525918285140374 | epot = -15.4092097128507 | etot = -14.6249037419215 -695000 ekin = 0.252576275208241 | erot = 0.553894058809539 | epot = -15.4313740758797 | etot = -14.624903741862 -696000 ekin = 0.253038186234903 | erot = 0.583300660396082 | epot = -15.4612425885006 | etot = -14.6249037418696 -697000 ekin = 0.260392018277369 | erot = 0.613388418368354 | epot = -15.4986841785946 | etot = -14.6249037419489 -698000 ekin = 0.274304391463235 | erot = 0.643241879182175 | epot = -15.5424500127355 | etot = -14.6249037420901 -699000 ekin = 0.293570250406476 | erot = 0.671848180608583 | epot = -15.5903221732866 | etot = -14.6249037422715 -700000 ekin = 0.316355070233252 | erot = 0.698191700482076 | epot = -15.6394505131798 | etot = -14.6249037424645 -701000 ekin = 0.340538337282147 | erot = 0.721359481465404 | epot = -15.6868015613873 | etot = -14.6249037426397 -702000 ekin = 0.364075443764542 | erot = 0.740637254693957 | epot = -15.7296164412326 | etot = -14.6249037427741 -703000 ekin = 0.385294321874673 | erot = 0.755576369453691 | epot = -15.7657744341838 | etot = -14.6249037428555 -704000 ekin = 0.403066716719495 | erot = 0.766018576886853 | epot = -15.7939890364902 | etot = -14.6249037428839 -705000 ekin = 0.416833588997526 | erot = 0.772075474099313 | epot = -15.8138128059661 | etot = -14.6249037428693 -706000 ekin = 0.426510451502379 | erot = 0.774072055031553 | epot = -15.8254862493606 | etot = -14.6249037428266 -707000 ekin = 0.432328070474044 | erot = 0.772470813769757 | epot = -15.8297026270148 | etot = -14.624903742771 -708000 ekin = 0.434671210546527 | erot = 0.76779427950511 | epot = -15.827369232765 | etot = -14.6249037427133 -709000 ekin = 0.433963855684076 | erot = 0.760560754832016 | epot = -15.8194283531749 | etot = -14.6249037426588 -710000 ekin = 0.430621214402443 | erot = 0.751241421805289 | epot = -15.8067663788153 | etot = -14.6249037426076 -711000 ekin = 0.425061028816158 | erot = 0.740240555545361 | epot = -15.7902053269182 | etot = -14.6249037425567 -712000 ekin = 0.417748693286293 | erot = 0.727895913280463 | epot = -15.7705483490692 | etot = -14.6249037425024 -713000 ekin = 0.409245407745191 | erot = 0.714493617369743 | epot = -15.748642767557 | etot = -14.624903742442 -714000 ekin = 0.400233112896686 | erot = 0.700290376393996 | epot = -15.725427231666 | etot = -14.6249037423753 -715000 ekin = 0.391499218629782 | erot = 0.685535269234813 | epot = -15.7019382301699 | etot = -14.6249037423053 -716000 ekin = 0.38387465328674 | erot = 0.670483824808895 | epot = -15.6792622203343 | etot = -14.6249037422387 -717000 ekin = 0.37812966517224 | erot = 0.655399296057453 | epot = -15.6584327034141 | etot = -14.6249037421844 -718000 ekin = 0.374843116813924 | erot = 0.640539821857324 | epot = -15.6402866808232 | etot = -14.6249037421519 -719000 ekin = 0.374271424141617 | erot = 0.626134666228947 | epot = -15.6253098325198 | etot = -14.6249037421492 -720000 ekin = 0.376249546442333 | erot = 0.612356169201708 | epot = -15.6135094578241 | etot = -14.62490374218 -721000 ekin = 0.38015578315651 | erot = 0.599295758360665 | epot = -15.6043552837594 | etot = -14.6249037422422 -722000 ekin = 0.384962761439327 | erot = 0.586951574250039 | epot = -15.5968180780159 | etot = -14.6249037423266 -723000 ekin = 0.38937982338218 | erot = 0.575232003297926 | epot = -15.5895155690983 | etot = -14.6249037424182 -724000 ekin = 0.392071125784558 | erot = 0.563975606697306 | epot = -15.5809504749809 | etot = -14.6249037424991 -725000 ekin = 0.391913283459399 | erot = 0.552983740178749 | epot = -15.5698007661892 | etot = -14.6249037425511 -726000 ekin = 0.388241956533271 | erot = 0.542058916015903 | epot = -15.5552046151099 | etot = -14.6249037425608 -727000 ekin = 0.381032991792366 | erot = 0.531040454531963 | epot = -15.5369771888461 | etot = -14.6249037425218 -728000 ekin = 0.370971903191828 | erot = 0.519829082375402 | epot = -15.515704728005 | etot = -14.6249037424378 -729000 ekin = 0.359388263612358 | erot = 0.50839572980859 | epot = -15.4926877357432 | etot = -14.6249037423222 -730000 ekin = 0.348057580439132 | erot = 0.496773021024845 | epot = -15.4697343436589 | etot = -14.6249037421949 -731000 ekin = 0.338902689198661 | erot = 0.485032671408036 | epot = -15.4488391026864 | etot = -14.6249037420797 -732000 ekin = 0.333649662944534 | erot = 0.473255762297357 | epot = -15.4318091672407 | etot = -14.6249037419988 -733000 ekin = 0.333505576675517 | erot = 0.461504910073763 | epot = -15.4199142287177 | etot = -14.6249037419685 -734000 ekin = 0.338924758983124 | erot = 0.44980725448349 | epot = -15.4136357554609 | etot = -14.6249037419943 -735000 ekin = 0.34951546857607 | erot = 0.438154711902834 | epot = -15.41257392255 | etot = -14.6249037420711 -736000 ekin = 0.364111355273647 | erot = 0.426523255164468 | epot = -15.4155383526203 | etot = -14.6249037421822 -737000 ekin = 0.38099571977356 | erot = 0.414906900972945 | epot = -15.4208063630506 | etot = -14.6249037423041 -738000 ekin = 0.398229414670415 | erot = 0.403356227833102 | epot = -15.4264893849155 | etot = -14.624903742412 -739000 ekin = 0.414005860072354 | erot = 0.392007798568672 | epot = -15.4309174011272 | etot = -14.6249037424862 -740000 ekin = 0.426948743961824 | erot = 0.381091720704565 | epot = -15.4329442071836 | etot = -14.6249037425172 -741000 ekin = 0.43628364768211 | erot = 0.370910229391996 | epot = -15.4320976195812 | etot = -14.6249037425071 -742000 ekin = 0.44185000182603 | erot = 0.361789064611378 | epot = -15.4285428089066 | etot = -14.6249037424692 -743000 ekin = 0.443963491146499 | erot = 0.354012421291944 | epot = -15.4228796548611 | etot = -14.6249037424227 -744000 ekin = 0.4431781085151 | erot = 0.347758127978473 | epot = -15.4158399788814 | etot = -14.6249037423879 -745000 ekin = 0.440021184884499 | erot = 0.343050543545547 | epot = -15.4079754708096 | etot = -14.6249037423796 -746000 ekin = 0.434779146250304 | erot = 0.339744491074578 | epot = -15.3994273797281 | etot = -14.6249037424032 -747000 ekin = 0.427396883604757 | erot = 0.337545938414333 | epot = -15.3898465644716 | etot = -14.6249037424525 -748000 ekin = 0.417523045840628 | erot = 0.336066252171896 | epot = -15.3784930405232 | etot = -14.6249037425107 -749000 ekin = 0.404692764111473 | erot = 0.334898725161965 | epot = -15.3644952318288 | etot = -14.6249037425554 -750000 ekin = 0.388596287616679 | erot = 0.333700338300972 | epot = -15.3472003684819 | etot = -14.6249037425642 -751000 ekin = 0.369348367994066 | erot = 0.332259621152988 | epot = -15.3265117316703 | etot = -14.6249037425233 -752000 ekin = 0.347662572336739 | erot = 0.330533807750213 | epot = -15.3031001225191 | etot = -14.6249037424322 -753000 ekin = 0.324856373470614 | erot = 0.328645172902147 | epot = -15.2784052886784 | etot = -14.6249037423056 -754000 ekin = 0.302664104351481 | erot = 0.326836116136386 | epot = -15.2544039626582 | etot = -14.6249037421703 -755000 ekin = 0.28289840530598 | erot = 0.325392677389915 | epot = -15.2331948247539 | etot = -14.624903742058 -756000 ekin = 0.267052130149329 | erot = 0.324553861439878 | epot = -15.2165097335856 | etot = -14.6249037419964 -757000 ekin = 0.255952872034472 | erot = 0.324427480977821 | epot = -15.2052840950144 | etot = -14.6249037420021 -758000 ekin = 0.24956686325796 | erot = 0.324931841856735 | epot = -15.1994024471903 | etot = -14.6249037420756 -759000 ekin = 0.247007285742123 | erot = 0.325777353497946 | epot = -15.1976883814417 | etot = -14.6249037422016 -760000 ekin = 0.246749335490671 | erot = 0.326494279609754 | epot = -15.1981473574522 | etot = -14.6249037423518 -761000 ekin = 0.247004464362874 | erot = 0.326503456901681 | epot = -15.1984116637553 | etot = -14.6249037424907 -762000 ekin = 0.246168267683208 | erot = 0.325217160868209 | epot = -15.1962891711361 | etot = -14.6249037425847 -763000 ekin = 0.243236270174742 | erot = 0.322149322885115 | epot = -15.1902893356692 | etot = -14.6249037426093 -764000 ekin = 0.238083572628182 | erot = 0.31701054114686 | epot = -15.1799978563319 | etot = -14.6249037425569 -765000 ekin = 0.231530329806237 | erot = 0.309765883621403 | epot = -15.166199955866 | etot = -14.6249037424384 -766000 ekin = 0.225163449189886 | erot = 0.300642577938324 | epot = -15.1507097694095 | etot = -14.6249037422813 -767000 ekin = 0.220947037641663 | erot = 0.29008793628379 | epot = -15.1359387160491 | etot = -14.6249037421236 -768000 ekin = 0.220714417705789 | erot = 0.278690999515915 | epot = -15.1243091592251 | etot = -14.6249037420034 -769000 ekin = 0.225674230585351 | erot = 0.267090069999984 | epot = -15.1176680425334 | etot = -14.6249037419481 -770000 ekin = 0.23606686040605 | erot = 0.255889903618604 | epot = -15.1168605059919 | etot = -14.6249037419673 -771000 ekin = 0.251070223471186 | erot = 0.245606888556646 | epot = -15.1215808540782 | etot = -14.6249037420504 -772000 ekin = 0.268985032794879 | erot = 0.236650197272996 | epot = -15.1305389722379 | etot = -14.62490374217 -773000 ekin = 0.287649902235825 | erot = 0.229335047808992 | epot = -15.1418886923345 | etot = -14.6249037422897 -774000 ekin = 0.304971347443094 | erot = 0.223914516380436 | epot = -15.1537896061991 | etot = -14.6249037423756 -775000 ekin = 0.319422560280909 | erot = 0.220611402281974 | epot = -15.1649377049681 | etot = -14.6249037424052 -776000 ekin = 0.330375903028573 | erot = 0.21963284072128 | epot = -15.1749124861238 | etot = -14.624903742374 -777000 ekin = 0.338182326480891 | erot = 0.221157252264285 | epot = -15.184243321042 | etot = -14.6249037422968 -778000 ekin = 0.343980993504904 | erot = 0.225293639771365 | epot = -15.1941783754794 | etot = -14.6249037422032 -779000 ekin = 0.349294202147107 | erot = 0.232023926336935 | epot = -15.2062218706133 | etot = -14.6249037421292 -780000 ekin = 0.355517983707508 | erot = 0.241146781674954 | epot = -15.2215685074899 | etot = -14.6249037421074 -781000 ekin = 0.363445847501857 | erot = 0.252244149939742 | epot = -15.2405937395992 | etot = -14.6249037421576 -782000 ekin = 0.372957766808644 | erot = 0.264688770757683 | epot = -15.2625502798455 | etot = -14.6249037422792 -783000 ekin = 0.382969267748679 | erot = 0.277702579811651 | epot = -15.2855755900109 | etot = -14.6249037424505 -784000 ekin = 0.391670514066047 | erot = 0.290462881205936 | epot = -15.3070371379042 | etot = -14.6249037426322 -785000 ekin = 0.397003136152503 | erot = 0.30223788282162 | epot = -15.3241447617521 | etot = -14.624903742778 -786000 ekin = 0.397244540913489 | erot = 0.312520082334536 | epot = -15.3346683660962 | etot = -14.6249037428482 -787000 ekin = 0.391525061079608 | erot = 0.321121025638165 | epot = -15.3375498295401 | etot = -14.6249037428223 -788000 ekin = 0.380116514494719 | erot = 0.328198366843703 | epot = -15.3332186240439 | etot = -14.6249037427055 -789000 ekin = 0.364402868103514 | erot = 0.334204933642789 | epot = -15.3235115442733 | etot = -14.624903742527 -790000 ekin = 0.34654788283668 | erot = 0.339772664563971 | epot = -15.3112242897311 | etot = -14.6249037423304 -791000 ekin = 0.328969533927298 | erot = 0.345562661329334 | epot = -15.2994359374173 | etot = -14.6249037421606 -792000 ekin = 0.313783234687856 | erot = 0.352120250332508 | epot = -15.2908072270725 | etot = -14.6249037420521 -793000 ekin = 0.302371973145943 | erot = 0.359769001652795 | epot = -15.2870447168187 | etot = -14.6249037420199 -794000 ekin = 0.295192752069597 | erot = 0.368565036951676 | epot = -15.288661531079 | etot = -14.6249037420577 -795000 ekin = 0.291854072001344 | erot = 0.378316728406861 | epot = -15.2950745425493 | etot = -14.6249037421411 -796000 ekin = 0.291420477240303 | erot = 0.388659220599258 | epot = -15.3049834400759 | etot = -14.6249037422364 -797000 ekin = 0.292835767593939 | erot = 0.39916067791523 | epot = -15.3169001878199 | etot = -14.6249037423108 -798000 ekin = 0.295321690654866 | erot = 0.409429919731993 | epot = -15.329655352731 | etot = -14.6249037423441 -799000 ekin = 0.298615606685225 | erot = 0.41919526946406 | epot = -15.3427146184839 | etot = -14.6249037423347 -800000 ekin = 0.302963113078809 | erot = 0.428333265393227 | epot = -15.3562001207724 | etot = -14.6249037423004 -801000 ekin = 0.30886980741851 | erot = 0.436842111958024 | epot = -15.3706156616477 | etot = -14.6249037422712 -802000 ekin = 0.316711643345927 | erot = 0.444773620895207 | epot = -15.3863890065174 | etot = -14.6249037422763 -803000 ekin = 0.326365730601817 | erot = 0.452151664704948 | epot = -15.4034211376386 | etot = -14.6249037423318 -804000 ekin = 0.337019280357668 | erot = 0.458909057451191 | epot = -15.4208320802431 | etot = -14.6249037424342 -805000 ekin = 0.347244531512514 | erot = 0.464865921885975 | epot = -15.4370141959586 | etot = -14.6249037425601 -806000 ekin = 0.355321558015248 | erot = 0.469755825323994 | epot = -15.4499811260149 | etot = -14.6249037426756 -807000 ekin = 0.359699244804389 | erot = 0.47328839989947 | epot = -15.4578913874509 | etot = -14.624903742747 -808000 ekin = 0.359442919436746 | erot = 0.475225772200574 | epot = -15.4595724343886 | etot = -14.6249037427513 -809000 ekin = 0.354532149710961 | erot = 0.475448148012512 | epot = -15.454884040406 | etot = -14.6249037426825 -810000 ekin = 0.345927121515436 | erot = 0.473990365430211 | epot = -15.4448212294985 | etot = -14.6249037425528 -811000 ekin = 0.335391497319453 | erot = 0.471042355239708 | epot = -15.4313375949476 | etot = -14.6249037423884 -812000 ekin = 0.325122479809057 | erot = 0.466917662639856 | epot = -15.416943884672 | etot = -14.6249037422231 -813000 ekin = 0.31728183261798 | erot = 0.462001954840949 | epot = -15.4041875295485 | etot = -14.6249037420896 -814000 ekin = 0.313538689250887 | erot = 0.456696276151244 | epot = -15.3951387074148 | etot = -14.6249037420127 -815000 ekin = 0.314725301426621 | erot = 0.451368238943233 | epot = -15.3909972823742 | etot = -14.6249037420043 -816000 ekin = 0.320674745952002 | erot = 0.446320054204494 | epot = -15.3918985422185 | etot = -14.624903742062 -817000 ekin = 0.330264402529528 | erot = 0.441777145069773 | epot = -15.3969452897695 | etot = -14.6249037421702 -818000 ekin = 0.341643112115936 | erot = 0.437896324121525 | epot = -15.404443178542 | etot = -14.6249037423045 -819000 ekin = 0.352584467965967 | erot = 0.43478868897098 | epot = -15.4122768993742 | etot = -14.6249037424372 -820000 ekin = 0.360890006680921 | erot = 0.432549774286878 | epot = -15.4183435235106 | etot = -14.6249037425428 -821000 ekin = 0.364764924967774 | erot = 0.431288293594747 | epot = -15.4209569611646 | etot = -14.624903742602 -822000 ekin = 0.36310132304895 | erot = 0.431144612410167 | epot = -15.419149678065 | etot = -14.6249037426059 -823000 ekin = 0.355627506072524 | erot = 0.432293079211457 | epot = -15.4128243278395 | etot = -14.6249037425555 -824000 ekin = 0.342909508000251 | erot = 0.43492611819946 | epot = -15.4027393686613 | etot = -14.6249037424616 -825000 ekin = 0.326218347991422 | erot = 0.439222871855163 | epot = -15.3903449621884 | etot = -14.6249037423418 -826000 ekin = 0.307298067027383 | erot = 0.445309293137298 | epot = -15.3775111023813 | etot = -14.6249037422166 -827000 ekin = 0.288081469810276 | erot = 0.453218819733682 | epot = -15.3662040316499 | etot = -14.6249037421059 -828000 ekin = 0.270403517644502 | erot = 0.462862712071626 | epot = -15.358169971742 | etot = -14.6249037420259 -829000 ekin = 0.255756724313645 | erot = 0.474017347276416 | epot = -15.354677813577 | etot = -14.624903741987 -830000 ekin = 0.245120383539843 | erot = 0.486332016594477 | epot = -15.3563561421264 | etot = -14.6249037419921 -831000 ekin = 0.238883956789448 | erot = 0.499357971990473 | epot = -15.3631456708169 | etot = -14.624903742037 -832000 ekin = 0.236868645662797 | erot = 0.512595315428093 | epot = -15.3743677032021 | etot = -14.6249037421112 -833000 ekin = 0.238435989568506 | erot = 0.525550909043033 | epot = -15.3888906408115 | etot = -14.6249037421999 -834000 ekin = 0.242658569127625 | erot = 0.537797737790879 | epot = -15.405360049206 | etot = -14.6249037422875 -835000 ekin = 0.248518315375854 | erot = 0.549024910270133 | epot = -15.4224469680061 | etot = -14.6249037423601 -836000 ekin = 0.255095050222772 | erot = 0.559068449138662 | epot = -15.4390672417693 | etot = -14.6249037424078 -837000 ekin = 0.261712817640357 | erot = 0.567916383628495 | epot = -15.4545329436954 | etot = -14.6249037424265 -838000 ekin = 0.268023056778553 | erot = 0.575686784519793 | epot = -15.4686135837165 | etot = -14.6249037424181 -839000 ekin = 0.27401827032314 | erot = 0.582582979367263 | epot = -15.4815049920797 | etot = -14.6249037423893 -840000 ekin = 0.279983100774025 | erot = 0.588834754839967 | epot = -15.4937215979637 | etot = -14.6249037423497 -841000 ekin = 0.286398274628728 | erot = 0.59463702433131 | epot = -15.5059390412703 | etot = -14.6249037423103 -842000 ekin = 0.293816650983536 | erot = 0.600098453281003 | epot = -15.5188188465462 | etot = -14.6249037422817 -843000 ekin = 0.302726774569486 | erot = 0.605208920749049 | epot = -15.5328394375911 | etot = -14.6249037422726 -844000 ekin = 0.313421069061172 | erot = 0.609833296485301 | epot = -15.5481581078353 | etot = -14.6249037422889 -845000 ekin = 0.325887895394733 | erot = 0.613733577818912 | epot = -15.5645252155452 | etot = -14.6249037423315 -846000 ekin = 0.339752400962196 | erot = 0.616615984720894 | epot = -15.5812721280789 | etot = -14.6249037423958 -847000 ekin = 0.354292335348444 | erot = 0.61819407953295 | epot = -15.5973901573525 | etot = -14.6249037424711 -848000 ekin = 0.368542667423182 | erot = 0.618254639142345 | epot = -15.6117010491079 | etot = -14.6249037425423 -849000 ekin = 0.381474241843926 | erot = 0.616711095273524 | epot = -15.6230890797115 | etot = -14.6249037425941 -850000 ekin = 0.392198266661771 | erot = 0.613631554979492 | epot = -15.6307335642567 | etot = -14.6249037426155 -851000 ekin = 0.40012936773711 | erot = 0.609234588535909 | epot = -15.6342676988772 | etot = -14.6249037426042 -852000 ekin = 0.405049998797733 | erot = 0.603854451146916 | epot = -15.633808192512 | etot = -14.6249037425674 -853000 ekin = 0.407056563941561 | erot = 0.597885334648249 | epot = -15.6298456411086 | etot = -14.6249037425187 -854000 ekin = 0.406415158938748 | erot = 0.591718979210661 | epot = -15.6230378806227 | etot = -14.6249037424733 -855000 ekin = 0.403390043512858 | erot = 0.585690332509252 | epot = -15.6139841184645 | etot = -14.6249037424423 -856000 ekin = 0.398116166002726 | erot = 0.580042463525136 | epot = -15.6030623719571 | etot = -14.6249037424293 -857000 ekin = 0.390568016159967 | erot = 0.574915889724967 | epot = -15.5903876483136 | etot = -14.6249037424286 -858000 ekin = 0.380638245096081 | erot = 0.570361176880736 | epot = -15.5759031644054 | etot = -14.6249037424286 -859000 ekin = 0.368297168914653 | erot = 0.566367903415377 | epot = -15.5595688147452 | etot = -14.6249037424151 -860000 ekin = 0.353771484486348 | erot = 0.56289933566704 | epot = -15.5415745625316 | etot = -14.6249037423782 -861000 ekin = 0.337668189076058 | erot = 0.55992119051608 | epot = -15.522493121908 | etot = -14.6249037423159 -862000 ekin = 0.320982687534733 | erot = 0.55741511441171 | epot = -15.5033015441828 | etot = -14.6249037422364 -863000 ekin = 0.304965814691443 | erot = 0.555372641472256 | epot = -15.4852421983211 | etot = -14.6249037421574 -864000 ekin = 0.290872653003623 | erot = 0.553772082573975 | epot = -15.4695484776774 | etot = -14.6249037420998 -865000 ekin = 0.279660774249956 | erot = 0.552546988655193 | epot = -15.4571115049878 | etot = -14.6249037420826 -866000 ekin = 0.271730646599716 | erot = 0.551558423386406 | epot = -15.448192812101 | etot = -14.6249037421149 -867000 ekin = 0.266795961580917 | erot = 0.550582916186157 | epot = -15.44228261996 | etot = -14.624903742193 -868000 ekin = 0.263936467175858 | erot = 0.549323573880104 | epot = -15.4381637833559 | etot = -14.6249037422999 -869000 ekin = 0.261831470221839 | erot = 0.547444696243376 | epot = -15.4341799088748 | etot = -14.6249037424095 -870000 ekin = 0.259116433169107 | erot = 0.544622620095519 | epot = -15.4286427957584 | etot = -14.6249037424938 -871000 ekin = 0.25476611341807 | erot = 0.540599894777859 | epot = -15.4202697507262 | etot = -14.6249037425303 -872000 ekin = 0.248397230690975 | erot = 0.535228153627688 | epot = -15.4085291268279 | etot = -14.6249037425092 -873000 ekin = 0.240403953825284 | erot = 0.528487826572668 | epot = -15.3937955228335 | etot = -14.6249037424356 -874000 ekin = 0.23188412578265 | erot = 0.52047931782111 | epot = -15.3772671859324 | etot = -14.6249037423286 -875000 ekin = 0.224371090312889 | erot = 0.51138848970078 | epot = -15.3606633222303 | etot = -14.6249037422166 -876000 ekin = 0.219440883379249 | erot = 0.501436812694071 | epot = -15.3457814382023 | etot = -14.624903742129 -877000 ekin = 0.218302972735591 | erot = 0.490831150818216 | epot = -15.3340378656416 | etot = -14.6249037420878 -878000 ekin = 0.221492456262699 | erot = 0.479728387736622 | epot = -15.3261245861005 | etot = -14.6249037421012 -879000 ekin = 0.228756262274367 | erot = 0.468225594693664 | epot = -15.3218855991281 | etot = -14.6249037421601 -880000 ekin = 0.239169160088235 | erot = 0.456378166082075 | epot = -15.3204510684122 | etot = -14.6249037422419 -881000 ekin = 0.251443176614178 | erot = 0.444238659512956 | epot = -15.3205855784449 | etot = -14.6249037423178 -882000 ekin = 0.264330844663498 | erot = 0.431901289695958 | epot = -15.3211358767212 | etot = -14.6249037423617 -883000 ekin = 0.276992343361542 | erot = 0.419534292632451 | epot = -15.3214303783535 | etot = -14.6249037423595 -884000 ekin = 0.289210952362652 | erot = 0.407386172192625 | epot = -15.321500866868 | etot = -14.6249037423127 -885000 ekin = 0.301394205510712 | erot = 0.395760928443729 | epot = -15.3220588761924 | etot = -14.6249037422379 -886000 ekin = 0.314368599205627 | erot = 0.384968165379708 | epot = -15.3242405067466 | etot = -14.6249037421612 -887000 ekin = 0.329038341775269 | erot = 0.375262338090432 | epot = -15.3292044219761 | etot = -14.6249037421104 -888000 ekin = 0.3460151111552 | erot = 0.366788650327974 | epot = -15.337707503589 | etot = -14.6249037421058 -889000 ekin = 0.365329693883301 | erot = 0.359550947377142 | epot = -15.3497843834163 | etot = -14.6249037421559 -890000 ekin = 0.386310696217007 | erot = 0.353410826837943 | epot = -15.364625265308 | etot = -14.6249037422531 -891000 ekin = 0.40766808705505 | erot = 0.348119126036606 | epot = -15.3806909554677 | etot = -14.624903742376 -892000 ekin = 0.427761236103282 | erot = 0.343372786941987 | epot = -15.3960377655415 | etot = -14.6249037424963 -893000 ekin = 0.444977236019449 | erot = 0.33888352569265 | epot = -15.4087645042971 | etot = -14.624903742585 -894000 ekin = 0.458112158680458 | erot = 0.334441343917185 | epot = -15.4174572452192 | etot = -14.6249037426215 -895000 ekin = 0.466648008331883 | erot = 0.329956933565113 | epot = -15.4215086844963 | etot = -14.6249037425993 -896000 ekin = 0.470850232519732 | erot = 0.325472374552551 | epot = -15.4212263495988 | etot = -14.6249037425265 -897000 ekin = 0.471664510488006 | erot = 0.321137893833118 | epot = -15.4177061467451 | etot = -14.624903742424 -898000 ekin = 0.470447771985807 | erot = 0.317161282107798 | epot = -15.4125127964124 | etot = -14.6249037423188 -899000 ekin = 0.468609320535655 | erot = 0.313743247831532 | epot = -15.407256310605 | etot = -14.6249037422378 -900000 ekin = 0.467255363896805 | erot = 0.311015004595507 | epot = -15.403174110693 | etot = -14.6249037422007 -901000 ekin = 0.466923299456955 | erot = 0.308993431077898 | epot = -15.4008204727509 | etot = -14.624903742216 -902000 ekin = 0.467466399705958 | erot = 0.307564919774008 | epot = -15.3999350617591 | etot = -14.6249037422791 -903000 ekin = 0.468112799245358 | erot = 0.306502589385531 | epot = -15.3995191310034 | etot = -14.6249037423725 -904000 ekin = 0.467682260080958 | erot = 0.305513914729679 | epot = -15.398099917282 | etot = -14.6249037424714 -905000 ekin = 0.464906903208091 | erot = 0.304308207539486 | epot = -15.3941188532968 | etot = -14.6249037425492 -906000 ekin = 0.458775313350218 | erot = 0.302667437698602 | epot = -15.386346493633 | etot = -14.6249037425842 -907000 ekin = 0.448811106797068 | erot = 0.300501710925682 | epot = -15.3742165602888 | etot = -14.624903742566 -908000 ekin = 0.435212888278286 | erot = 0.297873922704326 | epot = -15.3579905534802 | etot = -14.6249037424976 -909000 ekin = 0.418821166578994 | erot = 0.294986492955548 | epot = -15.338711401929 | etot = -14.6249037423944 -910000 ekin = 0.400928155652122 | erot = 0.292134043124749 | epot = -15.3179659410565 | etot = -14.6249037422796 -911000 ekin = 0.382990731318649 | erot = 0.289635345607696 | epot = -15.2975298191034 | etot = -14.6249037421771 -912000 ekin = 0.366329155569864 | erot = 0.28776245704618 | epot = -15.2789953547216 | etot = -14.6249037421055 -913000 ekin = 0.351888443631227 | erot = 0.286683662572629 | epot = -15.2634758482788 | etot = -14.624903742075 -914000 ekin = 0.340111462795541 | erot = 0.286431278414487 | epot = -15.2514464832954 | etot = -14.6249037420854 -915000 ekin = 0.330936398540049 | erot = 0.286898247267082 | epot = -15.2427383879356 | etot = -14.6249037421284 -916000 ekin = 0.323899271601486 | erot = 0.287861143478391 | epot = -15.2366641572706 | etot = -14.6249037421907 -917000 ekin = 0.318302399047232 | erot = 0.289022784865087 | epot = -15.2322289261691 | etot = -14.6249037422568 -918000 ekin = 0.313403328231463 | erot = 0.290065205370856 | epot = -15.2283722759152 | etot = -14.6249037423129 -919000 ekin = 0.308582994046901 | erot = 0.290702987753991 | epot = -15.2241897241499 | etot = -14.624903742349 -920000 ekin = 0.303462620954368 | erot = 0.290727692025052 | epot = -15.2190940553399 | etot = -14.6249037423605 -921000 ekin = 0.297952758522196 | erot = 0.290036267627498 | epot = -15.2128927684978 | etot = -14.6249037423481 -922000 ekin = 0.29223232916649 | erot = 0.28863969692327 | epot = -15.2057757684075 | etot = -14.6249037423178 -923000 ekin = 0.286668877937277 | erot = 0.286652137103424 | epot = -15.1982247573193 | etot = -14.6249037422786 -924000 ekin = 0.28170186865761 | erot = 0.28426466875578 | epot = -15.1908702796539 | etot = -14.6249037422405 -925000 ekin = 0.277717553237222 | erot = 0.281710557645316 | epot = -15.1843318530947 | etot = -14.6249037422121 -926000 ekin = 0.274945509178671 | erot = 0.279230091666927 | epot = -15.1790793430443 | etot = -14.6249037421988 -927000 ekin = 0.273402631519431 | erot = 0.277042382113437 | epot = -15.1753487558338 | etot = -14.624903742201 -928000 ekin = 0.272900230271358 | erot = 0.275329232545622 | epot = -15.1731332050314 | etot = -14.6249037422144 -929000 ekin = 0.273115271901108 | erot = 0.274232799537457 | epot = -15.1722518136694 | etot = -14.6249037422308 -930000 ekin = 0.273710515356084 | erot = 0.273865029644295 | epot = -15.1724792872405 | etot = -14.6249037422402 -931000 ekin = 0.274474107140427 | erot = 0.274323617229163 | epot = -15.1737014666035 | etot = -14.6249037422339 -932000 ekin = 0.275440857683932 | erot = 0.275707340217243 | epot = -15.1760519401082 | etot = -14.624903742207 -933000 ekin = 0.276957575782685 | erot = 0.278123705988738 | epot = -15.1799850239326 | etot = -14.6249037421612 -934000 ekin = 0.279664435384645 | erot = 0.281683992543778 | epot = -15.186252170033 | etot = -14.6249037421046 -935000 ekin = 0.284382433297568 | erot = 0.286484503522986 | epot = -15.1957706788719 | etot = -14.6249037420513 -936000 ekin = 0.291920557580458 | erot = 0.292577187598382 | epot = -15.2094014871973 | etot = -14.6249037420184 -937000 ekin = 0.302840159170039 | erot = 0.299936553990847 | epot = -15.2276804551831 | etot = -14.6249037420222 -938000 ekin = 0.317231541763436 | erot = 0.308432066638964 | epot = -15.2505673504756 | etot = -14.6249037420732 -939000 ekin = 0.334562734704465 | erot = 0.317815317270747 | epot = -15.277281794148 | etot = -14.6249037421728 -940000 ekin = 0.35364952180483 | erot = 0.327729086105148 | epot = -15.3062823502215 | etot = -14.6249037423115 -941000 ekin = 0.372770367646405 | erot = 0.337741122003473 | epot = -15.3354152321199 | etot = -14.62490374247 -942000 ekin = 0.389915662531244 | erot = 0.34739974979893 | epot = -15.3622191549524 | etot = -14.6249037426222 -943000 ekin = 0.403126345738701 | erot = 0.356302369933728 | epot = -15.3843324584131 | etot = -14.6249037427407 -944000 ekin = 0.410851754405684 | erot = 0.364163156178504 | epot = -15.3999186533874 | etot = -14.6249037428032 -945000 ekin = 0.41224792095984 | erot = 0.370864511414023 | epot = -15.4080161751712 | etot = -14.6249037427973 -946000 ekin = 0.407348747779498 | erot = 0.376479254456982 | epot = -15.4087317449601 | etot = -14.6249037427236 -947000 ekin = 0.397071124216324 | erot = 0.381256899558077 | epot = -15.4032317663699 | etot = -14.6249037425955 -948000 ekin = 0.38305345572573 | erot = 0.385576026490354 | epot = -15.3935332246524 | etot = -14.6249037424363 -949000 ekin = 0.367364810069699 | erot = 0.389872987608877 | epot = -15.3821415399525 | etot = -14.624903742274 -950000 ekin = 0.352149150210297 | erot = 0.394562514442363 | epot = -15.3716154067876 | etot = -14.6249037421349 -951000 ekin = 0.339280178142264 | erot = 0.399966938640697 | epot = -15.364150858822 | etot = -14.6249037420391 -952000 ekin = 0.330096120378427 | erot = 0.406268489131276 | epot = -15.3612683515059 | etot = -14.6249037419962 -953000 ekin = 0.32526183166892 | erot = 0.413492937870355 | epot = -15.3636585115441 | etot = -14.6249037420048 -954000 ekin = 0.324774911928697 | erot = 0.421526046052984 | epot = -15.3712047000353 | etot = -14.6249037420537 -955000 ekin = 0.328098170458837 | erot = 0.430156858160225 | epot = -15.3831587707443 | etot = -14.6249037421253 -956000 ekin = 0.334370903123397 | erot = 0.439135698167057 | epot = -15.3984103434923 | etot = -14.6249037422019 -957000 ekin = 0.342633913360124 | erot = 0.44823123979963 | epot = -15.4157688954295 | etot = -14.6249037422697 -958000 ekin = 0.352004139469675 | erot = 0.457271615168161 | epot = -15.4341794969606 | etot = -14.6249037423228 -959000 ekin = 0.361755395785515 | erot = 0.466159587644429 | epot = -15.4528187257936 | etot = -14.6249037423637 -960000 ekin = 0.37129634840351 | erot = 0.474860087933521 | epot = -15.4710601787381 | etot = -14.624903742401 -961000 ekin = 0.380073790913227 | erot = 0.483367158176183 | epot = -15.4883446915346 | etot = -14.6249037424452 -962000 ekin = 0.387455548951145 | erot = 0.491663490522134 | epot = -15.5040227819764 | etot = -14.6249037425031 -963000 ekin = 0.392654097313064 | erot = 0.499687295633833 | epot = -15.5172451355218 | etot = -14.6249037425749 -964000 ekin = 0.394737939560465 | erot = 0.507318071997362 | epot = -15.52695975421 | etot = -14.6249037426522 -965000 ekin = 0.392748486468401 | erot = 0.514386334668901 | epot = -15.5320385638565 | etot = -14.6249037427192 -966000 ekin = 0.385905473254046 | erot = 0.520705106529118 | epot = -15.5315143225403 | etot = -14.6249037427571 -967000 ekin = 0.373852021646475 | erot = 0.526114369236053 | epot = -15.5248701336312 | etot = -14.6249037427486 -968000 ekin = 0.356869417136842 | erot = 0.530525868586128 | epot = -15.5122990284073 | etot = -14.6249037426844 -969000 ekin = 0.335986889835165 | erot = 0.533955228285004 | epot = -15.4948458606873 | etot = -14.6249037425671 -970000 ekin = 0.312927788673001 | erot = 0.536531428462375 | epot = -15.4743629595488 | etot = -14.6249037424134 -971000 ekin = 0.289872105907279 | erot = 0.538479668129898 | epot = -15.4532555162884 | etot = -14.6249037422512 -972000 ekin = 0.269070232406882 | erot = 0.5400808983618 | epot = -15.4340548728819 | etot = -14.6249037421133 -973000 ekin = 0.252397022945549 | erot = 0.54161782723096 | epot = -15.4189185922049 | etot = -14.6249037420284 -974000 ekin = 0.240964852822479 | erot = 0.543321042151966 | epot = -15.4091896369876 | etot = -14.6249037420132 -975000 ekin = 0.23490216482404 | erot = 0.545328986458525 | epot = -15.4051348933507 | etot = -14.6249037420682 -976000 ekin = 0.233353466621782 | erot = 0.547671994179659 | epot = -15.4059292029795 | etot = -14.6249037421781 -977000 ekin = 0.234692201089083 | erot = 0.550284513866881 | epot = -15.4098804572724 | etot = -14.6249037423164 -978000 ekin = 0.236887903180263 | erot = 0.553043053342472 | epot = -15.4148346989741 | etot = -14.6249037424514 -979000 ekin = 0.237945797131594 | erot = 0.555821040963433 | epot = -15.4186705806471 | etot = -14.6249037425521 -980000 ekin = 0.236334546963168 | erot = 0.558547250125055 | epot = -15.4197855396823 | etot = -14.6249037425941 -981000 ekin = 0.231322843924042 | erot = 0.561252158432646 | epot = -15.4174787449221 | etot = -14.6249037425654 -982000 ekin = 0.223154169544533 | erot = 0.564087592074629 | epot = -15.4121455040889 | etot = -14.6249037424697 -983000 ekin = 0.213008719539339 | erot = 0.567310103886669 | epot = -15.4052225657532 | etot = -14.6249037423272 -984000 ekin = 0.202740628548441 | erot = 0.571227590062575 | epot = -15.3988719607827 | etot = -14.6249037421716 -985000 ekin = 0.194435665154694 | erot = 0.576119771487871 | epot = -15.3954591786846 | etot = -14.624903742042 -986000 ekin = 0.189894304519126 | erot = 0.58215285815263 | epot = -15.3969509046435 | etot = -14.6249037419717 -987000 ekin = 0.190182835424942 | erot = 0.589313613953793 | epot = -15.4044001913571 | etot = -14.6249037419783 -988000 ekin = 0.195390213187374 | erot = 0.597385005524008 | epot = -15.4176789607685 | etot = -14.6249037420571 -989000 ekin = 0.204671362362343 | erot = 0.605974905403727 | epot = -15.4355500099486 | etot = -14.6249037421825 -990000 ekin = 0.216563394578633 | erot = 0.614593273597528 | epot = -15.4560604104923 | etot = -14.6249037423162 -991000 ekin = 0.229465191861939 | erot = 0.622757127490605 | epot = -15.477126061773 | etot = -14.6249037424204 -992000 ekin = 0.24211427112869 | erot = 0.630092599916922 | epot = -15.4971106135161 | etot = -14.6249037424704 -993000 ekin = 0.253902581479766 | erot = 0.636403793831493 | epot = -15.5152101177725 | etot = -14.6249037424612 -994000 ekin = 0.264939510335544 | erot = 0.641689105047928 | epot = -15.5315323577914 | etot = -14.6249037424079 -995000 ekin = 0.275864888578878 | erot = 0.646102898208469 | epot = -15.5468715291258 | etot = -14.6249037423384 -996000 ekin = 0.287497820769962 | erot = 0.649877086441122 | epot = -15.562278649495 | etot = -14.6249037422839 -997000 ekin = 0.300450307467282 | erot = 0.653227423573226 | epot = -15.578581473309 | etot = -14.6249037422685 -998000 ekin = 0.314829914377661 | erot = 0.656270894957595 | epot = -15.5960045516386 | etot = -14.6249037423033 -999000 ekin = 0.330110494517446 | erot = 0.658973630822486 | epot = -15.613987867725 | etot = -14.6249037423851 -1000000 ekin = 0.345190458651126 | erot = 0.66113833946702 | epot = -15.6312325406162 | etot = -14.624903742498 - 1000000 0.025569664 -1.5839232 0.020799898 -1.5286042 -3.5789082e-06 -Loop time of 17.6535 on 4 procs for 1000000 steps with 10 atoms - -Performance: 48942.073 tau/day, 56645.918 timesteps/s -99.5% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 0.58208 | 6.2309 | 11.391 | 182.5 | 35.30 -Bond | 0.087981 | 0.28429 | 0.45668 | 28.3 | 1.61 -Neigh | 0 | 0 | 0 | 0.0 | 0.00 -Comm | 1.8415 | 2.1564 | 2.4456 | 17.3 | 12.21 -Output | 1.5e-05 | 2.275e-05 | 2.6e-05 | 0.0 | 0.00 -Modify | 0.1751 | 0.91094 | 1.6034 | 60.5 | 5.16 -Other | | 8.071 | | | 45.72 - -Nlocal: 2.5 ave 5.0 max 0.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 -Nghost: 7.5 ave 10.0 max 5.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 -Neighs: 16.0 ave 30.0 max 0.0 min -Histogram: 1 0 1 0 0 0 0 0 1 1 - -Total # of neighbors = 64 -Ave neighs/atom = 6.4 -Ave special neighs/atom = 3.6 -Neighbor list builds = 0 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:17 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.4type b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.4type index a8412eef07..7145f65137 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.4type +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.4type @@ -1,130 +1,132 @@ -# LAMMPS data file +LAMMPS data file via write_data, version 27 May 2021 + 26 atoms -26 ellipsoids -24 bonds - 4 atom types +24 bonds 1 bond types +26 ellipsoids -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms +Masses -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.957432645895970e-01 -3.379920348381733e-01 3.897628551303122e-01 1 1 1 -3 3 -2.192046146198370e-01 -5.585242491865227e-01 7.795257102606244e-01 1 1 1 -4 4 1.335125603737887e-01 -5.849567473090943e-01 1.169288565390937e+00 1 1 1 -5 1 4.398311230978960e-01 -4.081036426625517e-01 1.559051420521249e+00 1 1 1 -6 2 5.932984957350773e-01 -8.942535970570469e-02 1.948814275651561e+00 1 1 1 -7 3 5.405813207414517e-01 2.603302434705350e-01 2.338577130781873e+00 1 1 1 -8 4 3.000000000000002e-01 5.196152422706634e-01 2.728339985912185e+00 1 1 1 -9 1 -4.483805615185452e-02 5.983222783087083e-01 3.118102841042497e+00 1 1 1 -10 2 -3.740938811152403e-01 4.690988894808181e-01 3.507865696172809e+00 1 1 1 -11 3 -5.733436834716847e-01 1.768531046465427e-01 3.897628551303121e+00 1 1 1 -12 4 -5.733436834716849e-01 -1.768531046465427e-01 4.287391406433434e+00 1 1 1 -13 1 -3.740938811152403e-01 -4.690988894808182e-01 4.677154261563746e+00 1 1 1 -14 4 3.740938811152403e-01 4.690988894808182e-01 4.677154261563746e+00 2 1 1 -15 1 5.733436834716849e-01 1.768531046465427e-01 4.287391406433434e+00 2 1 1 -16 2 5.733436834716849e-01 -1.768531046465426e-01 3.897628551303122e+00 2 1 1 -17 3 3.740938811152403e-01 -4.690988894808181e-01 3.507865696172810e+00 2 1 1 -18 4 4.483805615185462e-02 -5.983222783087085e-01 3.118102841042498e+00 2 1 1 -19 1 -3.000000000000003e-01 -5.196152422706636e-01 2.728339985912186e+00 2 1 1 -20 2 -5.405813207414519e-01 -2.603302434705351e-01 2.338577130781874e+00 2 1 1 -21 3 -5.932984957350776e-01 8.942535970570474e-02 1.948814275651561e+00 2 1 1 -22 4 -4.398311230978962e-01 4.081036426625520e-01 1.559051420521249e+00 2 1 1 -23 1 -1.335125603737888e-01 5.849567473090947e-01 1.169288565390937e+00 2 1 1 -24 2 2.192046146198373e-01 5.585242491865231e-01 7.795257102606246e-01 2 1 1 -25 3 4.957432645895974e-01 3.379920348381736e-01 3.897628551303123e-01 2 1 1 -26 4 6.000000000000006e-01 0.000000000000000e+00 1.110223024625157e-16 2 1 1 +1 3.1575 +2 3.1575 +3 3.1575 +4 3.1575 + +Atoms # hybrid + +1 1 -0.5974293795290144 -0.47217734566783476 0.1149860099192362 1 1 3.7269849963023267 0 0 0 +2 2 -0.3607975285447209 -0.8084200276362509 0.5005631273908187 1 1 3.7269849963023267 0 0 0 +3 3 -0.1880165420620915 -0.9339012982528754 0.9372222930006777 1 1 3.7269849963023267 0 0 0 +4 4 0.18789028377909187 -0.8807473585891459 1.3080750447260532 1 1 3.7269849963023267 0 0 0 +5 1 0.46680288593900887 -0.6314504249974493 1.6544618495816525 1 1 3.7269849963023267 0 0 0 +6 2 0.6156490001978658 -0.24344915610488765 1.9998398114466447 1 1 3.7269849963023267 0 0 0 +7 3 0.5475869309223161 0.10633006738807783 2.395688109397028 1 1 3.7269849963023267 0 0 0 +8 4 0.3964561058464781 0.33864915662119616 2.855380256681012 1 1 3.7269849963023267 0 0 0 +9 1 0.09151778690925949 0.33572177117709545 3.2793107140407853 1 1 3.7269849963023267 0 0 0 +10 2 -0.260700239272384 0.23452584272483473 3.622064753017485 1 1 3.7269849963023267 0 0 0 +11 3 -0.44049173083867876 -0.04240311520575983 4.057361772274168 1 1 3.7269849963023267 0 0 0 +12 4 -0.48111471327910416 -0.3913669550617015 4.465217350523367 1 1 3.7269849963023267 0 0 0 +13 1 -0.3029890593292223 -0.6218232516387349 4.889919411438907 1 1 3.7269849963023267 0 0 0 +14 4 0.36538593166250877 0.467104033114044 4.885957202043727 2 1 3.7269849963023267 0 0 0 +15 1 0.5837256243756591 0.1432569770282543 4.587937684834979 2 1 3.7269849963023267 0 0 0 +16 2 0.7270895848434721 -0.21648156960230241 4.19127441749994 2 1 3.7269849963023267 0 0 0 +17 3 0.5694364623788377 -0.5971020505771416 3.7905394408535833 2 1 3.7269849963023267 0 0 0 +18 4 0.32183479629572403 -0.7826674384502239 3.3981789941001397 2 1 3.7269849963023267 0 0 0 +19 1 0.027943077828669855 -0.8173952163019756 2.892497591992246 2 1 3.7269849963023267 0 0 0 +20 2 -0.34389471043742403 -0.6801076538339801 2.6010059142333977 2 1 3.7269849963023267 0 0 0 +21 3 -0.5722337592890715 -0.31543771192866543 2.2496367888009035 2 1 3.7269849963023267 0 0 0 +22 4 -0.5243059431454682 -0.018794840926191582 1.6669602274961965 2 1 3.7269849963023267 0 0 0 +23 1 -0.4467049661654279 0.15318137385858244 1.1669311078565738 2 1 3.7269849963023267 0 0 0 +24 2 -0.04279541944801792 0.24071675674438053 0.7924196804793574 2 1 3.7269849963023267 0 0 0 +25 3 0.33688934798342335 0.1390449738629785 0.42004977704361546 2 1 3.7269849963023267 0 0 0 +26 4 0.5381606093378432 -0.28366941895261566 0.04905784853961178 2 1 3.7269849963023267 0 0 0 -# Atom-ID, translational, rotational velocity Velocities -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -11 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -12 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -13 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -14 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -15 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -16 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -17 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -18 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -19 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -20 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -21 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -22 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -23 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -24 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -25 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -26 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 +1 -0.1420563695014878 -0.2339928257547227 0.1871716305399088 -0.046333854442252194 0.08160574816172744 0.2791824603833533 +2 0.03390382747481304 0.2912921705525512 -0.1828986721885175 0.09422531767061365 -0.044398236946770545 0.011069519340877812 +3 0.05351747745964457 -0.3700026678535097 -0.01469442373794632 0.10875858697088675 0.2373869034785703 0.15028498953263314 +4 0.1107696836820372 0.012571134739153464 0.23554381030898286 0.11411649786729211 -0.23899527406990237 0.11196343804383825 +5 0.21949033826324368 -0.4153000294565104 0.18426481814713022 0.2497206165366295 0.2505624077277829 -0.35347918243093 +6 -0.24019769428878804 -0.16423570219236758 -0.003762466815720382 0.062008045889015595 0.22340307597010978 -0.38223196779931135 +7 0.12372477399377596 0.10393016373901434 0.08008946447311854 -0.15063203100274558 0.08544129561789665 -0.3233996805084572 +8 0.03216353270652909 -0.1291938805451393 0.1736283537356162 -0.17577447248216746 0.11132849782859955 -0.13659117762014125 +9 0.016485625003622013 0.01204732455105311 0.012268845318149781 -0.10829791072979295 0.1325154323216732 0.061321711941405295 +10 -0.10017034720683878 -0.09274368063499111 0.0712704971413183 -0.08539556363371427 -0.10194584018083674 0.12395163271335013 +11 0.1553620769751766 -0.017877616757193807 -0.1679552227127468 -0.11302061465460307 0.10833285249943261 -0.29004856929349787 +12 -0.25308607960176693 0.05651778438229357 -0.28293751231512154 0.08875447438401544 -0.0424858854741496 0.4807657704475166 +13 -0.006525152792083277 0.05278468067247092 0.0923614993309851 -0.17068957621149589 -0.21396827821680875 -0.22336174340467796 +14 -0.09024428084565417 0.19407821508904713 -0.27279958154128003 0.16579397498898726 0.05605196163049078 0.18139063086724955 +15 0.2329539015603435 0.08926675461196792 0.01755751945261716 0.14895763843533014 0.05566424996653055 0.038429304115211504 +16 -0.012766107314323394 -0.05870276075293287 0.22459362070331024 -0.051898555487544795 0.11349183901118838 -0.35625338947479507 +17 -0.20400754456760709 -0.43178141581578006 -0.05213026263746946 -0.16561150375144387 -0.08257869123336893 -0.31368221607714253 +18 0.26408469209202234 0.004101215813165573 -0.11409222616552296 -0.37751548716793587 0.021230702354981583 0.23218952685038605 +19 -0.2811352347889802 0.25474603468997514 0.0038005485218010606 0.2164466860189806 -0.3924452117278991 0.22754829879548555 +20 -0.34129793271588454 0.05074672818229578 -0.03388446943745919 -0.1368254010552013 -0.1547809974693013 -0.03266259795645136 +21 -0.25700758391191114 0.04693154859703793 0.08362546455733241 -0.08661574368141227 -0.030723569920460755 -0.18740437515161282 +22 0.08529314327765061 0.10662056255177826 -0.0742729015142829 -0.4671828719407557 -0.19246067344838313 0.20137866804242557 +23 -0.09337250162399305 -0.1907111010034805 0.19278254253312255 0.017795209772695803 -0.36506106427644847 0.24972052729172167 +24 -0.16063305395742022 0.12278800901705311 0.0513923554335936 -0.09716260028970423 -0.26401680055506943 0.08202659665577536 +25 -0.14736287972598905 0.09699085150412592 -0.20751532907712478 0.05612191742480806 -0.13929212905625324 0.034890079586931765 +26 -0.060417626533246734 0.35551862988152244 -0.19673503245092067 0.014766691426271806 0.02762183997756995 -0.20597323908506235 -# Atom-ID, shape, quaternion -Ellipsoids - -1 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.555728057861408e-01 0.000000000000000e+00 0.000000000000000e+00 2.947551744109042e-01 -3 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 8.262387743159949e-01 0.000000000000000e+00 0.000000000000000e+00 5.633200580636221e-01 -4 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 6.234898018587335e-01 0.000000000000000e+00 0.000000000000000e+00 7.818314824680299e-01 -5 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 3.653410243663950e-01 0.000000000000000e+00 0.000000000000000e+00 9.308737486442042e-01 -6 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 7.473009358642424e-02 0.000000000000000e+00 0.000000000000000e+00 9.972037971811802e-01 -7 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -2.225209339563144e-01 0.000000000000000e+00 0.000000000000000e+00 9.749279121818237e-01 -8 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -5.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 8.660254037844387e-01 -9 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 7.330518718298263e-01 -0.000000000000000e+00 0.000000000000000e+00 -6.801727377709196e-01 -10 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.009688679024190e-01 -0.000000000000000e+00 0.000000000000000e+00 -4.338837391175581e-01 -11 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.888308262251286e-01 -0.000000000000000e+00 0.000000000000000e+00 -1.490422661761745e-01 -12 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.888308262251286e-01 0.000000000000000e+00 0.000000000000000e+00 1.490422661761745e-01 -13 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.009688679024190e-01 0.000000000000000e+00 0.000000000000000e+00 4.338837391175582e-01 -14 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 -4.338837391175582e-01 9.009688679024190e-01 0.000000000000000e+00 -15 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -1.490422661761746e-01 9.888308262251286e-01 0.000000000000000e+00 -16 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 1.490422661761745e-01 9.888308262251286e-01 -0.000000000000000e+00 -17 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 4.338837391175581e-01 9.009688679024190e-01 -0.000000000000000e+00 -18 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 6.801727377709192e-01 7.330518718298267e-01 0.000000000000000e+00 -19 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.660254037844386e-01 5.000000000000001e-01 0.000000000000000e+00 -20 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.749279121818235e-01 2.225209339563145e-01 0.000000000000000e+00 -21 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.972037971811801e-01 -7.473009358642428e-02 0.000000000000000e+00 -22 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.308737486442041e-01 -3.653410243663952e-01 0.000000000000000e+00 -23 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 7.818314824680296e-01 -6.234898018587339e-01 0.000000000000000e+00 -24 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 5.633200580636215e-01 -8.262387743159952e-01 0.000000000000000e+00 -25 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -2.947551744109044e-01 9.555728057861407e-01 0.000000000000000e+00 -26 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology Bonds -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 5 6 -6 1 6 7 -7 1 7 8 -8 1 8 9 -9 1 9 10 -10 1 10 11 -11 1 11 12 -12 1 12 13 -13 1 14 15 -14 1 15 16 -15 1 16 17 -16 1 17 18 -17 1 18 19 -18 1 19 20 -19 1 20 21 -20 1 21 22 -21 1 22 23 -22 1 23 24 -23 1 24 25 -24 1 25 26 +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 5 6 +6 1 6 7 +7 1 7 8 +8 1 8 9 +9 1 9 10 +10 1 10 11 +11 1 11 12 +12 1 12 13 +13 1 14 15 +14 1 15 16 +15 1 16 17 +16 1 17 18 +17 1 18 19 +18 1 19 20 +19 1 20 21 +20 1 21 22 +21 1 22 23 +22 1 23 24 +23 1 24 25 +24 1 25 26 + +Ellipsoids + +1 1.173984503142341 1.173984503142341 1.173984503142341 0.9970278940278272 0.0014876174054512252 0.0750547523448584 0.017319055267040844 +2 1.173984503142341 1.173984503142341 1.173984503142341 0.9059171712388804 0.007913225291438054 0.04634256838354512 0.42083705406683053 +3 1.173984503142341 1.173984503142341 1.173984503142341 0.7657426991864452 0.028071560533125216 0.13224385975981257 0.6287779160305484 +4 1.173984503142341 1.173984503142341 1.173984503142341 0.5238981696613685 0.0516703526741727 0.1609645534282743 0.8348360887142046 +5 1.173984503142341 1.173984503142341 1.173984503142341 0.30973290897949424 0.0750672191209306 0.23962885621884192 0.9170651279902646 +6 1.173984503142341 1.173984503142341 1.173984503142341 -0.050269263744563454 0.08142241031464711 0.09584085715741358 0.9907865170259763 +7 1.173984503142341 1.173984503142341 1.173984503142341 -0.3805122714271814 0.08965734720629535 0.057827749665601925 0.9186010683391725 +8 1.173984503142341 1.173984503142341 1.173984503142341 -0.6066322463100545 0.015286960797006149 0.035984536832974555 0.7940206166563465 +9 1.173984503142341 1.173984503142341 1.173984503142341 0.771660293819677 0.02607541526374929 -0.08047223278265907 -0.6303845520092687 +10 1.173984503142341 1.173984503142341 1.173984503142341 0.9119628434851113 0.03686258000931541 -0.11017000132786052 -0.3934812487336936 +11 1.173984503142341 1.173984503142341 1.173984503142341 0.9917294290821066 0.05835078551401739 -0.08073737536574405 -0.08092837290732445 +12 1.173984503142341 1.173984503142341 1.173984503142341 0.9763527785523285 0.06753089597617556 0.004847281702108697 0.205307899901351 +13 1.173984503142341 1.173984503142341 1.173984503142341 0.8553397145502984 0.1399133966151149 0.07233200118835512 0.49354462388392356 +14 1.173984503142341 1.173984503142341 1.173984503142341 0.014416326682630282 -0.533642571147991 0.8442695396252617 0.04718813669228716 +15 1.173984503142341 1.173984503142341 1.173984503142341 0.14095892784917538 -0.2201285495070387 0.9406003462562982 -0.21666792788520955 +16 1.173984503142341 1.173984503142341 1.173984503142341 0.07323967796304806 0.05035907488974361 0.963136526452943 -0.2539053850556888 +17 1.173984503142341 1.173984503142341 1.173984503142341 0.030254986187638885 0.39195467212588947 0.9164794947567249 -0.07430684019611289 +18 1.173984503142341 1.173984503142341 1.173984503142341 -0.03080283760241768 0.6526511470205414 0.7481495879677094 -0.11562810865943304 +19 1.173984503142341 1.173984503142341 1.173984503142341 -0.09450197979153381 0.7469150592813072 0.6556128255138505 -0.0579576833217777 +20 1.173984503142341 1.173984503142341 1.173984503142341 -0.12903334341475137 0.9222523214328698 0.3501336268694509 -0.10103214950765672 +21 1.173984503142341 1.173984503142341 1.173984503142341 -0.0069954457806870336 0.9888131084284681 -0.09413955816471489 -0.11548785185859346 +22 1.173984503142341 1.173984503142341 1.173984503142341 0.029336230851923526 0.9805894852440379 -0.19236800606724952 -0.02404573205262194 +23 1.173984503142341 1.173984503142341 1.173984503142341 0.03080980270092377 0.872234086776475 -0.4869211139732921 0.03415088124407873 +24 1.173984503142341 1.173984503142341 1.173984503142341 0.007237815450514786 0.690265186998662 -0.7210993183911308 0.05913847022922672 +25 1.173984503142341 1.173984503142341 1.173984503142341 0.06694683426684143 -0.46894411325316443 0.8712038661029582 -0.12889283810247346 +26 1.173984503142341 1.173984503142341 1.173984503142341 0.07581973147109407 -0.10215114654759445 0.9759556607577902 -0.17699451916228467 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.8type b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.8type index b4d622ac46..a71ba9c32f 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.8type +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/data.duplex4.8type @@ -1,130 +1,136 @@ -# LAMMPS data file +LAMMPS data file via write_data, version 27 May 2021 + 26 atoms -26 ellipsoids -24 bonds - 8 atom types +24 bonds 1 bond types +26 ellipsoids -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms +Masses -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.957432645895970e-01 -3.379920348381733e-01 3.897628551303122e-01 1 1 1 -3 3 -2.192046146198370e-01 -5.585242491865227e-01 7.795257102606244e-01 1 1 1 -4 4 1.335125603737887e-01 -5.849567473090943e-01 1.169288565390937e+00 1 1 1 -5 5 4.398311230978960e-01 -4.081036426625517e-01 1.559051420521249e+00 1 1 1 -6 6 5.932984957350773e-01 -8.942535970570469e-02 1.948814275651561e+00 1 1 1 -7 7 5.405813207414517e-01 2.603302434705350e-01 2.338577130781873e+00 1 1 1 -8 8 3.000000000000002e-01 5.196152422706634e-01 2.728339985912185e+00 1 1 1 -9 1 -4.483805615185452e-02 5.983222783087083e-01 3.118102841042497e+00 1 1 1 -10 2 -3.740938811152403e-01 4.690988894808181e-01 3.507865696172809e+00 1 1 1 -11 7 -5.733436834716847e-01 1.768531046465427e-01 3.897628551303121e+00 1 1 1 -12 8 -5.733436834716849e-01 -1.768531046465427e-01 4.287391406433434e+00 1 1 1 -13 1 -3.740938811152403e-01 -4.690988894808182e-01 4.677154261563746e+00 1 1 1 -14 4 3.740938811152403e-01 4.690988894808182e-01 4.677154261563746e+00 2 1 1 -15 5 5.733436834716849e-01 1.768531046465427e-01 4.287391406433434e+00 2 1 1 -16 6 5.733436834716849e-01 -1.768531046465426e-01 3.897628551303122e+00 2 1 1 -17 3 3.740938811152403e-01 -4.690988894808181e-01 3.507865696172810e+00 2 1 1 -18 4 4.483805615185462e-02 -5.983222783087085e-01 3.118102841042498e+00 2 1 1 -19 5 -3.000000000000003e-01 -5.196152422706636e-01 2.728339985912186e+00 2 1 1 -20 6 -5.405813207414519e-01 -2.603302434705351e-01 2.338577130781874e+00 2 1 1 -21 7 -5.932984957350776e-01 8.942535970570474e-02 1.948814275651561e+00 2 1 1 -22 8 -4.398311230978962e-01 4.081036426625520e-01 1.559051420521249e+00 2 1 1 -23 1 -1.335125603737888e-01 5.849567473090947e-01 1.169288565390937e+00 2 1 1 -24 2 2.192046146198373e-01 5.585242491865231e-01 7.795257102606246e-01 2 1 1 -25 3 4.957432645895974e-01 3.379920348381736e-01 3.897628551303123e-01 2 1 1 -26 4 6.000000000000006e-01 0.000000000000000e+00 1.110223024625157e-16 2 1 1 +1 3.1575 +2 3.1575 +3 3.1575 +4 3.1575 +5 3.1575 +6 3.1575 +7 3.1575 +8 3.1575 + +Atoms # hybrid + +1 1 -0.5974293795290144 -0.47217734566783476 0.1149860099192362 1 1 3.7269849963023267 0 0 0 +2 2 -0.3607975285447209 -0.8084200276362509 0.5005631273908187 1 1 3.7269849963023267 0 0 0 +3 3 -0.1880165420620915 -0.9339012982528754 0.9372222930006777 1 1 3.7269849963023267 0 0 0 +4 4 0.18789028377909187 -0.8807473585891459 1.3080750447260532 1 1 3.7269849963023267 0 0 0 +5 5 0.46680288593900887 -0.6314504249974493 1.6544618495816525 1 1 3.7269849963023267 0 0 0 +6 6 0.6156490001978658 -0.24344915610488765 1.9998398114466447 1 1 3.7269849963023267 0 0 0 +7 7 0.5475869309223161 0.10633006738807783 2.395688109397028 1 1 3.7269849963023267 0 0 0 +8 8 0.3964561058464781 0.33864915662119616 2.855380256681012 1 1 3.7269849963023267 0 0 0 +9 1 0.09151778690925949 0.33572177117709545 3.2793107140407853 1 1 3.7269849963023267 0 0 0 +10 2 -0.260700239272384 0.23452584272483473 3.622064753017485 1 1 3.7269849963023267 0 0 0 +11 7 -0.44049173083867876 -0.04240311520575983 4.057361772274168 1 1 3.7269849963023267 0 0 0 +12 8 -0.48111471327910416 -0.3913669550617015 4.465217350523367 1 1 3.7269849963023267 0 0 0 +13 1 -0.3029890593292223 -0.6218232516387349 4.889919411438907 1 1 3.7269849963023267 0 0 0 +14 4 0.36538593166250877 0.467104033114044 4.885957202043727 2 1 3.7269849963023267 0 0 0 +15 5 0.5837256243756591 0.1432569770282543 4.587937684834979 2 1 3.7269849963023267 0 0 0 +16 6 0.7270895848434721 -0.21648156960230241 4.19127441749994 2 1 3.7269849963023267 0 0 0 +17 3 0.5694364623788377 -0.5971020505771416 3.7905394408535833 2 1 3.7269849963023267 0 0 0 +18 4 0.32183479629572403 -0.7826674384502239 3.3981789941001397 2 1 3.7269849963023267 0 0 0 +19 5 0.027943077828669855 -0.8173952163019756 2.892497591992246 2 1 3.7269849963023267 0 0 0 +20 6 -0.34389471043742403 -0.6801076538339801 2.6010059142333977 2 1 3.7269849963023267 0 0 0 +21 7 -0.5722337592890715 -0.31543771192866543 2.2496367888009035 2 1 3.7269849963023267 0 0 0 +22 8 -0.5243059431454682 -0.018794840926191582 1.6669602274961965 2 1 3.7269849963023267 0 0 0 +23 1 -0.4467049661654279 0.15318137385858244 1.1669311078565738 2 1 3.7269849963023267 0 0 0 +24 2 -0.04279541944801792 0.24071675674438053 0.7924196804793574 2 1 3.7269849963023267 0 0 0 +25 3 0.33688934798342335 0.1390449738629785 0.42004977704361546 2 1 3.7269849963023267 0 0 0 +26 4 0.5381606093378432 -0.28366941895261566 0.04905784853961178 2 1 3.7269849963023267 0 0 0 -# Atom-ID, translational, rotational velocity Velocities -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -11 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -12 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -13 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -14 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -15 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -16 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -17 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -18 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -19 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -20 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -21 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -22 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -23 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -24 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -25 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -26 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 +1 -0.1420563695014878 -0.2339928257547227 0.1871716305399088 -0.046333854442252194 0.08160574816172744 0.2791824603833533 +2 0.03390382747481304 0.2912921705525512 -0.1828986721885175 0.09422531767061365 -0.044398236946770545 0.011069519340877812 +3 0.05351747745964457 -0.3700026678535097 -0.01469442373794632 0.10875858697088675 0.2373869034785703 0.15028498953263314 +4 0.1107696836820372 0.012571134739153464 0.23554381030898286 0.11411649786729211 -0.23899527406990237 0.11196343804383825 +5 0.21949033826324368 -0.4153000294565104 0.18426481814713022 0.2497206165366295 0.2505624077277829 -0.35347918243093 +6 -0.24019769428878804 -0.16423570219236758 -0.003762466815720382 0.062008045889015595 0.22340307597010978 -0.38223196779931135 +7 0.12372477399377596 0.10393016373901434 0.08008946447311854 -0.15063203100274558 0.08544129561789665 -0.3233996805084572 +8 0.03216353270652909 -0.1291938805451393 0.1736283537356162 -0.17577447248216746 0.11132849782859955 -0.13659117762014125 +9 0.016485625003622013 0.01204732455105311 0.012268845318149781 -0.10829791072979295 0.1325154323216732 0.061321711941405295 +10 -0.10017034720683878 -0.09274368063499111 0.0712704971413183 -0.08539556363371427 -0.10194584018083674 0.12395163271335013 +11 0.1553620769751766 -0.017877616757193807 -0.1679552227127468 -0.11302061465460307 0.10833285249943261 -0.29004856929349787 +12 -0.25308607960176693 0.05651778438229357 -0.28293751231512154 0.08875447438401544 -0.0424858854741496 0.4807657704475166 +13 -0.006525152792083277 0.05278468067247092 0.0923614993309851 -0.17068957621149589 -0.21396827821680875 -0.22336174340467796 +14 -0.09024428084565417 0.19407821508904713 -0.27279958154128003 0.16579397498898726 0.05605196163049078 0.18139063086724955 +15 0.2329539015603435 0.08926675461196792 0.01755751945261716 0.14895763843533014 0.05566424996653055 0.038429304115211504 +16 -0.012766107314323394 -0.05870276075293287 0.22459362070331024 -0.051898555487544795 0.11349183901118838 -0.35625338947479507 +17 -0.20400754456760709 -0.43178141581578006 -0.05213026263746946 -0.16561150375144387 -0.08257869123336893 -0.31368221607714253 +18 0.26408469209202234 0.004101215813165573 -0.11409222616552296 -0.37751548716793587 0.021230702354981583 0.23218952685038605 +19 -0.2811352347889802 0.25474603468997514 0.0038005485218010606 0.2164466860189806 -0.3924452117278991 0.22754829879548555 +20 -0.34129793271588454 0.05074672818229578 -0.03388446943745919 -0.1368254010552013 -0.1547809974693013 -0.03266259795645136 +21 -0.25700758391191114 0.04693154859703793 0.08362546455733241 -0.08661574368141227 -0.030723569920460755 -0.18740437515161282 +22 0.08529314327765061 0.10662056255177826 -0.0742729015142829 -0.4671828719407557 -0.19246067344838313 0.20137866804242557 +23 -0.09337250162399305 -0.1907111010034805 0.19278254253312255 0.017795209772695803 -0.36506106427644847 0.24972052729172167 +24 -0.16063305395742022 0.12278800901705311 0.0513923554335936 -0.09716260028970423 -0.26401680055506943 0.08202659665577536 +25 -0.14736287972598905 0.09699085150412592 -0.20751532907712478 0.05612191742480806 -0.13929212905625324 0.034890079586931765 +26 -0.060417626533246734 0.35551862988152244 -0.19673503245092067 0.014766691426271806 0.02762183997756995 -0.20597323908506235 -# Atom-ID, shape, quaternion -Ellipsoids - -1 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.555728057861408e-01 0.000000000000000e+00 0.000000000000000e+00 2.947551744109042e-01 -3 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 8.262387743159949e-01 0.000000000000000e+00 0.000000000000000e+00 5.633200580636221e-01 -4 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 6.234898018587335e-01 0.000000000000000e+00 0.000000000000000e+00 7.818314824680299e-01 -5 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 3.653410243663950e-01 0.000000000000000e+00 0.000000000000000e+00 9.308737486442042e-01 -6 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 7.473009358642424e-02 0.000000000000000e+00 0.000000000000000e+00 9.972037971811802e-01 -7 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -2.225209339563144e-01 0.000000000000000e+00 0.000000000000000e+00 9.749279121818237e-01 -8 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -5.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 8.660254037844387e-01 -9 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 7.330518718298263e-01 -0.000000000000000e+00 0.000000000000000e+00 -6.801727377709196e-01 -10 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.009688679024190e-01 -0.000000000000000e+00 0.000000000000000e+00 -4.338837391175581e-01 -11 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.888308262251286e-01 -0.000000000000000e+00 0.000000000000000e+00 -1.490422661761745e-01 -12 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.888308262251286e-01 0.000000000000000e+00 0.000000000000000e+00 1.490422661761745e-01 -13 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.009688679024190e-01 0.000000000000000e+00 0.000000000000000e+00 4.338837391175582e-01 -14 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 -4.338837391175582e-01 9.009688679024190e-01 0.000000000000000e+00 -15 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -1.490422661761746e-01 9.888308262251286e-01 0.000000000000000e+00 -16 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 1.490422661761745e-01 9.888308262251286e-01 -0.000000000000000e+00 -17 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 4.338837391175581e-01 9.009688679024190e-01 -0.000000000000000e+00 -18 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 6.801727377709192e-01 7.330518718298267e-01 0.000000000000000e+00 -19 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.660254037844386e-01 5.000000000000001e-01 0.000000000000000e+00 -20 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.749279121818235e-01 2.225209339563145e-01 0.000000000000000e+00 -21 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.972037971811801e-01 -7.473009358642428e-02 0.000000000000000e+00 -22 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.308737486442041e-01 -3.653410243663952e-01 0.000000000000000e+00 -23 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 7.818314824680296e-01 -6.234898018587339e-01 0.000000000000000e+00 -24 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 5.633200580636215e-01 -8.262387743159952e-01 0.000000000000000e+00 -25 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -2.947551744109044e-01 9.555728057861407e-01 0.000000000000000e+00 -26 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology Bonds -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 5 6 -6 1 6 7 -7 1 7 8 -8 1 8 9 -9 1 9 10 -10 1 10 11 -11 1 11 12 -12 1 12 13 -13 1 14 15 -14 1 15 16 -15 1 16 17 -16 1 17 18 -17 1 18 19 -18 1 19 20 -19 1 20 21 -20 1 21 22 -21 1 22 23 -22 1 23 24 -23 1 24 25 -24 1 25 26 +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 5 6 +6 1 6 7 +7 1 7 8 +8 1 8 9 +9 1 9 10 +10 1 10 11 +11 1 11 12 +12 1 12 13 +13 1 14 15 +14 1 15 16 +15 1 16 17 +16 1 17 18 +17 1 18 19 +18 1 19 20 +19 1 20 21 +20 1 21 22 +21 1 22 23 +22 1 23 24 +23 1 24 25 +24 1 25 26 + +Ellipsoids + +1 1.173984503142341 1.173984503142341 1.173984503142341 0.9970278940278272 0.0014876174054512252 0.0750547523448584 0.017319055267040844 +2 1.173984503142341 1.173984503142341 1.173984503142341 0.9059171712388804 0.007913225291438054 0.04634256838354512 0.42083705406683053 +3 1.173984503142341 1.173984503142341 1.173984503142341 0.7657426991864452 0.028071560533125216 0.13224385975981257 0.6287779160305484 +4 1.173984503142341 1.173984503142341 1.173984503142341 0.5238981696613685 0.0516703526741727 0.1609645534282743 0.8348360887142046 +5 1.173984503142341 1.173984503142341 1.173984503142341 0.30973290897949424 0.0750672191209306 0.23962885621884192 0.9170651279902646 +6 1.173984503142341 1.173984503142341 1.173984503142341 -0.050269263744563454 0.08142241031464711 0.09584085715741358 0.9907865170259763 +7 1.173984503142341 1.173984503142341 1.173984503142341 -0.3805122714271814 0.08965734720629535 0.057827749665601925 0.9186010683391725 +8 1.173984503142341 1.173984503142341 1.173984503142341 -0.6066322463100545 0.015286960797006149 0.035984536832974555 0.7940206166563465 +9 1.173984503142341 1.173984503142341 1.173984503142341 0.771660293819677 0.02607541526374929 -0.08047223278265907 -0.6303845520092687 +10 1.173984503142341 1.173984503142341 1.173984503142341 0.9119628434851113 0.03686258000931541 -0.11017000132786052 -0.3934812487336936 +11 1.173984503142341 1.173984503142341 1.173984503142341 0.9917294290821066 0.05835078551401739 -0.08073737536574405 -0.08092837290732445 +12 1.173984503142341 1.173984503142341 1.173984503142341 0.9763527785523285 0.06753089597617556 0.004847281702108697 0.205307899901351 +13 1.173984503142341 1.173984503142341 1.173984503142341 0.8553397145502984 0.1399133966151149 0.07233200118835512 0.49354462388392356 +14 1.173984503142341 1.173984503142341 1.173984503142341 0.014416326682630282 -0.533642571147991 0.8442695396252617 0.04718813669228716 +15 1.173984503142341 1.173984503142341 1.173984503142341 0.14095892784917538 -0.2201285495070387 0.9406003462562982 -0.21666792788520955 +16 1.173984503142341 1.173984503142341 1.173984503142341 0.07323967796304806 0.05035907488974361 0.963136526452943 -0.2539053850556888 +17 1.173984503142341 1.173984503142341 1.173984503142341 0.030254986187638885 0.39195467212588947 0.9164794947567249 -0.07430684019611289 +18 1.173984503142341 1.173984503142341 1.173984503142341 -0.03080283760241768 0.6526511470205414 0.7481495879677094 -0.11562810865943304 +19 1.173984503142341 1.173984503142341 1.173984503142341 -0.09450197979153381 0.7469150592813072 0.6556128255138505 -0.0579576833217777 +20 1.173984503142341 1.173984503142341 1.173984503142341 -0.12903334341475137 0.9222523214328698 0.3501336268694509 -0.10103214950765672 +21 1.173984503142341 1.173984503142341 1.173984503142341 -0.0069954457806870336 0.9888131084284681 -0.09413955816471489 -0.11548785185859346 +22 1.173984503142341 1.173984503142341 1.173984503142341 0.029336230851923526 0.9805894852440379 -0.19236800606724952 -0.02404573205262194 +23 1.173984503142341 1.173984503142341 1.173984503142341 0.03080980270092377 0.872234086776475 -0.4869211139732921 0.03415088124407873 +24 1.173984503142341 1.173984503142341 1.173984503142341 0.007237815450514786 0.690265186998662 -0.7210993183911308 0.05913847022922672 +25 1.173984503142341 1.173984503142341 1.173984503142341 0.06694683426684143 -0.46894411325316443 0.8712038661029582 -0.12889283810247346 +26 1.173984503142341 1.173984503142341 1.173984503142341 0.07581973147109407 -0.10215114654759445 0.9759556607577902 -0.17699451916228467 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.4type b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.4type index eebc5c6eed..ebbd00c0e2 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.4type +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.4type @@ -1,10 +1,11 @@ -variable number equal 1 -variable ofreq equal 10000 -variable efreq equal 10000 +variable number equal 4 +variable ofreq equal 1000 +variable efreq equal 1000 variable ntype equal 4 variable T equal 0.1 +variable rhos equal 0.2 units lj @@ -14,20 +15,21 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 10 delay 0 check yes read_data data.duplex4.4type + mass * 3.1575 # sets per-type mass if not in data file set atom * mass 3.1575 # sets per-atom mass group all type 1 4 -# oxDNA bond interactions - FENE backbone +# oxDNA2 bond interactions - FENE backbone bond_style oxdna2/fene bond_coeff * 2.0 0.25 0.7564 special_bonds lj 0 1 1 @@ -52,28 +54,19 @@ jump in.duplex4.4type loop pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 0.2 0.815 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 # Langevin dynamics fix 1 all nve/asphere -fix 2 all langevin ${T} ${T} 25.0 457145 angmom 10 +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 -timestep 1e-4 +timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" compute erot all erotate/asphere compute ekin all ke @@ -84,14 +77,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -dump out all custom ${ofreq} out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz dump_modify out sort id -dump_modify out format line "%d %d %d %13.6le %13.6le %13.6le %d %d %d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le " - -#restart 10000 config0_restart config1_restart - -run 100000 - -#write_restart config.${number}.* +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" +run 1000000 +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.8type b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.8type index 07d3ffc423..9945dc5366 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.8type +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/in.duplex4.8type @@ -1,10 +1,11 @@ -variable number equal 1 -variable ofreq equal 10000 -variable efreq equal 10000 +variable number equal 8 +variable ofreq equal 1000 +variable efreq equal 1000 variable ntype equal 8 variable T equal 0.1 +variable rhos equal 0.2 units lj @@ -14,20 +15,21 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 10 delay 0 check yes read_data data.duplex4.8type + mass * 3.1575 # sets per-type mass if not in data file set atom * mass 3.1575 # sets per-atom mass group all type 1 8 -# oxDNA bond interactions - FENE backbone +# oxDNA2 bond interactions - FENE backbone bond_style oxdna2/fene bond_coeff * 2.0 0.25 0.7564 special_bonds lj 0 1 1 @@ -52,28 +54,19 @@ jump in.duplex4.8type loop pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 0.2 0.815 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 # Langevin dynamics fix 1 all nve/asphere -fix 2 all langevin ${T} ${T} 25.0 457145 angmom 10 +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 -timestep 1e-4 +timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" compute erot all erotate/asphere compute ekin all ke @@ -84,14 +77,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -dump out all custom ${ofreq} out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz dump_modify out sort id -dump_modify out format line "%d %d %d %13.6le %13.6le %13.6le %d %d %d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le " - -#restart 10000 config0_restart config1_restart - -run 100000 - -#write_restart config.${number}.* +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" +run 1000000 +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 new file mode 100644 index 0000000000..0193d361af --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 @@ -0,0 +1,1230 @@ +LAMMPS (27 May 2021) +variable number equal 4 +variable ofreq equal 1000 +variable efreq equal 1000 + +variable ntype equal 4 + +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 10 delay 0 check yes + +read_data data.duplex4.4type +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 26 atoms + reading velocities ... + 26 velocities + scanning bonds ... + 2 = max bonds/atom + 26 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 24 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.003 seconds + +mass * 3.1575 # sets per-type mass if not in data file +set atom * mass 3.1575 # sets per-atom mass +Setting atom values ... + 26 settings made for mass + +group all type 1 4 +26 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + +label loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 1%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+3 +variable comp equal 1+3 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.4type loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 2%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+1 +variable comp equal 2+1 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +next base +jump in.duplex4.4type loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 3%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.4type loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 4%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.4type loop + +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# Langevin dynamics +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.4.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 10 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 3.74991604702378 | erot = 3.45272678980464 | epot = -37.374200901142 | etot = -30.1715580643136 +Per MPI rank memory allocation (min/avg/max) = 9.578 | 9.578 | 9.578 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.099997761 -1.4717559 0.03428661 -1.2932417 5.6146609e-05 64000 +1000 ekin = 3.83184879800819 | erot = 3.50203401022061 | epot = -37.4730508915114 | etot = -30.1391680832826 +2000 ekin = 3.82227374831519 | erot = 3.79878100905234 | epot = -37.616191007464 | etot = -29.9951362500965 +3000 ekin = 3.90938932030971 | erot = 4.1584025695072 | epot = -37.7430329723255 | etot = -29.6752410825086 +4000 ekin = 3.82373321902577 | erot = 4.12183047279799 | epot = -37.8313543569025 | etot = -29.8857906650788 +5000 ekin = 3.7245469506492 | erot = 4.29953523687407 | epot = -37.8617217220935 | etot = -29.8376395345702 +6000 ekin = 3.75585156536887 | erot = 4.31270713695362 | epot = -37.8280629310505 | etot = -29.759504228728 +7000 ekin = 3.79326740841051 | erot = 4.16508360466874 | epot = -37.7640947397914 | etot = -29.8057437267121 +8000 ekin = 3.74746489835263 | erot = 4.25243425677965 | epot = -37.6835135449588 | etot = -29.6836143898265 +9000 ekin = 3.70802697723782 | erot = 4.00193184819408 | epot = -37.589938820096 | etot = -29.8799799946641 +10000 ekin = 3.5813559764108 | erot = 3.86411518632768 | epot = -37.5041732418664 | etot = -30.0587020791279 +11000 ekin = 3.45122934445656 | erot = 4.17035352993105 | epot = -37.485988256137 | etot = -29.8644053817494 +12000 ekin = 3.42435863038455 | erot = 4.2148747253892 | epot = -37.5307136425246 | etot = -29.8914802867509 +13000 ekin = 3.40216979362994 | erot = 4.07292918248778 | epot = -37.6378499557145 | etot = -30.1627509795968 +14000 ekin = 3.29213315521691 | erot = 4.50441987673247 | epot = -37.7761364031321 | etot = -29.9795833711827 +15000 ekin = 3.36883179726037 | erot = 4.91359031415189 | epot = -37.9357367952089 | etot = -29.6533146837967 +16000 ekin = 3.30177911852249 | erot = 5.0959341599744 | epot = -38.143737189117 | etot = -29.7460239106201 +17000 ekin = 3.27867865291038 | erot = 5.45789581601547 | epot = -38.3785999463332 | etot = -29.6420254774074 +18000 ekin = 3.36770908750654 | erot = 5.63036493519876 | epot = -38.5970397067551 | etot = -29.5989656840498 +19000 ekin = 3.29802639540141 | erot = 5.45616396083943 | epot = -38.7810833463914 | etot = -30.0268929901506 +20000 ekin = 3.28760849058064 | erot = 5.26031945979087 | epot = -38.9429500949467 | etot = -30.3950221445752 +21000 ekin = 3.32772748450134 | erot = 5.34990394778083 | epot = -39.0618181252057 | etot = -30.3841866929235 +22000 ekin = 3.34298346296243 | erot = 5.12273250375892 | epot = -39.1360899153794 | etot = -30.670373948658 +23000 ekin = 3.38280280428754 | erot = 5.14933572496704 | epot = -39.1974651493047 | etot = -30.6653266200501 +24000 ekin = 3.43991273776908 | erot = 5.03737353653106 | epot = -39.2427818934623 | etot = -30.7654956191621 +25000 ekin = 3.44382800915661 | erot = 4.56194227438371 | epot = -39.2491545805195 | etot = -31.2433842969791 +26000 ekin = 3.47220361933917 | erot = 4.88028216050144 | epot = -39.2033487475128 | etot = -30.8508629676722 +27000 ekin = 3.47824341108208 | erot = 4.79713670041817 | epot = -39.1340731989048 | etot = -30.8586930874045 +28000 ekin = 3.54835351423495 | erot = 4.6549460773945 | epot = -39.0768463918722 | etot = -30.8735468002427 +29000 ekin = 3.57491058588771 | erot = 4.31737192689198 | epot = -39.0420895500443 | etot = -31.1498070372646 +30000 ekin = 3.51438036654854 | erot = 4.50861299911588 | epot = -39.0276136699747 | etot = -31.0046203043103 +31000 ekin = 3.57650331888537 | erot = 4.40811531091205 | epot = -39.0168289246977 | etot = -31.0322102949003 +32000 ekin = 3.70658082522062 | erot = 4.15949186201365 | epot = -39.017410963825 | etot = -31.1513382765907 +33000 ekin = 3.83721022661993 | erot = 4.05055961618764 | epot = -39.0303039022728 | etot = -31.1425340594653 +34000 ekin = 3.9488588066567 | erot = 3.81495459058985 | epot = -39.0180833389346 | etot = -31.2542699416881 +35000 ekin = 3.97994525138311 | erot = 4.49904715736237 | epot = -38.9543629321031 | etot = -30.4753705233576 +36000 ekin = 3.90049506438254 | erot = 3.99723351860171 | epot = -38.8736492127443 | etot = -30.97592062976 +37000 ekin = 4.00119032736875 | erot = 4.30070706410094 | epot = -38.7576942972652 | etot = -30.4557969057955 +38000 ekin = 4.00581796835635 | erot = 3.82064458204037 | epot = -38.6053485149963 | etot = -30.7788859645996 +39000 ekin = 3.92374370666481 | erot = 3.80679256085699 | epot = -38.4357174066365 | etot = -30.7051811391147 +40000 ekin = 3.81525591020234 | erot = 3.60218215391064 | epot = -38.2889289083717 | etot = -30.8714908442588 +41000 ekin = 3.89801377589288 | erot = 3.52447171643245 | epot = -38.2033074629499 | etot = -30.7808219706246 +42000 ekin = 3.92469802136758 | erot = 3.7220708309091 | epot = -38.1843497161944 | etot = -30.5375808639177 +43000 ekin = 3.9035581905627 | erot = 3.65375269274892 | epot = -38.2197716832792 | etot = -30.6624607999676 +44000 ekin = 3.94906849382527 | erot = 3.48405507068381 | epot = -38.2852323155718 | etot = -30.8521087510627 +45000 ekin = 4.04988136986444 | erot = 3.38338492043344 | epot = -38.3792178397491 | etot = -30.9459515494513 +46000 ekin = 4.12456204511551 | erot = 3.52614566674481 | epot = -38.4473213411913 | etot = -30.796613629331 +47000 ekin = 4.05260082430176 | erot = 3.30110271195189 | epot = -38.4808326895797 | etot = -31.127129153326 +48000 ekin = 3.94672633965036 | erot = 3.3079094466035 | epot = -38.4845357728863 | etot = -31.2298999866324 +49000 ekin = 3.88681575217737 | erot = 3.7826220382333 | epot = -38.441512853504 | etot = -30.7720750630934 +50000 ekin = 3.82899985395713 | erot = 3.78573156370331 | epot = -38.3450518110651 | etot = -30.7303203934047 +51000 ekin = 3.8440574703342 | erot = 3.5318167647978 | epot = -38.2059734024446 | etot = -30.8300991673126 +52000 ekin = 3.72257170524991 | erot = 3.44233441463351 | epot = -38.0493176755068 | etot = -30.8844115556234 +53000 ekin = 3.58458805955591 | erot = 3.40175184254422 | epot = -37.8770316144348 | etot = -30.8906917123346 +54000 ekin = 3.42774104644871 | erot = 3.019334453294 | epot = -37.7242775274777 | etot = -31.277202027735 +55000 ekin = 3.30773758120279 | erot = 3.11354928843073 | epot = -37.5844277892892 | etot = -31.1631409196556 +56000 ekin = 3.30267684217519 | erot = 3.36746893036052 | epot = -37.4528615341921 | etot = -30.7827157616564 +57000 ekin = 3.19775481140565 | erot = 3.06235541109216 | epot = -37.3795633131474 | etot = -31.1194530906496 +58000 ekin = 3.11776701522974 | erot = 3.21225050262699 | epot = -37.3545495658646 | etot = -31.0245320480079 +59000 ekin = 3.02660076850685 | erot = 3.05700513362467 | epot = -37.3753385948442 | etot = -31.2917326927127 +60000 ekin = 3.05479252149933 | erot = 3.09854486170695 | epot = -37.4441725320784 | etot = -31.2908351488721 +61000 ekin = 3.0170447679161 | erot = 3.76451997765653 | epot = -37.5384296958522 | etot = -30.7568649502795 +62000 ekin = 3.04313706615767 | erot = 3.65046217125996 | epot = -37.6255736746588 | etot = -30.9319744372411 +63000 ekin = 3.01457068009159 | erot = 3.63417424777149 | epot = -37.6954625017368 | etot = -31.0467175738737 +64000 ekin = 2.98716002899792 | erot = 3.6682341307717 | epot = -37.7940816265088 | etot = -31.1386874667392 +65000 ekin = 3.02462936411614 | erot = 3.70957377344581 | epot = -37.8868266007907 | etot = -31.1526234632287 +66000 ekin = 3.04943307417966 | erot = 3.64749592963954 | epot = -37.9385532609816 | etot = -31.2416242571625 +67000 ekin = 3.1066499876682 | erot = 3.92441992350054 | epot = -37.9686488739492 | etot = -30.9375789627804 +68000 ekin = 3.10508542338566 | erot = 3.51781674899961 | epot = -37.9831132441551 | etot = -31.3602110717698 +69000 ekin = 3.12460161346405 | erot = 3.45336993587922 | epot = -38.016048039057 | etot = -31.4380764897137 +70000 ekin = 3.2758656602578 | erot = 2.9433048812549 | epot = -38.0712687269606 | etot = -31.8520981854479 +71000 ekin = 3.39211310061244 | erot = 2.74512861011507 | epot = -38.1409313278077 | etot = -32.0036896170801 +72000 ekin = 3.40645093836715 | erot = 2.75927481548162 | epot = -38.2448895790434 | etot = -32.0791638251946 +73000 ekin = 3.52971008848809 | erot = 2.59006671029947 | epot = -38.3559671032089 | etot = -32.2361903044213 +74000 ekin = 3.64539698532463 | erot = 2.94116909218571 | epot = -38.4934235930849 | etot = -31.9068575155746 +75000 ekin = 3.801696795608 | erot = 3.11004664709642 | epot = -38.6561648833572 | etot = -31.7444214406528 +76000 ekin = 3.86343004207976 | erot = 3.33165114941781 | epot = -38.7892518002905 | etot = -31.5941706087929 +77000 ekin = 3.90472352035102 | erot = 3.31177401193371 | epot = -38.8678679983232 | etot = -31.6513704660385 +78000 ekin = 3.9269153046816 | erot = 3.25784074314334 | epot = -38.8969605625463 | etot = -31.7122045147213 +79000 ekin = 3.93607959529908 | erot = 3.16472395725651 | epot = -38.8636036578362 | etot = -31.7628001052806 +80000 ekin = 3.92375596570378 | erot = 3.03932991445862 | epot = -38.7678348516125 | etot = -31.8047489714501 +81000 ekin = 3.94307777153344 | erot = 2.88134017144298 | epot = -38.6473318824763 | etot = -31.8229139394999 +82000 ekin = 3.86696228915961 | erot = 2.89149309255461 | epot = -38.5199433915521 | etot = -31.7614880098378 +83000 ekin = 3.6081427560926 | erot = 2.81572010912292 | epot = -38.3996592376439 | etot = -31.9757963724284 +84000 ekin = 3.71373301448703 | erot = 2.72793818704548 | epot = -38.3011883980017 | etot = -31.8595171964692 +85000 ekin = 3.50951070251159 | erot = 2.79348490714941 | epot = -38.2117363909516 | etot = -31.9087407812906 +86000 ekin = 3.47308524750452 | erot = 3.12141964520655 | epot = -38.1244236248809 | etot = -31.5299187321698 +87000 ekin = 3.47440394227045 | erot = 3.04160702571501 | epot = -38.0440539828501 | etot = -31.5280430148646 +88000 ekin = 3.44172477689074 | erot = 2.9990722717108 | epot = -37.985933210493 | etot = -31.5451361618915 +89000 ekin = 3.46547245050653 | erot = 3.42367325086154 | epot = -37.9432140623316 | etot = -31.0540683609635 +90000 ekin = 3.47276106924418 | erot = 3.41105238494323 | epot = -37.9009776655539 | etot = -31.0171642113665 +91000 ekin = 3.31717291023281 | erot = 4.00503611404964 | epot = -37.8509086765272 | etot = -30.5286996522448 +92000 ekin = 3.30281925189457 | erot = 3.78657692130456 | epot = -37.8308149894368 | etot = -30.7414188162377 +93000 ekin = 3.23932364656724 | erot = 3.46021357148709 | epot = -37.8328101558439 | etot = -31.1332729377896 +94000 ekin = 3.19291152023926 | erot = 3.36401906457213 | epot = -37.8297890174383 | etot = -31.2728584326269 +95000 ekin = 3.11174095364039 | erot = 3.84559531996385 | epot = -37.8285495206063 | etot = -30.871213247002 +96000 ekin = 3.08253957616711 | erot = 4.19970849347949 | epot = -37.8307056468836 | etot = -30.548457577237 +97000 ekin = 3.01019162595086 | erot = 4.79435511235201 | epot = -37.8474383063021 | etot = -30.0428915679993 +98000 ekin = 2.95004498340949 | erot = 4.45721895779629 | epot = -37.8489202082855 | etot = -30.4416562670797 +99000 ekin = 2.91563074020307 | erot = 4.14781823161594 | epot = -37.8396252499933 | etot = -30.7761762781743 +100000 ekin = 2.90648603235873 | erot = 3.81215086067846 | epot = -37.7900595351461 | etot = -31.0714226421089 +101000 ekin = 2.85218071196321 | erot = 3.48991910340801 | epot = -37.7570245236791 | etot = -31.4149247083079 +102000 ekin = 2.86052427330306 | erot = 3.57587365782281 | epot = -37.7214005697291 | etot = -31.2850026386032 +103000 ekin = 2.8891327192239 | erot = 3.41748118405775 | epot = -37.6983180369494 | etot = -31.3917041336678 +104000 ekin = 2.81650081212178 | erot = 3.64361039549593 | epot = -37.6651320682074 | etot = -31.2050208605896 +105000 ekin = 2.79823699847459 | erot = 3.35865525277727 | epot = -37.6511913094719 | etot = -31.4942990582201 +106000 ekin = 2.78255015161699 | erot = 3.64122601097051 | epot = -37.6357012767033 | etot = -31.2119251141158 +107000 ekin = 2.88530590298807 | erot = 3.80038887689837 | epot = -37.6526611371133 | etot = -30.9669663572269 +108000 ekin = 2.83844762508153 | erot = 3.95272494897021 | epot = -37.7224292501162 | etot = -30.9312566760645 +109000 ekin = 2.91484982662488 | erot = 4.34544884566574 | epot = -37.8436434051328 | etot = -30.5833447328422 +110000 ekin = 2.93667443132402 | erot = 4.67698362049716 | epot = -37.9759529936705 | etot = -30.3622949418493 +111000 ekin = 3.11047864616464 | erot = 4.30694673133238 | epot = -38.1028692919236 | etot = -30.6854439144265 +112000 ekin = 3.32630420939175 | erot = 4.07222830175948 | epot = -38.2330557688864 | etot = -30.8345232577351 +113000 ekin = 3.38238157246172 | erot = 4.25399862575992 | epot = -38.4031841501304 | etot = -30.7668039519087 +114000 ekin = 3.40165200205494 | erot = 4.30744946748784 | epot = -38.6070332241658 | etot = -30.897931754623 +115000 ekin = 3.57685598139984 | erot = 4.55740206723824 | epot = -38.8200433287838 | etot = -30.6857852801457 +116000 ekin = 3.75973031177342 | erot = 4.36157654592901 | epot = -39.0323085624547 | etot = -30.9110017047523 +117000 ekin = 4.08170792820106 | erot = 4.22817627757005 | epot = -39.2374888319018 | etot = -30.9276046261307 +118000 ekin = 4.20730049786356 | erot = 4.45363628574763 | epot = -39.4247594107618 | etot = -30.7638226271506 +119000 ekin = 4.26502745539808 | erot = 4.38707691524364 | epot = -39.5609276649307 | etot = -30.908823294289 +120000 ekin = 4.18668022830479 | erot = 4.24219249569083 | epot = -39.6276325806845 | etot = -31.1987598566889 +121000 ekin = 4.37673633947888 | erot = 4.44899930150558 | epot = -39.5989335189463 | etot = -30.7731978779618 +122000 ekin = 4.38970640566175 | erot = 4.08524736298497 | epot = -39.5011631447288 | etot = -31.0262093760821 +123000 ekin = 4.42858502015388 | erot = 3.3866674865171 | epot = -39.3700347945818 | etot = -31.5547822879108 +124000 ekin = 4.41843242629726 | erot = 3.2990259988492 | epot = -39.2496495732995 | etot = -31.5321911481531 +125000 ekin = 4.26174945235079 | erot = 3.29673673713418 | epot = -39.1012418833315 | etot = -31.5427556938465 +126000 ekin = 4.24892047563245 | erot = 3.36728042977254 | epot = -38.9439369649169 | etot = -31.3277360595119 +127000 ekin = 4.20697642244211 | erot = 3.24776092764455 | epot = -38.7860930134988 | etot = -31.3313556634122 +128000 ekin = 4.05115550712502 | erot = 3.47679598409542 | epot = -38.6330582994879 | etot = -31.1051068082675 +129000 ekin = 4.05771564566357 | erot = 3.55109790126645 | epot = -38.5073350485465 | etot = -30.8985215016165 +130000 ekin = 3.96453894213024 | erot = 3.53313522266287 | epot = -38.391565950826 | etot = -30.8938917860329 +131000 ekin = 3.98900505769185 | erot = 3.64077310068002 | epot = -38.2786451293433 | etot = -30.6488669709715 +132000 ekin = 3.73079609117297 | erot = 3.73126171283416 | epot = -38.1409399456635 | etot = -30.6788821416564 +133000 ekin = 3.65247250435604 | erot = 3.53430985836842 | epot = -38.0235035134258 | etot = -30.8367211507014 +134000 ekin = 3.69649402588234 | erot = 3.97356364722734 | epot = -37.9278485959381 | etot = -30.2577909228284 +135000 ekin = 3.57147615494151 | erot = 4.00472599145957 | epot = -37.8397002442412 | etot = -30.2634980978401 +136000 ekin = 3.54164301577371 | erot = 3.88237062104613 | epot = -37.7460882463412 | etot = -30.3220746095214 +137000 ekin = 3.41247180964225 | erot = 3.32750587829706 | epot = -37.624611292303 | etot = -30.8846336043637 +138000 ekin = 3.46206567288778 | erot = 3.47277237990371 | epot = -37.562116148782 | etot = -30.6272780959905 +139000 ekin = 3.46179863350055 | erot = 3.29345554522848 | epot = -37.5218039357363 | etot = -30.7665497570072 +140000 ekin = 3.57268233853845 | erot = 3.52021546572331 | epot = -37.4799882832129 | etot = -30.3870904789511 +141000 ekin = 3.48030321137918 | erot = 3.69147952189479 | epot = -37.4842309048151 | etot = -30.3124481715412 +142000 ekin = 3.63349703801688 | erot = 3.72222694231689 | epot = -37.5326170636814 | etot = -30.1768930833476 +143000 ekin = 3.71391772492725 | erot = 3.32855653910442 | epot = -37.5715573506383 | etot = -30.5290830866066 +144000 ekin = 3.59876610372653 | erot = 3.57133292531719 | epot = -37.6083426167156 | etot = -30.4382435876719 +145000 ekin = 3.5512989873801 | erot = 3.38442665443486 | epot = -37.645703742064 | etot = -30.709978100249 +146000 ekin = 3.57274630492877 | erot = 3.74306660671644 | epot = -37.691839929883 | etot = -30.3760270182378 +147000 ekin = 3.5117518000457 | erot = 4.0750620350483 | epot = -37.7115891932223 | etot = -30.1247753581283 +148000 ekin = 3.52194530375138 | erot = 4.22438638639834 | epot = -37.7453589028592 | etot = -29.9990272127095 +149000 ekin = 3.43829227837994 | erot = 4.25032155928027 | epot = -37.7800675049656 | etot = -30.0914536673054 +150000 ekin = 3.39573759305128 | erot = 4.12519198982267 | epot = -37.7779101405858 | etot = -30.2569805577119 +151000 ekin = 3.38494817974853 | erot = 3.91154836764821 | epot = -37.7346130185548 | etot = -30.4381164711581 +152000 ekin = 3.3392823348606 | erot = 3.82420376901226 | epot = -37.692306373128 | etot = -30.5288202692551 +153000 ekin = 3.38955645731951 | erot = 3.72251905459204 | epot = -37.6703717263954 | etot = -30.5582962144839 +154000 ekin = 3.40170171151684 | erot = 3.95270448125714 | epot = -37.678389708439 | etot = -30.323983515665 +155000 ekin = 3.44581188687109 | erot = 3.52528589615975 | epot = -37.7593041359925 | etot = -30.7882063529616 +156000 ekin = 3.55410349285978 | erot = 3.68359553101928 | epot = -37.8946612865558 | etot = -30.6569622626767 +157000 ekin = 3.67740663285557 | erot = 3.73708949692863 | epot = -38.0406477694048 | etot = -30.6261516396206 +158000 ekin = 3.70912292320975 | erot = 3.62418205239296 | epot = -38.1900046609472 | etot = -30.8566996853445 +159000 ekin = 3.68532826191219 | erot = 3.87298071798096 | epot = -38.2928836797074 | etot = -30.7345746998143 +160000 ekin = 3.72002440516707 | erot = 4.11592492943231 | epot = -38.3652902740975 | etot = -30.5293409394981 +161000 ekin = 3.73388863499049 | erot = 4.42836121024192 | epot = -38.4373191354185 | etot = -30.2750692901861 +162000 ekin = 4.02523829931051 | erot = 4.86807694190568 | epot = -38.4975346699526 | etot = -29.6042194287364 +163000 ekin = 4.03311015138293 | erot = 4.78291233450127 | epot = -38.5597523007636 | etot = -29.7437298148794 +164000 ekin = 4.13350042233596 | erot = 5.01454292769814 | epot = -38.5888368946085 | etot = -29.4407935445744 +165000 ekin = 4.25718467214142 | erot = 4.92225725319178 | epot = -38.5829201612761 | etot = -29.4034782359429 +166000 ekin = 4.11013815046467 | erot = 4.53806000830091 | epot = -38.5467907483034 | etot = -29.8985925895378 +167000 ekin = 4.08710467384557 | erot = 4.20997030650441 | epot = -38.4814936158367 | etot = -30.1844186354868 +168000 ekin = 4.03924000036824 | erot = 3.95993274976389 | epot = -38.3759188508994 | etot = -30.3767461007673 +169000 ekin = 3.94917218886625 | erot = 3.65240127094113 | epot = -38.2594355677077 | etot = -30.6578621079003 +170000 ekin = 3.90935554205295 | erot = 3.78797512477882 | epot = -38.1835201359158 | etot = -30.486189469084 +171000 ekin = 3.87732504895437 | erot = 4.28652570004447 | epot = -38.1402484566641 | etot = -29.9763977076653 +172000 ekin = 3.75957929171811 | erot = 4.02272820820135 | epot = -38.1557340618709 | etot = -30.3734265619515 +173000 ekin = 3.55030915228991 | erot = 4.03115995993289 | epot = -38.2480280629193 | etot = -30.6665589506965 +174000 ekin = 3.61281225750305 | erot = 4.30402685904732 | epot = -38.3795080285351 | etot = -30.4626689119848 +175000 ekin = 3.56741376549368 | erot = 4.24945045724327 | epot = -38.512592945838 | etot = -30.695728723101 +176000 ekin = 3.69966296688439 | erot = 4.22673264606626 | epot = -38.613145916328 | etot = -30.6867503033774 +177000 ekin = 3.72329334774794 | erot = 4.3963702174486 | epot = -38.6555013846404 | etot = -30.5358378194439 +178000 ekin = 3.79919357666777 | erot = 4.00194735045323 | epot = -38.66205820756 | etot = -30.860917280439 +179000 ekin = 3.78008346787866 | erot = 4.05267692212517 | epot = -38.6224110467894 | etot = -30.7896506567856 +180000 ekin = 3.84388711467654 | erot = 3.7091612553256 | epot = -38.5399848480518 | etot = -30.9869364780497 +181000 ekin = 3.78854199589324 | erot = 3.43025530256464 | epot = -38.4472679874806 | etot = -31.2284706890227 +182000 ekin = 3.65298336461987 | erot = 3.41446703840053 | epot = -38.3421256904841 | etot = -31.2746752874636 +183000 ekin = 3.57592466495276 | erot = 3.54000226366919 | epot = -38.2342661287445 | etot = -31.1183392001226 +184000 ekin = 3.59097293869165 | erot = 3.49764131752706 | epot = -38.1237685559037 | etot = -31.035154299685 +185000 ekin = 3.59874593561893 | erot = 3.34180949424636 | epot = -38.034561395544 | etot = -31.0940059656787 +186000 ekin = 3.55637392703386 | erot = 3.60010534755649 | epot = -37.9685691221059 | etot = -30.8120898475155 +187000 ekin = 3.30341471869178 | erot = 3.63282669533315 | epot = -37.9082034969873 | etot = -30.9719620829624 +188000 ekin = 3.25151380843724 | erot = 3.41587081506784 | epot = -37.8374520507026 | etot = -31.1700674271975 +189000 ekin = 3.09888859581596 | erot = 3.51324139411321 | epot = -37.7831379378027 | etot = -31.1710079478736 +190000 ekin = 2.93096647890479 | erot = 3.73100049541747 | epot = -37.7090579094218 | etot = -31.0470909350995 +191000 ekin = 2.78845789536297 | erot = 3.59181404756272 | epot = -37.6234731970087 | etot = -31.243201254083 +192000 ekin = 2.6870850400641 | erot = 3.91911783313644 | epot = -37.5268833853882 | etot = -30.9206805121877 +193000 ekin = 2.65091164661283 | erot = 3.82754219131909 | epot = -37.4213833049328 | etot = -30.9429294670009 +194000 ekin = 2.55372434146197 | erot = 3.81228833556049 | epot = -37.3433541779818 | etot = -30.9773415009593 +195000 ekin = 2.54515296633903 | erot = 3.77157425987469 | epot = -37.2550689450338 | etot = -30.93834171882 +196000 ekin = 2.57228739351373 | erot = 3.48448370430651 | epot = -37.1707275909679 | etot = -31.1139564931476 +197000 ekin = 2.47659034250724 | erot = 3.3178807523235 | epot = -37.1125490303325 | etot = -31.3180779355017 +198000 ekin = 2.47817611131603 | erot = 3.41593598489791 | epot = -37.0628542395746 | etot = -31.1687421433607 +199000 ekin = 2.46398696321841 | erot = 3.79330738397075 | epot = -37.0410272717133 | etot = -30.7837329245241 +200000 ekin = 2.66032750534599 | erot = 3.50045834258025 | epot = -37.0560186461539 | etot = -30.8952327982277 +201000 ekin = 2.82925423269706 | erot = 3.87280363693021 | epot = -37.1094527749142 | etot = -30.4073949052869 +202000 ekin = 2.87690134773418 | erot = 3.73724666810618 | epot = -37.1548849140445 | etot = -30.5407368982041 +203000 ekin = 3.09789929071276 | erot = 3.5468763526948 | epot = -37.1913390618664 | etot = -30.5465634184588 +204000 ekin = 3.22497830820396 | erot = 3.52082166300899 | epot = -37.2064645595877 | etot = -30.4606645883747 +205000 ekin = 3.08968228459861 | erot = 3.62768693137644 | epot = -37.2539593887054 | etot = -30.5365901727303 +206000 ekin = 3.11014150174799 | erot = 3.7385678659097 | epot = -37.3166778706671 | etot = -30.4679685030094 +207000 ekin = 3.1829453735337 | erot = 4.25652712659364 | epot = -37.3463184168163 | etot = -29.9068459166889 +208000 ekin = 3.18396090757435 | erot = 4.43896014450647 | epot = -37.3566061410103 | etot = -29.7336850889295 +209000 ekin = 3.31348354672036 | erot = 3.97662877739666 | epot = -37.3764215045059 | etot = -30.0863091803889 +210000 ekin = 3.17486958285111 | erot = 3.68714944924479 | epot = -37.3622513109276 | etot = -30.5002322788317 +211000 ekin = 3.24777381738383 | erot = 3.39112189744184 | epot = -37.3847088569506 | etot = -30.7458131421249 +212000 ekin = 3.1218235472922 | erot = 3.15133571404841 | epot = -37.4262282165351 | etot = -31.1530689551944 +213000 ekin = 3.12323090197305 | erot = 3.03298058440252 | epot = -37.4993866522037 | etot = -31.3431751658281 +214000 ekin = 3.02782055391862 | erot = 3.51893074263816 | epot = -37.6187398888692 | etot = -31.0719885923124 +215000 ekin = 3.08902625374248 | erot = 3.6205495251311 | epot = -37.8003692924877 | etot = -31.0907935136142 +216000 ekin = 3.04029181666715 | erot = 4.36545701920723 | epot = -38.008684651192 | etot = -30.6029358153176 +217000 ekin = 3.11869416684302 | erot = 4.23835788568566 | epot = -38.175518074188 | etot = -30.8184660216593 +218000 ekin = 3.12136726795469 | erot = 3.996273681316 | epot = -38.3382201370156 | etot = -31.2205791877449 +219000 ekin = 3.24749965239936 | erot = 4.03289859762057 | epot = -38.4910930976407 | etot = -31.2106948476207 +220000 ekin = 3.19731650656636 | erot = 4.16726840142139 | epot = -38.6410163306452 | etot = -31.2764314226575 +221000 ekin = 3.14591003185417 | erot = 4.47643673281146 | epot = -38.7807221211561 | etot = -31.1583753564904 +222000 ekin = 3.06194834255762 | erot = 4.40957176775777 | epot = -38.8960295960945 | etot = -31.4245094857791 +223000 ekin = 3.09392792198329 | erot = 4.36929377800849 | epot = -38.9696160320109 | etot = -31.5063943320191 +224000 ekin = 3.18434099924859 | erot = 4.67414126058087 | epot = -39.0019773177328 | etot = -31.1434950579034 +225000 ekin = 3.26887097312568 | erot = 4.32849031089059 | epot = -39.0446790784002 | etot = -31.4473177943839 +226000 ekin = 3.21195731331507 | erot = 5.11387401999727 | epot = -39.0947841174991 | etot = -30.7689527841868 +227000 ekin = 3.12036258026493 | erot = 5.06347912205035 | epot = -39.0762383614625 | etot = -30.8923966591473 +228000 ekin = 3.09996729726211 | erot = 5.29564700287474 | epot = -39.020898871325 | etot = -30.6252845711882 +229000 ekin = 3.038979337959 | erot = 5.24780237112316 | epot = -38.9575212211327 | etot = -30.6707395120505 +230000 ekin = 3.00051887289145 | erot = 4.62162674048173 | epot = -38.9098464143819 | etot = -31.2877008010087 +231000 ekin = 2.91912781370869 | erot = 4.1632154756593 | epot = -38.8503568044397 | etot = -31.7680135150717 +232000 ekin = 2.80548407611273 | erot = 4.26963451717883 | epot = -38.7971045932123 | etot = -31.7219859999207 +233000 ekin = 2.921352071703 | erot = 4.30663886521624 | epot = -38.7943069633022 | etot = -31.5663160263829 +234000 ekin = 2.89875675710069 | erot = 4.15218445741156 | epot = -38.7953536145697 | etot = -31.7444124000574 +235000 ekin = 2.99243729544443 | erot = 3.66858116296991 | epot = -38.7881689836611 | etot = -32.1271505252468 +236000 ekin = 3.05722012426339 | erot = 3.77007572255966 | epot = -38.8307946718327 | etot = -32.0034988250097 +237000 ekin = 2.9379768603675 | erot = 4.00589644921924 | epot = -38.9299465153368 | etot = -31.9860732057501 +238000 ekin = 2.94144352009249 | erot = 3.88111097233611 | epot = -39.049865747263 | etot = -32.2273112548344 +239000 ekin = 3.10382951223872 | erot = 3.96380163382862 | epot = -39.1526703213399 | etot = -32.0850391752726 +240000 ekin = 3.05998182778603 | erot = 4.32395093282876 | epot = -39.2052189603878 | etot = -31.821286199773 +241000 ekin = 3.07091800265519 | erot = 4.10063821004071 | epot = -39.2356744872186 | etot = -32.0641182745227 +242000 ekin = 2.97211136503678 | erot = 4.19271702506008 | epot = -39.2591861941866 | etot = -32.0943578040897 +243000 ekin = 2.88784895332254 | erot = 4.01063377556437 | epot = -39.2721844581365 | etot = -32.3737017292496 +244000 ekin = 2.72034159299268 | erot = 3.94970789536676 | epot = -39.2969463203695 | etot = -32.62689683201 +245000 ekin = 2.73288139378785 | erot = 4.2955252560862 | epot = -39.3467303394195 | etot = -32.3183236895454 +246000 ekin = 2.68282749729222 | erot = 4.4395870918117 | epot = -39.40368508993 | etot = -32.2812705008261 +247000 ekin = 2.73156079717722 | erot = 4.29997633507679 | epot = -39.4831744493475 | etot = -32.4516373170935 +248000 ekin = 2.71615239962783 | erot = 4.48384110145858 | epot = -39.562569036112 | etot = -32.3625755350256 +249000 ekin = 2.72571373834887 | erot = 4.53350194835673 | epot = -39.6161562336933 | etot = -32.3569405469877 +250000 ekin = 2.67302825179687 | erot = 5.17929377781993 | epot = -39.6758534551746 | etot = -31.8235314255578 +251000 ekin = 2.65073658987032 | erot = 5.39364408144152 | epot = -39.7013652486053 | etot = -31.6569845772935 +252000 ekin = 2.81604561937354 | erot = 5.50799647083818 | epot = -39.6939189845584 | etot = -31.3698768943466 +253000 ekin = 2.83629985586584 | erot = 4.91166111825353 | epot = -39.6825773475312 | etot = -31.9346163734119 +254000 ekin = 2.79908189634042 | erot = 4.88281944777358 | epot = -39.6620010988141 | etot = -31.9800997547001 +255000 ekin = 2.84238496514407 | erot = 4.79166487708071 | epot = -39.6680683880921 | etot = -32.0340185458674 +256000 ekin = 2.82611571908345 | erot = 4.38756969310689 | epot = -39.7220228798982 | etot = -32.5083374677078 +257000 ekin = 2.78077325096868 | erot = 4.56426394538529 | epot = -39.765795760232 | etot = -32.420758563878 +258000 ekin = 2.84466353932839 | erot = 4.94939241805623 | epot = -39.7743058264471 | etot = -31.9802498690625 +259000 ekin = 2.82994372921752 | erot = 4.84156348043274 | epot = -39.784508432178 | etot = -32.1130012225277 +260000 ekin = 2.84769599243485 | erot = 4.63369709433915 | epot = -39.8060470464451 | etot = -32.3246539596711 +261000 ekin = 2.87237157835355 | erot = 4.51865061212274 | epot = -39.7979847736534 | etot = -32.4069625831772 +262000 ekin = 2.96750612225969 | erot = 4.57561390426951 | epot = -39.7782660470081 | etot = -32.2351460204789 +263000 ekin = 2.99289365842386 | erot = 4.20953311292942 | epot = -39.745321167764 | etot = -32.5428943964107 +264000 ekin = 3.02610258005876 | erot = 4.41804994162533 | epot = -39.7005266944524 | etot = -32.2563741727683 +265000 ekin = 3.02210011112748 | erot = 4.29011549844086 | epot = -39.6578667285882 | etot = -32.3456511190199 +266000 ekin = 2.95526029973602 | erot = 3.97220133607363 | epot = -39.5863143733948 | etot = -32.6588527375852 +267000 ekin = 2.96306286479385 | erot = 4.39982365552045 | epot = -39.5117362736934 | etot = -32.1488497533791 +268000 ekin = 2.98837918599786 | erot = 4.59043107838108 | epot = -39.4346030266012 | etot = -31.8557927622223 +269000 ekin = 2.92733730866711 | erot = 4.81492520489309 | epot = -39.3017884762548 | etot = -31.5595259626946 +270000 ekin = 2.90335610024265 | erot = 4.98515255872077 | epot = -39.1437745457484 | etot = -31.255265886785 +271000 ekin = 2.87611923369233 | erot = 5.02631285080424 | epot = -38.9919498909518 | etot = -31.0895178064552 +272000 ekin = 2.87770260774598 | erot = 4.83651556609765 | epot = -38.840809395014 | etot = -31.1265912211704 +273000 ekin = 2.77329089721178 | erot = 4.69693225863749 | epot = -38.6610493537943 | etot = -31.190826197945 +274000 ekin = 2.68625637002662 | erot = 4.51669986790576 | epot = -38.4509728982942 | etot = -31.2480166603618 +275000 ekin = 2.60330324454304 | erot = 4.20171703621295 | epot = -38.218249935628 | etot = -31.413229654872 +276000 ekin = 2.5718307631142 | erot = 3.79152446287654 | epot = -38.0174336495133 | etot = -31.6540784235226 +277000 ekin = 2.49975386368567 | erot = 3.59614150828635 | epot = -37.8474968832235 | etot = -31.7516015112514 +278000 ekin = 2.46398069339708 | erot = 3.65098267442642 | epot = -37.6582057642293 | etot = -31.5432423964058 +279000 ekin = 2.48339824565313 | erot = 3.67548575635034 | epot = -37.5048702413578 | etot = -31.3459862393544 +280000 ekin = 2.53376634761126 | erot = 3.55656380463981 | epot = -37.3937621487776 | etot = -31.3034319965265 +281000 ekin = 2.67002406168562 | erot = 3.81689537677424 | epot = -37.3207483356567 | etot = -30.8338288971968 +282000 ekin = 2.63534042744473 | erot = 3.62617225051185 | epot = -37.2561498174831 | etot = -30.9946371395265 +283000 ekin = 2.62204960593212 | erot = 3.60063437351288 | epot = -37.1865464899413 | etot = -30.9638625104963 +284000 ekin = 2.67681575008792 | erot = 3.61566503901022 | epot = -37.1459845078296 | etot = -30.8535037187314 +285000 ekin = 2.71360352201124 | erot = 3.48822466196448 | epot = -37.1436040722676 | etot = -30.9417758882919 +286000 ekin = 2.72409949367872 | erot = 3.69046973300093 | epot = -37.1515114688671 | etot = -30.7369422421875 +287000 ekin = 2.78141221541724 | erot = 3.56169254019551 | epot = -37.1836412585712 | etot = -30.8405365029585 +288000 ekin = 2.93111949257215 | erot = 3.85252275716863 | epot = -37.2722312757955 | etot = -30.4885890260547 +289000 ekin = 3.22039073654111 | erot = 3.65796134125561 | epot = -37.4105935842029 | etot = -30.5322415064062 +290000 ekin = 3.45543672952173 | erot = 3.63587074171862 | epot = -37.5601919395408 | etot = -30.4688844683004 +291000 ekin = 3.52760878967904 | erot = 4.20430698093704 | epot = -37.7322836777774 | etot = -30.0003679071614 +292000 ekin = 3.68972381818918 | erot = 4.12076553978675 | epot = -37.9100323199299 | etot = -30.099542961954 +293000 ekin = 3.83177225674866 | erot = 4.37726484522711 | epot = -38.0821109906698 | etot = -29.873073888694 +294000 ekin = 4.06640459910184 | erot = 3.74462680595312 | epot = -38.1926156973086 | etot = -30.3815842922536 +295000 ekin = 4.21784736111051 | erot = 3.82616484716773 | epot = -38.2890286287626 | etot = -30.2450164204843 +296000 ekin = 4.26440738773642 | erot = 3.95694734709946 | epot = -38.3824567525617 | etot = -30.1611020177258 +297000 ekin = 4.04618321058694 | erot = 4.11344152769738 | epot = -38.4823151027029 | etot = -30.3226903644186 +298000 ekin = 4.04534420229638 | erot = 4.08413503201913 | epot = -38.5648464298593 | etot = -30.4353671955438 +299000 ekin = 4.05890996735844 | erot = 4.75454163668528 | epot = -38.6394632376441 | etot = -29.8260116336004 +300000 ekin = 4.0635552245577 | erot = 4.46292256841634 | epot = -38.7062117520834 | etot = -30.1797339591093 +301000 ekin = 4.01853385887666 | erot = 4.67242188374991 | epot = -38.7555551980346 | etot = -30.064599455408 +302000 ekin = 3.97170308302892 | erot = 4.62245717998414 | epot = -38.7884989680144 | etot = -30.1943387050014 +303000 ekin = 4.00670279913505 | erot = 4.89772983741924 | epot = -38.7992363136571 | etot = -29.8948036771028 +304000 ekin = 3.81374525151675 | erot = 4.65389365987343 | epot = -38.8327396351168 | etot = -30.3651007237266 +305000 ekin = 3.70792918499057 | erot = 4.53646691129898 | epot = -38.8671341843094 | etot = -30.6227380880198 +306000 ekin = 3.5851913585686 | erot = 4.40317156262038 | epot = -38.8961174826079 | etot = -30.9077545614189 +307000 ekin = 3.52830601019323 | erot = 4.12955816022915 | epot = -38.9381266871204 | etot = -31.280262516698 +308000 ekin = 3.37444573697906 | erot = 3.65266283146944 | epot = -38.9820449321947 | etot = -31.9549363637462 +309000 ekin = 3.29877896595899 | erot = 4.06788139443835 | epot = -39.036569619858 | etot = -31.6699092594607 +310000 ekin = 3.27216182566105 | erot = 3.86752279813193 | epot = -39.0649343092174 | etot = -31.9252496854244 +311000 ekin = 3.26050147382305 | erot = 3.90928978323582 | epot = -39.0580520931937 | etot = -31.8882608361348 +312000 ekin = 3.18483009089521 | erot = 3.90959546619214 | epot = -39.0257212693581 | etot = -31.9312957122708 +313000 ekin = 3.09609326591795 | erot = 3.75025646421262 | epot = -38.9535227577839 | etot = -32.1071730276533 +314000 ekin = 2.95184537018542 | erot = 4.07381717812341 | epot = -38.8888909934783 | etot = -31.8632284451695 +315000 ekin = 2.92238623527567 | erot = 3.96815066682739 | epot = -38.8370494801768 | etot = -31.9465125780737 +316000 ekin = 2.71301507861596 | erot = 3.80807978932931 | epot = -38.799834574398 | etot = -32.2787397064527 +317000 ekin = 2.71357150367647 | erot = 4.15190966526565 | epot = -38.7626719044115 | etot = -31.8971907354694 +318000 ekin = 2.62158267835359 | erot = 4.27134701113436 | epot = -38.7271070788676 | etot = -31.8341773893796 +319000 ekin = 2.55366548062862 | erot = 4.41350408683203 | epot = -38.7297464727616 | etot = -31.7625769053009 +320000 ekin = 2.43397240538545 | erot = 4.29070167476848 | epot = -38.7203908826319 | etot = -31.995716802478 +321000 ekin = 2.4091696193894 | erot = 4.08120981437134 | epot = -38.7041016741435 | etot = -32.2137222403828 +322000 ekin = 2.40921951438691 | erot = 3.84656254092884 | epot = -38.6896664254558 | etot = -32.4338843701401 +323000 ekin = 2.47763175846149 | erot = 3.74024157191534 | epot = -38.6582034756258 | etot = -32.440330145249 +324000 ekin = 2.50557286685258 | erot = 3.62726015904489 | epot = -38.6277589097223 | etot = -32.4949258838248 +325000 ekin = 2.46128003790469 | erot = 3.30955838055057 | epot = -38.6182210526501 | etot = -32.8473826341949 +326000 ekin = 2.5036042222413 | erot = 3.11309077075945 | epot = -38.6155228491478 | etot = -32.998827856147 +327000 ekin = 2.58559564340014 | erot = 3.03172964208485 | epot = -38.6235874334492 | etot = -33.0062621479642 +328000 ekin = 2.7498426607985 | erot = 3.02808338407904 | epot = -38.6550386035095 | etot = -32.8771125586319 +329000 ekin = 2.91966436364517 | erot = 2.97144348177553 | epot = -38.6820454853232 | etot = -32.7909376399025 +330000 ekin = 3.01494295487831 | erot = 3.44138384990523 | epot = -38.7383158304586 | etot = -32.2819890256751 +331000 ekin = 3.02442201542035 | erot = 3.78657407910216 | epot = -38.7939596216321 | etot = -31.9829635271096 +332000 ekin = 3.04445691127442 | erot = 3.8278890195312 | epot = -38.8517978078766 | etot = -31.979451877071 +333000 ekin = 3.03465557138406 | erot = 3.68623317701473 | epot = -38.9019287356726 | etot = -32.1810399872738 +334000 ekin = 2.98091475863421 | erot = 3.87909097065042 | epot = -38.9429458678105 | etot = -32.0829401385258 +335000 ekin = 3.18730692360931 | erot = 3.9229815323581 | epot = -38.9915367606724 | etot = -31.881248304705 +336000 ekin = 3.28082580011883 | erot = 4.25501923477972 | epot = -39.0382949038811 | etot = -31.5024498689825 +337000 ekin = 3.33075954016498 | erot = 4.58632261209064 | epot = -39.0662594017922 | etot = -31.1491772495366 +338000 ekin = 3.31328438683345 | erot = 4.17966745642974 | epot = -39.0415239975115 | etot = -31.5485721542483 +339000 ekin = 3.33917527804133 | erot = 4.28130062815462 | epot = -38.9842917012714 | etot = -31.3638157950755 +340000 ekin = 3.33492148280262 | erot = 4.35651035139101 | epot = -38.8943885223068 | etot = -31.2029566881131 +341000 ekin = 3.34614172096363 | erot = 4.05115720989153 | epot = -38.7823758155587 | etot = -31.3850768847036 +342000 ekin = 3.34251507796678 | erot = 4.42814474655728 | epot = -38.6331517957714 | etot = -30.8624919712473 +343000 ekin = 3.20631341754612 | erot = 3.78967989344564 | epot = -38.4960486393224 | etot = -31.5000553283306 +344000 ekin = 3.07148244251153 | erot = 3.87583965670226 | epot = -38.3948328820768 | etot = -31.447510782863 +345000 ekin = 3.09789874291703 | erot = 3.99460565240904 | epot = -38.3201974875894 | etot = -31.2276930922633 +346000 ekin = 3.02500081268322 | erot = 3.91508207831951 | epot = -38.27506306136 | etot = -31.3349801703573 +347000 ekin = 2.94406849477762 | erot = 3.8622967016244 | epot = -38.2289722622904 | etot = -31.4226070658884 +348000 ekin = 2.95641250006426 | erot = 3.72625853383772 | epot = -38.1919210104045 | etot = -31.5092499765026 +349000 ekin = 3.03918076184473 | erot = 3.94202050743586 | epot = -38.1810668298085 | etot = -31.1998655605279 +350000 ekin = 3.09062612520389 | erot = 3.91215331884812 | epot = -38.2023245264386 | etot = -31.1995450823866 +351000 ekin = 3.13831719496464 | erot = 3.99916602553218 | epot = -38.2111529945909 | etot = -31.0736697740941 +352000 ekin = 3.10196313130342 | erot = 3.92254342354138 | epot = -38.2543166357448 | etot = -31.2298100809 +353000 ekin = 3.17266611312433 | erot = 3.89473509639757 | epot = -38.3205511283306 | etot = -31.2531499188087 +354000 ekin = 3.20288707130886 | erot = 4.38957454856396 | epot = -38.3888699269268 | etot = -30.796408307054 +355000 ekin = 3.1596595759597 | erot = 4.27393537405652 | epot = -38.4369161779509 | etot = -31.0033212279347 +356000 ekin = 3.0196784402613 | erot = 4.46559381130417 | epot = -38.4622452099032 | etot = -30.9769729583378 +357000 ekin = 2.97836465744993 | erot = 4.24123654485003 | epot = -38.4340474220209 | etot = -31.214446219721 +358000 ekin = 2.90298621775703 | erot = 4.00214290087722 | epot = -38.3669225243923 | etot = -31.4617934057581 +359000 ekin = 2.89703951576627 | erot = 3.75540528896982 | epot = -38.2596281019022 | etot = -31.6071832971661 +360000 ekin = 2.89517468979402 | erot = 3.69844688179083 | epot = -38.1408983158931 | etot = -31.5472767443082 +361000 ekin = 2.80138616808295 | erot = 3.38323529451502 | epot = -38.0246589917391 | etot = -31.8400375291411 +362000 ekin = 2.77162168417612 | erot = 2.91331523066537 | epot = -37.9398868290149 | etot = -32.2549499141734 +363000 ekin = 2.78539815378433 | erot = 2.68460040337589 | epot = -37.8665635409938 | etot = -32.3965649838336 +364000 ekin = 2.6806781219229 | erot = 2.78677391239236 | epot = -37.7617899033784 | etot = -32.2943378690631 +365000 ekin = 2.54070043685876 | erot = 2.83653994835753 | epot = -37.6554311404474 | etot = -32.2781907552311 +366000 ekin = 2.41606481092138 | erot = 2.86609766611192 | epot = -37.5516282283376 | etot = -32.2694657513043 +367000 ekin = 2.46811866465482 | erot = 3.34221140329 | epot = -37.4475028758826 | etot = -31.6371728079378 +368000 ekin = 2.42926223365494 | erot = 3.33046663396725 | epot = -37.3674460967945 | etot = -31.6077172291723 +369000 ekin = 2.43816169312792 | erot = 3.26459431026916 | epot = -37.3019788371043 | etot = -31.5992228337072 +370000 ekin = 2.46038177337525 | erot = 3.10066469966251 | epot = -37.2626057339964 | etot = -31.7015592609586 +371000 ekin = 2.44062438526228 | erot = 2.87778487491551 | epot = -37.2539180634397 | etot = -31.9355088032619 +372000 ekin = 2.4119643832672 | erot = 3.07515188922145 | epot = -37.3089635753533 | etot = -31.8218473028647 +373000 ekin = 2.48050565170775 | erot = 3.18196875652298 | epot = -37.4397878357735 | etot = -31.7773134275428 +374000 ekin = 2.63530688061921 | erot = 3.59156982435214 | epot = -37.5884648424034 | etot = -31.3615881374321 +375000 ekin = 2.68283894448257 | erot = 3.3245108406823 | epot = -37.7715422578285 | etot = -31.7641924726636 +376000 ekin = 2.79488034579907 | erot = 3.22988532668875 | epot = -38.0009039102152 | etot = -31.9761382377273 +377000 ekin = 2.97793932778636 | erot = 3.1487944738539 | epot = -38.2360750185572 | etot = -32.1093412169169 +378000 ekin = 3.04959845592823 | erot = 3.49481966296083 | epot = -38.5013695235687 | etot = -31.9569514046797 +379000 ekin = 3.19106410727104 | erot = 3.36561045250103 | epot = -38.7688607813371 | etot = -32.2121862215651 +380000 ekin = 3.25183572215722 | erot = 3.58875776192795 | epot = -39.0288452181148 | etot = -32.1882517340297 +381000 ekin = 3.33794215221589 | erot = 3.69339177566719 | epot = -39.3017064605086 | etot = -32.2703725326255 +382000 ekin = 3.49270190624137 | erot = 3.86829998834039 | epot = -39.5268729273469 | etot = -32.1658710327651 +383000 ekin = 3.55662169084774 | erot = 3.53333329088007 | epot = -39.726779107516 | etot = -32.6368241257882 +384000 ekin = 3.69351012028544 | erot = 3.28268730044336 | epot = -39.8789874723582 | etot = -32.9027900516294 +385000 ekin = 3.68733706037504 | erot = 3.68055641648011 | epot = -39.999883925349 | etot = -32.6319904484938 +386000 ekin = 3.71694831249284 | erot = 3.79434784508062 | epot = -40.0869801892988 | etot = -32.5756840317253 +387000 ekin = 3.76861509268673 | erot = 3.88558369375086 | epot = -40.1715737743675 | etot = -32.5173749879299 +388000 ekin = 3.8301760688337 | erot = 4.20859412334347 | epot = -40.2007323597247 | etot = -32.1619621675475 +389000 ekin = 3.86768485031758 | erot = 3.99003783907099 | epot = -40.1899129305042 | etot = -32.3321902411156 +390000 ekin = 3.97485559059841 | erot = 3.73907035926306 | epot = -40.1534652302146 | etot = -32.4395392803531 +391000 ekin = 3.99255423920738 | erot = 3.459854141016 | epot = -40.0955220791989 | etot = -32.6431136989755 +392000 ekin = 4.01983776245668 | erot = 3.684257426475 | epot = -39.9999647918604 | etot = -32.2958696029287 +393000 ekin = 4.02356764424247 | erot = 3.83787437414721 | epot = -39.8549016020689 | etot = -31.9934595836793 +394000 ekin = 3.93980876114322 | erot = 3.99211744164119 | epot = -39.7011477670266 | etot = -31.7692215642422 +395000 ekin = 4.11174368478723 | erot = 3.75033473410246 | epot = -39.5451859148434 | etot = -31.6831074959538 +396000 ekin = 4.20376876107167 | erot = 3.67040632781357 | epot = -39.394880998087 | etot = -31.5207059092017 +397000 ekin = 4.13633572842997 | erot = 3.65151581957605 | epot = -39.2564297317577 | etot = -31.4685781837517 +398000 ekin = 4.13905245601627 | erot = 3.71620600673367 | epot = -39.093596770216 | etot = -31.2383383074661 +399000 ekin = 4.10332411545528 | erot = 3.71374971681591 | epot = -38.9205234935042 | etot = -31.103449661233 +400000 ekin = 4.06766016908479 | erot = 3.42139504654381 | epot = -38.7497473150009 | etot = -31.2606920993723 +401000 ekin = 3.97284164111999 | erot = 3.81120481171761 | epot = -38.6001977504163 | etot = -30.8161512975787 +402000 ekin = 3.90587383547465 | erot = 3.53418826218585 | epot = -38.4681757167877 | etot = -31.0281136191272 +403000 ekin = 3.91259869514561 | erot = 3.63738639184103 | epot = -38.3230308363684 | etot = -30.7730457493818 +404000 ekin = 3.79936006877832 | erot = 3.32641249272552 | epot = -38.2009092385689 | etot = -31.0751366770651 +405000 ekin = 3.8251759680116 | erot = 3.13064904024261 | epot = -38.1553776059004 | etot = -31.1995525976462 +406000 ekin = 3.73725599382609 | erot = 3.08306268157751 | epot = -38.1316917306566 | etot = -31.311373055253 +407000 ekin = 3.726517750459 | erot = 3.09861818078622 | epot = -38.1634910279953 | etot = -31.3383550967501 +408000 ekin = 3.79931976439459 | erot = 3.25718386016374 | epot = -38.2217683212397 | etot = -31.1652646966814 +409000 ekin = 3.95093187918724 | erot = 3.4395040977601 | epot = -38.2689453197333 | etot = -30.8785093427859 +410000 ekin = 4.07121708138889 | erot = 3.83760071106058 | epot = -38.3189798432044 | etot = -30.4101620507549 +411000 ekin = 4.23307978558165 | erot = 3.98162063698057 | epot = -38.3721329673504 | etot = -30.1574325447882 +412000 ekin = 4.241170808143 | erot = 3.99737193476948 | epot = -38.4124767699443 | etot = -30.1739340270318 +413000 ekin = 4.23580670923547 | erot = 3.8106439850279 | epot = -38.4212920990952 | etot = -30.3748414048318 +414000 ekin = 4.27445938143083 | erot = 3.9812454132049 | epot = -38.4106571527341 | etot = -30.1549523580983 +415000 ekin = 4.38899479005091 | erot = 3.80279226112388 | epot = -38.3596783722964 | etot = -30.1678913211216 +416000 ekin = 4.45628965411063 | erot = 3.63102956113277 | epot = -38.3042311126166 | etot = -30.2169118973732 +417000 ekin = 4.49028461121067 | erot = 3.62754419665983 | epot = -38.25831980893 | etot = -30.1404910010595 +418000 ekin = 4.45936601962003 | erot = 3.71144506663837 | epot = -38.1813464675297 | etot = -30.0105353812713 +419000 ekin = 4.38379837521008 | erot = 3.33513327030905 | epot = -38.0724868069419 | etot = -30.3535551614228 +420000 ekin = 4.283111933024 | erot = 3.09826419668605 | epot = -37.9370678690097 | etot = -30.5556917392996 +421000 ekin = 4.152480975106 | erot = 3.56237827808224 | epot = -37.7709210423883 | etot = -30.0560617892 +422000 ekin = 3.95490687211588 | erot = 3.47480957997332 | epot = -37.5854884820709 | etot = -30.1557720299817 +423000 ekin = 3.91714305790356 | erot = 3.4847628632339 | epot = -37.3949936437694 | etot = -29.9930877226319 +424000 ekin = 3.84213202460288 | erot = 3.52777059768033 | epot = -37.2158434462617 | etot = -29.8459408239785 +425000 ekin = 3.71924289661388 | erot = 3.33663609660611 | epot = -37.072252600123 | etot = -30.016373606903 +426000 ekin = 3.64441997260647 | erot = 3.36227935441014 | epot = -36.9667678357551 | etot = -29.9600685087385 +427000 ekin = 3.75655721345781 | erot = 3.37897054079373 | epot = -36.8611280898055 | etot = -29.7256003355539 +428000 ekin = 3.74409443646521 | erot = 3.1773287235424 | epot = -36.742715037602 | etot = -29.8212918775944 +429000 ekin = 3.6632902831786 | erot = 2.78764787478687 | epot = -36.6486255145436 | etot = -30.1976873565782 +430000 ekin = 3.62135290496445 | erot = 2.6733797516058 | epot = -36.560604151542 | etot = -30.2658714949717 +431000 ekin = 3.61616361793053 | erot = 2.69754710014203 | epot = -36.506732939117 | etot = -30.1930222210445 +432000 ekin = 3.49552617760825 | erot = 3.08491352170465 | epot = -36.485170074763 | etot = -29.9047303754501 +433000 ekin = 3.58020816083944 | erot = 2.88002256286314 | epot = -36.5217696117553 | etot = -30.0615388880528 +434000 ekin = 3.59867849318971 | erot = 3.0840797331355 | epot = -36.6202495320039 | etot = -29.9374913056787 +435000 ekin = 3.67331527289036 | erot = 3.42657552434419 | epot = -36.7488916307825 | etot = -29.6490008335479 +436000 ekin = 3.82088042289272 | erot = 3.65447442369897 | epot = -36.9085622220517 | etot = -29.43320737546 +437000 ekin = 3.86869421673766 | erot = 3.95470287079859 | epot = -37.0720316005957 | etot = -29.2486345130595 +438000 ekin = 4.11090595842083 | erot = 3.77540801446838 | epot = -37.2088542252226 | etot = -29.3225402523333 +439000 ekin = 4.12926159073602 | erot = 4.06917140325885 | epot = -37.351759051221 | etot = -29.1533260572261 +440000 ekin = 4.09029177261524 | erot = 4.14981299565281 | epot = -37.4912988817269 | etot = -29.2511941134588 +441000 ekin = 4.14485979348682 | erot = 4.37283240826395 | epot = -37.6181493098546 | etot = -29.1004571081038 +442000 ekin = 4.12304009572841 | erot = 4.39045893698217 | epot = -37.7155315750664 | etot = -29.2020325423558 +443000 ekin = 4.23471751438731 | erot = 4.14989601608928 | epot = -37.768614271265 | etot = -29.3840007407884 +444000 ekin = 4.35772646838224 | erot = 4.52232474512897 | epot = -37.7816885908053 | etot = -28.9016373772941 +445000 ekin = 4.39118784053262 | erot = 4.66570824296109 | epot = -37.7439950146598 | etot = -28.6870989311661 +446000 ekin = 4.39675921765031 | erot = 4.46936063153376 | epot = -37.6960851354907 | etot = -28.8299652863066 +447000 ekin = 4.35336664890442 | erot = 4.44173113672769 | epot = -37.6140263912413 | etot = -28.8189286056092 +448000 ekin = 4.28498441172979 | erot = 4.19781838322426 | epot = -37.5090341348627 | etot = -29.0262313399087 +449000 ekin = 4.31763982219652 | erot = 4.52832551746764 | epot = -37.4084017454329 | etot = -28.5624364057687 +450000 ekin = 4.34138928411261 | erot = 4.44258564037432 | epot = -37.3062489259438 | etot = -28.5222740014569 +451000 ekin = 4.30985185878605 | erot = 4.23825662962946 | epot = -37.1459619150061 | etot = -28.5978534265906 +452000 ekin = 4.32592045036098 | erot = 3.8660276663028 | epot = -36.9847035634508 | etot = -28.792755446787 +453000 ekin = 4.32845268851063 | erot = 3.54171363095618 | epot = -36.8340779762824 | etot = -28.9639116568156 +454000 ekin = 4.31011457813703 | erot = 3.79537837348597 | epot = -36.7199830616559 | etot = -28.6144901100328 +455000 ekin = 4.29550433639214 | erot = 3.85241036204668 | epot = -36.6489739160371 | etot = -28.5010592175982 +456000 ekin = 4.37032742709196 | erot = 4.00721124204773 | epot = -36.6190063800956 | etot = -28.2414677109559 +457000 ekin = 4.36426470286789 | erot = 3.85637152044941 | epot = -36.5969553476853 | etot = -28.376319124368 +458000 ekin = 4.32567014378617 | erot = 3.50123530464575 | epot = -36.5630453883135 | etot = -28.7361399398816 +459000 ekin = 4.3893381573867 | erot = 3.57401843708546 | epot = -36.5693343587042 | etot = -28.605977764232 +460000 ekin = 4.31317855607494 | erot = 4.09613513000612 | epot = -36.6229031356536 | etot = -28.2135894495725 +461000 ekin = 4.31811012640179 | erot = 4.38273826542215 | epot = -36.70247802377 | etot = -28.0016296319461 +462000 ekin = 4.3366863877001 | erot = 4.51374491218817 | epot = -36.8227361919449 | etot = -27.9723048920566 +463000 ekin = 4.27564269849664 | erot = 4.86202296781303 | epot = -36.9415310835084 | etot = -27.8038654171987 +464000 ekin = 4.25704856573543 | erot = 4.74085846897256 | epot = -37.0390079052471 | etot = -28.0411008705391 +465000 ekin = 4.27536374407092 | erot = 4.49932366093905 | epot = -37.1090432428533 | etot = -28.3343558378433 +466000 ekin = 4.30607368146068 | erot = 4.23786653917903 | epot = -37.1491605127936 | etot = -28.6052202921539 +467000 ekin = 4.2491978620046 | erot = 4.12771930877699 | epot = -37.1714598423964 | etot = -28.7945426716148 +468000 ekin = 4.39683218085591 | erot = 3.85228521386559 | epot = -37.2088712844973 | etot = -28.9597538897758 +469000 ekin = 4.64124419278982 | erot = 3.80754439193721 | epot = -37.276730222032 | etot = -28.8279416373049 +470000 ekin = 4.66178408905675 | erot = 3.92065938428513 | epot = -37.3876740781875 | etot = -28.8052306048457 +471000 ekin = 4.75392904131986 | erot = 4.24739494727095 | epot = -37.5007122646075 | etot = -28.4993882760167 +472000 ekin = 4.78287126449292 | erot = 4.29738258008793 | epot = -37.5977046601011 | etot = -28.5174508155202 +473000 ekin = 4.83746609770183 | erot = 4.38666527032485 | epot = -37.6671790710826 | etot = -28.4430477030559 +474000 ekin = 4.79054197671376 | erot = 4.34169424272138 | epot = -37.6856820094293 | etot = -28.5534457899942 +475000 ekin = 4.83235787688145 | erot = 4.21788406575012 | epot = -37.6508263787861 | etot = -28.6005844361546 +476000 ekin = 4.77650421806813 | erot = 4.23519664592598 | epot = -37.5559363402036 | etot = -28.5442354762095 +477000 ekin = 4.70149228687153 | erot = 3.94955206004049 | epot = -37.4316333722383 | etot = -28.7805890253263 +478000 ekin = 4.65828612344613 | erot = 3.52306589214554 | epot = -37.3056353897912 | etot = -29.1242833741995 +479000 ekin = 4.49034904671755 | erot = 3.69691237093679 | epot = -37.1645007343033 | etot = -28.977239316649 +480000 ekin = 4.42035953830873 | erot = 3.62614880736063 | epot = -36.9855336534948 | etot = -28.9390253078254 +481000 ekin = 4.29236052675552 | erot = 3.46283113670755 | epot = -36.778837676618 | etot = -29.0236460131549 +482000 ekin = 4.24695006747703 | erot = 3.64617122659715 | epot = -36.5783264764331 | etot = -28.685205182359 +483000 ekin = 4.27724439911399 | erot = 3.65906944039054 | epot = -36.4031794376627 | etot = -28.4668655981582 +484000 ekin = 4.2785974211617 | erot = 3.80998418987604 | epot = -36.2601336102694 | etot = -28.1715519992317 +485000 ekin = 4.21291837199932 | erot = 3.8427823044223 | epot = -36.141503315863 | etot = -28.0858026394413 +486000 ekin = 3.9839252640706 | erot = 3.69687119417294 | epot = -36.0420007851875 | etot = -28.3612043269439 +487000 ekin = 3.87685523954227 | erot = 3.52087214489094 | epot = -35.9790179936878 | etot = -28.5812906092545 +488000 ekin = 3.74675884240029 | erot = 3.80072807052997 | epot = -35.9652058586033 | etot = -28.417718945673 +489000 ekin = 3.61099051841834 | erot = 4.09702697313287 | epot = -35.9887686799326 | etot = -28.2807511883814 +490000 ekin = 3.72073699277815 | erot = 3.89157882585025 | epot = -36.0103724524783 | etot = -28.3980566338499 +491000 ekin = 3.72740917275115 | erot = 4.01795497893002 | epot = -36.0292354570353 | etot = -28.2838713053542 +492000 ekin = 3.67547789628858 | erot = 3.85969822517316 | epot = -36.0430681478948 | etot = -28.507892026433 +493000 ekin = 3.65198421841226 | erot = 3.75518718738361 | epot = -36.0824152706771 | etot = -28.6752438648813 +494000 ekin = 3.4852821998486 | erot = 3.8153550877854 | epot = -36.1423710455837 | etot = -28.8417337579497 +495000 ekin = 3.31359070882208 | erot = 4.11558724766118 | epot = -36.2268684383707 | etot = -28.7976904818874 +496000 ekin = 3.27798311005969 | erot = 3.88806115727323 | epot = -36.3363270902379 | etot = -29.170282822905 +497000 ekin = 3.23000081873816 | erot = 4.5315385178341 | epot = -36.481720183114 | etot = -28.7201808465418 +498000 ekin = 3.35490986062535 | erot = 4.76314991175258 | epot = -36.6514686581236 | etot = -28.5334088857457 +499000 ekin = 3.39102564180502 | erot = 4.99058516868934 | epot = -36.8025368986548 | etot = -28.4209260881604 +500000 ekin = 3.44319922277998 | erot = 4.29432196305736 | epot = -36.9177193599231 | etot = -29.1801981740858 +501000 ekin = 3.47746008955509 | erot = 4.289941738028 | epot = -37.0187053512324 | etot = -29.2513035236494 +502000 ekin = 3.58696948456752 | erot = 4.55410136617418 | epot = -37.1018103829437 | etot = -28.960739532202 +503000 ekin = 3.68317380855592 | erot = 4.60652443433648 | epot = -37.1620776601797 | etot = -28.8723794172873 +504000 ekin = 3.68852053014443 | erot = 4.67783023002264 | epot = -37.2052759454199 | etot = -28.8389251852528 +505000 ekin = 3.88723268453866 | erot = 4.53079850437663 | epot = -37.2950608294683 | etot = -28.877029640553 +506000 ekin = 3.80925396925163 | erot = 4.47086505886218 | epot = -37.3479933337838 | etot = -29.06787430567 +507000 ekin = 3.73248519551991 | erot = 4.21393839264144 | epot = -37.4256513139284 | etot = -29.4792277257671 +508000 ekin = 3.80672760184063 | erot = 3.93708079377005 | epot = -37.4951091449467 | etot = -29.751300749336 +509000 ekin = 3.80086991164608 | erot = 3.74333566662504 | epot = -37.5406480313395 | etot = -29.9964424530683 +510000 ekin = 3.89850649197978 | erot = 3.97775581109505 | epot = -37.5934385426631 | etot = -29.7171762395883 +511000 ekin = 3.81393185765464 | erot = 4.00469160928647 | epot = -37.6349932199755 | etot = -29.8163697530344 +512000 ekin = 3.7684396284637 | erot = 4.34524756747826 | epot = -37.6787808921542 | etot = -29.5650936962122 +513000 ekin = 3.70769437024747 | erot = 4.19222442242684 | epot = -37.7114576947707 | etot = -29.8115389020964 +514000 ekin = 3.65606306228176 | erot = 4.64296237641028 | epot = -37.7095823242883 | etot = -29.4105568855962 +515000 ekin = 3.5052281855745 | erot = 4.47916848114099 | epot = -37.6783049637298 | etot = -29.6939082970143 +516000 ekin = 3.59266443877101 | erot = 5.02978018029494 | epot = -37.6477009850688 | etot = -29.0252563660028 +517000 ekin = 3.53729866959058 | erot = 4.95641997732805 | epot = -37.644541266991 | etot = -29.1508226200724 +518000 ekin = 3.55341695305132 | erot = 4.57512459674255 | epot = -37.6532745224308 | etot = -29.5247329726369 +519000 ekin = 3.61605940841961 | erot = 4.59842321288953 | epot = -37.7181887221249 | etot = -29.5037061008158 +520000 ekin = 3.66003580736891 | erot = 4.52802897844102 | epot = -37.8184531846622 | etot = -29.6303883988522 +521000 ekin = 3.57990395101936 | erot = 4.58686564429493 | epot = -37.9529160430901 | etot = -29.7861464477758 +522000 ekin = 3.58721017350486 | erot = 4.78958389957763 | epot = -38.1056938634054 | etot = -29.7288997903229 +523000 ekin = 3.7455374895203 | erot = 4.82242710318161 | epot = -38.249659851946 | etot = -29.6816952592441 +524000 ekin = 3.8367296557297 | erot = 5.1780625575552 | epot = -38.3420385705452 | etot = -29.3272463572603 +525000 ekin = 3.97426514986068 | erot = 5.13820563111667 | epot = -38.4306455211977 | etot = -29.3181747402204 +526000 ekin = 4.03278131821146 | erot = 4.61480893928539 | epot = -38.4813375347266 | etot = -29.8337472772297 +527000 ekin = 4.15303805139338 | erot = 4.03339974605316 | epot = -38.4813261438674 | etot = -30.2948883464208 +528000 ekin = 4.34085606106391 | erot = 3.63416049936053 | epot = -38.4621670653444 | etot = -30.4871505049199 +529000 ekin = 4.53593485604709 | erot = 3.72087643644205 | epot = -38.417501648356 | etot = -30.1606903558668 +530000 ekin = 4.65836945322522 | erot = 3.5823370050418 | epot = -38.3861765288022 | etot = -30.1454700705352 +531000 ekin = 4.66519878740321 | erot = 3.41094947734083 | epot = -38.3363103504893 | etot = -30.2601620857452 +532000 ekin = 4.80041164317288 | erot = 3.07760528500134 | epot = -38.3151265786575 | etot = -30.4371096504833 +533000 ekin = 4.73180745168947 | erot = 3.06230961560373 | epot = -38.3468719461379 | etot = -30.5527548788447 +534000 ekin = 4.77276572097011 | erot = 3.01963113043202 | epot = -38.4024212860539 | etot = -30.6100244346518 +535000 ekin = 4.8569392849477 | erot = 2.8251632104728 | epot = -38.5360450508862 | etot = -30.8539425554657 +536000 ekin = 4.79265980947574 | erot = 2.9077544610961 | epot = -38.7196748122557 | etot = -31.0192605416839 +537000 ekin = 4.8694795576244 | erot = 3.00989555981224 | epot = -38.9076102830991 | etot = -31.0282351656625 +538000 ekin = 5.00269155741106 | erot = 2.68875189029915 | epot = -39.0473675460742 | etot = -31.355924098364 +539000 ekin = 4.98226102919721 | erot = 2.9218882996937 | epot = -39.1655668480607 | etot = -31.2614175191698 +540000 ekin = 4.99147016878216 | erot = 3.35574385805742 | epot = -39.2596960810253 | etot = -30.9124820541857 +541000 ekin = 4.92725844601428 | erot = 3.28345034188319 | epot = -39.3089899760125 | etot = -31.098281188115 +542000 ekin = 4.77242859226853 | erot = 3.31966912230266 | epot = -39.290238437105 | etot = -31.1981407225338 +543000 ekin = 4.65726157165086 | erot = 3.56099171692955 | epot = -39.1715392323124 | etot = -30.953285943732 +544000 ekin = 4.75158561074879 | erot = 2.98586301386342 | epot = -39.0000211966266 | etot = -31.2625725720144 +545000 ekin = 4.71389651780192 | erot = 3.29722166624284 | epot = -38.8124009343347 | etot = -30.8012827502899 +546000 ekin = 4.59452933616211 | erot = 3.65785900566388 | epot = -38.6597531372896 | etot = -30.4073647954636 +547000 ekin = 4.49485576841329 | erot = 3.52227156689634 | epot = -38.5261493757316 | etot = -30.509022040422 +548000 ekin = 4.49472654055115 | erot = 3.49603087938245 | epot = -38.3944216290951 | etot = -30.4036642091615 +549000 ekin = 4.39213180937533 | erot = 3.53228763855232 | epot = -38.2774675964384 | etot = -30.3530481485108 +550000 ekin = 4.36283999146784 | erot = 3.78776441036084 | epot = -38.2051317998107 | etot = -30.054527397982 +551000 ekin = 4.3226010693823 | erot = 4.01133252124201 | epot = -38.1611801425645 | etot = -29.8272465519402 +552000 ekin = 4.33183515664561 | erot = 3.98124414472576 | epot = -38.153772138803 | etot = -29.8406928374316 +553000 ekin = 4.30534974680474 | erot = 3.81209066755014 | epot = -38.1803693007097 | etot = -30.0629288863549 +554000 ekin = 4.29335219580314 | erot = 3.80213545963908 | epot = -38.2389597407399 | etot = -30.1434720852977 +555000 ekin = 4.45825549052385 | erot = 4.03672150414325 | epot = -38.3296083261046 | etot = -29.8346313314375 +556000 ekin = 4.63230188756517 | erot = 3.70797489704037 | epot = -38.4795834327921 | etot = -30.1393066481866 +557000 ekin = 4.7062229398582 | erot = 4.51036732636183 | epot = -38.6738842895281 | etot = -29.4572940233081 +558000 ekin = 4.70612532334176 | erot = 4.30314260207011 | epot = -38.9099036274272 | etot = -29.9006357020154 +559000 ekin = 4.85842132468142 | erot = 4.45569884582871 | epot = -39.1571701897087 | etot = -29.8430500191985 +560000 ekin = 4.84667483493842 | erot = 4.2909749826346 | epot = -39.3692871188964 | etot = -30.2316373013234 +561000 ekin = 4.93080663772512 | erot = 4.40964672372479 | epot = -39.5560309503474 | etot = -30.2155775888975 +562000 ekin = 5.02786763240469 | erot = 4.09895267825196 | epot = -39.6620959555469 | etot = -30.5352756448903 +563000 ekin = 4.99483060861824 | erot = 4.56393029644404 | epot = -39.7001867829015 | etot = -30.1414258778392 +564000 ekin = 5.01292656089529 | erot = 4.4655943412775 | epot = -39.6969046345991 | etot = -30.2183837324263 +565000 ekin = 4.97924499589803 | erot = 4.56764102867122 | epot = -39.6391307119519 | etot = -30.0922446873826 +566000 ekin = 4.80472039327358 | erot = 4.49618530358116 | epot = -39.532014253858 | etot = -30.2311085570032 +567000 ekin = 4.59721417192401 | erot = 4.44898156673777 | epot = -39.3835091139999 | etot = -30.3373133753381 +568000 ekin = 4.59948947791994 | erot = 4.21619266891999 | epot = -39.1697350851653 | etot = -30.3540529383253 +569000 ekin = 4.46814520025952 | erot = 4.13625120915546 | epot = -38.9496016480665 | etot = -30.3452052386516 +570000 ekin = 4.63380574109383 | erot = 3.97471689520422 | epot = -38.718728428018 | etot = -30.11020579172 +571000 ekin = 4.51646555902281 | erot = 3.77943581302556 | epot = -38.5103017941538 | etot = -30.2144004221055 +572000 ekin = 4.44329973394602 | erot = 3.7381898397106 | epot = -38.3513010282128 | etot = -30.1698114545561 +573000 ekin = 4.48138796166295 | erot = 3.67030746094246 | epot = -38.2531080005807 | etot = -30.1014125779753 +574000 ekin = 4.57372019352159 | erot = 3.64740839838101 | epot = -38.156347689767 | etot = -29.9352190978644 +575000 ekin = 4.81962720354415 | erot = 3.58128135189807 | epot = -38.0780197446127 | etot = -29.6771111891705 +576000 ekin = 4.78739960955874 | erot = 3.16941649568994 | epot = -38.0548669136925 | etot = -30.0980508084438 +577000 ekin = 4.89624137933428 | erot = 3.37301453509229 | epot = -38.0581159208699 | etot = -29.7888600064433 +578000 ekin = 4.89993171052244 | erot = 3.39468878464203 | epot = -38.0636938795354 | etot = -29.7690733843709 +579000 ekin = 4.83297661461352 | erot = 3.08572772864731 | epot = -38.0577731810634 | etot = -30.1390688378025 +580000 ekin = 4.77298411404082 | erot = 3.09603380464132 | epot = -38.0675771405193 | etot = -30.1985592218372 +581000 ekin = 4.96965435170517 | erot = 3.06610493080443 | epot = -38.0894896837321 | etot = -30.0537304012225 +582000 ekin = 4.84477580774046 | erot = 2.99273203470777 | epot = -38.1047755328766 | etot = -30.2672676904284 +583000 ekin = 4.80184612340906 | erot = 2.99121545039794 | epot = -38.0992283827671 | etot = -30.3061668089601 +584000 ekin = 4.73999729115027 | erot = 2.9582025614058 | epot = -38.1193022601923 | etot = -30.4211024076362 +585000 ekin = 4.62963491646133 | erot = 2.99096158598542 | epot = -38.1514766562945 | etot = -30.5308801538478 +586000 ekin = 4.66196804986657 | erot = 3.11428540249501 | epot = -38.1645218154685 | etot = -30.3882683631069 +587000 ekin = 4.58446438916316 | erot = 3.26198289890957 | epot = -38.1451310277746 | etot = -30.2986837397019 +588000 ekin = 4.59050554157097 | erot = 3.37267542289071 | epot = -38.0928945920966 | etot = -30.1297136276349 +589000 ekin = 4.52148456601106 | erot = 3.20426810396368 | epot = -38.0431145518049 | etot = -30.3173618818302 +590000 ekin = 4.54292012494665 | erot = 3.1746661588888 | epot = -37.9867331121618 | etot = -30.2691468283263 +591000 ekin = 4.4671534284139 | erot = 3.30654504351679 | epot = -37.9702893954325 | etot = -30.1965909235018 +592000 ekin = 4.47491098921977 | erot = 3.6999642514397 | epot = -37.96964005272 | etot = -29.7947648120605 +593000 ekin = 4.43506697623668 | erot = 3.70250326611378 | epot = -37.982672172325 | etot = -29.8451019299745 +594000 ekin = 4.36908136306916 | erot = 3.59308231950687 | epot = -38.0038521048194 | etot = -30.0416884222434 +595000 ekin = 4.30615021787055 | erot = 3.60547435881484 | epot = -38.0517692624258 | etot = -30.1401446857404 +596000 ekin = 4.27538703974133 | erot = 3.70718417029039 | epot = -38.1072020006231 | etot = -30.1246307905914 +597000 ekin = 4.09427835861054 | erot = 3.56040857145023 | epot = -38.1368054718234 | etot = -30.4821185417626 +598000 ekin = 4.06772969179115 | erot = 3.98852753231075 | epot = -38.1357675039156 | etot = -30.0795102798136 +599000 ekin = 4.05823661502991 | erot = 3.99204411848296 | epot = -38.094416622612 | etot = -30.0441358890991 +600000 ekin = 4.14000207696602 | erot = 3.69886036268676 | epot = -38.0126500071596 | etot = -30.1737875675068 +601000 ekin = 4.14331251606218 | erot = 4.02012885446818 | epot = -37.8931408419344 | etot = -29.729699471404 +602000 ekin = 4.19175322865721 | erot = 3.63789752518648 | epot = -37.7768382304761 | etot = -29.9471874766324 +603000 ekin = 4.17700109074315 | erot = 3.33190102346874 | epot = -37.6571796612342 | etot = -30.1482775470223 +604000 ekin = 4.32110078335241 | erot = 3.37359972635297 | epot = -37.5481087406157 | etot = -29.8534082309104 +605000 ekin = 4.40829637956699 | erot = 3.12232098209626 | epot = -37.4615593717344 | etot = -29.9309420100712 +606000 ekin = 4.50978571460473 | erot = 2.82903034171764 | epot = -37.4107566252709 | etot = -30.0719405689485 +607000 ekin = 4.64775510562435 | erot = 2.72855004395394 | epot = -37.3886864614939 | etot = -30.0123813119156 +608000 ekin = 4.62515883775204 | erot = 2.6927668656574 | epot = -37.3472679127842 | etot = -30.0293422093748 +609000 ekin = 4.58072072733859 | erot = 2.72618151323749 | epot = -37.3211555189931 | etot = -30.014253278417 +610000 ekin = 4.37064710749547 | erot = 2.94205446769451 | epot = -37.3313655411416 | etot = -30.0186639659516 +611000 ekin = 4.30243700562367 | erot = 2.94482669781559 | epot = -37.3282578261779 | etot = -30.0809941227387 +612000 ekin = 4.37982748485341 | erot = 2.81236690797527 | epot = -37.3366791579242 | etot = -30.1444847650955 +613000 ekin = 4.49298433908211 | erot = 2.94229499226113 | epot = -37.3617837170398 | etot = -29.9265043856965 +614000 ekin = 4.63192250195887 | erot = 2.81948937077722 | epot = -37.3623397651557 | etot = -29.9109278924196 +615000 ekin = 4.56431794922691 | erot = 3.0411203817408 | epot = -37.3360474756729 | etot = -29.7306091447052 +616000 ekin = 4.48538645093135 | erot = 2.98636794618235 | epot = -37.2843360454654 | etot = -29.8125816483517 +617000 ekin = 4.35777724185508 | erot = 3.27046740448594 | epot = -37.2149609045278 | etot = -29.5867162581867 +618000 ekin = 4.13929013645531 | erot = 3.31436963968888 | epot = -37.1380165806133 | etot = -29.6843568044691 +619000 ekin = 3.99812604761941 | erot = 3.8069721617963 | epot = -37.0480074184854 | etot = -29.2429092090697 +620000 ekin = 3.75775297824748 | erot = 3.88935078371488 | epot = -37.0016709350121 | etot = -29.3545671730497 +621000 ekin = 3.59837254942665 | erot = 3.36974253347194 | epot = -36.9571399968608 | etot = -29.9890249139622 +622000 ekin = 3.52853751549672 | erot = 3.57220920853455 | epot = -36.9826672270776 | etot = -29.8819205030464 +623000 ekin = 3.44776927445729 | erot = 3.68524482792421 | epot = -37.0520182183616 | etot = -29.9190041159801 +624000 ekin = 3.42459051153803 | erot = 4.10039189185604 | epot = -37.1561365046956 | etot = -29.6311541013015 +625000 ekin = 3.47427533928245 | erot = 4.19316198399255 | epot = -37.3128709391508 | etot = -29.6454336158758 +626000 ekin = 3.59243588690058 | erot = 4.25331544595912 | epot = -37.4538356021372 | etot = -29.6080842692775 +627000 ekin = 3.65834270574552 | erot = 3.84587709669878 | epot = -37.5560189371567 | etot = -30.0517991347124 +628000 ekin = 3.70047562334578 | erot = 3.68821102783487 | epot = -37.6346624168371 | etot = -30.2459757656565 +629000 ekin = 3.73516234913433 | erot = 3.92476956261683 | epot = -37.7008434862915 | etot = -30.0409115745404 +630000 ekin = 3.81181204861757 | erot = 3.95913149926755 | epot = -37.7335643601767 | etot = -29.9626208122916 +631000 ekin = 3.81645534702376 | erot = 3.13210702566919 | epot = -37.7706097068457 | etot = -30.8220473341528 +632000 ekin = 3.83367227377587 | erot = 3.16390787891897 | epot = -37.8179976528052 | etot = -30.8204175001103 +633000 ekin = 3.78875173101134 | erot = 3.28627876080406 | epot = -37.8551980571895 | etot = -30.7801675653741 +634000 ekin = 3.6443572434567 | erot = 3.54689069849334 | epot = -37.8771184407041 | etot = -30.685870498754 +635000 ekin = 3.74927918910692 | erot = 3.50067245026003 | epot = -37.9120332365851 | etot = -30.6620815972182 +636000 ekin = 3.89890106913058 | erot = 3.51590480850449 | epot = -37.9883703460315 | etot = -30.5735644683965 +637000 ekin = 3.98051852239103 | erot = 3.51683885701818 | epot = -38.1188954220066 | etot = -30.6215380425974 +638000 ekin = 4.18679252196735 | erot = 3.48363716100453 | epot = -38.3003898519918 | etot = -30.6299601690199 +639000 ekin = 4.29259370089823 | erot = 3.44532403016775 | epot = -38.5009165327291 | etot = -30.7629988016631 +640000 ekin = 4.33862023546748 | erot = 3.6140024868752 | epot = -38.6627935284696 | etot = -30.710170806127 +641000 ekin = 4.47895119284614 | erot = 3.60758277909088 | epot = -38.7986251266555 | etot = -30.7120911547185 +642000 ekin = 4.48471207018753 | erot = 3.75535910837188 | epot = -38.8636204148756 | etot = -30.6235492363162 +643000 ekin = 4.56445558617346 | erot = 3.81552004634158 | epot = -38.8645537025221 | etot = -30.4845780700071 +644000 ekin = 4.7332947847572 | erot = 3.55885168491642 | epot = -38.8054956282287 | etot = -30.5133491585551 +645000 ekin = 4.69129439625574 | erot = 3.28200064721723 | epot = -38.7015474297407 | etot = -30.7282523862678 +646000 ekin = 4.5858300200132 | erot = 3.40859569463286 | epot = -38.5478616511676 | etot = -30.5534359365215 +647000 ekin = 4.60741071742922 | erot = 3.38831322436686 | epot = -38.3932861693423 | etot = -30.3975622275462 +648000 ekin = 4.51463144345975 | erot = 3.24274100333129 | epot = -38.2758434893351 | etot = -30.518471042544 +649000 ekin = 4.55491099792928 | erot = 3.31738105307143 | epot = -38.2201110845426 | etot = -30.3478190335419 +650000 ekin = 4.67226589728797 | erot = 3.60950811156238 | epot = -38.2202225605506 | etot = -29.9384485517003 +651000 ekin = 4.60851815831642 | erot = 3.77278937705218 | epot = -38.253633099544 | etot = -29.8723255641754 +652000 ekin = 4.67845920019102 | erot = 3.39376240096224 | epot = -38.2868824175934 | etot = -30.2146608164401 +653000 ekin = 4.66844839257092 | erot = 3.83803199311147 | epot = -38.3235322989533 | etot = -29.8170519132709 +654000 ekin = 4.71048953319322 | erot = 3.48299287365118 | epot = -38.3580887397251 | etot = -30.1646063328807 +655000 ekin = 4.59645355598624 | erot = 3.74782025282036 | epot = -38.4145657066931 | etot = -30.0702918978865 +656000 ekin = 4.75902771581103 | erot = 3.81874385847387 | epot = -38.4693742928372 | etot = -29.8916027185523 +657000 ekin = 4.6466802059304 | erot = 3.66656001060126 | epot = -38.4843211797294 | etot = -30.1710809631977 +658000 ekin = 4.55836001875084 | erot = 3.93329833863017 | epot = -38.4803826070965 | etot = -29.9887242497155 +659000 ekin = 4.55537392119735 | erot = 3.62854716021115 | epot = -38.4363459414659 | etot = -30.2524248600574 +660000 ekin = 4.415513333681 | erot = 3.65395590072885 | epot = -38.3663969488347 | etot = -30.2969277144248 +661000 ekin = 4.32449081576482 | erot = 3.7409091571769 | epot = -38.2884247485437 | etot = -30.223024775602 +662000 ekin = 4.23823124010357 | erot = 3.58833666048794 | epot = -38.1946280661735 | etot = -30.368060165582 +663000 ekin = 4.32618520330365 | erot = 3.71369597709404 | epot = -38.0940311251123 | etot = -30.0541499447146 +664000 ekin = 4.30987713127752 | erot = 3.55193027406448 | epot = -38.0118003167728 | etot = -30.1499929114308 +665000 ekin = 4.32971268964141 | erot = 3.40416985470625 | epot = -37.9630121098135 | etot = -30.2291295654658 +666000 ekin = 4.30397058329246 | erot = 3.24563244836278 | epot = -37.9564459426243 | etot = -30.4068429109691 +667000 ekin = 4.23802718761169 | erot = 3.57923047722669 | epot = -37.9111709997968 | etot = -30.0939133349584 +668000 ekin = 4.17750835985179 | erot = 3.42921371885248 | epot = -37.8409684237743 | etot = -30.23424634507 +669000 ekin = 4.10123021238957 | erot = 3.38759831293404 | epot = -37.7732457913401 | etot = -30.2844172660165 +670000 ekin = 3.96563796265774 | erot = 3.59480187806746 | epot = -37.6965941156385 | etot = -30.1361542749133 +671000 ekin = 3.96406262528475 | erot = 3.64073126780244 | epot = -37.5753442355429 | etot = -29.9705503424557 +672000 ekin = 4.04265318678515 | erot = 3.67979591145804 | epot = -37.4296504342376 | etot = -29.7072013359944 +673000 ekin = 3.99224066234878 | erot = 3.52190422085284 | epot = -37.3047157518842 | etot = -29.7905708686826 +674000 ekin = 3.97681715793541 | erot = 3.75368024393795 | epot = -37.1885781675146 | etot = -29.4580807656412 +675000 ekin = 3.85833621087039 | erot = 3.97050815664598 | epot = -37.1417466549722 | etot = -29.3129022874559 +676000 ekin = 3.77676206895617 | erot = 3.79811590545672 | epot = -37.1253534099229 | etot = -29.55047543551 +677000 ekin = 3.78226586281959 | erot = 3.88942769355395 | epot = -37.138562963627 | etot = -29.4668694072535 +678000 ekin = 3.61579087416923 | erot = 3.83629032138265 | epot = -37.1880190743622 | etot = -29.7359378788103 +679000 ekin = 3.59940694058676 | erot = 3.92320694106409 | epot = -37.2411006365046 | etot = -29.7184867548538 +680000 ekin = 3.59936088858668 | erot = 3.59198808770724 | epot = -37.3103059663064 | etot = -30.1189569900125 +681000 ekin = 3.55068173353926 | erot = 3.62032338399716 | epot = -37.3978871586221 | etot = -30.2268820410857 +682000 ekin = 3.64312616149461 | erot = 3.63220095729225 | epot = -37.4824268307594 | etot = -30.2070997119725 +683000 ekin = 3.59147144886471 | erot = 4.00540882269656 | epot = -37.5784304648839 | etot = -29.9815501933227 +684000 ekin = 3.72558767154378 | erot = 4.43134049971583 | epot = -37.6663536443174 | etot = -29.5094254730578 +685000 ekin = 3.75700113340411 | erot = 4.4205179107468 | epot = -37.7011506850387 | etot = -29.5236316408878 +686000 ekin = 3.68716829673498 | erot = 4.29446170846275 | epot = -37.7134415714992 | etot = -29.7318115663015 +687000 ekin = 3.64818503755745 | erot = 4.53150873331275 | epot = -37.711537143075 | etot = -29.5318433722048 +688000 ekin = 3.65898677055768 | erot = 4.19517143645003 | epot = -37.717932414298 | etot = -29.8637742072903 +689000 ekin = 3.62053492938482 | erot = 4.90634872884688 | epot = -37.7254294906479 | etot = -29.1985458324162 +690000 ekin = 3.66313798116701 | erot = 4.56796147260999 | epot = -37.7316773182822 | etot = -29.5005778645052 +691000 ekin = 3.71240687811142 | erot = 4.32729443264309 | epot = -37.6986701891449 | etot = -29.6589688783904 +692000 ekin = 3.77937222983663 | erot = 4.25209713638369 | epot = -37.6463069321163 | etot = -29.614837565896 +693000 ekin = 3.82528389687004 | erot = 4.44391854020412 | epot = -37.5813521083395 | etot = -29.3121496712654 +694000 ekin = 3.77132757417721 | erot = 4.30342910423483 | epot = -37.529253149734 | etot = -29.4544964713219 +695000 ekin = 3.87816824099576 | erot = 3.61664690986643 | epot = -37.4977174174722 | etot = -30.00290226661 +696000 ekin = 4.03561630547949 | erot = 3.14881777436795 | epot = -37.5165237009965 | etot = -30.3320896211491 +697000 ekin = 4.10221303088943 | erot = 2.74688055821585 | epot = -37.6237315563432 | etot = -30.7746379672379 +698000 ekin = 4.33198843808374 | erot = 2.54448976763407 | epot = -37.8109238872742 | etot = -30.9344456815564 +699000 ekin = 4.45835519306672 | erot = 2.83727562812266 | epot = -38.0765099491825 | etot = -30.7808791279931 +700000 ekin = 4.62566765847138 | erot = 3.20413023616691 | epot = -38.366668680577 | etot = -30.5368707859387 +701000 ekin = 4.7119895804198 | erot = 3.20500762759523 | epot = -38.6531148244762 | etot = -30.7361176164611 +702000 ekin = 4.70320353975511 | erot = 3.49669921722524 | epot = -38.9020142648732 | etot = -30.7021115078929 +703000 ekin = 4.71666592176221 | erot = 3.4360587579244 | epot = -39.0983570180766 | etot = -30.94563233839 +704000 ekin = 4.81119997223628 | erot = 3.68842954975269 | epot = -39.2326154199854 | etot = -30.7329858979964 +705000 ekin = 4.76635995985857 | erot = 4.27225880905617 | epot = -39.3045830193539 | etot = -30.2659642504391 +706000 ekin = 4.61239689007865 | erot = 4.45743851438183 | epot = -39.3303553159894 | etot = -30.2605199115289 +707000 ekin = 4.4339240392442 | erot = 5.00090751066084 | epot = -39.3012148785927 | etot = -29.8663833286877 +708000 ekin = 4.49363980378809 | erot = 4.44827137132344 | epot = -39.185594508632 | etot = -30.2436833335204 +709000 ekin = 4.38087413515997 | erot = 4.33993340714001 | epot = -39.0225667156706 | etot = -30.3017591733706 +710000 ekin = 4.30084034805687 | erot = 4.18416076229502 | epot = -38.8018325665079 | etot = -30.3168314561561 +711000 ekin = 4.16061239283927 | erot = 3.75964607710248 | epot = -38.6119256895404 | etot = -30.6916672195987 +712000 ekin = 4.02785073941563 | erot = 3.9187380855626 | epot = -38.5032151267496 | etot = -30.5566263017714 +713000 ekin = 3.91042694307514 | erot = 4.02474708082432 | epot = -38.4555203424355 | etot = -30.5203463185361 +714000 ekin = 3.91972154955273 | erot = 3.86911398530045 | epot = -38.439191113934 | etot = -30.6503555790808 +715000 ekin = 3.7943288518239 | erot = 3.97493955426896 | epot = -38.464893488298 | etot = -30.6956250822051 +716000 ekin = 3.81379173421822 | erot = 4.12773796628725 | epot = -38.5344978321894 | etot = -30.592968131684 +717000 ekin = 3.81338083287865 | erot = 3.91040514076924 | epot = -38.6119475932714 | etot = -30.8881616196235 +718000 ekin = 3.98031853847212 | erot = 3.63481705596705 | epot = -38.678649410417 | etot = -31.0635138159778 +719000 ekin = 3.8566755406953 | erot = 3.54568346865612 | epot = -38.7335222105701 | etot = -31.3311632012187 +720000 ekin = 3.82130999837905 | erot = 3.12899985812948 | epot = -38.8000481793519 | etot = -31.8497383228434 +721000 ekin = 3.84625676410587 | erot = 3.33090070721984 | epot = -38.8362758074818 | etot = -31.6591183361561 +722000 ekin = 3.79224716661399 | erot = 3.20659617994805 | epot = -38.8301147634646 | etot = -31.8312714169026 +723000 ekin = 3.89270036914645 | erot = 3.09341373486911 | epot = -38.7612142662691 | etot = -31.7751001622535 +724000 ekin = 3.88950015267432 | erot = 3.37593260372107 | epot = -38.6472208331853 | etot = -31.3817880767899 +725000 ekin = 3.89253643906726 | erot = 3.36325650610821 | epot = -38.527809683643 | etot = -31.2720167384676 +726000 ekin = 3.77207579735124 | erot = 2.95762270097696 | epot = -38.4162496849588 | etot = -31.6865511866306 +727000 ekin = 3.85895083084016 | erot = 2.69741467226748 | epot = -38.3204112624909 | etot = -31.7640457593832 +728000 ekin = 3.95735248448051 | erot = 2.9120886214562 | epot = -38.2269317498774 | etot = -31.3574906439407 +729000 ekin = 3.90116579496187 | erot = 2.68023881807523 | epot = -38.1837112825913 | etot = -31.6023066695542 +730000 ekin = 3.96318220229617 | erot = 2.52640600275291 | epot = -38.1795006550048 | etot = -31.6899124499557 +731000 ekin = 4.07163559325283 | erot = 2.47524828245717 | epot = -38.2208467965997 | etot = -31.6739629208897 +732000 ekin = 4.1233129439478 | erot = 2.59059397612226 | epot = -38.2785246774241 | etot = -31.5646177573541 +733000 ekin = 4.18393032106832 | erot = 2.72580269413636 | epot = -38.392037043721 | etot = -31.4823040285164 +734000 ekin = 4.22490204001114 | erot = 2.94025387724302 | epot = -38.5577268408556 | etot = -31.3925709236014 +735000 ekin = 4.4163790638128 | erot = 3.39000978300276 | epot = -38.7520895879279 | etot = -30.9457007411124 +736000 ekin = 4.52682105512921 | erot = 3.59384799521515 | epot = -39.0007836443239 | etot = -30.8801145939796 +737000 ekin = 4.54518518822971 | erot = 3.67606395235669 | epot = -39.2431861398733 | etot = -31.0219369992869 +738000 ekin = 4.5411183131362 | erot = 3.87514152367616 | epot = -39.4689573474102 | etot = -31.0526975105979 +739000 ekin = 4.64515651334117 | erot = 3.86830954896682 | epot = -39.6580785017876 | etot = -31.1446124394797 +740000 ekin = 4.59721923359587 | erot = 3.83234514918728 | epot = -39.7800787241316 | etot = -31.3505143413485 +741000 ekin = 4.54920694202201 | erot = 4.22873772666809 | epot = -39.8001498706487 | etot = -31.0222052019586 +742000 ekin = 4.37775553859947 | erot = 4.07719515191239 | epot = -39.77291919362 | etot = -31.3179685031081 +743000 ekin = 4.3556617165814 | erot = 4.19296317409631 | epot = -39.6826493457459 | etot = -31.1340244550682 +744000 ekin = 4.35520781857197 | erot = 4.03027041959899 | epot = -39.5404877687078 | etot = -31.1550095305368 +745000 ekin = 4.22626887984311 | erot = 3.36034348052822 | epot = -39.3612863690873 | etot = -31.774674008716 +746000 ekin = 4.11995949308898 | erot = 3.27667360498754 | epot = -39.1619120183871 | etot = -31.7652789203105 +747000 ekin = 4.14400839200212 | erot = 3.30199438470027 | epot = -38.9827326721257 | etot = -31.5367298954233 +748000 ekin = 4.00468940718665 | erot = 3.14625781984354 | epot = -38.8044398216776 | etot = -31.6534925946474 +749000 ekin = 3.84115389861437 | erot = 2.95470003366606 | epot = -38.6687005011651 | etot = -31.8728465688847 +750000 ekin = 3.65410258827795 | erot = 3.15459365563751 | epot = -38.5278602215806 | etot = -31.7191639776652 +751000 ekin = 3.60281847230518 | erot = 3.24631581000329 | epot = -38.4153933025752 | etot = -31.5662590202667 +752000 ekin = 3.67731217795101 | erot = 3.63832283099237 | epot = -38.3028409880035 | etot = -30.9872059790601 +753000 ekin = 3.57605485188786 | erot = 3.26752665173283 | epot = -38.216520404161 | etot = -31.3729389005403 +754000 ekin = 3.69078656100566 | erot = 3.07077330953207 | epot = -38.2008529421059 | etot = -31.4392930715682 +755000 ekin = 3.70168225637966 | erot = 2.97263399944781 | epot = -38.2287093031121 | etot = -31.5543930472847 +756000 ekin = 3.82302121275981 | erot = 3.17826892909081 | epot = -38.3101319992817 | etot = -31.3088418574311 +757000 ekin = 3.92969183976116 | erot = 3.24398381681727 | epot = -38.4229976799529 | etot = -31.2493220233745 +758000 ekin = 4.01825553851179 | erot = 2.96087889455689 | epot = -38.5603809302419 | etot = -31.5812464971732 +759000 ekin = 4.1594567829226 | erot = 3.31368855914157 | epot = -38.7240687265499 | etot = -31.2509233844857 +760000 ekin = 4.08337495041284 | erot = 3.28527114059582 | epot = -38.8845645171708 | etot = -31.5159184261621 +761000 ekin = 4.14862342701 | erot = 3.30586771709934 | epot = -38.9896780479041 | etot = -31.5351869037948 +762000 ekin = 4.15291891523588 | erot = 3.21578962032623 | epot = -39.035237071941 | etot = -31.6665285363789 +763000 ekin = 4.13154828483799 | erot = 3.3900507889809 | epot = -39.064056495297 | etot = -31.5424574214781 +764000 ekin = 4.11445022984107 | erot = 3.78778087021378 | epot = -39.0692483990251 | etot = -31.1670172989703 +765000 ekin = 3.94937442988368 | erot = 3.99811330721235 | epot = -39.0421921917086 | etot = -31.0947044546125 +766000 ekin = 3.90772961551848 | erot = 4.01819621928476 | epot = -38.9772379154489 | etot = -31.0513120806457 +767000 ekin = 3.91865092379335 | erot = 3.66675942927309 | epot = -38.8570109636997 | etot = -31.2716006106333 +768000 ekin = 3.90455829915367 | erot = 3.57997769181359 | epot = -38.7106990781798 | etot = -31.2261630872126 +769000 ekin = 3.79614462627832 | erot = 3.72589479531036 | epot = -38.5987325117514 | etot = -31.0766930901627 +770000 ekin = 3.84943042371494 | erot = 3.41445940258821 | epot = -38.5242031402412 | etot = -31.260313313938 +771000 ekin = 3.93726861106208 | erot = 3.22573743650862 | epot = -38.4470290210347 | etot = -31.284022973464 +772000 ekin = 3.96999789478603 | erot = 3.15006319998271 | epot = -38.4433830504299 | etot = -31.3233219556611 +773000 ekin = 3.90264203603896 | erot = 3.08286085672449 | epot = -38.4596433115511 | etot = -31.4741404187877 +774000 ekin = 4.05136357587228 | erot = 3.17001936426352 | epot = -38.5137422973686 | etot = -31.2923593572328 +775000 ekin = 4.11418642080986 | erot = 3.81754399179959 | epot = -38.5927804349064 | etot = -30.661050022297 +776000 ekin = 4.11481050991311 | erot = 3.55328099460662 | epot = -38.6754580889835 | etot = -31.0073665844638 +777000 ekin = 4.23423405077874 | erot = 3.581082705526 | epot = -38.7616944176802 | etot = -30.9463776613754 +778000 ekin = 4.22244262963935 | erot = 3.64411855451435 | epot = -38.8420321429421 | etot = -30.9754709587884 +779000 ekin = 4.20492205038599 | erot = 3.89270804286641 | epot = -38.9009656289589 | etot = -30.8033355357065 +780000 ekin = 4.19457435208215 | erot = 3.98994130977104 | epot = -38.9050369874365 | etot = -30.7205213255833 +781000 ekin = 4.33837315790481 | erot = 3.45852422770952 | epot = -38.858660577552 | etot = -31.0617631919377 +782000 ekin = 4.36357496915256 | erot = 3.10010011432264 | epot = -38.7868584055569 | etot = -31.3231833220817 +783000 ekin = 4.42162598039043 | erot = 3.42028138737015 | epot = -38.7233668668894 | etot = -30.8814594991289 +784000 ekin = 4.52915280589042 | erot = 3.46746509226011 | epot = -38.6388342149203 | etot = -30.6422163167698 +785000 ekin = 4.55159402138248 | erot = 3.36141401661284 | epot = -38.5160993571772 | etot = -30.6030913191819 +786000 ekin = 4.4107707826177 | erot = 3.55728141641266 | epot = -38.3921286555455 | etot = -30.4240764565152 +787000 ekin = 4.54739828665105 | erot = 3.81681111076945 | epot = -38.2843232861691 | etot = -29.9201138887486 +788000 ekin = 4.51350891647147 | erot = 3.90594890385671 | epot = -38.2029645190102 | etot = -29.783506698682 +789000 ekin = 4.41183434492797 | erot = 4.01545730842708 | epot = -38.1545360413067 | etot = -29.7272443879517 +790000 ekin = 4.3621929679848 | erot = 4.38022337925409 | epot = -38.1642768248249 | etot = -29.4218604775861 +791000 ekin = 4.36856935453188 | erot = 4.10044084346352 | epot = -38.22190556061 | etot = -29.7528953626146 +792000 ekin = 4.15750522427246 | erot = 4.31220830506834 | epot = -38.3006248567473 | etot = -29.8309113274065 +793000 ekin = 4.04895474142999 | erot = 4.47406069249712 | epot = -38.4166817679431 | etot = -29.893666334016 +794000 ekin = 4.06782077729039 | erot = 4.5423761591342 | epot = -38.549740398153 | etot = -29.9395434617284 +795000 ekin = 4.13325369560992 | erot = 4.67664308533435 | epot = -38.7140310649861 | etot = -29.9041342840418 +796000 ekin = 4.24810673699366 | erot = 4.55090018691374 | epot = -38.8628377912584 | etot = -30.0638308673509 +797000 ekin = 4.47820483480062 | erot = 4.3710582070195 | epot = -39.0073103741375 | etot = -30.1580473323174 +798000 ekin = 4.41687882033674 | erot = 4.03192844801015 | epot = -39.1717655165837 | etot = -30.7229582482368 +799000 ekin = 4.51272621151671 | erot = 3.80275615695399 | epot = -39.326421036722 | etot = -31.0109386682513 +800000 ekin = 4.55406747540001 | erot = 3.86603589563195 | epot = -39.4550921156883 | etot = -31.0349887446563 +801000 ekin = 4.71425753043944 | erot = 4.19401636489447 | epot = -39.54550685129 | etot = -30.6372329559561 +802000 ekin = 4.73096724901053 | erot = 4.66018334519234 | epot = -39.5972922700863 | etot = -30.2061416758834 +803000 ekin = 4.62379738113316 | erot = 4.84687313016553 | epot = -39.6033097238912 | etot = -30.1326392125925 +804000 ekin = 4.73211781117971 | erot = 4.65405100631757 | epot = -39.5980929919843 | etot = -30.2119241744871 +805000 ekin = 4.74990370273775 | erot = 5.03061291222782 | epot = -39.5694988655322 | etot = -29.7889822505666 +806000 ekin = 4.71376969100982 | erot = 4.52737209746849 | epot = -39.5309941756429 | etot = -30.2898523871646 +807000 ekin = 4.86079475139436 | erot = 4.60056901312775 | epot = -39.4997078348835 | etot = -30.0383440703614 +808000 ekin = 4.80209833525355 | erot = 4.45818548395654 | epot = -39.4704788837952 | etot = -30.2101950645852 +809000 ekin = 4.63770011287829 | erot = 4.50410245159981 | epot = -39.4133092695816 | etot = -30.2715067051035 +810000 ekin = 4.5884562354768 | erot = 4.59839740206875 | epot = -39.3630399165046 | etot = -30.1761862789591 +811000 ekin = 4.49885529137743 | erot = 3.9887801293149 | epot = -39.2630135095319 | etot = -30.7753780888396 +812000 ekin = 4.26896362698773 | erot = 3.78568800845431 | epot = -39.1138584925267 | etot = -31.0592068570847 +813000 ekin = 4.13473287838125 | erot = 3.67097615600868 | epot = -38.9684769118809 | etot = -31.1627678774909 +814000 ekin = 3.94776533151707 | erot = 3.94579982777182 | epot = -38.8393181931019 | etot = -30.945753033813 +815000 ekin = 3.90824876714858 | erot = 4.04132924638676 | epot = -38.7551601823022 | etot = -30.8055821687669 +816000 ekin = 3.78701127768462 | erot = 3.90301930977965 | epot = -38.6978803550943 | etot = -31.00784976763 +817000 ekin = 3.66292511898638 | erot = 3.94682412287947 | epot = -38.6270985077426 | etot = -31.0173492658768 +818000 ekin = 3.57247131276286 | erot = 4.1784329766224 | epot = -38.5581000447573 | etot = -30.807195755372 +819000 ekin = 3.53877880324505 | erot = 4.11647252852256 | epot = -38.470998731369 | etot = -30.8157473996014 +820000 ekin = 3.50671598439872 | erot = 4.2563179936087 | epot = -38.3521077332955 | etot = -30.5890737552881 +821000 ekin = 3.53103431342872 | erot = 3.63219688182932 | epot = -38.2011634572155 | etot = -31.0379322619575 +822000 ekin = 3.51951391759943 | erot = 3.61259288561799 | epot = -38.0560993175181 | etot = -30.9239925143007 +823000 ekin = 3.57671320020567 | erot = 3.17979253207746 | epot = -37.8872361758758 | etot = -31.1307304435927 +824000 ekin = 3.52000952110933 | erot = 3.12347116703119 | epot = -37.7532307820924 | etot = -31.1097500939519 +825000 ekin = 3.58955759313317 | erot = 3.15061432333255 | epot = -37.6359982536735 | etot = -30.8958263372078 +826000 ekin = 3.67361585241127 | erot = 3.02327306669 | epot = -37.5692124634558 | etot = -30.8723235443545 +827000 ekin = 3.81109350736614 | erot = 2.85212407416514 | epot = -37.5611625241688 | etot = -30.8979449426375 +828000 ekin = 3.90531542763314 | erot = 2.81227386436725 | epot = -37.5694328663447 | etot = -30.8518435743443 +829000 ekin = 3.84587100054134 | erot = 2.81493449341339 | epot = -37.6070676030483 | etot = -30.9462621090935 +830000 ekin = 3.92673136944215 | erot = 3.15236191191148 | epot = -37.6537469157601 | etot = -30.5746536344065 +831000 ekin = 3.93921284330496 | erot = 3.06450076609936 | epot = -37.7261731649981 | etot = -30.7224595555938 +832000 ekin = 3.97197612374622 | erot = 3.05649894744995 | epot = -37.8221989970108 | etot = -30.7937239258147 +833000 ekin = 3.93725030890251 | erot = 3.02665836452882 | epot = -37.937171835506 | etot = -30.9732631620747 +834000 ekin = 3.98146697711155 | erot = 3.02136079279364 | epot = -38.0629385880238 | etot = -31.0601108181186 +835000 ekin = 4.05052897985959 | erot = 3.17273406713199 | epot = -38.1835463837721 | etot = -30.9602833367805 +836000 ekin = 4.19040397553803 | erot = 3.26946027032966 | epot = -38.300933644763 | etot = -30.8410693988953 +837000 ekin = 4.23633886579814 | erot = 3.17722972050009 | epot = -38.3895940577245 | etot = -30.9760254714262 +838000 ekin = 4.2979004072249 | erot = 3.15450479842831 | epot = -38.4727069904852 | etot = -31.020301784832 +839000 ekin = 4.1827320503791 | erot = 3.33215565016996 | epot = -38.5543306618494 | etot = -31.0394429613003 +840000 ekin = 4.10684077367706 | erot = 3.38230089969601 | epot = -38.6241675017604 | etot = -31.1350258283873 +841000 ekin = 4.23749853699732 | erot = 4.07451157411686 | epot = -38.6954306161323 | etot = -30.3834205050181 +842000 ekin = 4.21536707994271 | erot = 4.23835126074064 | epot = -38.7619078222529 | etot = -30.3081894815695 +843000 ekin = 4.22215504966707 | erot = 4.35771502414032 | epot = -38.8129398935363 | etot = -30.2330698197289 +844000 ekin = 4.30121627933579 | erot = 4.37450016715715 | epot = -38.8385476120778 | etot = -30.1628311655849 +845000 ekin = 4.21550077214613 | erot = 4.14378307005664 | epot = -38.8237568245828 | etot = -30.4644729823801 +846000 ekin = 4.02238016824688 | erot = 4.51654867802969 | epot = -38.7905889780242 | etot = -30.2516601317477 +847000 ekin = 4.01810256512938 | erot = 4.26125017170757 | epot = -38.7339575587521 | etot = -30.4546048219152 +848000 ekin = 3.96232133970733 | erot = 4.11983424179415 | epot = -38.6313622633388 | etot = -30.5492066818373 +849000 ekin = 3.80836560854392 | erot = 4.28564223418282 | epot = -38.48959631527 | etot = -30.3955884725433 +850000 ekin = 3.69578896780274 | erot = 4.39587758868534 | epot = -38.3525607889923 | etot = -30.2608942325043 +851000 ekin = 3.41959969074419 | erot = 4.26064520104068 | epot = -38.1456854690895 | etot = -30.4654405773046 +852000 ekin = 3.30829887930773 | erot = 3.71835542085462 | epot = -37.9409715149429 | etot = -30.9143172147806 +853000 ekin = 3.35508979255709 | erot = 3.37030184945615 | epot = -37.7900455534541 | etot = -31.0646539114409 +854000 ekin = 3.27022944339444 | erot = 3.34212111159848 | epot = -37.7131840806896 | etot = -31.1008335256967 +855000 ekin = 3.1986122719394 | erot = 3.88856216577092 | epot = -37.6928018165187 | etot = -30.6056273788084 +856000 ekin = 3.06768638261931 | erot = 3.9829801102148 | epot = -37.727010473156 | etot = -30.6763439803219 +857000 ekin = 3.0284945827112 | erot = 3.90128373509548 | epot = -37.7894644617561 | etot = -30.8596861439494 +858000 ekin = 3.01766394874129 | erot = 3.81481515545785 | epot = -37.864155422239 | etot = -31.0316763180398 +859000 ekin = 3.04279727315571 | erot = 3.58850792531729 | epot = -37.9147104139937 | etot = -31.2834052155206 +860000 ekin = 3.12250083122178 | erot = 3.47152341944192 | epot = -37.9805991878281 | etot = -31.3865749371644 +861000 ekin = 3.08661234486258 | erot = 3.19104504877415 | epot = -38.0455048743499 | etot = -31.7678474807132 +862000 ekin = 3.21284829409282 | erot = 3.29871938445951 | epot = -38.0992348440439 | etot = -31.5876671654916 +863000 ekin = 3.30782920492319 | erot = 3.18791577959006 | epot = -38.1747149198293 | etot = -31.6789699353161 +864000 ekin = 3.42420257195633 | erot = 2.92388402618492 | epot = -38.2365375033582 | etot = -31.8884509052169 +865000 ekin = 3.34466551527703 | erot = 3.0972998859353 | epot = -38.301208351407 | etot = -31.8592429501947 +866000 ekin = 3.36174635490682 | erot = 3.3198551234471 | epot = -38.3565233653476 | etot = -31.6749218869937 +867000 ekin = 3.421839196855 | erot = 2.79592217571863 | epot = -38.3877893327294 | etot = -32.1700279601558 +868000 ekin = 3.36274087144654 | erot = 2.53957841641307 | epot = -38.4029375195829 | etot = -32.5006182317233 +869000 ekin = 3.40964507660633 | erot = 2.56691032353925 | epot = -38.36070725069 | etot = -32.3841518505444 +870000 ekin = 3.53716918539255 | erot = 2.78671187381857 | epot = -38.3296120297664 | etot = -32.0057309705553 +871000 ekin = 3.59594316640844 | erot = 2.64188707611858 | epot = -38.2798157408161 | etot = -32.0419854982891 +872000 ekin = 3.50734679867103 | erot = 2.53533702817681 | epot = -38.2086073023315 | etot = -32.1659234754836 +873000 ekin = 3.4916725837923 | erot = 2.78144827221659 | epot = -38.1271407877643 | etot = -31.8540199317554 +874000 ekin = 3.51303146719815 | erot = 2.71312702979827 | epot = -38.0371921369836 | etot = -31.8110336399872 +875000 ekin = 3.48945347772522 | erot = 2.94850163157192 | epot = -37.9788388329101 | etot = -31.540883723613 +876000 ekin = 3.56075870692742 | erot = 3.00511197452216 | epot = -37.9138095080296 | etot = -31.34793882658 +877000 ekin = 3.47758786865161 | erot = 3.1639084633419 | epot = -37.8677942057125 | etot = -31.226297873719 +878000 ekin = 3.30311825505464 | erot = 3.03452838302456 | epot = -37.8643582436494 | etot = -31.5267116055702 +879000 ekin = 3.24374156245722 | erot = 3.40785973601244 | epot = -37.8934655456587 | etot = -31.241864247189 +880000 ekin = 3.37573093292728 | erot = 3.29280897525387 | epot = -37.94427513544 | etot = -31.2757352272588 +881000 ekin = 3.39840544569008 | erot = 3.5585281271734 | epot = -38.000888118187 | etot = -31.0439545453235 +882000 ekin = 3.58967670735277 | erot = 3.3599507497553 | epot = -38.026551897189 | etot = -31.0769244400809 +883000 ekin = 3.50982611331089 | erot = 2.96694324238043 | epot = -38.0094926569536 | etot = -31.5327233012623 +884000 ekin = 3.40446481075003 | erot = 3.29501620823909 | epot = -37.9974315131722 | etot = -31.2979504941831 +885000 ekin = 3.35965929451984 | erot = 3.11716654513079 | epot = -38.0104898466533 | etot = -31.5336640070026 +886000 ekin = 3.4398820879568 | erot = 3.03035945423277 | epot = -38.0693633346149 | etot = -31.5991217924253 +887000 ekin = 3.45628684947257 | erot = 3.13318789403751 | epot = -38.1677034351609 | etot = -31.5782286916509 +888000 ekin = 3.56219309594464 | erot = 3.51843891461384 | epot = -38.2809194479114 | etot = -31.2002874373529 +889000 ekin = 3.66415644518222 | erot = 4.27546474777851 | epot = -38.4171028829354 | etot = -30.4774816899746 +890000 ekin = 3.59199164776021 | erot = 4.54716655442229 | epot = -38.5531146541751 | etot = -30.4139564519926 +891000 ekin = 3.48698350789935 | erot = 4.75701182525661 | epot = -38.6580895919219 | etot = -30.414094258766 +892000 ekin = 3.5156285575795 | erot = 4.92508483334396 | epot = -38.7362622656564 | etot = -30.295548874733 +893000 ekin = 3.47661113338826 | erot = 5.21569244219348 | epot = -38.7939526432619 | etot = -30.1016490676802 +894000 ekin = 3.33377890272878 | erot = 5.32415823975917 | epot = -38.7809839614902 | etot = -30.1230468190022 +895000 ekin = 3.43478318369595 | erot = 5.41005154361594 | epot = -38.7354883491901 | etot = -29.8906536218782 +896000 ekin = 3.35681124753247 | erot = 5.27612600451783 | epot = -38.6441447733837 | etot = -30.0112075213334 +897000 ekin = 3.28668538949691 | erot = 5.17803324766006 | epot = -38.5248966927269 | etot = -30.0601780555699 +898000 ekin = 3.28286469703046 | erot = 5.1387437476849 | epot = -38.3749221439183 | etot = -29.9533136992029 +899000 ekin = 3.28106900834727 | erot = 5.02377463132161 | epot = -38.2159550339516 | etot = -29.9111113942827 +900000 ekin = 3.2375487758962 | erot = 4.74128859066627 | epot = -38.0678968923378 | etot = -30.0890595257754 +901000 ekin = 3.13978298302567 | erot = 4.32431292426646 | epot = -37.9137652588161 | etot = -30.449669351524 +902000 ekin = 3.14110495369396 | erot = 3.63711917032585 | epot = -37.7967183247471 | etot = -31.0184942007273 +903000 ekin = 3.11835106948985 | erot = 3.58358384011855 | epot = -37.7069569192994 | etot = -31.005022009691 +904000 ekin = 3.07376219479306 | erot = 3.52931006844845 | epot = -37.659746760624 | etot = -31.0566744973825 +905000 ekin = 3.06812362454382 | erot = 3.78913234205786 | epot = -37.6633180135035 | etot = -30.8060620469019 +906000 ekin = 3.16118254583051 | erot = 3.68210315785587 | epot = -37.7114125889236 | etot = -30.8681268852372 +907000 ekin = 3.05937736690029 | erot = 3.63166351278053 | epot = -37.8094278488434 | etot = -31.1183869691625 +908000 ekin = 3.20197665753497 | erot = 3.64411333350696 | epot = -37.8953945586469 | etot = -31.049304567605 +909000 ekin = 3.13419888287821 | erot = 3.44894287146556 | epot = -37.9553359165691 | etot = -31.3721941622254 +910000 ekin = 3.20114546563037 | erot = 3.42446813676887 | epot = -38.0249179476088 | etot = -31.3993043452096 +911000 ekin = 3.18332024249094 | erot = 3.30496399638702 | epot = -38.1090485606 | etot = -31.620764321722 +912000 ekin = 3.26276595850353 | erot = 3.24471741353574 | epot = -38.2096715613879 | etot = -31.7021881893487 +913000 ekin = 3.26815619138256 | erot = 3.26266624315757 | epot = -38.3821519588595 | etot = -31.8513295243194 +914000 ekin = 3.35412635067739 | erot = 3.33562334375849 | epot = -38.6092123987843 | etot = -31.9194627043485 +915000 ekin = 3.50776663391044 | erot = 3.60910336634357 | epot = -38.8009254120373 | etot = -31.6840554117832 +916000 ekin = 3.52773139010892 | erot = 3.4674530941274 | epot = -38.9707688836107 | etot = -31.9755843993744 +917000 ekin = 3.59076210165245 | erot = 3.4117857351299 | epot = -39.0925719913729 | etot = -32.0900241545906 +918000 ekin = 3.7045685353762 | erot = 3.18226166796498 | epot = -39.1781408185662 | etot = -32.291310615225 +919000 ekin = 3.7803778042616 | erot = 3.08638967761954 | epot = -39.2569196438482 | etot = -32.3901521619671 +920000 ekin = 3.91060781137672 | erot = 3.28711158692169 | epot = -39.3298863351684 | etot = -32.13216693687 +921000 ekin = 3.94747979949415 | erot = 3.453377720589 | epot = -39.3932618134519 | etot = -31.9924042933687 +922000 ekin = 3.94814734356937 | erot = 3.67117615571543 | epot = -39.442934644951 | etot = -31.8236111456662 +923000 ekin = 3.96148195878582 | erot = 4.16418425189008 | epot = -39.4697891977422 | etot = -31.3441229870663 +924000 ekin = 3.93156231463918 | erot = 4.23364521862781 | epot = -39.4747062603531 | etot = -31.3094987270862 +925000 ekin = 3.98364691406514 | erot = 4.37102519058194 | epot = -39.455954311955 | etot = -31.1012822073079 +926000 ekin = 3.9016583484788 | erot = 4.53983917650241 | epot = -39.3838686479858 | etot = -30.9423711230046 +927000 ekin = 3.86159556963871 | erot = 4.93409467569021 | epot = -39.300982283531 | etot = -30.505292038202 +928000 ekin = 3.88113409255633 | erot = 4.54344659797527 | epot = -39.2237313850885 | etot = -30.7991506945569 +929000 ekin = 3.73601262143401 | erot = 4.54159517313976 | epot = -39.0907845737874 | etot = -30.8131767792137 +930000 ekin = 3.62890283946134 | erot = 4.23223960576951 | epot = -38.9310668930158 | etot = -31.0699244477849 +931000 ekin = 3.51130978751943 | erot = 3.75580234575066 | epot = -38.7496742883208 | etot = -31.4825621550507 +932000 ekin = 3.4360478582471 | erot = 3.85916877458121 | epot = -38.6047820584061 | etot = -31.3095654255778 +933000 ekin = 3.34945134482961 | erot = 4.10711762351075 | epot = -38.510851150919 | etot = -31.0542821825786 +934000 ekin = 3.25407370525944 | erot = 4.02198516513935 | epot = -38.4343657155247 | etot = -31.1583068451259 +935000 ekin = 3.15706754617314 | erot = 3.94213624960975 | epot = -38.3842418910869 | etot = -31.285038095304 +936000 ekin = 3.00555649828169 | erot = 4.41385590541793 | epot = -38.3669049397814 | etot = -30.9474925360818 +937000 ekin = 2.92065396617303 | erot = 4.74523400801327 | epot = -38.3453538388337 | etot = -30.6794658646474 +938000 ekin = 2.97141948473083 | erot = 4.76974809222715 | epot = -38.3344331957964 | etot = -30.5932656188384 +939000 ekin = 2.94512706992735 | erot = 4.54496818954263 | epot = -38.3244620131105 | etot = -30.8343667536406 +940000 ekin = 2.88288211336416 | erot = 4.33037795313973 | epot = -38.3226244406597 | etot = -31.1093643741558 +941000 ekin = 3.07298949733874 | erot = 4.38312166999019 | epot = -38.3472582821343 | etot = -30.8911471148054 +942000 ekin = 3.09399973822823 | erot = 4.23262521183808 | epot = -38.3627707290365 | etot = -31.0361457789702 +943000 ekin = 3.06928348074207 | erot = 4.29810120769338 | epot = -38.3654861580835 | etot = -30.998101469648 +944000 ekin = 3.05361136554805 | erot = 4.57752136432057 | epot = -38.3891229370224 | etot = -30.7579902071538 +945000 ekin = 3.10532952733951 | erot = 4.63116672909514 | epot = -38.4481824906829 | etot = -30.7116862342482 +946000 ekin = 3.22536073155712 | erot = 4.97756078019748 | epot = -38.5304457687249 | etot = -30.3275242569703 +947000 ekin = 3.22481791886517 | erot = 4.85505897631128 | epot = -38.6306947506546 | etot = -30.5508178554781 +948000 ekin = 3.31258286730503 | erot = 4.40885070504342 | epot = -38.7111926164559 | etot = -30.9897590441074 +949000 ekin = 3.26341750645552 | erot = 4.50805562556237 | epot = -38.7582101439125 | etot = -30.9867370118946 +950000 ekin = 3.38312193033102 | erot = 4.30600402576272 | epot = -38.7909813747401 | etot = -31.1018554186463 +951000 ekin = 3.45878288324884 | erot = 3.92069079490449 | epot = -38.8089483233273 | etot = -31.429474645174 +952000 ekin = 3.42224118561199 | erot = 3.67807790241712 | epot = -38.8172186174577 | etot = -31.7168995294286 +953000 ekin = 3.53558981303889 | erot = 3.54582501818219 | epot = -38.8376037887753 | etot = -31.7561889575542 +954000 ekin = 3.74081536790968 | erot = 3.65672942044178 | epot = -38.8501623721149 | etot = -31.4526175837635 +955000 ekin = 3.7110092436565 | erot = 3.89616377536048 | epot = -38.8864415175109 | etot = -31.279268498494 +956000 ekin = 3.60593207480456 | erot = 3.60411690044688 | epot = -38.9258365620746 | etot = -31.7157875868231 +957000 ekin = 3.49530434439501 | erot = 3.8241034771156 | epot = -38.9468561104726 | etot = -31.627448288962 +958000 ekin = 3.33025913134867 | erot = 4.09361696296971 | epot = -38.956606995368 | etot = -31.5327309010496 +959000 ekin = 3.2325863398297 | erot = 4.27749630513801 | epot = -38.9400855462526 | etot = -31.4300029012849 +960000 ekin = 3.31834124707632 | erot = 4.19167538415384 | epot = -38.9006120641382 | etot = -31.3905954329081 +961000 ekin = 3.23354004257456 | erot = 4.33974592386025 | epot = -38.8709462828606 | etot = -31.2976603164258 +962000 ekin = 3.27687420354399 | erot = 4.18251799625541 | epot = -38.8399997192037 | etot = -31.3806075194043 +963000 ekin = 3.18724078299274 | erot = 4.29559449615356 | epot = -38.8215635568142 | etot = -31.3387282776679 +964000 ekin = 3.16628639784324 | erot = 4.17929146419551 | epot = -38.8033314242486 | etot = -31.4577535622098 +965000 ekin = 3.23601563824504 | erot = 4.51599223822389 | epot = -38.7801591620084 | etot = -31.0281512855395 +966000 ekin = 3.35348380272829 | erot = 3.96490873951942 | epot = -38.7593006562386 | etot = -31.4409081139909 +967000 ekin = 3.47301428118912 | erot = 3.78771221675284 | epot = -38.7263415939782 | etot = -31.4656150960363 +968000 ekin = 3.51493406845154 | erot = 3.36657292776078 | epot = -38.7364041234232 | etot = -31.8548971272109 +969000 ekin = 3.55243037222546 | erot = 3.66068265314136 | epot = -38.7529284526025 | etot = -31.5398154272357 +970000 ekin = 3.63553363347268 | erot = 3.13050605621035 | epot = -38.8016144947089 | etot = -32.0355748050258 +971000 ekin = 3.62760421034414 | erot = 3.43775684259619 | epot = -38.870763787289 | etot = -31.8054027343487 +972000 ekin = 3.66143241862989 | erot = 4.04556663388647 | epot = -38.9794799026743 | etot = -31.2724808501579 +973000 ekin = 3.7246589822928 | erot = 3.97416581320673 | epot = -39.0667487302084 | etot = -31.3679239347088 +974000 ekin = 3.99953950913791 | erot = 4.13912764019193 | epot = -39.1431741069697 | etot = -31.0045069576398 +975000 ekin = 4.00465817345131 | erot = 3.99525896460893 | epot = -39.1948973492942 | etot = -31.194980211234 +976000 ekin = 4.16803719317624 | erot = 4.27607609453618 | epot = -39.2042146461381 | etot = -30.7601013584257 +977000 ekin = 4.27763535208348 | erot = 4.3578537464676 | epot = -39.1647674598218 | etot = -30.5292783612708 +978000 ekin = 4.21509832146809 | erot = 3.96978575035229 | epot = -39.0661575270878 | etot = -30.8812734552674 +979000 ekin = 4.1121993977163 | erot = 3.86340161937279 | epot = -38.9126163242263 | etot = -30.9370153071372 +980000 ekin = 4.08548639230676 | erot = 3.71918260809163 | epot = -38.7460650378699 | etot = -30.9413960374715 +981000 ekin = 4.02033461236246 | erot = 3.54042819636898 | epot = -38.597187758635 | etot = -31.0364249499036 +982000 ekin = 4.05981657544079 | erot = 3.65178477672055 | epot = -38.4729888125583 | etot = -30.761387460397 +983000 ekin = 4.15649242216497 | erot = 3.62195027480226 | epot = -38.3342599610661 | etot = -30.5558172640988 +984000 ekin = 4.15445943144041 | erot = 3.41256983843898 | epot = -38.1946691276127 | etot = -30.6276398577333 +985000 ekin = 3.8765990108719 | erot = 3.43767805044635 | epot = -38.0505436384558 | etot = -30.7362665771376 +986000 ekin = 3.85786856381243 | erot = 3.30334700587336 | epot = -37.8996934133204 | etot = -30.7384778436346 +987000 ekin = 3.87294863787324 | erot = 3.15398232754985 | epot = -37.7929706719646 | etot = -30.7660397065415 +988000 ekin = 3.93790531951922 | erot = 3.08701498108577 | epot = -37.6532967522442 | etot = -30.6283764516392 +989000 ekin = 3.83115351568816 | erot = 3.07802242316593 | epot = -37.5101193189106 | etot = -30.6009433800565 +990000 ekin = 3.81048959043177 | erot = 3.11196082795564 | epot = -37.3832609771668 | etot = -30.4608105587794 +991000 ekin = 3.71517412131507 | erot = 3.09240412040415 | epot = -37.2833659467137 | etot = -30.4757877049945 +992000 ekin = 3.63849701384077 | erot = 2.99887074192575 | epot = -37.1786754428024 | etot = -30.5413076870359 +993000 ekin = 3.63209056043319 | erot = 3.27649085900159 | epot = -37.0906927302528 | etot = -30.182111310818 +994000 ekin = 3.59828390693157 | erot = 3.83169777268287 | epot = -37.0255816353103 | etot = -29.5955999556959 +995000 ekin = 3.75927077522085 | erot = 3.45385861701398 | epot = -36.9690811728773 | etot = -29.7559517806424 +996000 ekin = 3.7162823443018 | erot = 3.37243499359149 | epot = -36.9421300931431 | etot = -29.8534127552498 +997000 ekin = 3.60416089411945 | erot = 3.31461433836006 | epot = -36.952810875641 | etot = -30.0340356431615 +998000 ekin = 3.71457183702559 | erot = 3.42780251384754 | epot = -37.0325234658195 | etot = -29.8901491149464 +999000 ekin = 3.78703773886275 | erot = 3.63993408891199 | epot = -37.154809159371 | etot = -29.7278373315963 +1000000 ekin = 3.83883486112593 | erot = 3.47192929391939 | epot = -37.2430911050886 | etot = -29.9323269500432 + 1000000 0.10236893 -1.4701186 0.037692055 -1.2847791 5.0290761e-05 64000 +Loop time of 78.4082 on 1 procs for 1000000 steps with 26 atoms + +Performance: 11019.253 tau/day, 12753.765 timesteps/s +99.4% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 69.545 | 69.545 | 69.545 | 0.0 | 88.70 +Bond | 1.6652 | 1.6652 | 1.6652 | 0.0 | 2.12 +Neigh | 0.021387 | 0.021387 | 0.021387 | 0.0 | 0.03 +Comm | 0.20462 | 0.20462 | 0.20462 | 0.0 | 0.26 +Output | 0.23702 | 0.23702 | 0.23702 | 0.0 | 0.30 +Modify | 6.5296 | 6.5296 | 6.5296 | 0.0 | 8.33 +Other | | 0.2057 | | | 0.26 + +Nlocal: 26.0000 ave 26 max 26 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 301.000 ave 301 max 301 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 301 +Ave neighs/atom = 11.576923 +Ave special neighs/atom = 5.0769231 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.4.* nocoeff +System init for write_data ... +Total wall time: 0:01:18 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 new file mode 100644 index 0000000000..eda197670d --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 @@ -0,0 +1,1230 @@ +LAMMPS (27 May 2021) +variable number equal 4 +variable ofreq equal 1000 +variable efreq equal 1000 + +variable ntype equal 4 + +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 10 delay 0 check yes + +read_data data.duplex4.4type +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 26 atoms + reading velocities ... + 26 velocities + scanning bonds ... + 2 = max bonds/atom + 26 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 24 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +mass * 3.1575 # sets per-type mass if not in data file +set atom * mass 3.1575 # sets per-atom mass +Setting atom values ... + 26 settings made for mass + +group all type 1 4 +26 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + +label loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 1%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+3 +variable comp equal 1+3 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.4type loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 2%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+1 +variable comp equal 2+1 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +next base +jump in.duplex4.4type loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 3%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.4type loop +variable base loop ${ntype} +variable base loop 4 + variable basemod equal ${base}%4 + variable basemod equal 4%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.4type loop + +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# Langevin dynamics +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.4.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 10 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 3.74991604702378 | erot = 3.45272678980464 | epot = -37.3742009011421 | etot = -30.1715580643137 +Per MPI rank memory allocation (min/avg/max) = 9.571 | 9.572 | 9.573 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.099997761 -1.4717559 0.03428661 -1.2932417 5.6146609e-05 64000 +1000 ekin = 3.92430268570824 | erot = 3.29540971313705 | epot = -37.4816670091169 | etot = -30.2619546102716 +2000 ekin = 3.88644825046428 | erot = 3.58410925014822 | epot = -37.5871874286304 | etot = -30.1166299280179 +3000 ekin = 3.90603224055461 | erot = 3.78206057452861 | epot = -37.7021302921285 | etot = -30.0140374770453 +4000 ekin = 4.02636555552402 | erot = 3.91677901140303 | epot = -37.8027608694504 | etot = -29.8596163025233 +5000 ekin = 4.05442725401043 | erot = 4.07817807460239 | epot = -37.8494362833427 | etot = -29.7168309547299 +6000 ekin = 4.13499768127483 | erot = 4.03873475277247 | epot = -37.8257365098367 | etot = -29.6520040757894 +7000 ekin = 4.08584129662811 | erot = 3.98502892930338 | epot = -37.744776171106 | etot = -29.6739059451746 +8000 ekin = 4.04473728341539 | erot = 3.70461133282256 | epot = -37.6185211079512 | etot = -29.8691724917132 +9000 ekin = 3.97040375513034 | erot = 3.89171847539017 | epot = -37.4779912856655 | etot = -29.615869055145 +10000 ekin = 4.08064552796877 | erot = 4.10399273710613 | epot = -37.3378150214196 | etot = -29.1531767563447 +11000 ekin = 3.94505548567029 | erot = 4.14758664614567 | epot = -37.2085796341436 | etot = -29.1159375023277 +12000 ekin = 3.88687763742867 | erot = 4.11256727293728 | epot = -37.1168918341093 | etot = -29.1174469237433 +13000 ekin = 3.78376547312035 | erot = 3.94997258779545 | epot = -37.0636475805867 | etot = -29.3299095196709 +14000 ekin = 3.72114827358809 | erot = 3.83862755313067 | epot = -37.0539326083543 | etot = -29.4941567816355 +15000 ekin = 3.63885725366144 | erot = 3.37568559083325 | epot = -37.0775134892158 | etot = -30.0629706447211 +16000 ekin = 3.75926862366823 | erot = 3.47832285528771 | epot = -37.1763229835919 | etot = -29.938731504636 +17000 ekin = 3.80458992549718 | erot = 3.37818714949378 | epot = -37.3270848276044 | etot = -30.1443077526134 +18000 ekin = 3.81685915102048 | erot = 3.82235577807969 | epot = -37.4876996492705 | etot = -29.8484847201703 +19000 ekin = 3.80633274630077 | erot = 3.8039328333736 | epot = -37.6386270441084 | etot = -30.028361464434 +20000 ekin = 3.77027693322165 | erot = 3.97848447130841 | epot = -37.7861726918926 | etot = -30.0374112873625 +21000 ekin = 3.75594248876352 | erot = 3.90400523936658 | epot = -37.9165000666024 | etot = -30.2565523384723 +22000 ekin = 3.81729390633802 | erot = 3.70298358069274 | epot = -38.0211478246462 | etot = -30.5008703376154 +23000 ekin = 3.86462773298721 | erot = 3.52903064555341 | epot = -38.0539868057477 | etot = -30.6603284272071 +24000 ekin = 3.84611190496181 | erot = 3.47876891204866 | epot = -38.0524942369904 | etot = -30.7276134199799 +25000 ekin = 3.88431543220182 | erot = 3.80956733596667 | epot = -38.0090041212112 | etot = -30.3151213530427 +26000 ekin = 3.88520717073552 | erot = 4.04667753560866 | epot = -37.9336134642013 | etot = -30.0017287578571 +27000 ekin = 3.83553778749005 | erot = 4.18222306888362 | epot = -37.8633670830474 | etot = -29.8456062266737 +28000 ekin = 3.83638307293673 | erot = 4.13838046178307 | epot = -37.8079901228044 | etot = -29.8332265880846 +29000 ekin = 3.81360349447094 | erot = 4.16358811310864 | epot = -37.7885827024555 | etot = -29.8113910948759 +30000 ekin = 3.89572360919441 | erot = 4.04566996469674 | epot = -37.7874054211311 | etot = -29.84601184724 +31000 ekin = 3.89393888302718 | erot = 3.55790326104627 | epot = -37.8038131932178 | etot = -30.3519710491444 +32000 ekin = 3.80317271692918 | erot = 3.54273524643272 | epot = -37.8451815180301 | etot = -30.4992735546682 +33000 ekin = 3.78703980355191 | erot = 3.99364624500488 | epot = -37.9406281896734 | etot = -30.1599421411166 +34000 ekin = 3.77142087668807 | erot = 3.88594611308813 | epot = -38.097584352555 | etot = -30.4402173627788 +35000 ekin = 3.71264930628466 | erot = 3.65225843687418 | epot = -38.2835289304067 | etot = -30.9186211872479 +36000 ekin = 3.74220790707641 | erot = 3.95952222810293 | epot = -38.4596915935922 | etot = -30.7579614584129 +37000 ekin = 3.82423101226177 | erot = 4.44859396622365 | epot = -38.6538277887212 | etot = -30.3810028102358 +38000 ekin = 3.69455547696862 | erot = 4.82722829899228 | epot = -38.8348230288023 | etot = -30.3130392528414 +39000 ekin = 3.5954890965849 | erot = 5.03318978839678 | epot = -38.9632877762132 | etot = -30.3346088912316 +40000 ekin = 3.7239082672625 | erot = 4.77008246177599 | epot = -39.0432740898072 | etot = -30.5492833607687 +41000 ekin = 3.71845130286974 | erot = 4.66721188475359 | epot = -39.0678678855713 | etot = -30.6822046979479 +42000 ekin = 3.5469605515821 | erot = 4.50731751167304 | epot = -39.0616854007739 | etot = -31.0074073375187 +43000 ekin = 3.57495163768248 | erot = 4.94852093613523 | epot = -39.0169365666547 | etot = -30.493463992837 +44000 ekin = 3.52915394890506 | erot = 5.14481752350032 | epot = -38.9320102816114 | etot = -30.258038809206 +45000 ekin = 3.36103362047063 | erot = 5.30737062665206 | epot = -38.8074049309155 | etot = -30.1390006837928 +46000 ekin = 3.33204426677158 | erot = 4.63880623753679 | epot = -38.6602813061652 | etot = -30.6894308018569 +47000 ekin = 3.34546960167669 | erot = 4.072379763769 | epot = -38.5241501078281 | etot = -31.1063007423824 +48000 ekin = 3.40049787952112 | erot = 4.05251615432405 | epot = -38.3938498073687 | etot = -30.9408357735235 +49000 ekin = 3.31008896923648 | erot = 4.20737258711336 | epot = -38.2514760468933 | etot = -30.7340144905435 +50000 ekin = 3.27384446847297 | erot = 3.84861240213718 | epot = -38.0781706006623 | etot = -30.9557137300522 +51000 ekin = 3.28837845708164 | erot = 4.03176750511309 | epot = -37.9124524403703 | etot = -30.5923064781756 +52000 ekin = 3.3261261077424 | erot = 3.69449114481263 | epot = -37.7461543084426 | etot = -30.7255370558875 +53000 ekin = 3.24704253260756 | erot = 3.82351300738067 | epot = -37.5996085904181 | etot = -30.5290530504299 +54000 ekin = 3.28722266262306 | erot = 3.86366065026156 | epot = -37.4297798097104 | etot = -30.2788964968257 +55000 ekin = 3.24079189906262 | erot = 3.69908024112639 | epot = -37.2469422361789 | etot = -30.3070700959899 +56000 ekin = 3.183124569803 | erot = 3.47133297155146 | epot = -37.0860684089791 | etot = -30.4316108676246 +57000 ekin = 3.22541795737962 | erot = 3.05594699251087 | epot = -36.9568071104528 | etot = -30.6754421605623 +58000 ekin = 3.32107899021702 | erot = 2.99608132055983 | epot = -36.8451019319952 | etot = -30.5279416212183 +59000 ekin = 3.3775603338752 | erot = 3.02468556348897 | epot = -36.7527120143507 | etot = -30.3504661169865 +60000 ekin = 3.3783851820659 | erot = 2.80486585978131 | epot = -36.6500489307871 | etot = -30.4667978889399 +61000 ekin = 3.4259305825981 | erot = 2.57336693961335 | epot = -36.5598996921942 | etot = -30.5606021699827 +62000 ekin = 3.38330194206295 | erot = 2.48716523240079 | epot = -36.4917506706078 | etot = -30.6212834961441 +63000 ekin = 3.23944564751902 | erot = 2.68514269262901 | epot = -36.4581690118127 | etot = -30.5335806716646 +64000 ekin = 3.12857340842367 | erot = 2.81379000215884 | epot = -36.4694531808169 | etot = -30.5270897702344 +65000 ekin = 3.0972900172278 | erot = 2.97796742393482 | epot = -36.4999099304858 | etot = -30.4246524893232 +66000 ekin = 3.02532625214509 | erot = 2.98352661182224 | epot = -36.5477137384001 | etot = -30.5388608744328 +67000 ekin = 3.14798260660729 | erot = 3.20065089850768 | epot = -36.6320762786642 | etot = -30.2834427735492 +68000 ekin = 3.28121216444371 | erot = 3.27703862715896 | epot = -36.7797333797323 | etot = -30.2214825881296 +69000 ekin = 3.39109863872899 | erot = 3.49453676740748 | epot = -36.9477169900692 | etot = -30.0620815839328 +70000 ekin = 3.52145416968701 | erot = 3.19663795891378 | epot = -37.1459833247571 | etot = -30.4278911961563 +71000 ekin = 3.72588366820837 | erot = 3.11523594110614 | epot = -37.3394708863316 | etot = -30.4983512770171 +72000 ekin = 3.87053189634972 | erot = 3.51504753627359 | epot = -37.5837173340768 | etot = -30.1981379014535 +73000 ekin = 4.043534645073 | erot = 3.57819581965021 | epot = -37.8491002809696 | etot = -30.2273698162464 +74000 ekin = 4.21655599164747 | erot = 3.67972843708688 | epot = -38.0370200626724 | etot = -30.1407356339381 +75000 ekin = 4.2751803734558 | erot = 3.50148075250732 | epot = -38.1503543696657 | etot = -30.3736932437026 +76000 ekin = 4.39260378383777 | erot = 3.17711135808546 | epot = -38.2269779234848 | etot = -30.6572627815615 +77000 ekin = 4.46694156592454 | erot = 3.28356630286401 | epot = -38.2567512319265 | etot = -30.506243363138 +78000 ekin = 4.58031785764229 | erot = 3.27581240698066 | epot = -38.2501645622451 | etot = -30.3940342976221 +79000 ekin = 4.74132912230535 | erot = 3.40062659497661 | epot = -38.2259226034585 | etot = -30.0839668861766 +80000 ekin = 4.84478519554072 | erot = 3.56980153308286 | epot = -38.14766861013 | etot = -29.7330818815064 +81000 ekin = 4.71163727717015 | erot = 3.65201658810459 | epot = -38.0489180007765 | etot = -29.6852641355017 +82000 ekin = 4.62310894573492 | erot = 3.61128178949357 | epot = -37.9515873690417 | etot = -29.7171966338132 +83000 ekin = 4.53890753637813 | erot = 3.79707688079936 | epot = -37.8589639327863 | etot = -29.5229795156088 +84000 ekin = 4.51952558800272 | erot = 3.75897913437636 | epot = -37.8043394039473 | etot = -29.5258346815682 +85000 ekin = 4.44986224636044 | erot = 4.10169839029415 | epot = -37.7952059629819 | etot = -29.2436453263273 +86000 ekin = 4.40335859262171 | erot = 4.18303158637893 | epot = -37.840594671262 | etot = -29.2542044922614 +87000 ekin = 4.34352629789854 | erot = 4.00093225674539 | epot = -37.8981775676818 | etot = -29.5537190130379 +88000 ekin = 4.39692532206221 | erot = 3.88765396717304 | epot = -37.9120170018269 | etot = -29.6274377125917 +89000 ekin = 4.3589540780767 | erot = 4.0687705270632 | epot = -37.8812041939536 | etot = -29.4534795888137 +90000 ekin = 4.20715511673659 | erot = 3.96880041117212 | epot = -37.8268382933969 | etot = -29.6508827654882 +91000 ekin = 4.2202199323169 | erot = 4.12841045745315 | epot = -37.7475084891388 | etot = -29.3988780993687 +92000 ekin = 4.1326498688273 | erot = 3.86635436032376 | epot = -37.6428932571545 | etot = -29.6438890280035 +93000 ekin = 4.05697056146658 | erot = 3.48249980793546 | epot = -37.5034004108467 | etot = -29.9639300414447 +94000 ekin = 3.85560920909744 | erot = 3.51617278195642 | epot = -37.371684822218 | etot = -29.9999028311642 +95000 ekin = 3.7069616782419 | erot = 3.7453999268692 | epot = -37.2425364302767 | etot = -29.7901748251656 +96000 ekin = 3.64541489153227 | erot = 3.55177042583784 | epot = -37.1071295289257 | etot = -29.9099442115556 +97000 ekin = 3.59427366044239 | erot = 3.58237376190961 | epot = -36.9903312497973 | etot = -29.8136838274453 +98000 ekin = 3.36609732779817 | erot = 3.78920076230078 | epot = -36.8893462899042 | etot = -29.7340481998052 +99000 ekin = 3.24308716626432 | erot = 3.98439513504784 | epot = -36.7958275145326 | etot = -29.5683452132204 +100000 ekin = 3.10105716620438 | erot = 3.88380514198999 | epot = -36.7237148853879 | etot = -29.7388525771935 +101000 ekin = 3.05392814208233 | erot = 3.92712981026601 | epot = -36.701962452506 | etot = -29.7209045001576 +102000 ekin = 3.21793305977178 | erot = 4.11601242104532 | epot = -36.7682713932638 | etot = -29.4343259124467 +103000 ekin = 3.29518049820435 | erot = 4.13622147772539 | epot = -36.8839850328129 | etot = -29.4525830568832 +104000 ekin = 3.38349143563889 | erot = 4.1183455666037 | epot = -37.0170458924454 | etot = -29.5152088902028 +105000 ekin = 3.43063719220638 | erot = 4.19281995644327 | epot = -37.150125503217 | etot = -29.5266683545673 +106000 ekin = 3.3930587869785 | erot = 4.59139499879992 | epot = -37.2962927182996 | etot = -29.3118389325211 +107000 ekin = 3.49611625167344 | erot = 4.42190170056941 | epot = -37.4298253792172 | etot = -29.5118074269743 +108000 ekin = 3.59165643487494 | erot = 4.73333858652918 | epot = -37.482137044902 | etot = -29.1571420234978 +109000 ekin = 3.59878557010229 | erot = 5.08720641062802 | epot = -37.4454225962908 | etot = -28.7594306155605 +110000 ekin = 3.52607850054465 | erot = 4.92743402067557 | epot = -37.33464551381 | etot = -28.8811329925897 +111000 ekin = 3.52196404281882 | erot = 4.48970120472559 | epot = -37.2166378630308 | etot = -29.2049726154863 +112000 ekin = 3.64094551226758 | erot = 4.18578082474331 | epot = -37.1356107687899 | etot = -29.3088844317791 +113000 ekin = 3.59908785035488 | erot = 3.81929848767613 | epot = -37.1563156196511 | etot = -29.7379292816201 +114000 ekin = 3.73247165614552 | erot = 3.7191219132616 | epot = -37.1841072802386 | etot = -29.7325137108315 +115000 ekin = 3.81386546938849 | erot = 3.49889872890822 | epot = -37.2616543115737 | etot = -29.948890113277 +116000 ekin = 4.05829999340919 | erot = 3.58390665501405 | epot = -37.4003005682591 | etot = -29.7580939198359 +117000 ekin = 4.27550110925089 | erot = 3.79076820440125 | epot = -37.5923004712666 | etot = -29.5260311576145 +118000 ekin = 4.45490103530269 | erot = 3.77915185795812 | epot = -37.7846946186124 | etot = -29.5506417253515 +119000 ekin = 4.58790399115696 | erot = 3.86870152715706 | epot = -37.9811558924431 | etot = -29.5245503741291 +120000 ekin = 4.92259141545412 | erot = 3.84940365834982 | epot = -38.1382043293411 | etot = -29.3662092555371 +121000 ekin = 5.13183269148667 | erot = 4.03705087488496 | epot = -38.2560800244005 | etot = -29.0871964580288 +122000 ekin = 5.17140868558226 | erot = 3.61810962674133 | epot = -38.3381390234359 | etot = -29.5486207111123 +123000 ekin = 5.28384467069957 | erot = 4.14897954513993 | epot = -38.3803925391061 | etot = -28.9475683232666 +124000 ekin = 5.45144965935832 | erot = 3.74948516195925 | epot = -38.4152715166921 | etot = -29.2143366953745 +125000 ekin = 5.49907232704504 | erot = 3.62957174075197 | epot = -38.4698081948487 | etot = -29.3411641270517 +126000 ekin = 5.81275552922944 | erot = 3.50370762045612 | epot = -38.5369283444346 | etot = -29.2204651947491 +127000 ekin = 5.71810535961462 | erot = 3.50153411217264 | epot = -38.6097648991183 | etot = -29.390125427331 +128000 ekin = 5.59769610955185 | erot = 2.99726680348478 | epot = -38.6545287261786 | etot = -30.059565813142 +129000 ekin = 5.51657182067137 | erot = 3.37515224045319 | epot = -38.6909141535699 | etot = -29.7991900924454 +130000 ekin = 5.46626997343554 | erot = 3.77525421867741 | epot = -38.7059148210791 | etot = -29.4643906289662 +131000 ekin = 5.369877414402 | erot = 3.92459463488634 | epot = -38.6781199948582 | etot = -29.3836479455698 +132000 ekin = 5.13704854270014 | erot = 3.89365302265538 | epot = -38.6113331110915 | etot = -29.580631545736 +133000 ekin = 5.04851208372184 | erot = 4.17613618410306 | epot = -38.4969113589734 | etot = -29.2722630911485 +134000 ekin = 4.96335667475941 | erot = 4.28428652813741 | epot = -38.308416110038 | etot = -29.0607729071412 +135000 ekin = 4.67485522816795 | erot = 3.71485446937039 | epot = -38.0437601659662 | etot = -29.6540504684278 +136000 ekin = 4.4890629916043 | erot = 4.19015103736215 | epot = -37.7533241067258 | etot = -29.0741100777593 +137000 ekin = 4.31371561077616 | erot = 3.47925724303299 | epot = -37.4739407743081 | etot = -29.6809679204989 +138000 ekin = 3.96696543473023 | erot = 3.71675428283175 | epot = -37.2042587721437 | etot = -29.5205390545817 +139000 ekin = 3.59101315513219 | erot = 3.64278698721068 | epot = -36.9457852108051 | etot = -29.7119850684622 +140000 ekin = 3.44095423425017 | erot = 3.49830537198652 | epot = -36.7203613080872 | etot = -29.7811017018505 +141000 ekin = 3.36296546737369 | erot = 3.56983741924066 | epot = -36.4964767451357 | etot = -29.5636738585213 +142000 ekin = 3.18252441669259 | erot = 3.32935464682758 | epot = -36.3244758925308 | etot = -29.8125968290106 +143000 ekin = 3.18465930443846 | erot = 3.56170045589814 | epot = -36.2215210957505 | etot = -29.4751613354139 +144000 ekin = 3.08106725409747 | erot = 3.50261030291633 | epot = -36.1512447258049 | etot = -29.5675671687911 +145000 ekin = 3.08093776365794 | erot = 3.51948185643724 | epot = -36.0863085456317 | etot = -29.4858889255365 +146000 ekin = 3.02030159479387 | erot = 3.3739730546246 | epot = -36.0845314152703 | etot = -29.6902567658518 +147000 ekin = 3.0413907298566 | erot = 3.36603954258596 | epot = -36.1557232229402 | etot = -29.7482929504977 +148000 ekin = 3.14853067203595 | erot = 3.14562859809704 | epot = -36.2494960139439 | etot = -29.9553367438109 +149000 ekin = 3.18195150813314 | erot = 3.58071760906443 | epot = -36.3477640598882 | etot = -29.5850949426907 +150000 ekin = 3.21133048800031 | erot = 3.85389957660328 | epot = -36.4132627454733 | etot = -29.3480326808697 +151000 ekin = 3.3414410423208 | erot = 3.49391537632178 | epot = -36.47829445309 | etot = -29.6429380344474 +152000 ekin = 3.38469121090166 | erot = 3.35926284582918 | epot = -36.5578474424856 | etot = -29.8138933857547 +153000 ekin = 3.52527639525701 | erot = 3.56811727016358 | epot = -36.6674257186129 | etot = -29.5740320531923 +154000 ekin = 3.77924799771095 | erot = 3.5214579525681 | epot = -36.7622601921048 | etot = -29.4615542418258 +155000 ekin = 3.83418008764662 | erot = 3.28305394597573 | epot = -36.8282659682374 | etot = -29.7110319346151 +156000 ekin = 3.87517167307552 | erot = 2.7562101543893 | epot = -36.8507311290664 | etot = -30.2193493016016 +157000 ekin = 3.89846784481937 | erot = 3.03513966490494 | epot = -36.8490467787069 | etot = -29.9154392689826 +158000 ekin = 3.86372390524165 | erot = 3.0673314083842 | epot = -36.8143502444316 | etot = -29.8832949308058 +159000 ekin = 3.87560822586875 | erot = 2.72238394226955 | epot = -36.7720066653759 | etot = -30.1740144972376 +160000 ekin = 3.81659540649487 | erot = 2.79162883042019 | epot = -36.745609213871 | etot = -30.137384976956 +161000 ekin = 3.90364665450438 | erot = 2.85891130626961 | epot = -36.6767188031099 | etot = -29.9141608423359 +162000 ekin = 3.93432840871727 | erot = 3.23277686088047 | epot = -36.60685028113 | etot = -29.4397450115322 +163000 ekin = 3.97425577903338 | erot = 2.70754263327096 | epot = -36.5720643915924 | etot = -29.890265979288 +164000 ekin = 3.91949827572788 | erot = 3.05668804181471 | epot = -36.5812838593575 | etot = -29.6050975418149 +165000 ekin = 3.99425179561608 | erot = 3.29785069907607 | epot = -36.6379374004751 | etot = -29.345834905783 +166000 ekin = 4.02904533815474 | erot = 3.36634066781855 | epot = -36.7340868254029 | etot = -29.3387008194296 +167000 ekin = 4.03733260336922 | erot = 3.51733984448521 | epot = -36.8476519248263 | etot = -29.2929794769719 +168000 ekin = 4.01641387278262 | erot = 3.37538682559192 | epot = -36.9710980220148 | etot = -29.5792973236403 +169000 ekin = 3.94799788749928 | erot = 3.38842418926867 | epot = -37.1207420196424 | etot = -29.7843199428744 +170000 ekin = 3.98944239104452 | erot = 3.56779767670648 | epot = -37.2922600249326 | etot = -29.7350199571816 +171000 ekin = 4.04980262307219 | erot = 3.87308310464248 | epot = -37.4956434312003 | etot = -29.5727577034856 +172000 ekin = 4.10498686244998 | erot = 4.24595756362569 | epot = -37.6879527015205 | etot = -29.3370082754448 +173000 ekin = 4.12919710204796 | erot = 4.28575123018842 | epot = -37.8940672883479 | etot = -29.4791189561115 +174000 ekin = 4.04607401980617 | erot = 4.41784593637473 | epot = -38.1063274639924 | etot = -29.6424075078115 +175000 ekin = 4.13007220306847 | erot = 4.39679134693123 | epot = -38.3139522350302 | etot = -29.7870886850305 +176000 ekin = 4.14146369640392 | erot = 4.2556500250018 | epot = -38.5085743578719 | etot = -30.1114606364662 +177000 ekin = 4.33605278083781 | erot = 4.58687123058824 | epot = -38.6633454116433 | etot = -29.7404214002173 +178000 ekin = 4.32688916484258 | erot = 4.50454813785642 | epot = -38.7700089206445 | etot = -29.9385716179455 +179000 ekin = 4.39331384776139 | erot = 4.88121292734146 | epot = -38.8147888868654 | etot = -29.5402621117625 +180000 ekin = 4.36409495919737 | erot = 4.62653667682629 | epot = -38.7920356589672 | etot = -29.8014040229435 +181000 ekin = 4.40002739116585 | erot = 4.26572305349584 | epot = -38.7320900980018 | etot = -30.0663396533401 +182000 ekin = 4.38584471768771 | erot = 4.03958660380969 | epot = -38.6652721860916 | etot = -30.2398408645942 +183000 ekin = 4.38872118980224 | erot = 4.03920994265183 | epot = -38.5494953603397 | etot = -30.1215642278857 +184000 ekin = 4.58261674670921 | erot = 4.09854761999454 | epot = -38.3858248419668 | etot = -29.7046604752631 +185000 ekin = 4.61324410405521 | erot = 4.15998485211173 | epot = -38.1895073749226 | etot = -29.4162784187557 +186000 ekin = 4.58712030480558 | erot = 3.80292929559519 | epot = -37.9691363595879 | etot = -29.5790867591871 +187000 ekin = 4.49704057160045 | erot = 3.79953063209059 | epot = -37.7563677349904 | etot = -29.4597965312994 +188000 ekin = 4.67801335458777 | erot = 3.94614018085653 | epot = -37.5596730791519 | etot = -28.9355195437076 +189000 ekin = 4.7263502885126 | erot = 3.9798634268042 | epot = -37.3737961852728 | etot = -28.667582469956 +190000 ekin = 4.70422886783179 | erot = 3.76567525080944 | epot = -37.1968328742627 | etot = -28.7269287556214 +191000 ekin = 4.76615905270464 | erot = 4.11771710042017 | epot = -37.0524866708235 | etot = -28.1686105176987 +192000 ekin = 4.66334615993974 | erot = 4.32180108624847 | epot = -36.9281089002544 | etot = -27.9429616540662 +193000 ekin = 4.5422727261274 | erot = 4.37403333624765 | epot = -36.8106507982273 | etot = -27.8943447358523 +194000 ekin = 4.46258388626876 | erot = 4.57094153868298 | epot = -36.7126835627949 | etot = -27.6791581378432 +195000 ekin = 4.26009039309735 | erot = 5.10893274622639 | epot = -36.6717506302945 | etot = -27.3027274909708 +196000 ekin = 4.24016895096483 | erot = 4.95101320260763 | epot = -36.6607739952161 | etot = -27.4695918416436 +197000 ekin = 4.0755550793312 | erot = 5.33731157611758 | epot = -36.6886082622524 | etot = -27.2757416068037 +198000 ekin = 3.9809171395143 | erot = 5.37374733968369 | epot = -36.7238260637154 | etot = -27.3691615845174 +199000 ekin = 4.00067330792124 | erot = 5.3603518042305 | epot = -36.764372481588 | etot = -27.4033473694362 +200000 ekin = 3.91652525768025 | erot = 4.88675678602841 | epot = -36.7730308398536 | etot = -27.969748796145 +201000 ekin = 3.81609915882248 | erot = 4.31400854830177 | epot = -36.7481890160659 | etot = -28.6180813089416 +202000 ekin = 3.71932569397631 | erot = 4.38569878861448 | epot = -36.6956778034213 | etot = -28.5906533208305 +203000 ekin = 3.64290623072102 | erot = 4.37503789459276 | epot = -36.6304609598591 | etot = -28.6125168345453 +204000 ekin = 3.52854777039998 | erot = 4.29732321046279 | epot = -36.5744389849194 | etot = -28.7485680040566 +205000 ekin = 3.4768831982614 | erot = 4.0520539676819 | epot = -36.5314565547125 | etot = -29.0025193887692 +206000 ekin = 3.57867350058535 | erot = 4.28681914674893 | epot = -36.5152410045854 | etot = -28.6497483572511 +207000 ekin = 3.67789472949151 | erot = 4.07649115773262 | epot = -36.4807964879222 | etot = -28.7264106006981 +208000 ekin = 3.75162300302661 | erot = 3.99412890438543 | epot = -36.4719013777701 | etot = -28.7261494703581 +209000 ekin = 3.82882555477005 | erot = 4.07806686544371 | epot = -36.5274965379161 | etot = -28.6206041177023 +210000 ekin = 3.94589957381378 | erot = 4.05524037388615 | epot = -36.6356567037895 | etot = -28.6345167560895 +211000 ekin = 4.07654365300279 | erot = 3.99406586158679 | epot = -36.7715123193752 | etot = -28.7009028047856 +212000 ekin = 4.2840931333187 | erot = 4.41351434873049 | epot = -36.9240266223073 | etot = -28.2264191402581 +213000 ekin = 4.49200123946036 | erot = 4.57752549048046 | epot = -37.0744914076603 | etot = -28.0049646777194 +214000 ekin = 4.68170470060604 | erot = 4.83486386570169 | epot = -37.2372407583261 | etot = -27.7206721920184 +215000 ekin = 4.98081379617958 | erot = 4.46606343482534 | epot = -37.4068324828889 | etot = -27.959955251884 +216000 ekin = 5.16729766417706 | erot = 4.60318830168444 | epot = -37.5464555705166 | etot = -27.7759696046551 +217000 ekin = 5.38386929678608 | erot = 4.7775249437354 | epot = -37.6405601527452 | etot = -27.4791659122238 +218000 ekin = 5.7058164504659 | erot = 4.70370884810713 | epot = -37.6984019699825 | etot = -27.2888766714095 +219000 ekin = 5.88600523163654 | erot = 4.58694924042796 | epot = -37.7125786046508 | etot = -27.2396241325863 +220000 ekin = 6.15427965489048 | erot = 4.4293131697244 | epot = -37.684602076139 | etot = -27.1010092515241 +221000 ekin = 6.20955938016028 | erot = 4.5400172518757 | epot = -37.6213945439902 | etot = -26.8718179119542 +222000 ekin = 6.245684726226 | erot = 4.97311797105747 | epot = -37.5132484834202 | etot = -26.2944457861367 +223000 ekin = 6.23087495739563 | erot = 4.87026240860726 | epot = -37.4093126450279 | etot = -26.308175279025 +224000 ekin = 6.34215727178204 | erot = 4.95416073100327 | epot = -37.3138628835634 | etot = -26.0175448807781 +225000 ekin = 6.34418551658382 | erot = 4.97197547495996 | epot = -37.2296241301022 | etot = -25.9134631385584 +226000 ekin = 6.27234146176852 | erot = 4.71232076169797 | epot = -37.1649091144301 | etot = -26.1802468909636 +227000 ekin = 6.2978205054749 | erot = 4.6427999636898 | epot = -37.1521034204924 | etot = -26.2114829513277 +228000 ekin = 6.45215375342435 | erot = 4.66543105642573 | epot = -37.1176036705896 | etot = -26.0000188607395 +229000 ekin = 6.57609932445515 | erot = 4.31104294387344 | epot = -37.0319087568372 | etot = -26.1447664885086 +230000 ekin = 6.39415967649336 | erot = 4.16613500609569 | epot = -36.9020701489008 | etot = -26.3417754663118 +231000 ekin = 6.06981997767599 | erot = 4.16164382029996 | epot = -36.7672531588273 | etot = -26.5357893608513 +232000 ekin = 6.07851417086657 | erot = 3.9261416963498 | epot = -36.6287349588698 | etot = -26.6240790916534 +233000 ekin = 5.86578448983439 | erot = 3.89415959164456 | epot = -36.4650343354141 | etot = -26.7050902539352 +234000 ekin = 5.66525736866315 | erot = 3.89419060194094 | epot = -36.3317105619271 | etot = -26.772262591323 +235000 ekin = 5.45947253618461 | erot = 3.51915643493529 | epot = -36.187740376365 | etot = -27.2091114052451 +236000 ekin = 5.23839596197821 | erot = 3.35080370425694 | epot = -36.0601413821494 | etot = -27.4709417159143 +237000 ekin = 5.1101503869311 | erot = 3.41418634041018 | epot = -35.9797234474537 | etot = -27.4553867201124 +238000 ekin = 5.07705507560338 | erot = 3.55422258848856 | epot = -35.9558941013151 | etot = -27.3246164372232 +239000 ekin = 5.11036683512679 | erot = 3.60903830571299 | epot = -35.9686036709473 | etot = -27.2491985301075 +240000 ekin = 5.05273101840571 | erot = 3.85355249273444 | epot = -36.0380166955235 | etot = -27.1317331843833 +241000 ekin = 5.09369536459432 | erot = 3.64338000437258 | epot = -36.1343234897528 | etot = -27.3972481207859 +242000 ekin = 5.26488817621371 | erot = 4.01055195692819 | epot = -36.2412063129132 | etot = -26.9657661797713 +243000 ekin = 5.23195261673081 | erot = 4.46546566729792 | epot = -36.3456054296423 | etot = -26.6481871456136 +244000 ekin = 5.2263873943456 | erot = 4.31088904489877 | epot = -36.4415840114132 | etot = -26.9043075721688 +245000 ekin = 5.4485313703965 | erot = 4.1760797727831 | epot = -36.5182986507186 | etot = -26.893687507539 +246000 ekin = 5.514569703999 | erot = 3.74595442038546 | epot = -36.5760003166759 | etot = -27.3154761922915 +247000 ekin = 5.60809096900033 | erot = 4.1530771765417 | epot = -36.6102851986095 | etot = -26.8491170530675 +248000 ekin = 5.44607700345191 | erot = 4.00137483235474 | epot = -36.6173189081378 | etot = -27.1698670723311 +249000 ekin = 5.39824066997525 | erot = 4.00527284085329 | epot = -36.6178595818605 | etot = -27.214346071032 +250000 ekin = 5.40591864200742 | erot = 3.83152692098416 | epot = -36.5913298844141 | etot = -27.3538843214225 +251000 ekin = 5.42515843147862 | erot = 3.74120297831913 | epot = -36.5372880481642 | etot = -27.3709266383664 +252000 ekin = 5.47125756589202 | erot = 3.93923600749381 | epot = -36.471810314552 | etot = -27.0613167411661 +253000 ekin = 5.45280164405867 | erot = 4.07788577485892 | epot = -36.3971958399348 | etot = -26.8665084210172 +254000 ekin = 5.3513601049315 | erot = 4.05065697891602 | epot = -36.3208515747322 | etot = -26.9188344908847 +255000 ekin = 5.26929844479146 | erot = 3.99546469631083 | epot = -36.2503502909161 | etot = -26.9855871498138 +256000 ekin = 5.28023678974977 | erot = 4.22040986008186 | epot = -36.1946445254543 | etot = -26.6939978756227 +257000 ekin = 5.06048081748216 | erot = 4.23177072888008 | epot = -36.1310700373968 | etot = -26.8388184910345 +258000 ekin = 5.04266904507247 | erot = 4.32321520328045 | epot = -36.0647093578741 | etot = -26.6988251095212 +259000 ekin = 4.83091830266297 | erot = 4.34656742782648 | epot = -36.0089991272053 | etot = -26.8315133967159 +260000 ekin = 4.8366999116753 | erot = 4.25709648660373 | epot = -35.9697036974581 | etot = -26.8759072991791 +261000 ekin = 4.77396719262911 | erot = 4.09292214976309 | epot = -35.9054139064698 | etot = -27.0385245640776 +262000 ekin = 4.66601270858316 | erot = 3.73102576614686 | epot = -35.8157479345083 | etot = -27.4187094597782 +263000 ekin = 4.5802706196014 | erot = 3.74679758350907 | epot = -35.763125473781 | etot = -27.4360572706705 +264000 ekin = 4.65921569864806 | erot = 3.90501973344001 | epot = -35.7356757776833 | etot = -27.1714403455952 +265000 ekin = 4.67586149937246 | erot = 3.94654925905539 | epot = -35.7049387943745 | etot = -27.0825280359466 +266000 ekin = 4.69584694538507 | erot = 3.98055672084537 | epot = -35.6673176149256 | etot = -26.9909139486952 +267000 ekin = 4.78499421532903 | erot = 4.03648169158355 | epot = -35.6392507408887 | etot = -26.8177748339762 +268000 ekin = 4.84316914009027 | erot = 3.99860778002458 | epot = -35.6448334716846 | etot = -26.8030565515698 +269000 ekin = 4.90837806472302 | erot = 4.04652570535924 | epot = -35.649642070165 | etot = -26.6947383000828 +270000 ekin = 4.78579400655265 | erot = 4.34179455226949 | epot = -35.6115561484003 | etot = -26.4839675895782 +271000 ekin = 4.85153732395756 | erot = 3.76641259729531 | epot = -35.6137753066569 | etot = -26.9958253854041 +272000 ekin = 4.97803664593748 | erot = 4.19853764559909 | epot = -35.6642256780782 | etot = -26.4876513865416 +273000 ekin = 4.99431287425834 | erot = 4.16775756950281 | epot = -35.7125500141222 | etot = -26.550479570361 +274000 ekin = 5.02755533075287 | erot = 4.06015777810463 | epot = -35.7335253506929 | etot = -26.6458122418354 +275000 ekin = 4.96372481963251 | erot = 4.27522667590908 | epot = -35.7375976828855 | etot = -26.4986461873439 +276000 ekin = 5.07934127118672 | erot = 4.03884457577096 | epot = -35.7684807851678 | etot = -26.6502949382101 +277000 ekin = 5.11065676525152 | erot = 3.89593355388432 | epot = -35.8299825238661 | etot = -26.8233922047303 +278000 ekin = 5.1443449346496 | erot = 4.10431801630134 | epot = -35.9156424264972 | etot = -26.6669794755462 +279000 ekin = 5.13854043459778 | erot = 3.33687958464079 | epot = -35.956728093981 | etot = -27.4813080747424 +280000 ekin = 5.13698711985589 | erot = 3.1321095347808 | epot = -35.9663254349012 | etot = -27.6972287802645 +281000 ekin = 5.12014323326413 | erot = 3.01072130069925 | epot = -35.9687821467587 | etot = -27.8379176127953 +282000 ekin = 5.07487298196239 | erot = 2.78222371236679 | epot = -35.9666224009215 | etot = -28.1095257065923 +283000 ekin = 4.93728532174466 | erot = 2.51682526487924 | epot = -36.0092096947436 | etot = -28.5550991081197 +284000 ekin = 5.10799487537405 | erot = 2.3440616424374 | epot = -36.0766867016227 | etot = -28.6246301838113 +285000 ekin = 5.21438921803052 | erot = 2.42355410917329 | epot = -36.1686025783616 | etot = -28.5306592511578 +286000 ekin = 5.22674428893651 | erot = 2.43127546535983 | epot = -36.2811716154221 | etot = -28.6231518611258 +287000 ekin = 5.42842235635998 | erot = 2.80110266939557 | epot = -36.3926299688273 | etot = -28.1631049430717 +288000 ekin = 5.53841609379908 | erot = 3.04198571498586 | epot = -36.5118610231699 | etot = -27.9314592143849 +289000 ekin = 5.34670403011154 | erot = 3.09938875481729 | epot = -36.6304827875401 | etot = -28.1843900026112 +290000 ekin = 5.34231674745526 | erot = 3.31160144161424 | epot = -36.7456392368764 | etot = -28.0917210478069 +291000 ekin = 5.36188526202275 | erot = 3.45917476353447 | epot = -36.830253723617 | etot = -28.0091936980598 +292000 ekin = 5.47780509141236 | erot = 3.77906726321862 | epot = -36.8842491471661 | etot = -27.6273767925352 +293000 ekin = 5.28302000096918 | erot = 3.57818629599089 | epot = -36.8949841799428 | etot = -28.0337778829827 +294000 ekin = 5.30853543438887 | erot = 3.56263204697633 | epot = -36.882573669786 | etot = -28.0114061884208 +295000 ekin = 5.20536069491219 | erot = 3.77206495855704 | epot = -36.8703913967999 | etot = -27.8929657433306 +296000 ekin = 5.16948391824644 | erot = 3.64242202500146 | epot = -36.8524591521913 | etot = -28.0405532089434 +297000 ekin = 5.1494869829345 | erot = 3.56300071318446 | epot = -36.8077681088429 | etot = -28.0952804127239 +298000 ekin = 5.07831718808035 | erot = 3.56647326916626 | epot = -36.744195155603 | etot = -28.0994046983564 +299000 ekin = 5.07638833142117 | erot = 3.33911289208767 | epot = -36.7050879472256 | etot = -28.2895867237168 +300000 ekin = 5.03413727775456 | erot = 3.74853034027389 | epot = -36.6636621891816 | etot = -27.8809945711531 +301000 ekin = 4.97235848835814 | erot = 3.32835758650091 | epot = -36.6711630757892 | etot = -28.3704470009301 +302000 ekin = 5.00968958710056 | erot = 3.04854259478488 | epot = -36.7093256921451 | etot = -28.6510935102597 +303000 ekin = 5.1292911047111 | erot = 3.0802372254873 | epot = -36.795184172806 | etot = -28.5856558426076 +304000 ekin = 5.16690416140478 | erot = 3.34049274709003 | epot = -36.9126194047394 | etot = -28.4052224962446 +305000 ekin = 5.23349789631498 | erot = 3.46551744359711 | epot = -37.0448370009157 | etot = -28.3458216610036 +306000 ekin = 5.28860974527375 | erot = 3.56105103024499 | epot = -37.1811985422458 | etot = -28.331537766727 +307000 ekin = 5.40125295123197 | erot = 3.87520415097952 | epot = -37.305532344159 | etot = -28.0290752419475 +308000 ekin = 5.46740727789042 | erot = 3.91865002312578 | epot = -37.3892778155261 | etot = -28.0032205145099 +309000 ekin = 5.43990046762827 | erot = 4.00265425349897 | epot = -37.4336308324244 | etot = -27.9910761112972 +310000 ekin = 5.38744019614258 | erot = 3.91760045067575 | epot = -37.4766997166651 | etot = -28.1716590698468 +311000 ekin = 5.54869794564892 | erot = 3.97913763348738 | epot = -37.5380640420292 | etot = -28.0102284628929 +312000 ekin = 5.71519006739901 | erot = 4.09263126769853 | epot = -37.5745318459447 | etot = -27.7667105108472 +313000 ekin = 5.6033160766113 | erot = 3.83543196463871 | epot = -37.6101139619699 | etot = -28.1713659207199 +314000 ekin = 5.51800417081449 | erot = 3.7494474523441 | epot = -37.6279066647947 | etot = -28.3604550416361 +315000 ekin = 5.47833005901023 | erot = 4.08581993263846 | epot = -37.640612435341 | etot = -28.0764624436923 +316000 ekin = 5.33860837296314 | erot = 4.51116644302074 | epot = -37.6217312448188 | etot = -27.7719564288349 +317000 ekin = 5.23941916557637 | erot = 4.78689518832666 | epot = -37.5731600528526 | etot = -27.5468456989496 +318000 ekin = 5.11187775633096 | erot = 4.82958812680045 | epot = -37.5155006216097 | etot = -27.5740347384783 +319000 ekin = 5.22954347525673 | erot = 4.49457407004902 | epot = -37.4371163833057 | etot = -27.7129988379999 +320000 ekin = 5.30878948863381 | erot = 4.92186054084637 | epot = -37.3586788029377 | etot = -27.1280287734575 +321000 ekin = 5.25051542685381 | erot = 4.81963950413314 | epot = -37.312294527991 | etot = -27.242139597004 +322000 ekin = 5.07574443571145 | erot = 4.74007360204254 | epot = -37.2420599117425 | etot = -27.4262418739885 +323000 ekin = 5.02653253509398 | erot = 4.66604787555051 | epot = -37.1620424354781 | etot = -27.4694620248336 +324000 ekin = 5.12999279273078 | erot = 4.55456244400836 | epot = -37.1081993843437 | etot = -27.4236441476046 +325000 ekin = 5.01484863365284 | erot = 5.03270116093522 | epot = -37.0549970668846 | etot = -27.0074472722965 +326000 ekin = 5.15105125743379 | erot = 4.77726330645663 | epot = -37.0062804471441 | etot = -27.0779658832536 +327000 ekin = 5.17373663939365 | erot = 4.75720955177068 | epot = -36.9735735310227 | etot = -27.0426273398583 +328000 ekin = 5.3265809986393 | erot = 4.45847251670642 | epot = -36.9463177254327 | etot = -27.161264210087 +329000 ekin = 5.28491385975242 | erot = 4.2365002087062 | epot = -36.9151642788529 | etot = -27.3937502103943 +330000 ekin = 5.12552135481241 | erot = 4.79027984581669 | epot = -36.8863179466156 | etot = -26.9705167459865 +331000 ekin = 5.12103290586646 | erot = 5.03778117543897 | epot = -36.8413630474537 | etot = -26.6825489661482 +332000 ekin = 5.06929714597599 | erot = 4.90820597157558 | epot = -36.7488012231943 | etot = -26.7712981056427 +333000 ekin = 4.96505468499544 | erot = 5.01335794632771 | epot = -36.6271163009906 | etot = -26.6487036696675 +334000 ekin = 4.99343125906637 | erot = 5.01439694959174 | epot = -36.5036049758879 | etot = -26.4957767672298 +335000 ekin = 4.90069371729849 | erot = 4.54385275511644 | epot = -36.377759964637 | etot = -26.9332134922221 +336000 ekin = 5.07863725672843 | erot = 4.69305135725114 | epot = -36.2629152842743 | etot = -26.4912266702948 +337000 ekin = 4.94799955754099 | erot = 4.52583833193054 | epot = -36.1612360033446 | etot = -26.6873981138731 +338000 ekin = 4.85224868200247 | erot = 4.50041298245536 | epot = -36.0752991866368 | etot = -26.7226375221789 +339000 ekin = 4.72144640536392 | erot = 4.54752039051201 | epot = -35.9970632546959 | etot = -26.7280964588199 +340000 ekin = 4.80943098922142 | erot = 4.34708343509477 | epot = -35.9687361528339 | etot = -26.8122217285177 +341000 ekin = 4.70361214653912 | erot = 4.47793300498467 | epot = -35.9999322617892 | etot = -26.8183871102654 +342000 ekin = 4.760647614817 | erot = 4.66605256976235 | epot = -36.043378412271 | etot = -26.6166782276917 +343000 ekin = 4.67728032528815 | erot = 4.66100839176406 | epot = -35.9211632159817 | etot = -26.5828744989295 +344000 ekin = 4.96339724601292 | erot = 4.93823124551203 | epot = -36.221225061482 | etot = -26.3195965699571 +345000 ekin = 4.92216540601213 | erot = 5.1046016577438 | epot = -36.3841924486031 | etot = -26.3574253848472 +346000 ekin = 4.99792813974919 | erot = 4.77882820289924 | epot = -36.4406602112532 | etot = -26.6639038686048 +347000 ekin = 4.97738387739169 | erot = 4.57238123569558 | epot = -36.4353446283207 | etot = -26.8855795152334 +348000 ekin = 4.92451917191373 | erot = 4.32330547944782 | epot = -36.3741726686484 | etot = -27.1263480172868 +349000 ekin = 4.79018344488603 | erot = 4.64955099606439 | epot = -36.223205179622 | etot = -26.7834707386715 +350000 ekin = 4.74997485376182 | erot = 4.41441619332993 | epot = -36.0086530481282 | etot = -26.8442620010365 +351000 ekin = 4.65861306362181 | erot = 4.54712008187925 | epot = -35.7312651155864 | etot = -26.5255319700854 +352000 ekin = 4.64876538273227 | erot = 4.76138349321479 | epot = -35.450636936112 | etot = -26.0404880601649 +353000 ekin = 4.59253342081085 | erot = 4.29456686626191 | epot = -35.1553683981329 | etot = -26.2682681110601 +354000 ekin = 4.5381016314927 | erot = 4.43945254667789 | epot = -34.9111484982536 | etot = -25.933594320083 +355000 ekin = 4.47391617267677 | erot = 4.20275229581173 | epot = -34.7382448152821 | etot = -26.0615763467936 +356000 ekin = 4.33084740359937 | erot = 4.16589789857719 | epot = -34.645946257664 | etot = -26.1492009554875 +357000 ekin = 4.27639689643637 | erot = 4.49834201135572 | epot = -34.623409347858 | etot = -25.848670440066 +358000 ekin = 4.37058163127658 | erot = 4.62827517810171 | epot = -34.660122927085 | etot = -25.6612661177067 +359000 ekin = 4.33282658147941 | erot = 4.3585277169614 | epot = -34.7355034140379 | etot = -26.0441491155971 +360000 ekin = 4.2302574599471 | erot = 3.73692187296606 | epot = -34.8272714416459 | etot = -26.8600921087327 +361000 ekin = 4.32772510308598 | erot = 3.40799158120822 | epot = -34.9260321184263 | etot = -27.1903154341322 +362000 ekin = 4.43772207587162 | erot = 3.9282425665155 | epot = -35.0362517129443 | etot = -26.6702870705572 +363000 ekin = 4.60059512711759 | erot = 3.7852782080073 | epot = -35.1492303885082 | etot = -26.7633570533833 +364000 ekin = 4.67620778921833 | erot = 3.65656363115961 | epot = -35.2108467629343 | etot = -26.8780753425564 +365000 ekin = 4.68744796027403 | erot = 3.48647035761076 | epot = -35.2579291425392 | etot = -27.0840108246544 +366000 ekin = 4.63171694657446 | erot = 3.80732263161716 | epot = -35.3317328424945 | etot = -26.8926932643029 +367000 ekin = 4.58794520776148 | erot = 4.31664541166342 | epot = -35.411407687399 | etot = -26.5068170679741 +368000 ekin = 4.53697760644357 | erot = 4.37812449310863 | epot = -35.4654560531489 | etot = -26.5503539535967 +369000 ekin = 4.50593348762471 | erot = 4.09682529638636 | epot = -35.502904475486 | etot = -26.9001456914749 +370000 ekin = 4.51011536275126 | erot = 4.41695795738184 | epot = -35.5220659543718 | etot = -26.5949926342387 +371000 ekin = 4.53049860135433 | erot = 4.68112317413008 | epot = -35.5213297387008 | etot = -26.3097079632164 +372000 ekin = 4.42660066351885 | erot = 4.78148611859358 | epot = -35.5227844835439 | etot = -26.3146977014315 +373000 ekin = 4.28146792836402 | erot = 4.87997662616423 | epot = -35.4825501780567 | etot = -26.3211056235285 +374000 ekin = 4.13287464156697 | erot = 4.84001159820239 | epot = -35.4523011025149 | etot = -26.4794148627455 +375000 ekin = 4.1254545194713 | erot = 4.8180743382467 | epot = -35.4637375699461 | etot = -26.5202087122281 +376000 ekin = 3.87506271806603 | erot = 5.35141111797724 | epot = -35.4720072259952 | etot = -26.2455333899519 +377000 ekin = 3.7977056590801 | erot = 5.28013401771242 | epot = -35.5177354201969 | etot = -26.4398957434044 +378000 ekin = 3.64048261255653 | erot = 5.42072423796152 | epot = -35.5808236384767 | etot = -26.5196167879587 +379000 ekin = 3.52386111576647 | erot = 5.97567004606738 | epot = -35.6532146067625 | etot = -26.1536834449286 +380000 ekin = 3.32387900413189 | erot = 6.59135162244889 | epot = -35.7551331169142 | etot = -25.8399024903334 +381000 ekin = 3.31695717077463 | erot = 6.10983514346576 | epot = -35.8815158952862 | etot = -26.4547235810458 +382000 ekin = 3.19546651526133 | erot = 6.36489840256999 | epot = -35.9926058393689 | etot = -26.4322409215376 +383000 ekin = 3.24368169764623 | erot = 6.33114976953635 | epot = -36.0664601033037 | etot = -26.4916286361211 +384000 ekin = 3.20726412806439 | erot = 6.19392941274155 | epot = -36.13258109202 | etot = -26.7313875512141 +385000 ekin = 3.23885859839814 | erot = 6.31552666314694 | epot = -36.1503271354803 | etot = -26.5959418739352 +386000 ekin = 3.16874411708083 | erot = 5.94413881699879 | epot = -36.1310192334958 | etot = -27.0181362994162 +387000 ekin = 3.1549970524927 | erot = 5.48308596050834 | epot = -36.0714221491829 | etot = -27.4333391361819 +388000 ekin = 3.24907989403076 | erot = 5.58200944567837 | epot = -35.9925882356966 | etot = -27.1614988959874 +389000 ekin = 3.39871525437769 | erot = 5.14342534967113 | epot = -35.9262739307719 | etot = -27.384133326723 +390000 ekin = 3.53157771561222 | erot = 5.0660110699086 | epot = -35.908983793516 | etot = -27.3113950079952 +391000 ekin = 3.64602168736988 | erot = 4.88661504875141 | epot = -35.885482230409 | etot = -27.3528454942877 +392000 ekin = 3.79325143536366 | erot = 5.07292816992986 | epot = -35.8524207546015 | etot = -26.986241149308 +393000 ekin = 3.89148460233114 | erot = 5.02930522203665 | epot = -35.795122258631 | etot = -26.8743324342632 +394000 ekin = 3.96458882833181 | erot = 4.47630346760488 | epot = -35.7247928997471 | etot = -27.2839006038104 +395000 ekin = 4.03856036181308 | erot = 4.53784941780792 | epot = -35.6586367417738 | etot = -27.0822269621528 +396000 ekin = 3.99683646706711 | erot = 4.49727898211262 | epot = -35.5718421340357 | etot = -27.077726684856 +397000 ekin = 4.03872005304138 | erot = 4.03153022392527 | epot = -35.5101946272741 | etot = -27.4399443503075 +398000 ekin = 4.01516330520003 | erot = 4.23226303701241 | epot = -35.4578715559685 | etot = -27.2104452137561 +399000 ekin = 4.01922616565289 | erot = 3.71642260619024 | epot = -35.3548490578807 | etot = -27.6192002860376 +400000 ekin = 4.17225085372102 | erot = 4.04093039429602 | epot = -35.2265510847563 | etot = -27.0133698367392 +401000 ekin = 4.1531499643259 | erot = 3.64804961209453 | epot = -35.0943512868027 | etot = -27.2931517103823 +402000 ekin = 4.20245298417996 | erot = 3.70137380667448 | epot = -34.9745627237163 | etot = -27.0707359328619 +403000 ekin = 4.34132456228991 | erot = 3.62891618665791 | epot = -34.8718657472304 | etot = -26.9016249982826 +404000 ekin = 4.42465890243367 | erot = 3.38938035287143 | epot = -34.7967250831428 | etot = -26.9826858278377 +405000 ekin = 4.60663041953486 | erot = 3.44054758174463 | epot = -34.7925257887161 | etot = -26.7453477874366 +406000 ekin = 4.73346375173126 | erot = 3.27915256113194 | epot = -34.8343083282573 | etot = -26.8216920153941 +407000 ekin = 4.82559135473415 | erot = 3.35253133282322 | epot = -34.9059066553788 | etot = -26.7277839678214 +408000 ekin = 4.89298564336964 | erot = 3.47339817729183 | epot = -34.9848536782083 | etot = -26.6184698575468 +409000 ekin = 4.94069048180851 | erot = 3.76649967413607 | epot = -35.0728065521172 | etot = -26.3656163961726 +410000 ekin = 5.0837627829781 | erot = 3.48855890171053 | epot = -35.187607935011 | etot = -26.6152862503224 +411000 ekin = 5.10492342399056 | erot = 3.39152717909369 | epot = -35.2939784996981 | etot = -26.7975278966138 +412000 ekin = 5.2111592148929 | erot = 3.62435455589215 | epot = -35.3853247581651 | etot = -26.54981098738 +413000 ekin = 5.25687541732572 | erot = 3.76308251202569 | epot = -35.4593584594661 | etot = -26.4394005301146 +414000 ekin = 5.1324847249699 | erot = 3.31025282824723 | epot = -35.5393093363061 | etot = -27.0965717830889 +415000 ekin = 5.09217261574528 | erot = 3.59401320391361 | epot = -35.6051617924017 | etot = -26.9189759727428 +416000 ekin = 5.04807348985225 | erot = 3.48392073248423 | epot = -35.6748296719198 | etot = -27.1428354495833 +417000 ekin = 4.99138526936748 | erot = 3.46255923404135 | epot = -35.7531502554471 | etot = -27.2992057520383 +418000 ekin = 5.08999508315138 | erot = 3.44390708246943 | epot = -35.8333696081094 | etot = -27.2994674424886 +419000 ekin = 5.21842750435985 | erot = 3.38325168590963 | epot = -35.8593643490784 | etot = -27.2576851588089 +420000 ekin = 5.28947719533168 | erot = 3.50797044377656 | epot = -35.8848039905133 | etot = -27.0873563514051 +421000 ekin = 5.35268927232197 | erot = 3.36603650801233 | epot = -35.8749221051677 | etot = -27.1561963248334 +422000 ekin = 5.23695191026875 | erot = 3.5384192070691 | epot = -35.889640869454 | etot = -27.1142697521161 +423000 ekin = 5.09577504756812 | erot = 3.67923583037239 | epot = -35.9137595336543 | etot = -27.1387486557138 +424000 ekin = 5.01335188113047 | erot = 3.70110718137013 | epot = -35.9185617531989 | etot = -27.2041026906983 +425000 ekin = 5.05206155589306 | erot = 3.57652002072429 | epot = -35.9081181462489 | etot = -27.2795365696316 +426000 ekin = 4.96532396129214 | erot = 3.38938274590534 | epot = -35.8769982527922 | etot = -27.5222915455948 +427000 ekin = 4.77195218714309 | erot = 3.50252627514185 | epot = -35.7935414010628 | etot = -27.5190629387779 +428000 ekin = 4.81068646615448 | erot = 3.51825958765431 | epot = -35.6664317412178 | etot = -27.337485687409 +429000 ekin = 4.73870321335492 | erot = 3.84986931063852 | epot = -35.48737645591 | etot = -26.8988039319166 +430000 ekin = 4.60213714825158 | erot = 3.45284870606443 | epot = -35.3073410925574 | etot = -27.2523552382414 +431000 ekin = 4.57358006593925 | erot = 3.25422348182535 | epot = -35.1367594918962 | etot = -27.3089559441316 +432000 ekin = 4.5072400368044 | erot = 3.29998192315337 | epot = -35.0290425710883 | etot = -27.2218206111306 +433000 ekin = 4.30860495703181 | erot = 3.42741416873389 | epot = -34.9513402987262 | etot = -27.2153211729605 +434000 ekin = 4.18610269286835 | erot = 3.55059973000668 | epot = -34.9144648758603 | etot = -27.1777624529852 +435000 ekin = 4.12003359590273 | erot = 3.78033374370969 | epot = -34.8780591099565 | etot = -26.9776917703441 +436000 ekin = 3.97313974106111 | erot = 4.05117020636312 | epot = -34.8427841720093 | etot = -26.8184742245851 +437000 ekin = 3.88596008320741 | erot = 4.32902730056047 | epot = -34.8121331683379 | etot = -26.59714578457 +438000 ekin = 4.0300322104638 | erot = 4.35508047283467 | epot = -34.7917492531093 | etot = -26.4066365698108 +439000 ekin = 4.04655148511089 | erot = 4.17322604141044 | epot = -34.7786348227552 | etot = -26.5588572962338 +440000 ekin = 4.02801522674428 | erot = 4.13470601724877 | epot = -34.783993085415 | etot = -26.621271841422 +441000 ekin = 3.9407814794189 | erot = 4.22144190117305 | epot = -34.8185771480924 | etot = -26.6563537675004 +442000 ekin = 3.97730990695624 | erot = 4.24233406975314 | epot = -34.8718962191131 | etot = -26.6522522424037 +443000 ekin = 3.98508138243203 | erot = 4.16122580291752 | epot = -34.9266782585657 | etot = -26.7803710732162 +444000 ekin = 4.00042709081881 | erot = 4.50741850480051 | epot = -34.9630696153483 | etot = -26.455224019729 +445000 ekin = 4.02620459576009 | erot = 4.64580325300967 | epot = -34.9893039643633 | etot = -26.3172961155935 +446000 ekin = 4.01454608720561 | erot = 4.89747165518573 | epot = -34.9969089036747 | etot = -26.0848911612834 +447000 ekin = 3.9634269487331 | erot = 4.85867800390581 | epot = -34.9830933662453 | etot = -26.1609884136064 +448000 ekin = 3.74592315828131 | erot = 5.17578433357899 | epot = -34.9638816619607 | etot = -26.0421741701004 +449000 ekin = 3.73316291077397 | erot = 5.18498661281911 | epot = -34.928043894125 | etot = -26.0098943705319 +450000 ekin = 3.85313039093471 | erot = 4.86926583888851 | epot = -34.871696979835 | etot = -26.1493007500118 +451000 ekin = 4.0635928053116 | erot = 4.99817049859077 | epot = -34.8377147695102 | etot = -25.7759514656078 +452000 ekin = 4.12215980217323 | erot = 4.58488292412152 | epot = -34.8398353293668 | etot = -26.132792603072 +453000 ekin = 4.16332842884585 | erot = 4.32671008371169 | epot = -34.8570499988891 | etot = -26.3670114863315 +454000 ekin = 4.11754892618458 | erot = 4.47415692336241 | epot = -34.8913194738516 | etot = -26.2996136243046 +455000 ekin = 4.22185774995392 | erot = 4.65517828169302 | epot = -34.9334347985056 | etot = -26.0563987668587 +456000 ekin = 4.30177202276186 | erot = 4.77747798616555 | epot = -35.0188770940117 | etot = -25.9396270850843 +457000 ekin = 4.26451460758692 | erot = 4.69009499467403 | epot = -35.1021143238335 | etot = -26.1475047215725 +458000 ekin = 4.31289289804826 | erot = 4.48148846421096 | epot = -35.1135359976452 | etot = -26.319154635386 +459000 ekin = 4.40924309472913 | erot = 4.70052929057904 | epot = -35.3709113999322 | etot = -26.261139014624 +460000 ekin = 4.47691183250362 | erot = 4.50574141189091 | epot = -35.566195356935 | etot = -26.5835421125405 +461000 ekin = 4.43873436995047 | erot = 4.99077626254052 | epot = -35.6310455171601 | etot = -26.2015348846691 +462000 ekin = 4.38932525316334 | erot = 4.94989100042744 | epot = -35.7174404682251 | etot = -26.3782242146343 +463000 ekin = 4.36115268480756 | erot = 5.66229263914062 | epot = -35.7828736923833 | etot = -25.7594283684351 +464000 ekin = 4.32411863133059 | erot = 5.21874712373015 | epot = -35.831817418358 | etot = -26.2889516632972 +465000 ekin = 4.25283049437785 | erot = 4.89311928407883 | epot = -35.8307748329822 | etot = -26.6848250545255 +466000 ekin = 3.97961054012127 | erot = 4.30523919521546 | epot = -35.8019205162795 | etot = -27.5170707809428 +467000 ekin = 3.96957942645049 | erot = 4.02414635207156 | epot = -35.7935881476328 | etot = -27.7998623691107 +468000 ekin = 3.81067149059023 | erot = 3.91311573890038 | epot = -35.8192046044613 | etot = -28.0954173749707 +469000 ekin = 3.82956653035844 | erot = 3.76358708523021 | epot = -35.8554657317423 | etot = -28.2623121161536 +470000 ekin = 3.84315155222981 | erot = 3.46319185355953 | epot = -35.9283028420635 | etot = -28.6219594362741 +471000 ekin = 3.84189885920186 | erot = 3.51787257644774 | epot = -36.0370536568174 | etot = -28.6772822211678 +472000 ekin = 3.86861114122289 | erot = 3.36458500068021 | epot = -36.136832298983 | etot = -28.9036361570799 +473000 ekin = 3.73700168734163 | erot = 3.58329228877658 | epot = -36.2233655143198 | etot = -28.9030715382016 +474000 ekin = 3.82928273613466 | erot = 3.70070391401449 | epot = -36.2919855352817 | etot = -28.7619988851326 +475000 ekin = 3.89544030959981 | erot = 3.76401640046676 | epot = -36.368430738898 | etot = -28.7089740288314 +476000 ekin = 4.08932767113311 | erot = 3.7090790175484 | epot = -36.4684310716285 | etot = -28.670024382947 +477000 ekin = 4.15334136664067 | erot = 3.70899967496142 | epot = -36.5311600367317 | etot = -28.6688189951296 +478000 ekin = 4.07512882728801 | erot = 3.80913887771278 | epot = -36.5715417700018 | etot = -28.687274065001 +479000 ekin = 3.96184225144662 | erot = 3.67584263229307 | epot = -36.6049454628497 | etot = -28.96726057911 +480000 ekin = 3.86072911979592 | erot = 3.85211085064263 | epot = -36.6106292252495 | etot = -28.897789254811 +481000 ekin = 3.78563823255482 | erot = 4.02431409923187 | epot = -36.604468258428 | etot = -28.7945159266413 +482000 ekin = 3.81986353724767 | erot = 3.94457553240232 | epot = -36.555624249585 | etot = -28.791185179935 +483000 ekin = 3.91937069686989 | erot = 3.97985471481289 | epot = -36.4953515335722 | etot = -28.5961261218894 +484000 ekin = 3.90565472316258 | erot = 3.68508276016124 | epot = -36.4265142327187 | etot = -28.8357767493949 +485000 ekin = 3.97067640669119 | erot = 3.52818833629898 | epot = -36.3385351029671 | etot = -28.8396703599769 +486000 ekin = 4.08924338068637 | erot = 3.45150371793016 | epot = -36.2407040808275 | etot = -28.699956982211 +487000 ekin = 4.0776172953027 | erot = 3.69577064303949 | epot = -36.1174543397059 | etot = -28.3440664013637 +488000 ekin = 3.98120330041654 | erot = 4.01179749212316 | epot = -35.9662140009108 | etot = -27.9732132083711 +489000 ekin = 3.94304108511277 | erot = 4.09948585344473 | epot = -35.8365811443669 | etot = -27.7940542058094 +490000 ekin = 3.98200750178095 | erot = 4.1933065556559 | epot = -35.7436522395692 | etot = -27.5683381821323 +491000 ekin = 4.04453601319225 | erot = 4.06864604679556 | epot = -35.6813038605047 | etot = -27.5681218005169 +492000 ekin = 4.10478194610714 | erot = 4.27931273272371 | epot = -35.6201850620968 | etot = -27.2360903832659 +493000 ekin = 4.14218811078641 | erot = 4.30328516242947 | epot = -35.552932172172 | etot = -27.1074588989561 +494000 ekin = 4.15483197917405 | erot = 4.22087230768693 | epot = -35.5007035923698 | etot = -27.1249993055088 +495000 ekin = 4.26671892357318 | erot = 4.21745137304138 | epot = -35.4450128389798 | etot = -26.9608425423653 +496000 ekin = 4.42373869014847 | erot = 3.65535322096903 | epot = -35.3933064942827 | etot = -27.3142145831652 +497000 ekin = 4.57363309591063 | erot = 3.63766344362447 | epot = -35.3630685420949 | etot = -27.1517720025598 +498000 ekin = 4.7241733979428 | erot = 3.40665904233516 | epot = -35.3570714026385 | etot = -27.2262389623605 +499000 ekin = 4.76806375994875 | erot = 3.58204839805272 | epot = -35.3646341268585 | etot = -27.014521968857 +500000 ekin = 4.86803273232483 | erot = 3.40069391727023 | epot = -35.4199817543268 | etot = -27.1512551047318 +501000 ekin = 4.96743307602627 | erot = 3.46724128896305 | epot = -35.4970649677118 | etot = -27.0623906027225 +502000 ekin = 4.91929166862615 | erot = 3.57165212036678 | epot = -35.5889625489512 | etot = -27.0980187599583 +503000 ekin = 4.90703913138678 | erot = 3.86458875313933 | epot = -35.6771862828227 | etot = -26.9055583982966 +504000 ekin = 5.1370533506199 | erot = 3.5369546296831 | epot = -35.7347477259461 | etot = -27.0607397456431 +505000 ekin = 5.23249143944225 | erot = 3.46343104093314 | epot = -35.7820571844966 | etot = -27.0861347041212 +506000 ekin = 5.11675278315717 | erot = 3.7206718650993 | epot = -35.8198968197658 | etot = -26.9824721715093 +507000 ekin = 5.1899390138749 | erot = 4.15215085847695 | epot = -35.8269271672396 | etot = -26.4848372948877 +508000 ekin = 4.9859787822663 | erot = 4.11598571893968 | epot = -35.7826195676286 | etot = -26.6806550664226 +509000 ekin = 4.8941242567771 | erot = 4.30807642739895 | epot = -35.6890852058564 | etot = -26.4868845216804 +510000 ekin = 4.89504815269032 | erot = 4.46013837584195 | epot = -35.5893215666418 | etot = -26.2341350381096 +511000 ekin = 4.85835750083421 | erot = 4.41721118692693 | epot = -35.4748886415727 | etot = -26.1993199538116 +512000 ekin = 4.85632567302005 | erot = 4.58501467870099 | epot = -35.3170557845382 | etot = -25.8757154328171 +513000 ekin = 4.79088228903437 | erot = 4.4189824922301 | epot = -35.1398620511889 | etot = -25.9299972699244 +514000 ekin = 4.84082723167344 | erot = 4.10048582144436 | epot = -34.952894027941 | etot = -26.0115809748232 +515000 ekin = 4.66396867258937 | erot = 3.7079532547263 | epot = -34.8081323279133 | etot = -26.4362104005976 +516000 ekin = 4.4520372226043 | erot = 3.7424161749218 | epot = -34.7399422586774 | etot = -26.5454888611513 +517000 ekin = 4.39320763550332 | erot = 3.61293763489243 | epot = -34.7115969229745 | etot = -26.7054516525788 +518000 ekin = 4.3351626742312 | erot = 3.46685163663689 | epot = -34.7205591716219 | etot = -26.9185448607538 +519000 ekin = 4.32678001120832 | erot = 3.8333130859946 | epot = -34.7543932584755 | etot = -26.5943001612725 +520000 ekin = 4.16017569753314 | erot = 3.99442103376417 | epot = -34.7797387277815 | etot = -26.6251419964842 +521000 ekin = 4.01091284601602 | erot = 4.71227661622732 | epot = -34.8119764016188 | etot = -26.0887869393754 +522000 ekin = 3.9255586814989 | erot = 4.67306017627962 | epot = -34.8638412525408 | etot = -26.2652223947623 +523000 ekin = 4.10629342994203 | erot = 4.236908212199 | epot = -34.9392637364661 | etot = -26.5960620943251 +524000 ekin = 4.16964406138591 | erot = 4.51539305326744 | epot = -35.0302476439308 | etot = -26.3452105292774 +525000 ekin = 4.14574067413465 | erot = 4.59255192964589 | epot = -35.1665459803983 | etot = -26.4282533766178 +526000 ekin = 4.296358047754 | erot = 5.381812036993 | epot = -35.3702076593238 | etot = -25.6920375745768 +527000 ekin = 4.43341423246361 | erot = 5.4208701656542 | epot = -35.5881352754177 | etot = -25.7338508772999 +528000 ekin = 4.65221997264072 | erot = 5.64432261927517 | epot = -35.7907306535609 | etot = -25.494188061645 +529000 ekin = 4.75833001518924 | erot = 6.22279494556947 | epot = -35.9649272181716 | etot = -24.9838022574129 +530000 ekin = 4.85254900576415 | erot = 6.26630645813046 | epot = -36.1175112827238 | etot = -24.9986558188292 +531000 ekin = 4.88314038497982 | erot = 6.22256761998238 | epot = -36.2218727030894 | etot = -25.1161646981272 +532000 ekin = 4.89429192132463 | erot = 6.19376619305432 | epot = -36.2791850407375 | etot = -25.1911269263585 +533000 ekin = 4.98074956905521 | erot = 6.71246035574362 | epot = -36.2873072492241 | etot = -24.5940973244253 +534000 ekin = 5.05914514163862 | erot = 6.72049132345808 | epot = -36.2541186702089 | etot = -24.4744822051122 +535000 ekin = 4.98307281629264 | erot = 6.60876507020625 | epot = -36.1722591997817 | etot = -24.5804213132828 +536000 ekin = 4.92092214615494 | erot = 6.71824597922688 | epot = -36.0492643890656 | etot = -24.4100962636838 +537000 ekin = 4.73594122849286 | erot = 6.46069540815352 | epot = -35.9116294607651 | etot = -24.7149928241187 +538000 ekin = 4.79280389212849 | erot = 6.10794151385203 | epot = -35.7423046160126 | etot = -24.8415592100321 +539000 ekin = 4.77579753855575 | erot = 5.97217188520334 | epot = -35.5336009816514 | etot = -24.7856315578923 +540000 ekin = 4.5934335322059 | erot = 6.0288231594335 | epot = -35.2969540919917 | etot = -24.6746974003523 +541000 ekin = 4.56261508857232 | erot = 5.60884609986387 | epot = -35.074241498478 | etot = -24.9027803100418 +542000 ekin = 4.4230407907828 | erot = 5.24180126466482 | epot = -34.8728664426871 | etot = -25.2080243872395 +543000 ekin = 4.31458565966237 | erot = 5.3064811880571 | epot = -34.6809264080031 | etot = -25.0598595602836 +544000 ekin = 4.16990383767255 | erot = 5.09480741715239 | epot = -34.5077033118771 | etot = -25.2429920570521 +545000 ekin = 4.03506404145806 | erot = 4.95913193735205 | epot = -34.3738505570893 | etot = -25.3796545782792 +546000 ekin = 4.05283758597002 | erot = 4.62357416672456 | epot = -34.2732549004477 | etot = -25.5968431477531 +547000 ekin = 3.91892476341072 | erot = 4.42471065792704 | epot = -34.1888485564159 | etot = -25.8452131350781 +548000 ekin = 3.85923648383023 | erot = 4.18493881932583 | epot = -34.1251823218203 | etot = -26.0810070186642 +549000 ekin = 3.89277095561291 | erot = 4.20183962759824 | epot = -34.0968256559695 | etot = -26.0022150727584 +550000 ekin = 3.88489313663741 | erot = 4.0698735084027 | epot = -34.083498992554 | etot = -26.1287323475139 +551000 ekin = 3.87639970039824 | erot = 4.25043058335786 | epot = -34.0931086790785 | etot = -25.9662783953224 +552000 ekin = 3.88627319211738 | erot = 4.0010203354773 | epot = -34.163860291438 | etot = -26.2765667638433 +553000 ekin = 4.05569156373835 | erot = 3.56403629580258 | epot = -34.2474834864243 | etot = -26.6277556268834 +554000 ekin = 4.25626838001505 | erot = 3.70804766862573 | epot = -34.2954308218042 | etot = -26.3311147731634 +555000 ekin = 4.26487407035246 | erot = 3.78496110408411 | epot = -34.3412268896546 | etot = -26.291391715218 +556000 ekin = 4.24622902964942 | erot = 4.03454820388574 | epot = -34.3344093396383 | etot = -26.0536321061031 +557000 ekin = 4.0731966983783 | erot = 3.86372668854402 | epot = -34.2640157691765 | etot = -26.3270923822542 +558000 ekin = 3.9948930644697 | erot = 3.82027814531928 | epot = -34.1455461859523 | etot = -26.3303749761633 +559000 ekin = 4.00179663426005 | erot = 3.82651776959161 | epot = -33.9924674804782 | etot = -26.1641530766265 +560000 ekin = 3.90938418270034 | erot = 3.49539199637402 | epot = -33.8018928207131 | etot = -26.3971166416387 +561000 ekin = 3.70375196060258 | erot = 3.38165869548275 | epot = -33.615733164291 | etot = -26.5303225082057 +562000 ekin = 3.64392595608231 | erot = 3.67997084627181 | epot = -33.4612560313007 | etot = -26.1373592289466 +563000 ekin = 3.59769761679705 | erot = 3.74125845764523 | epot = -33.3480734777517 | etot = -26.0091174033094 +564000 ekin = 3.58725325354742 | erot = 3.35524020938125 | epot = -33.267517196837 | etot = -26.3250237339083 +565000 ekin = 3.63835964444106 | erot = 3.77402574563878 | epot = -33.240901552366 | etot = -25.8285161622862 +566000 ekin = 3.64384501808566 | erot = 3.77515123487333 | epot = -33.2503593116368 | etot = -25.8313630586779 +567000 ekin = 3.63214417671457 | erot = 3.86854489788161 | epot = -33.2603190278794 | etot = -25.7596299532833 +568000 ekin = 3.76759211619052 | erot = 3.9732101485638 | epot = -33.2947231384409 | etot = -25.5539208736866 +569000 ekin = 3.75607920629751 | erot = 3.91893504114413 | epot = -33.3766443391901 | etot = -25.7016300917484 +570000 ekin = 3.88570178164854 | erot = 3.8701337006161 | epot = -33.4676246266793 | etot = -25.7117891444146 +571000 ekin = 3.91109063039706 | erot = 4.38873366379694 | epot = -33.5301619269313 | etot = -25.2303376327373 +572000 ekin = 3.9135736753704 | erot = 4.54669425634133 | epot = -33.5613071721044 | etot = -25.1010392403927 +573000 ekin = 4.00256460246037 | erot = 4.69928602914644 | epot = -33.547965409059 | etot = -24.8461147774522 +574000 ekin = 4.04557469411573 | erot = 4.85104808888591 | epot = -33.4823141367226 | etot = -24.5856913537209 +575000 ekin = 4.01990448331334 | erot = 4.48360936846642 | epot = -33.4090682352895 | etot = -24.9055543835097 +576000 ekin = 3.8077042063495 | erot = 4.4090298473991 | epot = -33.3559765416156 | etot = -25.139242487867 +577000 ekin = 3.65176770723656 | erot = 4.69770290650885 | epot = -33.3414847753624 | etot = -24.992014161617 +578000 ekin = 3.65416507269697 | erot = 5.09984939028917 | epot = -33.3628873386868 | etot = -24.6088728757007 +579000 ekin = 3.65457514215401 | erot = 4.83085466504536 | epot = -33.4229058723706 | etot = -24.9374760651712 +580000 ekin = 3.61022362260401 | erot = 5.21507039569716 | epot = -33.5257015423967 | etot = -24.7004075240955 +581000 ekin = 3.494914275922 | erot = 5.80898315058267 | epot = -33.6374701054948 | etot = -24.3335726789901 +582000 ekin = 3.45150652331189 | erot = 5.20797294729429 | epot = -33.7413132898266 | etot = -25.0818338192204 +583000 ekin = 3.43883253778127 | erot = 4.99240818298312 | epot = -33.7992206024418 | etot = -25.3679798816774 +584000 ekin = 3.41950743993982 | erot = 5.30429667829813 | epot = -33.8273198616872 | etot = -25.1035157434492 +585000 ekin = 3.52988736379251 | erot = 5.26888625710182 | epot = -33.8562169326841 | etot = -25.0574433117897 +586000 ekin = 3.54522421505632 | erot = 5.15182886320336 | epot = -33.8748034063857 | etot = -25.177750328126 +587000 ekin = 3.64975640444305 | erot = 4.43116878398965 | epot = -33.8790223191809 | etot = -25.7980971307482 +588000 ekin = 3.85787406303013 | erot = 4.33848995606292 | epot = -33.9012642894901 | etot = -25.704900270397 +589000 ekin = 3.94871508842027 | erot = 4.36958758855398 | epot = -33.9512157067312 | etot = -25.632913029757 +590000 ekin = 4.04576150007614 | erot = 4.34777620153041 | epot = -33.9849374243125 | etot = -25.5913997227059 +591000 ekin = 4.13483818439864 | erot = 4.2847530812366 | epot = -33.997537224377 | etot = -25.5779459587418 +592000 ekin = 4.25566804148588 | erot = 4.00241438742632 | epot = -33.9905173022463 | etot = -25.7324348733341 +593000 ekin = 4.26695504286498 | erot = 3.75133860519142 | epot = -33.9824243028368 | etot = -25.9641306547804 +594000 ekin = 4.24513038558001 | erot = 3.88826331815687 | epot = -33.9597952629285 | etot = -25.8264015591916 +595000 ekin = 4.33307108334578 | erot = 3.92609577318101 | epot = -33.9197199407769 | etot = -25.6605530842501 +596000 ekin = 4.23611726585083 | erot = 3.89070717461436 | epot = -33.8740124837555 | etot = -25.7471880432903 +597000 ekin = 4.40233879096545 | erot = 3.99738130824423 | epot = -33.8902431987863 | etot = -25.4905230995766 +598000 ekin = 4.23795477390283 | erot = 4.04526003587962 | epot = -33.9155939268415 | etot = -25.632379117059 +599000 ekin = 4.13745802988963 | erot = 3.88641709707891 | epot = -33.9296772436184 | etot = -25.9058021166499 +600000 ekin = 4.21239990479373 | erot = 3.82373814742806 | epot = -33.9651236246002 | etot = -25.9289855723784 +601000 ekin = 4.31969973340156 | erot = 3.98399943561206 | epot = -34.0172721411617 | etot = -25.7135729721481 +602000 ekin = 4.27803621196591 | erot = 4.02063732656592 | epot = -34.1006984229854 | etot = -25.8020248844535 +603000 ekin = 4.31016670434105 | erot = 4.06109056998793 | epot = -34.2290225355025 | etot = -25.8577652611735 +604000 ekin = 4.35436231281015 | erot = 4.27081433433638 | epot = -34.3693989473761 | etot = -25.7442223002295 +605000 ekin = 4.29263786573535 | erot = 4.35816455016065 | epot = -34.5293522620236 | etot = -25.8785498461276 +606000 ekin = 4.23493766333219 | erot = 4.45889694601915 | epot = -34.6959569640143 | etot = -26.002122354663 +607000 ekin = 4.21589668454704 | erot = 4.35851580050846 | epot = -34.8643734064671 | etot = -26.2899609214116 +608000 ekin = 4.31617609118148 | erot = 4.37118434041818 | epot = -35.0106665625387 | etot = -26.323306130939 +609000 ekin = 4.40054829762706 | erot = 4.09556922746415 | epot = -35.1090427558584 | etot = -26.6129252307672 +610000 ekin = 4.38360179734749 | erot = 4.43080811091103 | epot = -35.1590130940805 | etot = -26.344603185822 +611000 ekin = 4.30911071720803 | erot = 4.66858603342419 | epot = -35.199774136202 | etot = -26.2220773855698 +612000 ekin = 4.38115044343898 | erot = 4.62952065066672 | epot = -35.2189008927589 | etot = -26.2082297986532 +613000 ekin = 4.49640333428286 | erot = 4.73033949191667 | epot = -35.2311946320123 | etot = -26.0044518058127 +614000 ekin = 4.42698019674728 | erot = 4.54387450238911 | epot = -35.2270245654641 | etot = -26.2561698663278 +615000 ekin = 4.3629388204899 | erot = 4.65167437175519 | epot = -35.2500098144353 | etot = -26.2353966221903 +616000 ekin = 4.25552094369014 | erot = 3.96773357990598 | epot = -35.2626465654004 | etot = -27.0393920418043 +617000 ekin = 4.02844203107081 | erot = 3.93306028038353 | epot = -35.3085438772357 | etot = -27.3470415657814 +618000 ekin = 3.91410624199523 | erot = 3.99915504239056 | epot = -35.3773572154983 | etot = -27.4640959311125 +619000 ekin = 3.9294433404095 | erot = 3.65858234543169 | epot = -35.4549579850513 | etot = -27.8669322992101 +620000 ekin = 3.94632769198393 | erot = 4.05357915876527 | epot = -35.5452298743849 | etot = -27.5453230236357 +621000 ekin = 4.00876452457071 | erot = 4.18557952361359 | epot = -35.6568787558286 | etot = -27.4625347076443 +622000 ekin = 3.97770547832547 | erot = 4.20428409244749 | epot = -35.7853832130651 | etot = -27.6033936422921 +623000 ekin = 3.87623409179537 | erot = 4.44200976918119 | epot = -35.9345595163542 | etot = -27.6163156553776 +624000 ekin = 3.81461749379546 | erot = 4.73413928443235 | epot = -36.0610458736418 | etot = -27.512289095414 +625000 ekin = 3.89702417514946 | erot = 4.5196799549034 | epot = -36.1593702506668 | etot = -27.7426661206139 +626000 ekin = 4.0528518195111 | erot = 5.12209714551147 | epot = -36.237370947802 | etot = -27.0624219827794 +627000 ekin = 4.06919694856893 | erot = 5.16853241383708 | epot = -36.2459696084307 | etot = -27.0082402460247 +628000 ekin = 3.97574634490031 | erot = 5.15377915037523 | epot = -36.1860007276678 | etot = -27.0564752323922 +629000 ekin = 3.97847076093763 | erot = 4.98743417354921 | epot = -36.084160296335 | etot = -27.1182553618481 +630000 ekin = 3.82117049554653 | erot = 4.72915936447952 | epot = -35.9627884752431 | etot = -27.4124586152171 +631000 ekin = 3.8646114143111 | erot = 4.86154549635015 | epot = -35.8061457051951 | etot = -27.0799887945339 +632000 ekin = 3.74664734149751 | erot = 4.54810894057716 | epot = -35.6214135997292 | etot = -27.3266573176545 +633000 ekin = 3.70561564688156 | erot = 3.84492477779505 | epot = -35.4366028892496 | etot = -27.886062464573 +634000 ekin = 3.59215409071566 | erot = 3.93871515972519 | epot = -35.2896538627894 | etot = -27.7587846123485 +635000 ekin = 3.50545587494281 | erot = 4.06717110382225 | epot = -35.1730596180138 | etot = -27.6004326392487 +636000 ekin = 3.33094541502758 | erot = 4.07821458070319 | epot = -35.1077038533339 | etot = -27.6985438576031 +637000 ekin = 3.1450521799885 | erot = 4.05756077132578 | epot = -35.1055524080602 | etot = -27.9029394567459 +638000 ekin = 3.09050584392124 | erot = 4.40258652090801 | epot = -35.1570633539873 | etot = -27.6639709891581 +639000 ekin = 3.07687333216972 | erot = 4.16491810908533 | epot = -35.2467836386701 | etot = -28.0049921974151 +640000 ekin = 3.00973730804964 | erot = 4.26924181333289 | epot = -35.3354522376063 | etot = -28.0564731162238 +641000 ekin = 2.94445196408731 | erot = 4.64391413205011 | epot = -35.4644644387943 | etot = -27.8760983426569 +642000 ekin = 2.98442414954527 | erot = 4.99747556124224 | epot = -35.629005703419 | etot = -27.6471059926314 +643000 ekin = 3.20556469531983 | erot = 4.80255317913171 | epot = -35.7795885297912 | etot = -27.7714706553396 +644000 ekin = 3.27488214023669 | erot = 4.64957731616528 | epot = -35.9161733239232 | etot = -27.9917138675212 +645000 ekin = 3.41323831994906 | erot = 4.71321420527498 | epot = -36.0213663956136 | etot = -27.8949138703896 +646000 ekin = 3.56963422518063 | erot = 4.46391006184168 | epot = -36.0597764611991 | etot = -28.0262321741768 +647000 ekin = 3.65146108953654 | erot = 4.34882885781815 | epot = -36.0539738525772 | etot = -28.0536839052225 +648000 ekin = 3.80589253043734 | erot = 4.22505125234539 | epot = -35.9957895068619 | etot = -27.9648457240791 +649000 ekin = 4.01844415748726 | erot = 4.19109412255692 | epot = -35.918006133173 | etot = -27.7084678531288 +650000 ekin = 4.03810277748455 | erot = 3.86362623058827 | epot = -35.8260490160414 | etot = -27.9243200079685 +651000 ekin = 4.1420394457061 | erot = 3.56888807374624 | epot = -35.7087423281368 | etot = -27.9978148086844 +652000 ekin = 4.23250261214613 | erot = 3.18710224409333 | epot = -35.6367851174003 | etot = -28.2171802611608 +653000 ekin = 4.36352642925903 | erot = 3.20148998565931 | epot = -35.6464209942524 | etot = -28.0814045793341 +654000 ekin = 4.52792032439863 | erot = 3.02237039454649 | epot = -35.6995719521279 | etot = -28.1492812331828 +655000 ekin = 4.60546960877418 | erot = 2.96007185178607 | epot = -35.8223013228776 | etot = -28.2567598623174 +656000 ekin = 4.78956137675958 | erot = 3.38896158834532 | epot = -35.9826527468522 | etot = -27.8041297817474 +657000 ekin = 4.78481247088143 | erot = 3.67040934516362 | epot = -36.1522101931014 | etot = -27.6969883770563 +658000 ekin = 4.68735602442142 | erot = 4.10635530609203 | epot = -36.3122539915035 | etot = -27.5185426609901 +659000 ekin = 4.79643464434846 | erot = 4.31091667955153 | epot = -36.4198222001284 | etot = -27.3124708762284 +660000 ekin = 4.65613606555458 | erot = 4.00182169137101 | epot = -36.5017357753368 | etot = -27.8437780184112 +661000 ekin = 4.53939481189358 | erot = 4.39327864100421 | epot = -36.552237956014 | etot = -27.6195645031162 +662000 ekin = 4.62075189021939 | erot = 4.64171304234462 | epot = -36.545875274844 | etot = -27.28341034228 +663000 ekin = 4.60627251324175 | erot = 4.44191382325611 | epot = -36.5358428119652 | etot = -27.4876564754673 +664000 ekin = 4.5322487745738 | erot = 4.69535654969877 | epot = -36.5440045788996 | etot = -27.3163992546271 +665000 ekin = 4.33791904760918 | erot = 4.79511074251709 | epot = -36.5712979957051 | etot = -27.4382682055788 +666000 ekin = 4.01034004769755 | erot = 5.144756302773 | epot = -36.6275167021822 | etot = -27.4724203517116 +667000 ekin = 3.92791037721526 | erot = 5.1180589475915 | epot = -36.7022697315157 | etot = -27.656300406709 +668000 ekin = 3.69207242860475 | erot = 4.95115852091633 | epot = -36.77482844315 | etot = -28.1315974936289 +669000 ekin = 3.52850414694741 | erot = 5.30513713121027 | epot = -36.8468924103787 | etot = -28.013251132221 +670000 ekin = 3.43685158392318 | erot = 5.67353767341462 | epot = -36.8571678878536 | etot = -27.7467786305158 +671000 ekin = 3.37237891900108 | erot = 4.81383151363229 | epot = -36.789877261468 | etot = -28.6036668288346 +672000 ekin = 3.42142864489494 | erot = 4.47410705082113 | epot = -36.6509805759882 | etot = -28.7554448802721 +673000 ekin = 3.47620696197669 | erot = 4.5346881275349 | epot = -36.4695914666357 | etot = -28.4586963771241 +674000 ekin = 3.34015467342445 | erot = 4.56003540036683 | epot = -36.2728042739957 | etot = -28.3726142002044 +675000 ekin = 3.26558121431912 | erot = 4.75716318196968 | epot = -36.081244882487 | etot = -28.0585004861982 +676000 ekin = 3.30557173090105 | erot = 4.66626180335483 | epot = -35.8858133485329 | etot = -27.9139798142771 +677000 ekin = 3.38252137148696 | erot = 4.68979222844271 | epot = -35.7238379181649 | etot = -27.6515243182352 +678000 ekin = 3.33430766992679 | erot = 4.45636421682296 | epot = -35.5898515746292 | etot = -27.7991796878794 +679000 ekin = 3.26716522041086 | erot = 4.1364314169021 | epot = -35.5282160560392 | etot = -28.1246194187263 +680000 ekin = 3.22330491222295 | erot = 4.11355311991395 | epot = -35.5522418172891 | etot = -28.2153837851522 +681000 ekin = 3.27654998707864 | erot = 4.40088508884101 | epot = -35.6343431031162 | etot = -27.9569080271965 +682000 ekin = 3.38403402083093 | erot = 4.64957783602951 | epot = -35.7255960652544 | etot = -27.6919842083939 +683000 ekin = 3.58392532059595 | erot = 4.15499488835509 | epot = -35.8541956283799 | etot = -28.1152754194289 +684000 ekin = 3.63284008875844 | erot = 4.14497212696412 | epot = -36.0448350473468 | etot = -28.2670228316243 +685000 ekin = 3.75538152185827 | erot = 3.95609692494467 | epot = -36.2462524041805 | etot = -28.5347739573775 +686000 ekin = 3.91883145536903 | erot = 3.95298902028762 | epot = -36.4771155861876 | etot = -28.605295110531 +687000 ekin = 4.05299881159346 | erot = 4.06027810523509 | epot = -36.7169526369106 | etot = -28.6036757200821 +688000 ekin = 4.13599667613487 | erot = 4.10331489254492 | epot = -36.9524101670374 | etot = -28.7130985983576 +689000 ekin = 4.25987754434331 | erot = 4.14481492316617 | epot = -37.1900775910787 | etot = -28.7853851235692 +690000 ekin = 4.43074027682691 | erot = 4.04380513304471 | epot = -37.3931354089472 | etot = -28.9185899990756 +691000 ekin = 4.53821721573907 | erot = 3.8050334589901 | epot = -37.5576014163145 | etot = -29.2143507415853 +692000 ekin = 4.64150042779563 | erot = 3.59872997928139 | epot = -37.6895260553266 | etot = -29.4492956482496 +693000 ekin = 4.69075885893268 | erot = 3.47578918601684 | epot = -37.8114874122412 | etot = -29.6449393672917 +694000 ekin = 4.7382251866288 | erot = 3.84263750148522 | epot = -37.9027003996521 | etot = -29.3218377115381 +695000 ekin = 4.75494194628237 | erot = 3.78113333862439 | epot = -37.9681336831645 | etot = -29.4320583982578 +696000 ekin = 4.697866081995 | erot = 3.78526821175916 | epot = -38.0084908312995 | etot = -29.5253565375453 +697000 ekin = 4.69854328160722 | erot = 3.62432955932709 | epot = -38.0258612384494 | etot = -29.7029883975151 +698000 ekin = 4.71023285873083 | erot = 3.64111389234168 | epot = -38.0301547340748 | etot = -29.6788079830023 +699000 ekin = 4.56773244344101 | erot = 3.71983710702471 | epot = -38.0529467082179 | etot = -29.7653771577522 +700000 ekin = 4.43155866208815 | erot = 3.5335546196022 | epot = -38.068583492112 | etot = -30.1034702104217 +701000 ekin = 4.47548631411863 | erot = 3.38963138436185 | epot = -38.0500116139802 | etot = -30.1848939154997 +702000 ekin = 4.46550513017092 | erot = 3.66852889097233 | epot = -38.0164512923389 | etot = -29.8824172711957 +703000 ekin = 4.38742906998922 | erot = 3.97599599383663 | epot = -37.9817705180933 | etot = -29.6183454542675 +704000 ekin = 4.41020682713785 | erot = 3.83147838533244 | epot = -37.9674346241353 | etot = -29.725749411665 +705000 ekin = 4.39308990786526 | erot = 3.75664217186731 | epot = -37.9282520396859 | etot = -29.7785199599533 +706000 ekin = 4.43040906703226 | erot = 4.12756254176834 | epot = -37.8939279543814 | etot = -29.3359563455808 +707000 ekin = 4.51700671633719 | erot = 3.77573523129425 | epot = -37.8444471024425 | etot = -29.5517051548111 +708000 ekin = 4.49065124304644 | erot = 3.88552877103945 | epot = -37.7744800646496 | etot = -29.3983000505637 +709000 ekin = 4.41855498291582 | erot = 3.53582586052254 | epot = -37.6656825257606 | etot = -29.7113016823223 +710000 ekin = 4.40535258977441 | erot = 3.39649502688896 | epot = -37.546693994465 | etot = -29.7448463778016 +711000 ekin = 4.32709544005412 | erot = 3.54995473847997 | epot = -37.3866324258477 | etot = -29.5095822473136 +712000 ekin = 4.40620309391045 | erot = 3.7155744253842 | epot = -37.1793914331046 | etot = -29.05761391381 +713000 ekin = 4.39226105260381 | erot = 3.64956114520254 | epot = -36.9592491146155 | etot = -28.9174269168092 +714000 ekin = 4.3945904765123 | erot = 3.58799428596503 | epot = -36.7844109062829 | etot = -28.8018261438055 +715000 ekin = 4.41458674942753 | erot = 4.01850565037344 | epot = -36.5924446920391 | etot = -28.1593522922382 +716000 ekin = 4.33665938530876 | erot = 3.50452219695681 | epot = -36.4143425377369 | etot = -28.5731609554713 +717000 ekin = 4.18088462864216 | erot = 3.21190204009032 | epot = -36.2481677379304 | etot = -28.8553810691979 +718000 ekin = 4.03231025467992 | erot = 2.91104295996765 | epot = -36.1402693367145 | etot = -29.196916122067 +719000 ekin = 3.97260579411936 | erot = 3.29783620298701 | epot = -36.0849771003507 | etot = -28.8145351032443 +720000 ekin = 3.82567789821418 | erot = 3.46218504309359 | epot = -36.1068353452668 | etot = -28.818972403959 +721000 ekin = 3.83433718059127 | erot = 4.03084036947922 | epot = -36.1868958046435 | etot = -28.321718254573 +722000 ekin = 3.7130087276568 | erot = 3.84736896155859 | epot = -36.2838656104841 | etot = -28.7234879212687 +723000 ekin = 3.74703466957696 | erot = 3.71040850656983 | epot = -36.3812410760553 | etot = -28.9237978999085 +724000 ekin = 3.75607081603443 | erot = 4.02813532874788 | epot = -36.4992818358981 | etot = -28.7150756911158 +725000 ekin = 3.77808990085885 | erot = 4.20966764087265 | epot = -36.6263500488386 | etot = -28.6385925071071 +726000 ekin = 3.99703012102755 | erot = 3.67945861038478 | epot = -36.7651398392487 | etot = -29.0886511078363 +727000 ekin = 4.01741049095273 | erot = 3.72684228835856 | epot = -36.8887239674894 | etot = -29.1444711881781 +728000 ekin = 4.05655244457389 | erot = 3.64411335656528 | epot = -36.9831032192825 | etot = -29.2824374181433 +729000 ekin = 4.15914112670555 | erot = 3.22368867517415 | epot = -37.0758214193937 | etot = -29.692991617514 +730000 ekin = 4.27496625989352 | erot = 3.03434396509935 | epot = -37.1060663359384 | etot = -29.7967561109456 +731000 ekin = 4.35621946146742 | erot = 3.31453862248463 | epot = -37.0811379025023 | etot = -29.4103798185503 +732000 ekin = 4.31460322853858 | erot = 3.19560214587386 | epot = -37.0358028654693 | etot = -29.5255974910568 +733000 ekin = 4.2295226795695 | erot = 3.20037871937962 | epot = -36.9673423522061 | etot = -29.537440953257 +734000 ekin = 4.24709820971147 | erot = 3.10598269123683 | epot = -36.8800091287772 | etot = -29.5269282278289 +735000 ekin = 4.14981162925897 | erot = 3.12549638567468 | epot = -36.7838119752116 | etot = -29.508503960278 +736000 ekin = 4.20814181481824 | erot = 2.91522500178861 | epot = -36.7063833852233 | etot = -29.5830165686164 +737000 ekin = 4.01828120268193 | erot = 2.40495812578651 | epot = -36.6589611248533 | etot = -30.2357217963848 +738000 ekin = 4.01094036028549 | erot = 2.68632566149055 | epot = -36.6548343802808 | etot = -29.9575683585048 +739000 ekin = 4.14661584174142 | erot = 2.59506078530577 | epot = -36.6780631105738 | etot = -29.9363864835266 +740000 ekin = 4.08413039710925 | erot = 2.57365823993747 | epot = -36.7021237291546 | etot = -30.0443350921079 +741000 ekin = 4.10845660619181 | erot = 2.78416335535206 | epot = -36.7754492326706 | etot = -29.8828292711267 +742000 ekin = 4.09068760907163 | erot = 3.09866824560576 | epot = -36.8187451874485 | etot = -29.6293893327711 +743000 ekin = 3.96610963094402 | erot = 3.04878673776408 | epot = -36.8535622197241 | etot = -29.838665851016 +744000 ekin = 3.97087885402719 | erot = 3.04950786237685 | epot = -36.8512621314634 | etot = -29.8308754150594 +745000 ekin = 3.78295099566376 | erot = 3.09154774657146 | epot = -36.8410165021252 | etot = -29.96651775989 +746000 ekin = 3.88442560568396 | erot = 3.15773579416763 | epot = -36.8645704531019 | etot = -29.8224090532503 +747000 ekin = 3.94794600572092 | erot = 3.04363515896551 | epot = -36.9228275975776 | etot = -29.9312464328912 +748000 ekin = 3.94186404778235 | erot = 3.24130800398347 | epot = -37.0438118681966 | etot = -29.8606398164308 +749000 ekin = 3.93262026571516 | erot = 3.71710044171151 | epot = -37.210963278996 | etot = -29.5612425715694 +750000 ekin = 3.82713052636346 | erot = 4.02486049381691 | epot = -37.385471620714 | etot = -29.5334806005336 +751000 ekin = 4.02336237199802 | erot = 4.23099342037285 | epot = -37.5518597142007 | etot = -29.2975039218298 +752000 ekin = 4.06152925020837 | erot = 3.76231639564619 | epot = -37.6809132611595 | etot = -29.8570676153049 +753000 ekin = 4.07859449790949 | erot = 3.97018598947847 | epot = -37.7593004103674 | etot = -29.7105199229794 +754000 ekin = 4.26771269586214 | erot = 4.64006960442373 | epot = -37.8141557249888 | etot = -28.9063734247029 +755000 ekin = 4.26666906965093 | erot = 4.77784474773889 | epot = -37.8576299963078 | etot = -28.8131161789179 +756000 ekin = 4.2913114700946 | erot = 5.38525988164132 | epot = -37.8917845570772 | etot = -28.2152132053412 +757000 ekin = 4.35562563894453 | erot = 5.14819699923274 | epot = -37.8935376948375 | etot = -28.3897150566602 +758000 ekin = 4.22616249374932 | erot = 5.19713356473755 | epot = -37.890171313439 | etot = -28.4668752549521 +759000 ekin = 4.24184449956944 | erot = 5.16496183591484 | epot = -37.8881235068873 | etot = -28.481317171403 +760000 ekin = 4.23424644958301 | erot = 5.47628298706072 | epot = -37.9000330984149 | etot = -28.1895036617712 +761000 ekin = 4.26448749341469 | erot = 5.45907771030503 | epot = -37.9055730645743 | etot = -28.1820078608546 +762000 ekin = 4.22061932798692 | erot = 5.04369074313446 | epot = -37.9108772679031 | etot = -28.6465671967817 +763000 ekin = 4.09989014592102 | erot = 5.10778066514902 | epot = -37.9045250455542 | etot = -28.6968542344841 +764000 ekin = 4.18374834614763 | erot = 5.46818179899514 | epot = -37.8676566747109 | etot = -28.2157265295681 +765000 ekin = 4.08761418374972 | erot = 5.8085838804908 | epot = -37.8033181876409 | etot = -27.9071201234004 +766000 ekin = 4.0399954168056 | erot = 5.48136006660783 | epot = -37.7411893537017 | etot = -28.2198338702883 +767000 ekin = 4.01701285460552 | erot = 5.31665044278829 | epot = -37.6438611160235 | etot = -28.3101978186297 +768000 ekin = 3.97951625206149 | erot = 5.25792422549898 | epot = -37.5214426737382 | etot = -28.2840021961778 +769000 ekin = 3.9904400552595 | erot = 5.21175341266091 | epot = -37.3810973556055 | etot = -28.1789038876851 +770000 ekin = 3.99199742512277 | erot = 5.21810902470249 | epot = -37.1986211065242 | etot = -27.9885146566989 +771000 ekin = 3.82567851870305 | erot = 4.95130845103932 | epot = -36.9906650314374 | etot = -28.213678061695 +772000 ekin = 3.72123202682396 | erot = 4.74084322348116 | epot = -36.7445513213713 | etot = -28.2824760710662 +773000 ekin = 3.61186619870637 | erot = 4.48764169415196 | epot = -36.4404296879 | etot = -28.3409217950417 +774000 ekin = 3.5323856332149 | erot = 4.0851560641829 | epot = -36.1430482929722 | etot = -28.5255065955744 +775000 ekin = 3.61960121968643 | erot = 4.03007080844262 | epot = -35.8636424209038 | etot = -28.2139703927748 +776000 ekin = 3.50131397859944 | erot = 3.82783005287474 | epot = -35.5938202085534 | etot = -28.2646761770792 +777000 ekin = 3.4086720204846 | erot = 3.85221546935551 | epot = -35.4006619567329 | etot = -28.1397744668928 +778000 ekin = 3.45838031028943 | erot = 3.51853820068418 | epot = -35.2979750992092 | etot = -28.3210565882356 +779000 ekin = 3.42307480042057 | erot = 3.59321040457246 | epot = -35.2809430031764 | etot = -28.2646577981833 +780000 ekin = 3.42440692402825 | erot = 3.60521054559613 | epot = -35.3411249792481 | etot = -28.3115075096237 +781000 ekin = 3.46934151467246 | erot = 3.84731508491177 | epot = -35.4518670976751 | etot = -28.1352104980909 +782000 ekin = 3.5271040668097 | erot = 4.28376670942143 | epot = -35.595026056589 | etot = -27.7841552803579 +783000 ekin = 3.61729821661169 | erot = 4.75537078140916 | epot = -35.7562125383807 | etot = -27.3835435403599 +784000 ekin = 3.5836655359854 | erot = 4.1138012313496 | epot = -35.8708728516423 | etot = -28.1734060843073 +785000 ekin = 3.63226984987313 | erot = 4.14613629449608 | epot = -35.9549809353083 | etot = -28.1765747909391 +786000 ekin = 3.55353155352361 | erot = 3.96170523540214 | epot = -36.0104316125812 | etot = -28.4951948236555 +787000 ekin = 3.65679390509628 | erot = 4.13482060006033 | epot = -36.0644977241106 | etot = -28.272883218954 +788000 ekin = 3.86757699285448 | erot = 4.10779053552829 | epot = -36.0997261456416 | etot = -28.1243586172588 +789000 ekin = 3.93645468275084 | erot = 4.27766163431728 | epot = -36.1406694170053 | etot = -27.9265530999371 +790000 ekin = 3.99051031327637 | erot = 3.95340487784933 | epot = -36.2018617372706 | etot = -28.257946546145 +791000 ekin = 4.10452718423621 | erot = 3.99235351847229 | epot = -36.2624115283487 | etot = -28.1655308256402 +792000 ekin = 4.33302884516885 | erot = 3.8304429162738 | epot = -36.335701261074 | etot = -28.1722294996313 +793000 ekin = 4.59966330091451 | erot = 3.74212535974463 | epot = -36.4314410279318 | etot = -28.0896523672727 +794000 ekin = 4.70509453522008 | erot = 3.7325457155236 | epot = -36.5039677226926 | etot = -28.0663274719489 +795000 ekin = 4.8237350135353 | erot = 3.69936645898633 | epot = -36.5467302591204 | etot = -28.0236287865987 +796000 ekin = 5.02825099690258 | erot = 3.65845895224835 | epot = -36.5441938749373 | etot = -27.8574839257863 +797000 ekin = 4.98369350470464 | erot = 3.33483563015714 | epot = -36.5302539300605 | etot = -28.2117247951988 +798000 ekin = 5.04627515833455 | erot = 3.251844315584 | epot = -36.5269098314607 | etot = -28.2287903575422 +799000 ekin = 4.96165968599494 | erot = 3.39539196017299 | epot = -36.5580084896278 | etot = -28.2009568434598 +800000 ekin = 4.96087289523802 | erot = 3.54932033291718 | epot = -36.6052154994154 | etot = -28.0950222712602 +801000 ekin = 4.96148873220024 | erot = 3.39995120227887 | epot = -36.6619752973816 | etot = -28.3005353629025 +802000 ekin = 4.86744715226323 | erot = 3.35338258088299 | epot = -36.6942224647938 | etot = -28.4733927316476 +803000 ekin = 4.75056128639553 | erot = 3.25410486957708 | epot = -36.7045390401517 | etot = -28.6998728841791 +804000 ekin = 4.78109129200108 | erot = 3.0776597288298 | epot = -36.698526519421 | etot = -28.8397754985901 +805000 ekin = 4.82892493818665 | erot = 3.27499533781798 | epot = -36.6737874267413 | etot = -28.5698671507367 +806000 ekin = 4.74542372520114 | erot = 3.18323237798552 | epot = -36.6406513076392 | etot = -28.7119952044525 +807000 ekin = 4.64766139287985 | erot = 3.38424960796022 | epot = -36.6476730883982 | etot = -28.6157620875581 +808000 ekin = 4.45707835864346 | erot = 3.35175675914227 | epot = -36.7022500935515 | etot = -28.8934149757658 +809000 ekin = 4.32670887591497 | erot = 3.3204635551547 | epot = -36.7741824114222 | etot = -29.1270099803525 +810000 ekin = 4.19642960492062 | erot = 3.20396083815671 | epot = -36.8832195227742 | etot = -29.4828290796969 +811000 ekin = 4.18603442116872 | erot = 3.54097838794675 | epot = -37.0402774324897 | etot = -29.3132646233742 +812000 ekin = 4.3319099162396 | erot = 3.67977508148913 | epot = -37.2334955671967 | etot = -29.221810569468 +813000 ekin = 4.46701990899706 | erot = 3.84749046887719 | epot = -37.4770063129616 | etot = -29.1624959350873 +814000 ekin = 4.70593563863212 | erot = 4.02074050200669 | epot = -37.7739765579907 | etot = -29.0473004173519 +815000 ekin = 4.61635561952459 | erot = 4.30893882425418 | epot = -38.0622407069025 | etot = -29.1369462631237 +816000 ekin = 4.66419241223221 | erot = 4.43348416466983 | epot = -38.3533945439932 | etot = -29.2557179670912 +817000 ekin = 4.61492034782011 | erot = 4.8589683614048 | epot = -38.6054729848476 | etot = -29.1315842756226 +818000 ekin = 4.69361355558547 | erot = 4.57560992803662 | epot = -38.8141140205618 | etot = -29.5448905369397 +819000 ekin = 4.99561997491401 | erot = 4.59057590873866 | epot = -38.986131465386 | etot = -29.3999355817333 +820000 ekin = 5.14251771001076 | erot = 4.38257454602465 | epot = -39.1119793527868 | etot = -29.5868870967514 +821000 ekin = 5.21211790510897 | erot = 3.7649363964534 | epot = -39.1791873910089 | etot = -30.2021330894465 +822000 ekin = 5.2276374734314 | erot = 3.8199393472184 | epot = -39.2257832500633 | etot = -30.1782064294135 +823000 ekin = 5.20824824630017 | erot = 3.61818509207455 | epot = -39.2577442235125 | etot = -30.4313108851377 +824000 ekin = 5.29481176258827 | erot = 3.61607107182776 | epot = -39.2930045776047 | etot = -30.3821217431886 +825000 ekin = 5.34590564278664 | erot = 3.4760580167516 | epot = -39.3020776711423 | etot = -30.4801140116041 +826000 ekin = 5.38005087585455 | erot = 3.56002985231027 | epot = -39.2878928900547 | etot = -30.3478121618899 +827000 ekin = 5.38251681844102 | erot = 3.31581026558379 | epot = -39.283897328375 | etot = -30.5855702443502 +828000 ekin = 5.30162295798549 | erot = 2.79999506814083 | epot = -39.2990437954937 | etot = -31.1974257693674 +829000 ekin = 5.34935471298301 | erot = 2.6338075385136 | epot = -39.3079384502704 | etot = -31.3247761987738 +830000 ekin = 5.15642397228145 | erot = 2.78944963382923 | epot = -39.3294203636002 | etot = -31.3835467574896 +831000 ekin = 5.04271329110473 | erot = 3.07984504895606 | epot = -39.3562191308944 | etot = -31.2336607908336 +832000 ekin = 5.04415123872855 | erot = 3.36917057661115 | epot = -39.3458026730645 | etot = -30.9324808577248 +833000 ekin = 4.97652700754261 | erot = 3.11016826810616 | epot = -39.3003589046717 | etot = -31.2136636290229 +834000 ekin = 4.66785324148471 | erot = 2.98799062968103 | epot = -39.2007615011679 | etot = -31.5449176300022 +835000 ekin = 4.4196794841071 | erot = 3.24754240638097 | epot = -39.0370935965117 | etot = -31.3698717060237 +836000 ekin = 4.1939950117267 | erot = 3.40709899396284 | epot = -38.8824429433984 | etot = -31.2813489377089 +837000 ekin = 4.05102708476636 | erot = 3.50403284169154 | epot = -38.7291298465769 | etot = -31.174069920119 +838000 ekin = 3.94991363719784 | erot = 3.82377156946596 | epot = -38.5557937558062 | etot = -30.7821085491424 +839000 ekin = 3.74326665318806 | erot = 3.97324655976055 | epot = -38.364381604374 | etot = -30.6478683914254 +840000 ekin = 3.7035157452831 | erot = 3.5124488621716 | epot = -38.1559200259235 | etot = -30.9399554184688 +841000 ekin = 3.60547887438446 | erot = 3.69151206404978 | epot = -37.9552189953856 | etot = -30.6582280569514 +842000 ekin = 3.38591284746056 | erot = 3.48115901302566 | epot = -37.7647482919521 | etot = -30.8976764314659 +843000 ekin = 3.11807787995921 | erot = 3.24962582172021 | epot = -37.5931200484574 | etot = -31.225416346778 +844000 ekin = 3.03125896851729 | erot = 3.10915311466668 | epot = -37.4053554848136 | etot = -31.2649434016296 +845000 ekin = 2.84759324027404 | erot = 3.53115382226703 | epot = -37.2260086331777 | etot = -30.8472615706367 +846000 ekin = 2.83613069836942 | erot = 3.41497522988127 | epot = -37.085320604792 | etot = -30.8342146765413 +847000 ekin = 2.82518542790909 | erot = 3.92646137605455 | epot = -36.9740965925522 | etot = -30.2224497885886 +848000 ekin = 2.8035610196741 | erot = 3.75897131812056 | epot = -36.8749675315763 | etot = -30.3124351937817 +849000 ekin = 2.84159199816875 | erot = 3.65493979263097 | epot = -36.7798908055852 | etot = -30.2833590147855 +850000 ekin = 2.91517374365839 | erot = 3.25543936029153 | epot = -36.7388454898332 | etot = -30.5682323858832 +851000 ekin = 3.08764953673805 | erot = 3.74455145978084 | epot = -36.722364218189 | etot = -29.8901632216702 +852000 ekin = 3.20356705871957 | erot = 3.86422941824788 | epot = -36.7413165099185 | etot = -29.6735200329511 +853000 ekin = 3.25796036952423 | erot = 4.25509323905633 | epot = -36.7658517979734 | etot = -29.2527981893928 +854000 ekin = 3.57244822927295 | erot = 4.1896974412388 | epot = -36.8021340521276 | etot = -29.0399883816159 +855000 ekin = 3.61706783412956 | erot = 4.16292249791868 | epot = -36.8626923862697 | etot = -29.0827020542215 +856000 ekin = 3.78538239756072 | erot = 4.11253551603666 | epot = -36.9244661414333 | etot = -29.0265482278359 +857000 ekin = 3.7817884765619 | erot = 4.13628071929874 | epot = -37.0292483027729 | etot = -29.1111791069122 +858000 ekin = 3.79767899411331 | erot = 4.25390024597203 | epot = -37.1883443366328 | etot = -29.1367650965475 +859000 ekin = 3.79646558910377 | erot = 4.39490149089977 | epot = -37.3423128301967 | etot = -29.1509457501932 +860000 ekin = 3.86711139340926 | erot = 4.91957560544857 | epot = -37.4915022932785 | etot = -28.7048152944207 +861000 ekin = 3.99177075241504 | erot = 4.92589410247942 | epot = -37.5868681074784 | etot = -28.6692032525839 +862000 ekin = 4.0977748877086 | erot = 4.85487231115065 | epot = -37.6175250863704 | etot = -28.6648778875111 +863000 ekin = 4.13925231113692 | erot = 4.50896117392355 | epot = -37.5986086016775 | etot = -28.950395116617 +864000 ekin = 4.14764866587724 | erot = 4.42487018235684 | epot = -37.5204132439163 | etot = -28.9478943956823 +865000 ekin = 4.14664914911426 | erot = 4.25648196395736 | epot = -37.3939280409738 | etot = -28.9907969279022 +866000 ekin = 4.14214320133934 | erot = 4.18089045470177 | epot = -37.217946082973 | etot = -28.8949124269318 +867000 ekin = 4.2533355578306 | erot = 3.91180056252889 | epot = -37.0368358637666 | etot = -28.8716997434071 +868000 ekin = 4.25544635673827 | erot = 4.03934502097174 | epot = -36.892523740773 | etot = -28.597732363063 +869000 ekin = 4.24112681076909 | erot = 4.01454747654454 | epot = -36.8084367274645 | etot = -28.5527624401508 +870000 ekin = 4.33478513328131 | erot = 3.78349131069572 | epot = -36.7681636745504 | etot = -28.6498872305733 +871000 ekin = 4.17502061004023 | erot = 3.95421063049773 | epot = -36.7899780247081 | etot = -28.6607467841701 +872000 ekin = 4.17603847735526 | erot = 3.83768938083062 | epot = -36.8688005631066 | etot = -28.8550727049207 +873000 ekin = 4.41693719639203 | erot = 4.07505566261082 | epot = -36.9767379853334 | etot = -28.4847451263305 +874000 ekin = 4.41295334009184 | erot = 4.18394759912804 | epot = -37.1369142438381 | etot = -28.5400133046182 +875000 ekin = 4.52955334955961 | erot = 4.19580464694757 | epot = -37.3370998777392 | etot = -28.611741881232 +876000 ekin = 4.61247068682171 | erot = 4.50897081856651 | epot = -37.5248349335733 | etot = -28.4033934281851 +877000 ekin = 4.76533246609024 | erot = 4.08201826718837 | epot = -37.6873606048119 | etot = -28.8400098715333 +878000 ekin = 4.8610970109619 | erot = 4.033155729642 | epot = -37.8092910984767 | etot = -28.9150383578728 +879000 ekin = 4.93322526419523 | erot = 3.94479688455364 | epot = -37.8433128250758 | etot = -28.965290676327 +880000 ekin = 4.91177719282767 | erot = 3.90966953329197 | epot = -37.7988935874806 | etot = -28.9774468613609 +881000 ekin = 4.87595051611486 | erot = 3.76638474532604 | epot = -37.6791282073033 | etot = -29.0367929458624 +882000 ekin = 4.80398792776863 | erot = 3.52725045146498 | epot = -37.4958553191656 | etot = -29.164616939932 +883000 ekin = 4.56372183806134 | erot = 3.17268134770781 | epot = -37.3026048485108 | etot = -29.5662016627417 +884000 ekin = 4.38408070690848 | erot = 2.95287988074379 | epot = -37.1164899885588 | etot = -29.7795294009065 +885000 ekin = 4.2140126763182 | erot = 3.28627816383894 | epot = -36.942394624606 | etot = -29.4421037844489 +886000 ekin = 3.94208450896381 | erot = 3.61827008671528 | epot = -36.8244889717495 | etot = -29.2641343760704 +887000 ekin = 3.76025689669878 | erot = 3.89282193563174 | epot = -36.7542446517018 | etot = -29.1011658193713 +888000 ekin = 3.58518173626509 | erot = 4.10918051627072 | epot = -36.7235080282654 | etot = -29.0291457757296 +889000 ekin = 3.52227905599303 | erot = 4.53948895643315 | epot = -36.7423345916829 | etot = -28.6805665792567 +890000 ekin = 3.48725850687851 | erot = 4.9165184567076 | epot = -36.8110749451072 | etot = -28.4072979815211 +891000 ekin = 3.51807183016932 | erot = 5.36785996032727 | epot = -36.9187079043847 | etot = -28.0327761138882 +892000 ekin = 3.486514414829 | erot = 5.25687644163098 | epot = -37.0005216584193 | etot = -28.2571308019593 +893000 ekin = 3.51467838155448 | erot = 5.65149044087548 | epot = -37.0594453420589 | etot = -27.8932765196289 +894000 ekin = 3.45974654612958 | erot = 5.22169711042558 | epot = -37.102064267985 | etot = -28.4206206114299 +895000 ekin = 3.57216437063937 | erot = 5.40895067977451 | epot = -37.1028729086238 | etot = -28.1217578582099 +896000 ekin = 3.56655921068659 | erot = 5.69090228219611 | epot = -37.0708217415226 | etot = -27.8133602486399 +897000 ekin = 3.57757547803441 | erot = 5.90228049359103 | epot = -36.985951453297 | etot = -27.5060954816716 +898000 ekin = 3.52295514054554 | erot = 5.8453836024045 | epot = -36.8484715408739 | etot = -27.4801327979239 +899000 ekin = 3.42191869064122 | erot = 5.47174915922149 | epot = -36.6856616378138 | etot = -27.7919937879511 +900000 ekin = 3.45720121517251 | erot = 5.5997377251197 | epot = -36.5148133918243 | etot = -27.4578744515321 +901000 ekin = 3.51607619901873 | erot = 5.88763510779633 | epot = -36.2859464010554 | etot = -26.8822350942404 +902000 ekin = 3.56087621117599 | erot = 5.17399063106631 | epot = -36.0621785767821 | etot = -27.3273117345398 +903000 ekin = 3.56470936099584 | erot = 5.07361698005476 | epot = -35.8794588183591 | etot = -27.2411324773085 +904000 ekin = 3.64294879518974 | erot = 5.28022715353087 | epot = -35.7543216612797 | etot = -26.8311457125591 +905000 ekin = 3.72447152602649 | erot = 5.02657007424407 | epot = -35.658280490972 | etot = -26.9072388907014 +906000 ekin = 3.7591413367746 | erot = 4.63070748715657 | epot = -35.6129995043961 | etot = -27.2231506804649 +907000 ekin = 4.00046169414905 | erot = 4.63743176602948 | epot = -35.6087015116484 | etot = -26.9708080514698 +908000 ekin = 3.98050966425778 | erot = 4.23795607914778 | epot = -35.6020003534093 | etot = -27.3835346100038 +909000 ekin = 4.14488755713113 | erot = 3.77771446920632 | epot = -35.5819012555779 | etot = -27.6592992292404 +910000 ekin = 4.18878899263847 | erot = 3.85878998652442 | epot = -35.5853308204837 | etot = -27.5377518413208 +911000 ekin = 4.15448454865027 | erot = 3.93063753948133 | epot = -35.6075046071671 | etot = -27.5223825190355 +912000 ekin = 4.30922033403085 | erot = 4.53644215925813 | epot = -35.6368602869792 | etot = -26.7911977936902 +913000 ekin = 4.42050627097881 | erot = 4.36559538893036 | epot = -35.6635505470016 | etot = -26.8774488870924 +914000 ekin = 4.640384167071 | erot = 4.57708989772434 | epot = -35.6621612967503 | etot = -26.4446872319549 +915000 ekin = 4.71121950508134 | erot = 4.34018648406978 | epot = -35.6015140360078 | etot = -26.5501080468567 +916000 ekin = 4.67735943326423 | erot = 4.0723772918907 | epot = -35.4903050476411 | etot = -26.7405683224862 +917000 ekin = 4.78142703706188 | erot = 4.20198791892984 | epot = -35.3917685265255 | etot = -26.4083535705337 +918000 ekin = 4.77421198697552 | erot = 4.42971373988936 | epot = -35.2582637676415 | etot = -26.0543380407766 +919000 ekin = 4.73422216253545 | erot = 4.77044814340035 | epot = -35.0931913565727 | etot = -25.5885210506369 +920000 ekin = 4.64583700130455 | erot = 4.69774436792038 | epot = -34.9395895324828 | etot = -25.5960081632579 +921000 ekin = 4.61516328270518 | erot = 4.43350879426847 | epot = -34.8128426462836 | etot = -25.7641705693099 +922000 ekin = 4.55621337364702 | erot = 4.21768777753359 | epot = -34.7312720351653 | etot = -25.9573708839847 +923000 ekin = 4.59034826680647 | erot = 4.50920703076125 | epot = -34.7044992141191 | etot = -25.6049439165514 +924000 ekin = 4.58356240196665 | erot = 4.62074320796166 | epot = -34.7126986327387 | etot = -25.5083930228104 +925000 ekin = 4.53220072801023 | erot = 4.79254817721209 | epot = -34.7588998026814 | etot = -25.4341508974591 +926000 ekin = 4.55832715206815 | erot = 5.00471911281168 | epot = -34.8080246038137 | etot = -25.2449783389339 +927000 ekin = 4.62575171089295 | erot = 4.71181044830442 | epot = -34.8667293476304 | etot = -25.529167188433 +928000 ekin = 4.68657375207003 | erot = 4.76234601746771 | epot = -34.915949836791 | etot = -25.4670300672533 +929000 ekin = 4.7061028915664 | erot = 5.07097104655604 | epot = -34.9791697926744 | etot = -25.202095854552 +930000 ekin = 4.79474071813729 | erot = 5.21915381885274 | epot = -35.0589708185177 | etot = -25.0450762815277 +931000 ekin = 4.69039359230418 | erot = 5.48593447848777 | epot = -35.1099047138343 | etot = -24.9335766430423 +932000 ekin = 4.71110094603637 | erot = 5.47204685356053 | epot = -35.1612846037812 | etot = -24.9781368041843 +933000 ekin = 4.7636965267817 | erot = 5.41370570081805 | epot = -35.2317575147297 | etot = -25.05435528713 +934000 ekin = 4.8364389439216 | erot = 5.2350863141415 | epot = -35.3109086743972 | etot = -25.2393834163341 +935000 ekin = 4.76586014730834 | erot = 5.228655408338 | epot = -35.3670038676022 | etot = -25.3724883119559 +936000 ekin = 4.7459923218976 | erot = 5.40903849081579 | epot = -35.4141584031058 | etot = -25.2591275903924 +937000 ekin = 4.7066536683933 | erot = 5.90535300927756 | epot = -35.4573569432673 | etot = -24.8453502655964 +938000 ekin = 4.73520980049429 | erot = 5.48994015212968 | epot = -35.4717259493542 | etot = -25.2465759967302 +939000 ekin = 4.66471904112943 | erot = 5.58667162801301 | epot = -35.4363389851247 | etot = -25.1849483159823 +940000 ekin = 4.73670308439586 | erot = 5.59502045341196 | epot = -35.3410735898338 | etot = -25.0093500520259 +941000 ekin = 4.56546752366747 | erot = 5.16939612930364 | epot = -35.2196425314888 | etot = -25.4847788785177 +942000 ekin = 4.36600564083038 | erot = 4.55609433699296 | epot = -35.0782455188793 | etot = -26.156145541056 +943000 ekin = 4.27680501591152 | erot = 4.77186490926151 | epot = -34.9346146494734 | etot = -25.8859447243004 +944000 ekin = 4.17576408255027 | erot = 4.64476704064174 | epot = -34.7936442239037 | etot = -25.9731131007117 +945000 ekin = 4.08165692512656 | erot = 4.64307958397957 | epot = -34.7241648822034 | etot = -25.9994283730973 +946000 ekin = 3.9823833768563 | erot = 4.33903183997624 | epot = -34.720898188062 | etot = -26.3994829712295 +947000 ekin = 4.11312487406737 | erot = 4.25698162025429 | epot = -34.8023164533845 | etot = -26.4322099590628 +948000 ekin = 4.03905965505087 | erot = 4.28038925265714 | epot = -34.928198667426 | etot = -26.608749759718 +949000 ekin = 4.12081251669323 | erot = 4.40083354096753 | epot = -35.1348098866843 | etot = -26.6131638290236 +950000 ekin = 4.19947300195308 | erot = 4.46892156641812 | epot = -35.3299547862415 | etot = -26.6615602178703 +951000 ekin = 4.28802819219167 | erot = 4.3680742443603 | epot = -35.5595339264167 | etot = -26.9034314898647 +952000 ekin = 4.44618066979822 | erot = 4.88998578447886 | epot = -35.776264591199 | etot = -26.4400981369219 +953000 ekin = 4.53022835549443 | erot = 4.90684636989333 | epot = -35.9402525430781 | etot = -26.5031778176903 +954000 ekin = 4.65793433636178 | erot = 4.95789701943152 | epot = -36.1007223995856 | etot = -26.4848910437923 +955000 ekin = 4.68472849923193 | erot = 4.84778271057121 | epot = -36.2250094081872 | etot = -26.692498198384 +956000 ekin = 4.83489144923702 | erot = 4.61252423076074 | epot = -36.2912267944626 | etot = -26.8438111144649 +957000 ekin = 4.83158754758543 | erot = 4.06427874835662 | epot = -36.3314048744461 | etot = -27.4355385785041 +958000 ekin = 4.95872508890491 | erot = 3.86764289322934 | epot = -36.3554965538449 | etot = -27.5291285717106 +959000 ekin = 4.88220034385557 | erot = 3.76501141985199 | epot = -36.3703754351835 | etot = -27.7231636714759 +960000 ekin = 4.96739750076083 | erot = 3.70143986321351 | epot = -36.3537104260526 | etot = -27.6848730620782 +961000 ekin = 5.05073619223015 | erot = 3.58723306284219 | epot = -36.3292284086185 | etot = -27.6912591535462 +962000 ekin = 5.10220917296402 | erot = 3.43365806618123 | epot = -36.292660732266 | etot = -27.7567934931207 +963000 ekin = 5.25727455724231 | erot = 3.39047088285751 | epot = -36.2233249912108 | etot = -27.5755795511109 +964000 ekin = 5.33892942752122 | erot = 3.38850636488222 | epot = -36.1631800361608 | etot = -27.4357442437574 +965000 ekin = 5.29707309584692 | erot = 3.40709075904033 | epot = -36.114647791191 | etot = -27.4104839363038 +966000 ekin = 5.27380254283779 | erot = 3.34984185029608 | epot = -36.0934598827398 | etot = -27.4698154896059 +967000 ekin = 5.19975037009087 | erot = 3.54967607074493 | epot = -36.1222651146705 | etot = -27.3728386738347 +968000 ekin = 5.22098509097161 | erot = 3.38920040678115 | epot = -36.1570868906189 | etot = -27.5469013928661 +969000 ekin = 5.01248198517091 | erot = 3.26201512253216 | epot = -36.2130447987696 | etot = -27.9385476910665 +970000 ekin = 4.97914863237121 | erot = 3.76343819077309 | epot = -36.2895058744048 | etot = -27.5469190512605 +971000 ekin = 5.04224300192755 | erot = 3.59024832311355 | epot = -36.3590409977773 | etot = -27.7265496727362 +972000 ekin = 5.05787332232144 | erot = 3.83558558676212 | epot = -36.3997125264357 | etot = -27.5062536173522 +973000 ekin = 5.01777031588903 | erot = 3.27986497682672 | epot = -36.416683733591 | etot = -28.1190484408752 +974000 ekin = 4.96186842907965 | erot = 3.23479851019082 | epot = -36.4352005399287 | etot = -28.2385336006583 +975000 ekin = 4.97224363278484 | erot = 3.35077904927885 | epot = -36.455709806026 | etot = -28.1326871239623 +976000 ekin = 5.01625531380467 | erot = 3.41837200675027 | epot = -36.4643526378165 | etot = -28.0297253172615 +977000 ekin = 5.04359880486621 | erot = 3.40669885598948 | epot = -36.4673967616861 | etot = -28.0170991008304 +978000 ekin = 4.96814116021997 | erot = 3.3988542289389 | epot = -36.4671439769023 | etot = -28.1001485877434 +979000 ekin = 4.68494120169423 | erot = 3.87226166481182 | epot = -36.4696261904956 | etot = -27.9124233239896 +980000 ekin = 4.80514576213004 | erot = 3.73614562894118 | epot = -36.4753768381447 | etot = -27.9340854470735 +981000 ekin = 4.85375109376568 | erot = 4.35522911700057 | epot = -36.4902775794649 | etot = -27.2812973686986 +982000 ekin = 4.79648806853534 | erot = 4.15595945903824 | epot = -36.5084812040043 | etot = -27.5560336764307 +983000 ekin = 4.75907969484559 | erot = 4.43556787871588 | epot = -36.5083539693089 | etot = -27.3137063957474 +984000 ekin = 4.81598118844461 | erot = 4.52957555705406 | epot = -36.5383410952792 | etot = -27.1927843497806 +985000 ekin = 4.87924474651563 | erot = 4.3163097901408 | epot = -36.5777006480737 | etot = -27.3821461114172 +986000 ekin = 4.77128314225264 | erot = 4.12408981491538 | epot = -36.5819281400493 | etot = -27.6865551828813 +987000 ekin = 4.70900566206954 | erot = 4.08922713836853 | epot = -36.5892891612702 | etot = -27.7910563608322 +988000 ekin = 4.69685644927805 | erot = 4.03217145235649 | epot = -36.6289948782911 | etot = -27.8999669766566 +989000 ekin = 4.56955203825868 | erot = 4.16364650343098 | epot = -36.6885496975511 | etot = -27.9553511558614 +990000 ekin = 4.56207337975407 | erot = 3.92865148644803 | epot = -36.7375440238769 | etot = -28.2468191576748 +991000 ekin = 4.45863269474038 | erot = 3.99370804360135 | epot = -36.8046932644695 | etot = -28.3523525261278 +992000 ekin = 4.52516169638379 | erot = 4.19036473784521 | epot = -36.90459516699 | etot = -28.189068732761 +993000 ekin = 4.26593637771868 | erot = 4.55899726308546 | epot = -37.028392229238 | etot = -28.2034585884339 +994000 ekin = 4.14968593988764 | erot = 4.67871188882305 | epot = -37.1561829580787 | etot = -28.327785129368 +995000 ekin = 4.20875361665793 | erot = 4.51127733270572 | epot = -37.2858931380942 | etot = -28.5658621887305 +996000 ekin = 4.10968366764503 | erot = 4.2587192792391 | epot = -37.3745810703572 | etot = -29.006178123473 +997000 ekin = 4.00616178452013 | erot = 4.48911641516102 | epot = -37.4314666701193 | etot = -28.9361884704382 +998000 ekin = 4.02180091280217 | erot = 4.35841167717868 | epot = -37.4443636100146 | etot = -29.0641510200337 +999000 ekin = 4.07504562976173 | erot = 4.26230873450589 | epot = -37.4098012996895 | etot = -29.0724469354219 +1000000 ekin = 3.90433765201102 | erot = 4.668818882285 | epot = -37.3063332342176 | etot = -28.7331766999216 + 1000000 0.10411567 -1.4674304 0.032571422 -1.2846921 -6.6175275e-05 64000 +Loop time of 49.5478 on 4 procs for 1000000 steps with 26 atoms + +Performance: 17437.690 tau/day, 20182.512 timesteps/s +99.7% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 23.242 | 32.434 | 41.795 | 160.6 | 65.46 +Bond | 0.49597 | 0.66041 | 0.81294 | 18.0 | 1.33 +Neigh | 0.014073 | 0.014118 | 0.014157 | 0.0 | 0.03 +Comm | 3.3957 | 12.586 | 21.586 | 253.2 | 25.40 +Output | 0.12903 | 0.14424 | 0.15087 | 2.3 | 0.29 +Modify | 1.6058 | 2.2732 | 2.9387 | 44.1 | 4.59 +Other | | 1.436 | | | 2.90 + +Nlocal: 6.50000 ave 10 max 3 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Nghost: 19.5000 ave 23 max 16 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Neighs: 131.000 ave 195 max 67 min +Histogram: 2 0 0 0 0 0 0 0 0 2 + +Total # of neighbors = 524 +Ave neighs/atom = 20.153846 +Ave special neighs/atom = 5.0769231 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.4.* nocoeff +System init for write_data ... +Total wall time: 0:00:49 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 new file mode 100644 index 0000000000..e6c11be477 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 @@ -0,0 +1,1272 @@ +LAMMPS (27 May 2021) +variable number equal 8 +variable ofreq equal 1000 +variable efreq equal 1000 + +variable ntype equal 8 + +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 10 delay 0 check yes + +read_data data.duplex4.8type +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 26 atoms + reading velocities ... + 26 velocities + scanning bonds ... + 2 = max bonds/atom + 26 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 24 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.003 seconds + +mass * 3.1575 # sets per-type mass if not in data file +set atom * mass 3.1575 # sets per-atom mass +Setting atom values ... + 26 settings made for mass + +group all type 1 8 +26 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + +label loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 1%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+3 +variable comp equal 1+3 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 2%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+1 +variable comp equal 2+1 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 3%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 4%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 5%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+3 +variable comp equal 5+3 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 5 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 5 8 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 6%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+1 +variable comp equal 6+1 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 6 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 6 7 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 7%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 8%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop + +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# Langevin dynamics +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.8.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 10 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 3.74991604702378 | erot = 3.45272678980464 | epot = -37.374200901142 | etot = -30.1715580643136 +Per MPI rank memory allocation (min/avg/max) = 9.578 | 9.578 | 9.578 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.099997761 -1.4717559 0.03428661 -1.2932417 5.6146609e-05 64000 +1000 ekin = 3.83184879800819 | erot = 3.50203401022061 | epot = -37.4730508915114 | etot = -30.1391680832826 +2000 ekin = 3.82227374831519 | erot = 3.79878100905234 | epot = -37.616191007464 | etot = -29.9951362500965 +3000 ekin = 3.90938932030971 | erot = 4.1584025695072 | epot = -37.7430329723255 | etot = -29.6752410825086 +4000 ekin = 3.82373321902577 | erot = 4.12183047279799 | epot = -37.8313543569025 | etot = -29.8857906650788 +5000 ekin = 3.7245469506492 | erot = 4.29953523687407 | epot = -37.8617217220935 | etot = -29.8376395345702 +6000 ekin = 3.75585156536887 | erot = 4.31270713695362 | epot = -37.8280629310505 | etot = -29.759504228728 +7000 ekin = 3.79326740841051 | erot = 4.16508360466874 | epot = -37.7640947397914 | etot = -29.8057437267121 +8000 ekin = 3.74746489835263 | erot = 4.25243425677965 | epot = -37.6835135449588 | etot = -29.6836143898265 +9000 ekin = 3.70802697723782 | erot = 4.00193184819408 | epot = -37.589938820096 | etot = -29.8799799946641 +10000 ekin = 3.5813559764108 | erot = 3.86411518632768 | epot = -37.5041732418664 | etot = -30.0587020791279 +11000 ekin = 3.45122934445656 | erot = 4.17035352993105 | epot = -37.485988256137 | etot = -29.8644053817494 +12000 ekin = 3.42435863038455 | erot = 4.2148747253892 | epot = -37.5307136425246 | etot = -29.8914802867509 +13000 ekin = 3.40216979362994 | erot = 4.07292918248778 | epot = -37.6378499557145 | etot = -30.1627509795968 +14000 ekin = 3.29213315521691 | erot = 4.50441987673247 | epot = -37.7761364031321 | etot = -29.9795833711827 +15000 ekin = 3.36883179726037 | erot = 4.91359031415189 | epot = -37.9357367952089 | etot = -29.6533146837967 +16000 ekin = 3.30177911852249 | erot = 5.0959341599744 | epot = -38.143737189117 | etot = -29.7460239106201 +17000 ekin = 3.27867865291038 | erot = 5.45789581601547 | epot = -38.3785999463332 | etot = -29.6420254774074 +18000 ekin = 3.36770908750654 | erot = 5.63036493519876 | epot = -38.5970397067551 | etot = -29.5989656840498 +19000 ekin = 3.29802639540141 | erot = 5.45616396083943 | epot = -38.7810833463914 | etot = -30.0268929901506 +20000 ekin = 3.28760849058064 | erot = 5.26031945979087 | epot = -38.9429500949467 | etot = -30.3950221445752 +21000 ekin = 3.32772748450134 | erot = 5.34990394778083 | epot = -39.0618181252057 | etot = -30.3841866929235 +22000 ekin = 3.34298346296243 | erot = 5.12273250375892 | epot = -39.1360899153794 | etot = -30.670373948658 +23000 ekin = 3.38280280428754 | erot = 5.14933572496704 | epot = -39.1974651493047 | etot = -30.6653266200501 +24000 ekin = 3.43991273776908 | erot = 5.03737353653106 | epot = -39.2427818934623 | etot = -30.7654956191621 +25000 ekin = 3.44382800915661 | erot = 4.56194227438371 | epot = -39.2491545805195 | etot = -31.2433842969791 +26000 ekin = 3.47220361933917 | erot = 4.88028216050144 | epot = -39.2033487475128 | etot = -30.8508629676722 +27000 ekin = 3.47824341108208 | erot = 4.79713670041817 | epot = -39.1340731989048 | etot = -30.8586930874045 +28000 ekin = 3.54835351423495 | erot = 4.6549460773945 | epot = -39.0768463918722 | etot = -30.8735468002427 +29000 ekin = 3.57491058588771 | erot = 4.31737192689198 | epot = -39.0420895500443 | etot = -31.1498070372646 +30000 ekin = 3.51438036654854 | erot = 4.50861299911588 | epot = -39.0276136699747 | etot = -31.0046203043103 +31000 ekin = 3.57650331888537 | erot = 4.40811531091205 | epot = -39.0168289246977 | etot = -31.0322102949003 +32000 ekin = 3.70658082522062 | erot = 4.15949186201365 | epot = -39.017410963825 | etot = -31.1513382765907 +33000 ekin = 3.83721022661993 | erot = 4.05055961618764 | epot = -39.0303039022728 | etot = -31.1425340594653 +34000 ekin = 3.9488588066567 | erot = 3.81495459058985 | epot = -39.0180833389346 | etot = -31.2542699416881 +35000 ekin = 3.97994525138311 | erot = 4.49904715736237 | epot = -38.9543629321031 | etot = -30.4753705233576 +36000 ekin = 3.90049506438254 | erot = 3.99723351860171 | epot = -38.8736492127443 | etot = -30.97592062976 +37000 ekin = 4.00119032736875 | erot = 4.30070706410094 | epot = -38.7576942972652 | etot = -30.4557969057955 +38000 ekin = 4.00581796835635 | erot = 3.82064458204037 | epot = -38.6053485149963 | etot = -30.7788859645996 +39000 ekin = 3.92374370666481 | erot = 3.80679256085699 | epot = -38.4357174066365 | etot = -30.7051811391147 +40000 ekin = 3.81525591020234 | erot = 3.60218215391064 | epot = -38.2889289083717 | etot = -30.8714908442588 +41000 ekin = 3.89801377589288 | erot = 3.52447171643245 | epot = -38.2033074629499 | etot = -30.7808219706246 +42000 ekin = 3.92469802136758 | erot = 3.7220708309091 | epot = -38.1843497161944 | etot = -30.5375808639177 +43000 ekin = 3.9035581905627 | erot = 3.65375269274892 | epot = -38.2197716832792 | etot = -30.6624607999676 +44000 ekin = 3.94906849382527 | erot = 3.48405507068381 | epot = -38.2852323155718 | etot = -30.8521087510627 +45000 ekin = 4.04988136986444 | erot = 3.38338492043344 | epot = -38.3792178397491 | etot = -30.9459515494513 +46000 ekin = 4.12456204511551 | erot = 3.52614566674481 | epot = -38.4473213411913 | etot = -30.796613629331 +47000 ekin = 4.05260082430176 | erot = 3.30110271195189 | epot = -38.4808326895797 | etot = -31.127129153326 +48000 ekin = 3.94672633965036 | erot = 3.3079094466035 | epot = -38.4845357728863 | etot = -31.2298999866324 +49000 ekin = 3.88681575217737 | erot = 3.7826220382333 | epot = -38.441512853504 | etot = -30.7720750630934 +50000 ekin = 3.82899985395713 | erot = 3.78573156370331 | epot = -38.3450518110651 | etot = -30.7303203934047 +51000 ekin = 3.8440574703342 | erot = 3.5318167647978 | epot = -38.2059734024446 | etot = -30.8300991673126 +52000 ekin = 3.72257170524991 | erot = 3.44233441463351 | epot = -38.0493176755068 | etot = -30.8844115556234 +53000 ekin = 3.58458805955591 | erot = 3.40175184254422 | epot = -37.8770316144348 | etot = -30.8906917123346 +54000 ekin = 3.42774104644871 | erot = 3.019334453294 | epot = -37.7242775274777 | etot = -31.277202027735 +55000 ekin = 3.30773758120279 | erot = 3.11354928843073 | epot = -37.5844277892892 | etot = -31.1631409196556 +56000 ekin = 3.30267684217519 | erot = 3.36746893036052 | epot = -37.4528615341921 | etot = -30.7827157616564 +57000 ekin = 3.19775481140565 | erot = 3.06235541109216 | epot = -37.3795633131474 | etot = -31.1194530906496 +58000 ekin = 3.11776701522974 | erot = 3.21225050262699 | epot = -37.3545495658646 | etot = -31.0245320480079 +59000 ekin = 3.02660076850685 | erot = 3.05700513362467 | epot = -37.3753385948442 | etot = -31.2917326927127 +60000 ekin = 3.05479252149933 | erot = 3.09854486170695 | epot = -37.4441725320784 | etot = -31.2908351488721 +61000 ekin = 3.0170447679161 | erot = 3.76451997765653 | epot = -37.5384296958522 | etot = -30.7568649502795 +62000 ekin = 3.04313706615767 | erot = 3.65046217125996 | epot = -37.6255736746588 | etot = -30.9319744372411 +63000 ekin = 3.01457068009159 | erot = 3.63417424777149 | epot = -37.6954625017368 | etot = -31.0467175738737 +64000 ekin = 2.98716002899792 | erot = 3.6682341307717 | epot = -37.7940816265088 | etot = -31.1386874667392 +65000 ekin = 3.02462936411614 | erot = 3.70957377344581 | epot = -37.8868266007907 | etot = -31.1526234632287 +66000 ekin = 3.04943307417966 | erot = 3.64749592963954 | epot = -37.9385532609816 | etot = -31.2416242571625 +67000 ekin = 3.1066499876682 | erot = 3.92441992350054 | epot = -37.9686488739492 | etot = -30.9375789627804 +68000 ekin = 3.10508542338566 | erot = 3.51781674899961 | epot = -37.9831132441551 | etot = -31.3602110717698 +69000 ekin = 3.12460161346405 | erot = 3.45336993587922 | epot = -38.016048039057 | etot = -31.4380764897137 +70000 ekin = 3.2758656602578 | erot = 2.9433048812549 | epot = -38.0712687269606 | etot = -31.8520981854479 +71000 ekin = 3.39211310061244 | erot = 2.74512861011507 | epot = -38.1409313278077 | etot = -32.0036896170801 +72000 ekin = 3.40645093836715 | erot = 2.75927481548162 | epot = -38.2448895790434 | etot = -32.0791638251946 +73000 ekin = 3.52971008848809 | erot = 2.59006671029947 | epot = -38.3559671032089 | etot = -32.2361903044213 +74000 ekin = 3.64539698532463 | erot = 2.94116909218571 | epot = -38.4934235930849 | etot = -31.9068575155746 +75000 ekin = 3.801696795608 | erot = 3.11004664709642 | epot = -38.6561648833572 | etot = -31.7444214406528 +76000 ekin = 3.86343004207976 | erot = 3.33165114941781 | epot = -38.7892518002905 | etot = -31.5941706087929 +77000 ekin = 3.90472352035102 | erot = 3.31177401193371 | epot = -38.8678679983232 | etot = -31.6513704660385 +78000 ekin = 3.9269153046816 | erot = 3.25784074314334 | epot = -38.8969605625463 | etot = -31.7122045147213 +79000 ekin = 3.93607959529908 | erot = 3.16472395725651 | epot = -38.8636036578362 | etot = -31.7628001052806 +80000 ekin = 3.92375596570378 | erot = 3.03932991445862 | epot = -38.7678348516125 | etot = -31.8047489714501 +81000 ekin = 3.94307777153344 | erot = 2.88134017144298 | epot = -38.6473318824763 | etot = -31.8229139394999 +82000 ekin = 3.86696228915961 | erot = 2.89149309255461 | epot = -38.5199433915521 | etot = -31.7614880098378 +83000 ekin = 3.6081427560926 | erot = 2.81572010912292 | epot = -38.3996592376439 | etot = -31.9757963724284 +84000 ekin = 3.71373301448703 | erot = 2.72793818704548 | epot = -38.3011883980017 | etot = -31.8595171964692 +85000 ekin = 3.50951070251159 | erot = 2.79348490714941 | epot = -38.2117363909516 | etot = -31.9087407812906 +86000 ekin = 3.47308524750452 | erot = 3.12141964520655 | epot = -38.1244236248809 | etot = -31.5299187321698 +87000 ekin = 3.47440394227045 | erot = 3.04160702571501 | epot = -38.0440539828501 | etot = -31.5280430148646 +88000 ekin = 3.44172477689074 | erot = 2.9990722717108 | epot = -37.985933210493 | etot = -31.5451361618915 +89000 ekin = 3.46547245050653 | erot = 3.42367325086154 | epot = -37.9432140623316 | etot = -31.0540683609635 +90000 ekin = 3.47276106924418 | erot = 3.41105238494323 | epot = -37.9009776655539 | etot = -31.0171642113665 +91000 ekin = 3.31717291023281 | erot = 4.00503611404964 | epot = -37.8509086765272 | etot = -30.5286996522448 +92000 ekin = 3.30281925189457 | erot = 3.78657692130456 | epot = -37.8308149894368 | etot = -30.7414188162377 +93000 ekin = 3.23932364656724 | erot = 3.46021357148709 | epot = -37.8328101558439 | etot = -31.1332729377896 +94000 ekin = 3.19291152023926 | erot = 3.36401906457213 | epot = -37.8297890174383 | etot = -31.2728584326269 +95000 ekin = 3.11174095364039 | erot = 3.84559531996385 | epot = -37.8285495206063 | etot = -30.871213247002 +96000 ekin = 3.08253957616711 | erot = 4.19970849347949 | epot = -37.8307056468836 | etot = -30.548457577237 +97000 ekin = 3.01019162595086 | erot = 4.79435511235201 | epot = -37.8474383063021 | etot = -30.0428915679993 +98000 ekin = 2.95004498340949 | erot = 4.45721895779629 | epot = -37.8489202082855 | etot = -30.4416562670797 +99000 ekin = 2.91563074020307 | erot = 4.14781823161594 | epot = -37.8396252499933 | etot = -30.7761762781743 +100000 ekin = 2.90648603235873 | erot = 3.81215086067846 | epot = -37.7900595351461 | etot = -31.0714226421089 +101000 ekin = 2.85218071196321 | erot = 3.48991910340801 | epot = -37.7570245236791 | etot = -31.4149247083079 +102000 ekin = 2.86052427330306 | erot = 3.57587365782281 | epot = -37.7214005697291 | etot = -31.2850026386032 +103000 ekin = 2.8891327192239 | erot = 3.41748118405775 | epot = -37.6983180369494 | etot = -31.3917041336678 +104000 ekin = 2.81650081212178 | erot = 3.64361039549593 | epot = -37.6651320682074 | etot = -31.2050208605896 +105000 ekin = 2.79823699847459 | erot = 3.35865525277727 | epot = -37.6511913094719 | etot = -31.4942990582201 +106000 ekin = 2.78255015161699 | erot = 3.64122601097051 | epot = -37.6357012767033 | etot = -31.2119251141158 +107000 ekin = 2.88530590298807 | erot = 3.80038887689837 | epot = -37.6526611371133 | etot = -30.9669663572269 +108000 ekin = 2.83844762508153 | erot = 3.95272494897021 | epot = -37.7224292501162 | etot = -30.9312566760645 +109000 ekin = 2.91484982662488 | erot = 4.34544884566574 | epot = -37.8436434051328 | etot = -30.5833447328422 +110000 ekin = 2.93667443132402 | erot = 4.67698362049716 | epot = -37.9759529936705 | etot = -30.3622949418493 +111000 ekin = 3.11047864616464 | erot = 4.30694673133238 | epot = -38.1028692919236 | etot = -30.6854439144265 +112000 ekin = 3.32630420939175 | erot = 4.07222830175948 | epot = -38.2330557688864 | etot = -30.8345232577351 +113000 ekin = 3.38238157246172 | erot = 4.25399862575992 | epot = -38.4031841501304 | etot = -30.7668039519087 +114000 ekin = 3.40165200205494 | erot = 4.30744946748784 | epot = -38.6070332241658 | etot = -30.897931754623 +115000 ekin = 3.57685598139984 | erot = 4.55740206723824 | epot = -38.8200433287838 | etot = -30.6857852801457 +116000 ekin = 3.75973031177342 | erot = 4.36157654592901 | epot = -39.0323085624547 | etot = -30.9110017047523 +117000 ekin = 4.08170792820106 | erot = 4.22817627757005 | epot = -39.2374888319018 | etot = -30.9276046261307 +118000 ekin = 4.20730049786356 | erot = 4.45363628574763 | epot = -39.4247594107618 | etot = -30.7638226271506 +119000 ekin = 4.26502745539808 | erot = 4.38707691524364 | epot = -39.5609276649307 | etot = -30.908823294289 +120000 ekin = 4.18668022830479 | erot = 4.24219249569083 | epot = -39.6276325806845 | etot = -31.1987598566889 +121000 ekin = 4.37673633947888 | erot = 4.44899930150558 | epot = -39.5989335189463 | etot = -30.7731978779618 +122000 ekin = 4.38970640566175 | erot = 4.08524736298497 | epot = -39.5011631447288 | etot = -31.0262093760821 +123000 ekin = 4.42858502015388 | erot = 3.3866674865171 | epot = -39.3700347945818 | etot = -31.5547822879108 +124000 ekin = 4.41843242629726 | erot = 3.2990259988492 | epot = -39.2496495732995 | etot = -31.5321911481531 +125000 ekin = 4.26174945235079 | erot = 3.29673673713418 | epot = -39.1012418833315 | etot = -31.5427556938465 +126000 ekin = 4.24892047563245 | erot = 3.36728042977254 | epot = -38.9439369649169 | etot = -31.3277360595119 +127000 ekin = 4.20697642244211 | erot = 3.24776092764455 | epot = -38.7860930134988 | etot = -31.3313556634122 +128000 ekin = 4.05115550712502 | erot = 3.47679598409542 | epot = -38.6330582994879 | etot = -31.1051068082675 +129000 ekin = 4.05771564566357 | erot = 3.55109790126645 | epot = -38.5073350485465 | etot = -30.8985215016165 +130000 ekin = 3.96453894213024 | erot = 3.53313522266287 | epot = -38.391565950826 | etot = -30.8938917860329 +131000 ekin = 3.98900505769185 | erot = 3.64077310068002 | epot = -38.2786451293433 | etot = -30.6488669709715 +132000 ekin = 3.73079609117297 | erot = 3.73126171283416 | epot = -38.1409399456635 | etot = -30.6788821416564 +133000 ekin = 3.65247250435604 | erot = 3.53430985836842 | epot = -38.0235035134258 | etot = -30.8367211507014 +134000 ekin = 3.69649402588234 | erot = 3.97356364722734 | epot = -37.9278485959381 | etot = -30.2577909228284 +135000 ekin = 3.57147615494151 | erot = 4.00472599145957 | epot = -37.8397002442412 | etot = -30.2634980978401 +136000 ekin = 3.54164301577371 | erot = 3.88237062104613 | epot = -37.7460882463412 | etot = -30.3220746095214 +137000 ekin = 3.41247180964225 | erot = 3.32750587829706 | epot = -37.624611292303 | etot = -30.8846336043637 +138000 ekin = 3.46206567288778 | erot = 3.47277237990371 | epot = -37.562116148782 | etot = -30.6272780959905 +139000 ekin = 3.46179863350055 | erot = 3.29345554522848 | epot = -37.5218039357363 | etot = -30.7665497570072 +140000 ekin = 3.57268233853845 | erot = 3.52021546572331 | epot = -37.4799882832129 | etot = -30.3870904789511 +141000 ekin = 3.48030321137918 | erot = 3.69147952189479 | epot = -37.4842309048151 | etot = -30.3124481715412 +142000 ekin = 3.63349703801688 | erot = 3.72222694231689 | epot = -37.5326170636814 | etot = -30.1768930833476 +143000 ekin = 3.71391772492725 | erot = 3.32855653910442 | epot = -37.5715573506383 | etot = -30.5290830866066 +144000 ekin = 3.59876610372653 | erot = 3.57133292531719 | epot = -37.6083426167156 | etot = -30.4382435876719 +145000 ekin = 3.5512989873801 | erot = 3.38442665443486 | epot = -37.645703742064 | etot = -30.709978100249 +146000 ekin = 3.57274630492877 | erot = 3.74306660671644 | epot = -37.691839929883 | etot = -30.3760270182378 +147000 ekin = 3.5117518000457 | erot = 4.0750620350483 | epot = -37.7115891932223 | etot = -30.1247753581283 +148000 ekin = 3.52194530375138 | erot = 4.22438638639834 | epot = -37.7453589028592 | etot = -29.9990272127095 +149000 ekin = 3.43829227837994 | erot = 4.25032155928027 | epot = -37.7800675049656 | etot = -30.0914536673054 +150000 ekin = 3.39573759305128 | erot = 4.12519198982267 | epot = -37.7779101405858 | etot = -30.2569805577119 +151000 ekin = 3.38494817974853 | erot = 3.91154836764821 | epot = -37.7346130185548 | etot = -30.4381164711581 +152000 ekin = 3.3392823348606 | erot = 3.82420376901226 | epot = -37.692306373128 | etot = -30.5288202692551 +153000 ekin = 3.38955645731951 | erot = 3.72251905459204 | epot = -37.6703717263954 | etot = -30.5582962144839 +154000 ekin = 3.40170171151684 | erot = 3.95270448125714 | epot = -37.678389708439 | etot = -30.323983515665 +155000 ekin = 3.44581188687109 | erot = 3.52528589615975 | epot = -37.7593041359925 | etot = -30.7882063529616 +156000 ekin = 3.55410349285978 | erot = 3.68359553101928 | epot = -37.8946612865558 | etot = -30.6569622626767 +157000 ekin = 3.67740663285557 | erot = 3.73708949692863 | epot = -38.0406477694048 | etot = -30.6261516396206 +158000 ekin = 3.70912292320975 | erot = 3.62418205239296 | epot = -38.1900046609472 | etot = -30.8566996853445 +159000 ekin = 3.68532826191219 | erot = 3.87298071798096 | epot = -38.2928836797074 | etot = -30.7345746998143 +160000 ekin = 3.72002440516707 | erot = 4.11592492943231 | epot = -38.3652902740975 | etot = -30.5293409394981 +161000 ekin = 3.73388863499049 | erot = 4.42836121024192 | epot = -38.4373191354185 | etot = -30.2750692901861 +162000 ekin = 4.02523829931051 | erot = 4.86807694190568 | epot = -38.4975346699526 | etot = -29.6042194287364 +163000 ekin = 4.03311015138293 | erot = 4.78291233450127 | epot = -38.5597523007636 | etot = -29.7437298148794 +164000 ekin = 4.13350042233596 | erot = 5.01454292769814 | epot = -38.5888368946085 | etot = -29.4407935445744 +165000 ekin = 4.25718467214142 | erot = 4.92225725319178 | epot = -38.5829201612761 | etot = -29.4034782359429 +166000 ekin = 4.11013815046467 | erot = 4.53806000830091 | epot = -38.5467907483034 | etot = -29.8985925895378 +167000 ekin = 4.08710467384557 | erot = 4.20997030650441 | epot = -38.4814936158367 | etot = -30.1844186354868 +168000 ekin = 4.03924000036824 | erot = 3.95993274976389 | epot = -38.3759188508994 | etot = -30.3767461007673 +169000 ekin = 3.94917218886625 | erot = 3.65240127094113 | epot = -38.2594355677077 | etot = -30.6578621079003 +170000 ekin = 3.90935554205295 | erot = 3.78797512477882 | epot = -38.1835201359158 | etot = -30.486189469084 +171000 ekin = 3.87732504895437 | erot = 4.28652570004447 | epot = -38.1402484566641 | etot = -29.9763977076653 +172000 ekin = 3.75957929171811 | erot = 4.02272820820135 | epot = -38.1557340618709 | etot = -30.3734265619515 +173000 ekin = 3.55030915228991 | erot = 4.03115995993289 | epot = -38.2480280629193 | etot = -30.6665589506965 +174000 ekin = 3.61281225750305 | erot = 4.30402685904732 | epot = -38.3795080285351 | etot = -30.4626689119848 +175000 ekin = 3.56741376549368 | erot = 4.24945045724327 | epot = -38.512592945838 | etot = -30.695728723101 +176000 ekin = 3.69966296688439 | erot = 4.22673264606626 | epot = -38.613145916328 | etot = -30.6867503033774 +177000 ekin = 3.72329334774794 | erot = 4.3963702174486 | epot = -38.6555013846404 | etot = -30.5358378194439 +178000 ekin = 3.79919357666777 | erot = 4.00194735045323 | epot = -38.66205820756 | etot = -30.860917280439 +179000 ekin = 3.78008346787866 | erot = 4.05267692212517 | epot = -38.6224110467894 | etot = -30.7896506567856 +180000 ekin = 3.84388711467654 | erot = 3.7091612553256 | epot = -38.5399848480518 | etot = -30.9869364780497 +181000 ekin = 3.78854199589324 | erot = 3.43025530256464 | epot = -38.4472679874806 | etot = -31.2284706890227 +182000 ekin = 3.65298336461987 | erot = 3.41446703840053 | epot = -38.3421256904841 | etot = -31.2746752874636 +183000 ekin = 3.57592466495276 | erot = 3.54000226366919 | epot = -38.2342661287445 | etot = -31.1183392001226 +184000 ekin = 3.59097293869165 | erot = 3.49764131752706 | epot = -38.1237685559037 | etot = -31.035154299685 +185000 ekin = 3.59874593561893 | erot = 3.34180949424636 | epot = -38.034561395544 | etot = -31.0940059656787 +186000 ekin = 3.55637392703386 | erot = 3.60010534755649 | epot = -37.9685691221059 | etot = -30.8120898475155 +187000 ekin = 3.30341471869178 | erot = 3.63282669533315 | epot = -37.9082034969873 | etot = -30.9719620829624 +188000 ekin = 3.25151380843724 | erot = 3.41587081506784 | epot = -37.8374520507026 | etot = -31.1700674271975 +189000 ekin = 3.09888859581596 | erot = 3.51324139411321 | epot = -37.7831379378027 | etot = -31.1710079478736 +190000 ekin = 2.93096647890479 | erot = 3.73100049541747 | epot = -37.7090579094218 | etot = -31.0470909350995 +191000 ekin = 2.78845789536297 | erot = 3.59181404756272 | epot = -37.6234731970087 | etot = -31.243201254083 +192000 ekin = 2.6870850400641 | erot = 3.91911783313644 | epot = -37.5268833853882 | etot = -30.9206805121877 +193000 ekin = 2.65091164661283 | erot = 3.82754219131909 | epot = -37.4213833049328 | etot = -30.9429294670009 +194000 ekin = 2.55372434146197 | erot = 3.81228833556049 | epot = -37.3433541779818 | etot = -30.9773415009593 +195000 ekin = 2.54515296633903 | erot = 3.77157425987469 | epot = -37.2550689450338 | etot = -30.93834171882 +196000 ekin = 2.57228739351373 | erot = 3.48448370430651 | epot = -37.1707275909679 | etot = -31.1139564931476 +197000 ekin = 2.47659034250724 | erot = 3.3178807523235 | epot = -37.1125490303325 | etot = -31.3180779355017 +198000 ekin = 2.47817611131603 | erot = 3.41593598489791 | epot = -37.0628542395746 | etot = -31.1687421433607 +199000 ekin = 2.46398696321841 | erot = 3.79330738397075 | epot = -37.0410272717133 | etot = -30.7837329245241 +200000 ekin = 2.66032750534599 | erot = 3.50045834258025 | epot = -37.0560186461539 | etot = -30.8952327982277 +201000 ekin = 2.82925423269706 | erot = 3.87280363693021 | epot = -37.1094527749142 | etot = -30.4073949052869 +202000 ekin = 2.87690134773418 | erot = 3.73724666810618 | epot = -37.1548849140445 | etot = -30.5407368982041 +203000 ekin = 3.09789929071276 | erot = 3.5468763526948 | epot = -37.1913390618664 | etot = -30.5465634184588 +204000 ekin = 3.22497830820396 | erot = 3.52082166300899 | epot = -37.2064645595877 | etot = -30.4606645883747 +205000 ekin = 3.08968228459861 | erot = 3.62768693137644 | epot = -37.2539593887054 | etot = -30.5365901727303 +206000 ekin = 3.11014150174799 | erot = 3.7385678659097 | epot = -37.3166778706671 | etot = -30.4679685030094 +207000 ekin = 3.1829453735337 | erot = 4.25652712659364 | epot = -37.3463184168163 | etot = -29.9068459166889 +208000 ekin = 3.18396090757435 | erot = 4.43896014450647 | epot = -37.3566061410103 | etot = -29.7336850889295 +209000 ekin = 3.31348354672036 | erot = 3.97662877739666 | epot = -37.3764215045059 | etot = -30.0863091803889 +210000 ekin = 3.17486958285111 | erot = 3.68714944924479 | epot = -37.3622513109276 | etot = -30.5002322788317 +211000 ekin = 3.24777381738383 | erot = 3.39112189744184 | epot = -37.3847088569506 | etot = -30.7458131421249 +212000 ekin = 3.1218235472922 | erot = 3.15133571404841 | epot = -37.4262282165351 | etot = -31.1530689551944 +213000 ekin = 3.12323090197305 | erot = 3.03298058440252 | epot = -37.4993866522037 | etot = -31.3431751658281 +214000 ekin = 3.02782055391862 | erot = 3.51893074263816 | epot = -37.6187398888692 | etot = -31.0719885923124 +215000 ekin = 3.08902625374248 | erot = 3.6205495251311 | epot = -37.8003692924877 | etot = -31.0907935136142 +216000 ekin = 3.04029181666715 | erot = 4.36545701920723 | epot = -38.008684651192 | etot = -30.6029358153176 +217000 ekin = 3.11869416684302 | erot = 4.23835788568566 | epot = -38.175518074188 | etot = -30.8184660216593 +218000 ekin = 3.12136726795469 | erot = 3.996273681316 | epot = -38.3382201370156 | etot = -31.2205791877449 +219000 ekin = 3.24749965239936 | erot = 4.03289859762057 | epot = -38.4910930976407 | etot = -31.2106948476207 +220000 ekin = 3.19731650656636 | erot = 4.16726840142139 | epot = -38.6410163306452 | etot = -31.2764314226575 +221000 ekin = 3.14591003185417 | erot = 4.47643673281146 | epot = -38.7807221211561 | etot = -31.1583753564904 +222000 ekin = 3.06194834255762 | erot = 4.40957176775777 | epot = -38.8960295960945 | etot = -31.4245094857791 +223000 ekin = 3.09392792198329 | erot = 4.36929377800849 | epot = -38.9696160320109 | etot = -31.5063943320191 +224000 ekin = 3.18434099924859 | erot = 4.67414126058087 | epot = -39.0019773177328 | etot = -31.1434950579034 +225000 ekin = 3.26887097312568 | erot = 4.32849031089059 | epot = -39.0446790784002 | etot = -31.4473177943839 +226000 ekin = 3.21195731331507 | erot = 5.11387401999727 | epot = -39.0947841174991 | etot = -30.7689527841868 +227000 ekin = 3.12036258026493 | erot = 5.06347912205035 | epot = -39.0762383614625 | etot = -30.8923966591473 +228000 ekin = 3.09996729726211 | erot = 5.29564700287474 | epot = -39.020898871325 | etot = -30.6252845711882 +229000 ekin = 3.038979337959 | erot = 5.24780237112316 | epot = -38.9575212211327 | etot = -30.6707395120505 +230000 ekin = 3.00051887289145 | erot = 4.62162674048173 | epot = -38.9098464143819 | etot = -31.2877008010087 +231000 ekin = 2.91912781370869 | erot = 4.1632154756593 | epot = -38.8503568044397 | etot = -31.7680135150717 +232000 ekin = 2.80548407611273 | erot = 4.26963451717883 | epot = -38.7971045932123 | etot = -31.7219859999207 +233000 ekin = 2.921352071703 | erot = 4.30663886521624 | epot = -38.7943069633022 | etot = -31.5663160263829 +234000 ekin = 2.89875675710069 | erot = 4.15218445741156 | epot = -38.7953536145697 | etot = -31.7444124000574 +235000 ekin = 2.99243729544443 | erot = 3.66858116296991 | epot = -38.7881689836611 | etot = -32.1271505252468 +236000 ekin = 3.05722012426339 | erot = 3.77007572255966 | epot = -38.8307946718327 | etot = -32.0034988250097 +237000 ekin = 2.9379768603675 | erot = 4.00589644921924 | epot = -38.9299465153368 | etot = -31.9860732057501 +238000 ekin = 2.94144352009249 | erot = 3.88111097233611 | epot = -39.049865747263 | etot = -32.2273112548344 +239000 ekin = 3.10382951223872 | erot = 3.96380163382862 | epot = -39.1526703213399 | etot = -32.0850391752726 +240000 ekin = 3.05998182778603 | erot = 4.32395093282876 | epot = -39.2052189603878 | etot = -31.821286199773 +241000 ekin = 3.07091800265519 | erot = 4.10063821004071 | epot = -39.2356744872186 | etot = -32.0641182745227 +242000 ekin = 2.97211136503678 | erot = 4.19271702506008 | epot = -39.2591861941866 | etot = -32.0943578040897 +243000 ekin = 2.88784895332254 | erot = 4.01063377556437 | epot = -39.2721844581365 | etot = -32.3737017292496 +244000 ekin = 2.72034159299268 | erot = 3.94970789536676 | epot = -39.2969463203695 | etot = -32.62689683201 +245000 ekin = 2.73288139378785 | erot = 4.2955252560862 | epot = -39.3467303394195 | etot = -32.3183236895454 +246000 ekin = 2.68282749729222 | erot = 4.4395870918117 | epot = -39.40368508993 | etot = -32.2812705008261 +247000 ekin = 2.73156079717722 | erot = 4.29997633507679 | epot = -39.4831744493475 | etot = -32.4516373170935 +248000 ekin = 2.71615239962783 | erot = 4.48384110145858 | epot = -39.562569036112 | etot = -32.3625755350256 +249000 ekin = 2.72571373834887 | erot = 4.53350194835673 | epot = -39.6161562336933 | etot = -32.3569405469877 +250000 ekin = 2.67302825179687 | erot = 5.17929377781993 | epot = -39.6758534551746 | etot = -31.8235314255578 +251000 ekin = 2.65073658987032 | erot = 5.39364408144152 | epot = -39.7013652486053 | etot = -31.6569845772935 +252000 ekin = 2.81604561937354 | erot = 5.50799647083818 | epot = -39.6939189845584 | etot = -31.3698768943466 +253000 ekin = 2.83629985586584 | erot = 4.91166111825353 | epot = -39.6825773475312 | etot = -31.9346163734119 +254000 ekin = 2.79908189634042 | erot = 4.88281944777358 | epot = -39.6620010988141 | etot = -31.9800997547001 +255000 ekin = 2.84238496514407 | erot = 4.79166487708071 | epot = -39.6680683880921 | etot = -32.0340185458674 +256000 ekin = 2.82611571908345 | erot = 4.38756969310689 | epot = -39.7220228798982 | etot = -32.5083374677078 +257000 ekin = 2.78077325096868 | erot = 4.56426394538529 | epot = -39.765795760232 | etot = -32.420758563878 +258000 ekin = 2.84466353932839 | erot = 4.94939241805623 | epot = -39.7743058264471 | etot = -31.9802498690625 +259000 ekin = 2.82994372921752 | erot = 4.84156348043274 | epot = -39.784508432178 | etot = -32.1130012225277 +260000 ekin = 2.84769599243485 | erot = 4.63369709433915 | epot = -39.8060470464451 | etot = -32.3246539596711 +261000 ekin = 2.87237157835355 | erot = 4.51865061212274 | epot = -39.7979847736534 | etot = -32.4069625831772 +262000 ekin = 2.96750612225969 | erot = 4.57561390426951 | epot = -39.7782660470081 | etot = -32.2351460204789 +263000 ekin = 2.99289365842386 | erot = 4.20953311292942 | epot = -39.745321167764 | etot = -32.5428943964107 +264000 ekin = 3.02610258005876 | erot = 4.41804994162533 | epot = -39.7005266944524 | etot = -32.2563741727683 +265000 ekin = 3.02210011112748 | erot = 4.29011549844086 | epot = -39.6578667285882 | etot = -32.3456511190199 +266000 ekin = 2.95526029973602 | erot = 3.97220133607363 | epot = -39.5863143733948 | etot = -32.6588527375852 +267000 ekin = 2.96306286479385 | erot = 4.39982365552045 | epot = -39.5117362736934 | etot = -32.1488497533791 +268000 ekin = 2.98837918599786 | erot = 4.59043107838108 | epot = -39.4346030266012 | etot = -31.8557927622223 +269000 ekin = 2.92733730866711 | erot = 4.81492520489309 | epot = -39.3017884762548 | etot = -31.5595259626946 +270000 ekin = 2.90335610024265 | erot = 4.98515255872077 | epot = -39.1437745457484 | etot = -31.255265886785 +271000 ekin = 2.87611923369233 | erot = 5.02631285080424 | epot = -38.9919498909518 | etot = -31.0895178064552 +272000 ekin = 2.87770260774598 | erot = 4.83651556609765 | epot = -38.840809395014 | etot = -31.1265912211704 +273000 ekin = 2.77329089721178 | erot = 4.69693225863749 | epot = -38.6610493537943 | etot = -31.190826197945 +274000 ekin = 2.68625637002662 | erot = 4.51669986790576 | epot = -38.4509728982942 | etot = -31.2480166603618 +275000 ekin = 2.60330324454304 | erot = 4.20171703621295 | epot = -38.218249935628 | etot = -31.413229654872 +276000 ekin = 2.5718307631142 | erot = 3.79152446287654 | epot = -38.0174336495133 | etot = -31.6540784235226 +277000 ekin = 2.49975386368567 | erot = 3.59614150828635 | epot = -37.8474968832235 | etot = -31.7516015112514 +278000 ekin = 2.46398069339708 | erot = 3.65098267442642 | epot = -37.6582057642293 | etot = -31.5432423964058 +279000 ekin = 2.48339824565313 | erot = 3.67548575635034 | epot = -37.5048702413578 | etot = -31.3459862393544 +280000 ekin = 2.53376634761126 | erot = 3.55656380463981 | epot = -37.3937621487776 | etot = -31.3034319965265 +281000 ekin = 2.67002406168562 | erot = 3.81689537677424 | epot = -37.3207483356567 | etot = -30.8338288971968 +282000 ekin = 2.63534042744473 | erot = 3.62617225051185 | epot = -37.2561498174831 | etot = -30.9946371395265 +283000 ekin = 2.62204960593212 | erot = 3.60063437351288 | epot = -37.1865464899413 | etot = -30.9638625104963 +284000 ekin = 2.67681575008792 | erot = 3.61566503901022 | epot = -37.1459845078296 | etot = -30.8535037187314 +285000 ekin = 2.71360352201124 | erot = 3.48822466196448 | epot = -37.1436040722676 | etot = -30.9417758882919 +286000 ekin = 2.72409949367872 | erot = 3.69046973300093 | epot = -37.1515114688671 | etot = -30.7369422421875 +287000 ekin = 2.78141221541724 | erot = 3.56169254019551 | epot = -37.1836412585712 | etot = -30.8405365029585 +288000 ekin = 2.93111949257215 | erot = 3.85252275716863 | epot = -37.2722312757955 | etot = -30.4885890260547 +289000 ekin = 3.22039073654111 | erot = 3.65796134125561 | epot = -37.4105935842029 | etot = -30.5322415064062 +290000 ekin = 3.45543672952173 | erot = 3.63587074171862 | epot = -37.5601919395408 | etot = -30.4688844683004 +291000 ekin = 3.52760878967904 | erot = 4.20430698093704 | epot = -37.7322836777774 | etot = -30.0003679071614 +292000 ekin = 3.68972381818918 | erot = 4.12076553978675 | epot = -37.9100323199299 | etot = -30.099542961954 +293000 ekin = 3.83177225674866 | erot = 4.37726484522711 | epot = -38.0821109906698 | etot = -29.873073888694 +294000 ekin = 4.06640459910184 | erot = 3.74462680595312 | epot = -38.1926156973086 | etot = -30.3815842922536 +295000 ekin = 4.21784736111051 | erot = 3.82616484716773 | epot = -38.2890286287626 | etot = -30.2450164204843 +296000 ekin = 4.26440738773642 | erot = 3.95694734709946 | epot = -38.3824567525617 | etot = -30.1611020177258 +297000 ekin = 4.04618321058694 | erot = 4.11344152769738 | epot = -38.4823151027029 | etot = -30.3226903644186 +298000 ekin = 4.04534420229638 | erot = 4.08413503201913 | epot = -38.5648464298593 | etot = -30.4353671955438 +299000 ekin = 4.05890996735844 | erot = 4.75454163668528 | epot = -38.6394632376441 | etot = -29.8260116336004 +300000 ekin = 4.0635552245577 | erot = 4.46292256841634 | epot = -38.7062117520834 | etot = -30.1797339591093 +301000 ekin = 4.01853385887666 | erot = 4.67242188374991 | epot = -38.7555551980346 | etot = -30.064599455408 +302000 ekin = 3.97170308302892 | erot = 4.62245717998414 | epot = -38.7884989680144 | etot = -30.1943387050014 +303000 ekin = 4.00670279913505 | erot = 4.89772983741924 | epot = -38.7992363136571 | etot = -29.8948036771028 +304000 ekin = 3.81374525151675 | erot = 4.65389365987343 | epot = -38.8327396351168 | etot = -30.3651007237266 +305000 ekin = 3.70792918499057 | erot = 4.53646691129898 | epot = -38.8671341843094 | etot = -30.6227380880198 +306000 ekin = 3.5851913585686 | erot = 4.40317156262038 | epot = -38.8961174826079 | etot = -30.9077545614189 +307000 ekin = 3.52830601019323 | erot = 4.12955816022915 | epot = -38.9381266871204 | etot = -31.280262516698 +308000 ekin = 3.37444573697906 | erot = 3.65266283146944 | epot = -38.9820449321947 | etot = -31.9549363637462 +309000 ekin = 3.29877896595899 | erot = 4.06788139443835 | epot = -39.036569619858 | etot = -31.6699092594607 +310000 ekin = 3.27216182566105 | erot = 3.86752279813193 | epot = -39.0649343092174 | etot = -31.9252496854244 +311000 ekin = 3.26050147382305 | erot = 3.90928978323582 | epot = -39.0580520931937 | etot = -31.8882608361348 +312000 ekin = 3.18483009089521 | erot = 3.90959546619214 | epot = -39.0257212693581 | etot = -31.9312957122708 +313000 ekin = 3.09609326591795 | erot = 3.75025646421262 | epot = -38.9535227577839 | etot = -32.1071730276533 +314000 ekin = 2.95184537018542 | erot = 4.07381717812341 | epot = -38.8888909934783 | etot = -31.8632284451695 +315000 ekin = 2.92238623527567 | erot = 3.96815066682739 | epot = -38.8370494801768 | etot = -31.9465125780737 +316000 ekin = 2.71301507861596 | erot = 3.80807978932931 | epot = -38.799834574398 | etot = -32.2787397064527 +317000 ekin = 2.71357150367647 | erot = 4.15190966526565 | epot = -38.7626719044115 | etot = -31.8971907354694 +318000 ekin = 2.62158267835359 | erot = 4.27134701113436 | epot = -38.7271070788676 | etot = -31.8341773893796 +319000 ekin = 2.55366548062862 | erot = 4.41350408683203 | epot = -38.7297464727616 | etot = -31.7625769053009 +320000 ekin = 2.43397240538545 | erot = 4.29070167476848 | epot = -38.7203908826319 | etot = -31.995716802478 +321000 ekin = 2.4091696193894 | erot = 4.08120981437134 | epot = -38.7041016741435 | etot = -32.2137222403828 +322000 ekin = 2.40921951438691 | erot = 3.84656254092884 | epot = -38.6896664254558 | etot = -32.4338843701401 +323000 ekin = 2.47763175846149 | erot = 3.74024157191534 | epot = -38.6582034756258 | etot = -32.440330145249 +324000 ekin = 2.50557286685258 | erot = 3.62726015904489 | epot = -38.6277589097223 | etot = -32.4949258838248 +325000 ekin = 2.46128003790469 | erot = 3.30955838055057 | epot = -38.6182210526501 | etot = -32.8473826341949 +326000 ekin = 2.5036042222413 | erot = 3.11309077075945 | epot = -38.6155228491478 | etot = -32.998827856147 +327000 ekin = 2.58559564340014 | erot = 3.03172964208485 | epot = -38.6235874334492 | etot = -33.0062621479642 +328000 ekin = 2.7498426607985 | erot = 3.02808338407904 | epot = -38.6550386035095 | etot = -32.8771125586319 +329000 ekin = 2.91966436364517 | erot = 2.97144348177553 | epot = -38.6820454853232 | etot = -32.7909376399025 +330000 ekin = 3.01494295487831 | erot = 3.44138384990523 | epot = -38.7383158304586 | etot = -32.2819890256751 +331000 ekin = 3.02442201542035 | erot = 3.78657407910216 | epot = -38.7939596216321 | etot = -31.9829635271096 +332000 ekin = 3.04445691127442 | erot = 3.8278890195312 | epot = -38.8517978078766 | etot = -31.979451877071 +333000 ekin = 3.03465557138406 | erot = 3.68623317701473 | epot = -38.9019287356726 | etot = -32.1810399872738 +334000 ekin = 2.98091475863421 | erot = 3.87909097065042 | epot = -38.9429458678105 | etot = -32.0829401385258 +335000 ekin = 3.18730692360931 | erot = 3.9229815323581 | epot = -38.9915367606724 | etot = -31.881248304705 +336000 ekin = 3.28082580011883 | erot = 4.25501923477972 | epot = -39.0382949038811 | etot = -31.5024498689825 +337000 ekin = 3.33075954016498 | erot = 4.58632261209064 | epot = -39.0662594017922 | etot = -31.1491772495366 +338000 ekin = 3.31328438683345 | erot = 4.17966745642974 | epot = -39.0415239975115 | etot = -31.5485721542483 +339000 ekin = 3.33917527804133 | erot = 4.28130062815462 | epot = -38.9842917012714 | etot = -31.3638157950755 +340000 ekin = 3.33492148280262 | erot = 4.35651035139101 | epot = -38.8943885223068 | etot = -31.2029566881131 +341000 ekin = 3.34614172096363 | erot = 4.05115720989153 | epot = -38.7823758155587 | etot = -31.3850768847036 +342000 ekin = 3.34251507796678 | erot = 4.42814474655728 | epot = -38.6331517957714 | etot = -30.8624919712473 +343000 ekin = 3.20631341754612 | erot = 3.78967989344564 | epot = -38.4960486393224 | etot = -31.5000553283306 +344000 ekin = 3.07148244251153 | erot = 3.87583965670226 | epot = -38.3948328820768 | etot = -31.447510782863 +345000 ekin = 3.09789874291703 | erot = 3.99460565240904 | epot = -38.3201974875894 | etot = -31.2276930922633 +346000 ekin = 3.02500081268322 | erot = 3.91508207831951 | epot = -38.27506306136 | etot = -31.3349801703573 +347000 ekin = 2.94406849477762 | erot = 3.8622967016244 | epot = -38.2289722622904 | etot = -31.4226070658884 +348000 ekin = 2.95641250006426 | erot = 3.72625853383772 | epot = -38.1919210104045 | etot = -31.5092499765026 +349000 ekin = 3.03918076184473 | erot = 3.94202050743586 | epot = -38.1810668298085 | etot = -31.1998655605279 +350000 ekin = 3.09062612520389 | erot = 3.91215331884812 | epot = -38.2023245264386 | etot = -31.1995450823866 +351000 ekin = 3.13831719496464 | erot = 3.99916602553218 | epot = -38.2111529945909 | etot = -31.0736697740941 +352000 ekin = 3.10196313130342 | erot = 3.92254342354138 | epot = -38.2543166357448 | etot = -31.2298100809 +353000 ekin = 3.17266611312433 | erot = 3.89473509639757 | epot = -38.3205511283306 | etot = -31.2531499188087 +354000 ekin = 3.20288707130886 | erot = 4.38957454856396 | epot = -38.3888699269268 | etot = -30.796408307054 +355000 ekin = 3.1596595759597 | erot = 4.27393537405652 | epot = -38.4369161779509 | etot = -31.0033212279347 +356000 ekin = 3.0196784402613 | erot = 4.46559381130417 | epot = -38.4622452099032 | etot = -30.9769729583378 +357000 ekin = 2.97836465744993 | erot = 4.24123654485003 | epot = -38.4340474220209 | etot = -31.214446219721 +358000 ekin = 2.90298621775703 | erot = 4.00214290087722 | epot = -38.3669225243923 | etot = -31.4617934057581 +359000 ekin = 2.89703951576627 | erot = 3.75540528896982 | epot = -38.2596281019022 | etot = -31.6071832971661 +360000 ekin = 2.89517468979402 | erot = 3.69844688179083 | epot = -38.1408983158931 | etot = -31.5472767443082 +361000 ekin = 2.80138616808295 | erot = 3.38323529451502 | epot = -38.0246589917391 | etot = -31.8400375291411 +362000 ekin = 2.77162168417612 | erot = 2.91331523066537 | epot = -37.9398868290149 | etot = -32.2549499141734 +363000 ekin = 2.78539815378433 | erot = 2.68460040337589 | epot = -37.8665635409938 | etot = -32.3965649838336 +364000 ekin = 2.6806781219229 | erot = 2.78677391239236 | epot = -37.7617899033784 | etot = -32.2943378690631 +365000 ekin = 2.54070043685876 | erot = 2.83653994835753 | epot = -37.6554311404474 | etot = -32.2781907552311 +366000 ekin = 2.41606481092138 | erot = 2.86609766611192 | epot = -37.5516282283376 | etot = -32.2694657513043 +367000 ekin = 2.46811866465482 | erot = 3.34221140329 | epot = -37.4475028758826 | etot = -31.6371728079378 +368000 ekin = 2.42926223365494 | erot = 3.33046663396725 | epot = -37.3674460967945 | etot = -31.6077172291723 +369000 ekin = 2.43816169312792 | erot = 3.26459431026916 | epot = -37.3019788371043 | etot = -31.5992228337072 +370000 ekin = 2.46038177337525 | erot = 3.10066469966251 | epot = -37.2626057339964 | etot = -31.7015592609586 +371000 ekin = 2.44062438526228 | erot = 2.87778487491551 | epot = -37.2539180634397 | etot = -31.9355088032619 +372000 ekin = 2.4119643832672 | erot = 3.07515188922145 | epot = -37.3089635753533 | etot = -31.8218473028647 +373000 ekin = 2.48050565170775 | erot = 3.18196875652298 | epot = -37.4397878357735 | etot = -31.7773134275428 +374000 ekin = 2.63530688061921 | erot = 3.59156982435214 | epot = -37.5884648424034 | etot = -31.3615881374321 +375000 ekin = 2.68283894448257 | erot = 3.3245108406823 | epot = -37.7715422578285 | etot = -31.7641924726636 +376000 ekin = 2.79488034579907 | erot = 3.22988532668875 | epot = -38.0009039102152 | etot = -31.9761382377273 +377000 ekin = 2.97793932778636 | erot = 3.1487944738539 | epot = -38.2360750185572 | etot = -32.1093412169169 +378000 ekin = 3.04959845592823 | erot = 3.49481966296083 | epot = -38.5013695235687 | etot = -31.9569514046797 +379000 ekin = 3.19106410727104 | erot = 3.36561045250103 | epot = -38.7688607813371 | etot = -32.2121862215651 +380000 ekin = 3.25183572215722 | erot = 3.58875776192795 | epot = -39.0288452181148 | etot = -32.1882517340297 +381000 ekin = 3.33794215221589 | erot = 3.69339177566719 | epot = -39.3017064605086 | etot = -32.2703725326255 +382000 ekin = 3.49270190624137 | erot = 3.86829998834039 | epot = -39.5268729273469 | etot = -32.1658710327651 +383000 ekin = 3.55662169084774 | erot = 3.53333329088007 | epot = -39.726779107516 | etot = -32.6368241257882 +384000 ekin = 3.69351012028544 | erot = 3.28268730044336 | epot = -39.8789874723582 | etot = -32.9027900516294 +385000 ekin = 3.68733706037504 | erot = 3.68055641648011 | epot = -39.999883925349 | etot = -32.6319904484938 +386000 ekin = 3.71694831249284 | erot = 3.79434784508062 | epot = -40.0869801892988 | etot = -32.5756840317253 +387000 ekin = 3.76861509268673 | erot = 3.88558369375086 | epot = -40.1715737743675 | etot = -32.5173749879299 +388000 ekin = 3.8301760688337 | erot = 4.20859412334347 | epot = -40.2007323597247 | etot = -32.1619621675475 +389000 ekin = 3.86768485031758 | erot = 3.99003783907099 | epot = -40.1899129305042 | etot = -32.3321902411156 +390000 ekin = 3.97485559059841 | erot = 3.73907035926306 | epot = -40.1534652302146 | etot = -32.4395392803531 +391000 ekin = 3.99255423920738 | erot = 3.459854141016 | epot = -40.0955220791989 | etot = -32.6431136989755 +392000 ekin = 4.01983776245668 | erot = 3.684257426475 | epot = -39.9999647918604 | etot = -32.2958696029287 +393000 ekin = 4.02356764424247 | erot = 3.83787437414721 | epot = -39.8549016020689 | etot = -31.9934595836793 +394000 ekin = 3.93980876114322 | erot = 3.99211744164119 | epot = -39.7011477670266 | etot = -31.7692215642422 +395000 ekin = 4.11174368478723 | erot = 3.75033473410246 | epot = -39.5451859148434 | etot = -31.6831074959538 +396000 ekin = 4.20376876107167 | erot = 3.67040632781357 | epot = -39.394880998087 | etot = -31.5207059092017 +397000 ekin = 4.13633572842997 | erot = 3.65151581957605 | epot = -39.2564297317577 | etot = -31.4685781837517 +398000 ekin = 4.13905245601627 | erot = 3.71620600673367 | epot = -39.093596770216 | etot = -31.2383383074661 +399000 ekin = 4.10332411545528 | erot = 3.71374971681591 | epot = -38.9205234935042 | etot = -31.103449661233 +400000 ekin = 4.06766016908479 | erot = 3.42139504654381 | epot = -38.7497473150009 | etot = -31.2606920993723 +401000 ekin = 3.97284164111999 | erot = 3.81120481171761 | epot = -38.6001977504163 | etot = -30.8161512975787 +402000 ekin = 3.90587383547465 | erot = 3.53418826218585 | epot = -38.4681757167877 | etot = -31.0281136191272 +403000 ekin = 3.91259869514561 | erot = 3.63738639184103 | epot = -38.3230308363684 | etot = -30.7730457493818 +404000 ekin = 3.79936006877832 | erot = 3.32641249272552 | epot = -38.2009092385689 | etot = -31.0751366770651 +405000 ekin = 3.8251759680116 | erot = 3.13064904024261 | epot = -38.1553776059004 | etot = -31.1995525976462 +406000 ekin = 3.73725599382609 | erot = 3.08306268157751 | epot = -38.1316917306566 | etot = -31.311373055253 +407000 ekin = 3.726517750459 | erot = 3.09861818078622 | epot = -38.1634910279953 | etot = -31.3383550967501 +408000 ekin = 3.79931976439459 | erot = 3.25718386016374 | epot = -38.2217683212397 | etot = -31.1652646966814 +409000 ekin = 3.95093187918724 | erot = 3.4395040977601 | epot = -38.2689453197333 | etot = -30.8785093427859 +410000 ekin = 4.07121708138889 | erot = 3.83760071106058 | epot = -38.3189798432044 | etot = -30.4101620507549 +411000 ekin = 4.23307978558165 | erot = 3.98162063698057 | epot = -38.3721329673504 | etot = -30.1574325447882 +412000 ekin = 4.241170808143 | erot = 3.99737193476948 | epot = -38.4124767699443 | etot = -30.1739340270318 +413000 ekin = 4.23580670923547 | erot = 3.8106439850279 | epot = -38.4212920990952 | etot = -30.3748414048318 +414000 ekin = 4.27445938143083 | erot = 3.9812454132049 | epot = -38.4106571527341 | etot = -30.1549523580983 +415000 ekin = 4.38899479005091 | erot = 3.80279226112388 | epot = -38.3596783722964 | etot = -30.1678913211216 +416000 ekin = 4.45628965411063 | erot = 3.63102956113277 | epot = -38.3042311126166 | etot = -30.2169118973732 +417000 ekin = 4.49028461121067 | erot = 3.62754419665983 | epot = -38.25831980893 | etot = -30.1404910010595 +418000 ekin = 4.45936601962003 | erot = 3.71144506663837 | epot = -38.1813464675297 | etot = -30.0105353812713 +419000 ekin = 4.38379837521008 | erot = 3.33513327030905 | epot = -38.0724868069419 | etot = -30.3535551614228 +420000 ekin = 4.283111933024 | erot = 3.09826419668605 | epot = -37.9370678690097 | etot = -30.5556917392996 +421000 ekin = 4.152480975106 | erot = 3.56237827808224 | epot = -37.7709210423883 | etot = -30.0560617892 +422000 ekin = 3.95490687211588 | erot = 3.47480957997332 | epot = -37.5854884820709 | etot = -30.1557720299817 +423000 ekin = 3.91714305790356 | erot = 3.4847628632339 | epot = -37.3949936437694 | etot = -29.9930877226319 +424000 ekin = 3.84213202460288 | erot = 3.52777059768033 | epot = -37.2158434462617 | etot = -29.8459408239785 +425000 ekin = 3.71924289661388 | erot = 3.33663609660611 | epot = -37.072252600123 | etot = -30.016373606903 +426000 ekin = 3.64441997260647 | erot = 3.36227935441014 | epot = -36.9667678357551 | etot = -29.9600685087385 +427000 ekin = 3.75655721345781 | erot = 3.37897054079373 | epot = -36.8611280898055 | etot = -29.7256003355539 +428000 ekin = 3.74409443646521 | erot = 3.1773287235424 | epot = -36.742715037602 | etot = -29.8212918775944 +429000 ekin = 3.6632902831786 | erot = 2.78764787478687 | epot = -36.6486255145436 | etot = -30.1976873565782 +430000 ekin = 3.62135290496445 | erot = 2.6733797516058 | epot = -36.560604151542 | etot = -30.2658714949717 +431000 ekin = 3.61616361793053 | erot = 2.69754710014203 | epot = -36.506732939117 | etot = -30.1930222210445 +432000 ekin = 3.49552617760825 | erot = 3.08491352170465 | epot = -36.485170074763 | etot = -29.9047303754501 +433000 ekin = 3.58020816083944 | erot = 2.88002256286314 | epot = -36.5217696117553 | etot = -30.0615388880528 +434000 ekin = 3.59867849318971 | erot = 3.0840797331355 | epot = -36.6202495320039 | etot = -29.9374913056787 +435000 ekin = 3.67331527289036 | erot = 3.42657552434419 | epot = -36.7488916307825 | etot = -29.6490008335479 +436000 ekin = 3.82088042289272 | erot = 3.65447442369897 | epot = -36.9085622220517 | etot = -29.43320737546 +437000 ekin = 3.86869421673766 | erot = 3.95470287079859 | epot = -37.0720316005957 | etot = -29.2486345130595 +438000 ekin = 4.11090595842083 | erot = 3.77540801446838 | epot = -37.2088542252226 | etot = -29.3225402523333 +439000 ekin = 4.12926159073602 | erot = 4.06917140325885 | epot = -37.351759051221 | etot = -29.1533260572261 +440000 ekin = 4.09029177261524 | erot = 4.14981299565281 | epot = -37.4912988817269 | etot = -29.2511941134588 +441000 ekin = 4.14485979348682 | erot = 4.37283240826395 | epot = -37.6181493098546 | etot = -29.1004571081038 +442000 ekin = 4.12304009572841 | erot = 4.39045893698217 | epot = -37.7155315750664 | etot = -29.2020325423558 +443000 ekin = 4.23471751438731 | erot = 4.14989601608928 | epot = -37.768614271265 | etot = -29.3840007407884 +444000 ekin = 4.35772646838224 | erot = 4.52232474512897 | epot = -37.7816885908053 | etot = -28.9016373772941 +445000 ekin = 4.39118784053262 | erot = 4.66570824296109 | epot = -37.7439950146598 | etot = -28.6870989311661 +446000 ekin = 4.39675921765031 | erot = 4.46936063153376 | epot = -37.6960851354907 | etot = -28.8299652863066 +447000 ekin = 4.35336664890442 | erot = 4.44173113672769 | epot = -37.6140263912413 | etot = -28.8189286056092 +448000 ekin = 4.28498441172979 | erot = 4.19781838322426 | epot = -37.5090341348627 | etot = -29.0262313399087 +449000 ekin = 4.31763982219652 | erot = 4.52832551746764 | epot = -37.4084017454329 | etot = -28.5624364057687 +450000 ekin = 4.34138928411261 | erot = 4.44258564037432 | epot = -37.3062489259438 | etot = -28.5222740014569 +451000 ekin = 4.30985185878605 | erot = 4.23825662962946 | epot = -37.1459619150061 | etot = -28.5978534265906 +452000 ekin = 4.32592045036098 | erot = 3.8660276663028 | epot = -36.9847035634508 | etot = -28.792755446787 +453000 ekin = 4.32845268851063 | erot = 3.54171363095618 | epot = -36.8340779762824 | etot = -28.9639116568156 +454000 ekin = 4.31011457813703 | erot = 3.79537837348597 | epot = -36.7199830616559 | etot = -28.6144901100328 +455000 ekin = 4.29550433639214 | erot = 3.85241036204668 | epot = -36.6489739160371 | etot = -28.5010592175982 +456000 ekin = 4.37032742709196 | erot = 4.00721124204773 | epot = -36.6190063800956 | etot = -28.2414677109559 +457000 ekin = 4.36426470286789 | erot = 3.85637152044941 | epot = -36.5969553476853 | etot = -28.376319124368 +458000 ekin = 4.32567014378617 | erot = 3.50123530464575 | epot = -36.5630453883135 | etot = -28.7361399398816 +459000 ekin = 4.3893381573867 | erot = 3.57401843708546 | epot = -36.5693343587042 | etot = -28.605977764232 +460000 ekin = 4.31317855607494 | erot = 4.09613513000612 | epot = -36.6229031356536 | etot = -28.2135894495725 +461000 ekin = 4.31811012640179 | erot = 4.38273826542215 | epot = -36.70247802377 | etot = -28.0016296319461 +462000 ekin = 4.3366863877001 | erot = 4.51374491218817 | epot = -36.8227361919449 | etot = -27.9723048920566 +463000 ekin = 4.27564269849664 | erot = 4.86202296781303 | epot = -36.9415310835084 | etot = -27.8038654171987 +464000 ekin = 4.25704856573543 | erot = 4.74085846897256 | epot = -37.0390079052471 | etot = -28.0411008705391 +465000 ekin = 4.27536374407092 | erot = 4.49932366093905 | epot = -37.1090432428533 | etot = -28.3343558378433 +466000 ekin = 4.30607368146068 | erot = 4.23786653917903 | epot = -37.1491605127936 | etot = -28.6052202921539 +467000 ekin = 4.2491978620046 | erot = 4.12771930877699 | epot = -37.1714598423964 | etot = -28.7945426716148 +468000 ekin = 4.39683218085591 | erot = 3.85228521386559 | epot = -37.2088712844973 | etot = -28.9597538897758 +469000 ekin = 4.64124419278982 | erot = 3.80754439193721 | epot = -37.276730222032 | etot = -28.8279416373049 +470000 ekin = 4.66178408905675 | erot = 3.92065938428513 | epot = -37.3876740781875 | etot = -28.8052306048457 +471000 ekin = 4.75392904131986 | erot = 4.24739494727095 | epot = -37.5007122646075 | etot = -28.4993882760167 +472000 ekin = 4.78287126449292 | erot = 4.29738258008793 | epot = -37.5977046601011 | etot = -28.5174508155202 +473000 ekin = 4.83746609770183 | erot = 4.38666527032485 | epot = -37.6671790710826 | etot = -28.4430477030559 +474000 ekin = 4.79054197671376 | erot = 4.34169424272138 | epot = -37.6856820094293 | etot = -28.5534457899942 +475000 ekin = 4.83235787688145 | erot = 4.21788406575012 | epot = -37.6508263787861 | etot = -28.6005844361546 +476000 ekin = 4.77650421806813 | erot = 4.23519664592598 | epot = -37.5559363402036 | etot = -28.5442354762095 +477000 ekin = 4.70149228687153 | erot = 3.94955206004049 | epot = -37.4316333722383 | etot = -28.7805890253263 +478000 ekin = 4.65828612344613 | erot = 3.52306589214554 | epot = -37.3056353897912 | etot = -29.1242833741995 +479000 ekin = 4.49034904671755 | erot = 3.69691237093679 | epot = -37.1645007343033 | etot = -28.977239316649 +480000 ekin = 4.42035953830873 | erot = 3.62614880736063 | epot = -36.9855336534948 | etot = -28.9390253078254 +481000 ekin = 4.29236052675552 | erot = 3.46283113670755 | epot = -36.778837676618 | etot = -29.0236460131549 +482000 ekin = 4.24695006747703 | erot = 3.64617122659715 | epot = -36.5783264764331 | etot = -28.685205182359 +483000 ekin = 4.27724439911399 | erot = 3.65906944039054 | epot = -36.4031794376627 | etot = -28.4668655981582 +484000 ekin = 4.2785974211617 | erot = 3.80998418987604 | epot = -36.2601336102694 | etot = -28.1715519992317 +485000 ekin = 4.21291837199932 | erot = 3.8427823044223 | epot = -36.141503315863 | etot = -28.0858026394413 +486000 ekin = 3.9839252640706 | erot = 3.69687119417294 | epot = -36.0420007851875 | etot = -28.3612043269439 +487000 ekin = 3.87685523954227 | erot = 3.52087214489094 | epot = -35.9790179936878 | etot = -28.5812906092545 +488000 ekin = 3.74675884240029 | erot = 3.80072807052997 | epot = -35.9652058586033 | etot = -28.417718945673 +489000 ekin = 3.61099051841834 | erot = 4.09702697313287 | epot = -35.9887686799326 | etot = -28.2807511883814 +490000 ekin = 3.72073699277815 | erot = 3.89157882585025 | epot = -36.0103724524783 | etot = -28.3980566338499 +491000 ekin = 3.72740917275115 | erot = 4.01795497893002 | epot = -36.0292354570353 | etot = -28.2838713053542 +492000 ekin = 3.67547789628858 | erot = 3.85969822517316 | epot = -36.0430681478948 | etot = -28.507892026433 +493000 ekin = 3.65198421841226 | erot = 3.75518718738361 | epot = -36.0824152706771 | etot = -28.6752438648813 +494000 ekin = 3.4852821998486 | erot = 3.8153550877854 | epot = -36.1423710455837 | etot = -28.8417337579497 +495000 ekin = 3.31359070882208 | erot = 4.11558724766118 | epot = -36.2268684383707 | etot = -28.7976904818874 +496000 ekin = 3.27798311005969 | erot = 3.88806115727323 | epot = -36.3363270902379 | etot = -29.170282822905 +497000 ekin = 3.23000081873816 | erot = 4.5315385178341 | epot = -36.481720183114 | etot = -28.7201808465418 +498000 ekin = 3.35490986062535 | erot = 4.76314991175258 | epot = -36.6514686581236 | etot = -28.5334088857457 +499000 ekin = 3.39102564180502 | erot = 4.99058516868934 | epot = -36.8025368986548 | etot = -28.4209260881604 +500000 ekin = 3.44319922277998 | erot = 4.29432196305736 | epot = -36.9177193599231 | etot = -29.1801981740858 +501000 ekin = 3.47746008955509 | erot = 4.289941738028 | epot = -37.0187053512324 | etot = -29.2513035236494 +502000 ekin = 3.58696948456752 | erot = 4.55410136617418 | epot = -37.1018103829437 | etot = -28.960739532202 +503000 ekin = 3.68317380855592 | erot = 4.60652443433648 | epot = -37.1620776601797 | etot = -28.8723794172873 +504000 ekin = 3.68852053014443 | erot = 4.67783023002264 | epot = -37.2052759454199 | etot = -28.8389251852528 +505000 ekin = 3.88723268453866 | erot = 4.53079850437663 | epot = -37.2950608294683 | etot = -28.877029640553 +506000 ekin = 3.80925396925163 | erot = 4.47086505886218 | epot = -37.3479933337838 | etot = -29.06787430567 +507000 ekin = 3.73248519551991 | erot = 4.21393839264144 | epot = -37.4256513139284 | etot = -29.4792277257671 +508000 ekin = 3.80672760184063 | erot = 3.93708079377005 | epot = -37.4951091449467 | etot = -29.751300749336 +509000 ekin = 3.80086991164608 | erot = 3.74333566662504 | epot = -37.5406480313395 | etot = -29.9964424530683 +510000 ekin = 3.89850649197978 | erot = 3.97775581109505 | epot = -37.5934385426631 | etot = -29.7171762395883 +511000 ekin = 3.81393185765464 | erot = 4.00469160928647 | epot = -37.6349932199755 | etot = -29.8163697530344 +512000 ekin = 3.7684396284637 | erot = 4.34524756747826 | epot = -37.6787808921542 | etot = -29.5650936962122 +513000 ekin = 3.70769437024747 | erot = 4.19222442242684 | epot = -37.7114576947707 | etot = -29.8115389020964 +514000 ekin = 3.65606306228176 | erot = 4.64296237641028 | epot = -37.7095823242883 | etot = -29.4105568855962 +515000 ekin = 3.5052281855745 | erot = 4.47916848114099 | epot = -37.6783049637298 | etot = -29.6939082970143 +516000 ekin = 3.59266443877101 | erot = 5.02978018029494 | epot = -37.6477009850688 | etot = -29.0252563660028 +517000 ekin = 3.53729866959058 | erot = 4.95641997732805 | epot = -37.644541266991 | etot = -29.1508226200724 +518000 ekin = 3.55341695305132 | erot = 4.57512459674255 | epot = -37.6532745224308 | etot = -29.5247329726369 +519000 ekin = 3.61605940841961 | erot = 4.59842321288953 | epot = -37.7181887221249 | etot = -29.5037061008158 +520000 ekin = 3.66003580736891 | erot = 4.52802897844102 | epot = -37.8184531846622 | etot = -29.6303883988522 +521000 ekin = 3.57990395101936 | erot = 4.58686564429493 | epot = -37.9529160430901 | etot = -29.7861464477758 +522000 ekin = 3.58721017350486 | erot = 4.78958389957763 | epot = -38.1056938634054 | etot = -29.7288997903229 +523000 ekin = 3.7455374895203 | erot = 4.82242710318161 | epot = -38.249659851946 | etot = -29.6816952592441 +524000 ekin = 3.8367296557297 | erot = 5.1780625575552 | epot = -38.3420385705452 | etot = -29.3272463572603 +525000 ekin = 3.97426514986068 | erot = 5.13820563111667 | epot = -38.4306455211977 | etot = -29.3181747402204 +526000 ekin = 4.03278131821146 | erot = 4.61480893928539 | epot = -38.4813375347266 | etot = -29.8337472772297 +527000 ekin = 4.15303805139338 | erot = 4.03339974605316 | epot = -38.4813261438674 | etot = -30.2948883464208 +528000 ekin = 4.34085606106391 | erot = 3.63416049936053 | epot = -38.4621670653444 | etot = -30.4871505049199 +529000 ekin = 4.53593485604709 | erot = 3.72087643644205 | epot = -38.417501648356 | etot = -30.1606903558668 +530000 ekin = 4.65836945322522 | erot = 3.5823370050418 | epot = -38.3861765288022 | etot = -30.1454700705352 +531000 ekin = 4.66519878740321 | erot = 3.41094947734083 | epot = -38.3363103504893 | etot = -30.2601620857452 +532000 ekin = 4.80041164317288 | erot = 3.07760528500134 | epot = -38.3151265786575 | etot = -30.4371096504833 +533000 ekin = 4.73180745168947 | erot = 3.06230961560373 | epot = -38.3468719461379 | etot = -30.5527548788447 +534000 ekin = 4.77276572097011 | erot = 3.01963113043202 | epot = -38.4024212860539 | etot = -30.6100244346518 +535000 ekin = 4.8569392849477 | erot = 2.8251632104728 | epot = -38.5360450508862 | etot = -30.8539425554657 +536000 ekin = 4.79265980947574 | erot = 2.9077544610961 | epot = -38.7196748122557 | etot = -31.0192605416839 +537000 ekin = 4.8694795576244 | erot = 3.00989555981224 | epot = -38.9076102830991 | etot = -31.0282351656625 +538000 ekin = 5.00269155741106 | erot = 2.68875189029915 | epot = -39.0473675460742 | etot = -31.355924098364 +539000 ekin = 4.98226102919721 | erot = 2.9218882996937 | epot = -39.1655668480607 | etot = -31.2614175191698 +540000 ekin = 4.99147016878216 | erot = 3.35574385805742 | epot = -39.2596960810253 | etot = -30.9124820541857 +541000 ekin = 4.92725844601428 | erot = 3.28345034188319 | epot = -39.3089899760125 | etot = -31.098281188115 +542000 ekin = 4.77242859226853 | erot = 3.31966912230266 | epot = -39.290238437105 | etot = -31.1981407225338 +543000 ekin = 4.65726157165086 | erot = 3.56099171692955 | epot = -39.1715392323124 | etot = -30.953285943732 +544000 ekin = 4.75158561074879 | erot = 2.98586301386342 | epot = -39.0000211966266 | etot = -31.2625725720144 +545000 ekin = 4.71389651780192 | erot = 3.29722166624284 | epot = -38.8124009343347 | etot = -30.8012827502899 +546000 ekin = 4.59452933616211 | erot = 3.65785900566388 | epot = -38.6597531372896 | etot = -30.4073647954636 +547000 ekin = 4.49485576841329 | erot = 3.52227156689634 | epot = -38.5261493757316 | etot = -30.509022040422 +548000 ekin = 4.49472654055115 | erot = 3.49603087938245 | epot = -38.3944216290951 | etot = -30.4036642091615 +549000 ekin = 4.39213180937533 | erot = 3.53228763855232 | epot = -38.2774675964384 | etot = -30.3530481485108 +550000 ekin = 4.36283999146784 | erot = 3.78776441036084 | epot = -38.2051317998107 | etot = -30.054527397982 +551000 ekin = 4.3226010693823 | erot = 4.01133252124201 | epot = -38.1611801425645 | etot = -29.8272465519402 +552000 ekin = 4.33183515664561 | erot = 3.98124414472576 | epot = -38.153772138803 | etot = -29.8406928374316 +553000 ekin = 4.30534974680474 | erot = 3.81209066755014 | epot = -38.1803693007097 | etot = -30.0629288863549 +554000 ekin = 4.29335219580314 | erot = 3.80213545963908 | epot = -38.2389597407399 | etot = -30.1434720852977 +555000 ekin = 4.45825549052385 | erot = 4.03672150414325 | epot = -38.3296083261046 | etot = -29.8346313314375 +556000 ekin = 4.63230188756517 | erot = 3.70797489704037 | epot = -38.4795834327921 | etot = -30.1393066481866 +557000 ekin = 4.7062229398582 | erot = 4.51036732636183 | epot = -38.6738842895281 | etot = -29.4572940233081 +558000 ekin = 4.70612532334176 | erot = 4.30314260207011 | epot = -38.9099036274272 | etot = -29.9006357020154 +559000 ekin = 4.85842132468142 | erot = 4.45569884582871 | epot = -39.1571701897087 | etot = -29.8430500191985 +560000 ekin = 4.84667483493842 | erot = 4.2909749826346 | epot = -39.3692871188964 | etot = -30.2316373013234 +561000 ekin = 4.93080663772512 | erot = 4.40964672372479 | epot = -39.5560309503474 | etot = -30.2155775888975 +562000 ekin = 5.02786763240469 | erot = 4.09895267825196 | epot = -39.6620959555469 | etot = -30.5352756448903 +563000 ekin = 4.99483060861824 | erot = 4.56393029644404 | epot = -39.7001867829015 | etot = -30.1414258778392 +564000 ekin = 5.01292656089529 | erot = 4.4655943412775 | epot = -39.6969046345991 | etot = -30.2183837324263 +565000 ekin = 4.97924499589803 | erot = 4.56764102867122 | epot = -39.6391307119519 | etot = -30.0922446873826 +566000 ekin = 4.80472039327358 | erot = 4.49618530358116 | epot = -39.532014253858 | etot = -30.2311085570032 +567000 ekin = 4.59721417192401 | erot = 4.44898156673777 | epot = -39.3835091139999 | etot = -30.3373133753381 +568000 ekin = 4.59948947791994 | erot = 4.21619266891999 | epot = -39.1697350851653 | etot = -30.3540529383253 +569000 ekin = 4.46814520025952 | erot = 4.13625120915546 | epot = -38.9496016480665 | etot = -30.3452052386516 +570000 ekin = 4.63380574109383 | erot = 3.97471689520422 | epot = -38.718728428018 | etot = -30.11020579172 +571000 ekin = 4.51646555902281 | erot = 3.77943581302556 | epot = -38.5103017941538 | etot = -30.2144004221055 +572000 ekin = 4.44329973394602 | erot = 3.7381898397106 | epot = -38.3513010282128 | etot = -30.1698114545561 +573000 ekin = 4.48138796166295 | erot = 3.67030746094246 | epot = -38.2531080005807 | etot = -30.1014125779753 +574000 ekin = 4.57372019352159 | erot = 3.64740839838101 | epot = -38.156347689767 | etot = -29.9352190978644 +575000 ekin = 4.81962720354415 | erot = 3.58128135189807 | epot = -38.0780197446127 | etot = -29.6771111891705 +576000 ekin = 4.78739960955874 | erot = 3.16941649568994 | epot = -38.0548669136925 | etot = -30.0980508084438 +577000 ekin = 4.89624137933428 | erot = 3.37301453509229 | epot = -38.0581159208699 | etot = -29.7888600064433 +578000 ekin = 4.89993171052244 | erot = 3.39468878464203 | epot = -38.0636938795354 | etot = -29.7690733843709 +579000 ekin = 4.83297661461352 | erot = 3.08572772864731 | epot = -38.0577731810634 | etot = -30.1390688378025 +580000 ekin = 4.77298411404082 | erot = 3.09603380464132 | epot = -38.0675771405193 | etot = -30.1985592218372 +581000 ekin = 4.96965435170517 | erot = 3.06610493080443 | epot = -38.0894896837321 | etot = -30.0537304012225 +582000 ekin = 4.84477580774046 | erot = 2.99273203470777 | epot = -38.1047755328766 | etot = -30.2672676904284 +583000 ekin = 4.80184612340906 | erot = 2.99121545039794 | epot = -38.0992283827671 | etot = -30.3061668089601 +584000 ekin = 4.73999729115027 | erot = 2.9582025614058 | epot = -38.1193022601923 | etot = -30.4211024076362 +585000 ekin = 4.62963491646133 | erot = 2.99096158598542 | epot = -38.1514766562945 | etot = -30.5308801538478 +586000 ekin = 4.66196804986657 | erot = 3.11428540249501 | epot = -38.1645218154685 | etot = -30.3882683631069 +587000 ekin = 4.58446438916316 | erot = 3.26198289890957 | epot = -38.1451310277746 | etot = -30.2986837397019 +588000 ekin = 4.59050554157097 | erot = 3.37267542289071 | epot = -38.0928945920966 | etot = -30.1297136276349 +589000 ekin = 4.52148456601106 | erot = 3.20426810396368 | epot = -38.0431145518049 | etot = -30.3173618818302 +590000 ekin = 4.54292012494665 | erot = 3.1746661588888 | epot = -37.9867331121618 | etot = -30.2691468283263 +591000 ekin = 4.4671534284139 | erot = 3.30654504351679 | epot = -37.9702893954325 | etot = -30.1965909235018 +592000 ekin = 4.47491098921977 | erot = 3.6999642514397 | epot = -37.96964005272 | etot = -29.7947648120605 +593000 ekin = 4.43506697623668 | erot = 3.70250326611378 | epot = -37.982672172325 | etot = -29.8451019299745 +594000 ekin = 4.36908136306916 | erot = 3.59308231950687 | epot = -38.0038521048194 | etot = -30.0416884222434 +595000 ekin = 4.30615021787055 | erot = 3.60547435881484 | epot = -38.0517692624258 | etot = -30.1401446857404 +596000 ekin = 4.27538703974133 | erot = 3.70718417029039 | epot = -38.1072020006231 | etot = -30.1246307905914 +597000 ekin = 4.09427835861054 | erot = 3.56040857145023 | epot = -38.1368054718234 | etot = -30.4821185417626 +598000 ekin = 4.06772969179115 | erot = 3.98852753231075 | epot = -38.1357675039156 | etot = -30.0795102798136 +599000 ekin = 4.05823661502991 | erot = 3.99204411848296 | epot = -38.094416622612 | etot = -30.0441358890991 +600000 ekin = 4.14000207696602 | erot = 3.69886036268676 | epot = -38.0126500071596 | etot = -30.1737875675068 +601000 ekin = 4.14331251606218 | erot = 4.02012885446818 | epot = -37.8931408419344 | etot = -29.729699471404 +602000 ekin = 4.19175322865721 | erot = 3.63789752518648 | epot = -37.7768382304761 | etot = -29.9471874766324 +603000 ekin = 4.17700109074315 | erot = 3.33190102346874 | epot = -37.6571796612342 | etot = -30.1482775470223 +604000 ekin = 4.32110078335241 | erot = 3.37359972635297 | epot = -37.5481087406157 | etot = -29.8534082309104 +605000 ekin = 4.40829637956699 | erot = 3.12232098209626 | epot = -37.4615593717344 | etot = -29.9309420100712 +606000 ekin = 4.50978571460473 | erot = 2.82903034171764 | epot = -37.4107566252709 | etot = -30.0719405689485 +607000 ekin = 4.64775510562435 | erot = 2.72855004395394 | epot = -37.3886864614939 | etot = -30.0123813119156 +608000 ekin = 4.62515883775204 | erot = 2.6927668656574 | epot = -37.3472679127842 | etot = -30.0293422093748 +609000 ekin = 4.58072072733859 | erot = 2.72618151323749 | epot = -37.3211555189931 | etot = -30.014253278417 +610000 ekin = 4.37064710749547 | erot = 2.94205446769451 | epot = -37.3313655411416 | etot = -30.0186639659516 +611000 ekin = 4.30243700562367 | erot = 2.94482669781559 | epot = -37.3282578261779 | etot = -30.0809941227387 +612000 ekin = 4.37982748485341 | erot = 2.81236690797527 | epot = -37.3366791579242 | etot = -30.1444847650955 +613000 ekin = 4.49298433908211 | erot = 2.94229499226113 | epot = -37.3617837170398 | etot = -29.9265043856965 +614000 ekin = 4.63192250195887 | erot = 2.81948937077722 | epot = -37.3623397651557 | etot = -29.9109278924196 +615000 ekin = 4.56431794922691 | erot = 3.0411203817408 | epot = -37.3360474756729 | etot = -29.7306091447052 +616000 ekin = 4.48538645093135 | erot = 2.98636794618235 | epot = -37.2843360454654 | etot = -29.8125816483517 +617000 ekin = 4.35777724185508 | erot = 3.27046740448594 | epot = -37.2149609045278 | etot = -29.5867162581867 +618000 ekin = 4.13929013645531 | erot = 3.31436963968888 | epot = -37.1380165806133 | etot = -29.6843568044691 +619000 ekin = 3.99812604761941 | erot = 3.8069721617963 | epot = -37.0480074184854 | etot = -29.2429092090697 +620000 ekin = 3.75775297824748 | erot = 3.88935078371488 | epot = -37.0016709350121 | etot = -29.3545671730497 +621000 ekin = 3.59837254942665 | erot = 3.36974253347194 | epot = -36.9571399968608 | etot = -29.9890249139622 +622000 ekin = 3.52853751549672 | erot = 3.57220920853455 | epot = -36.9826672270776 | etot = -29.8819205030464 +623000 ekin = 3.44776927445729 | erot = 3.68524482792421 | epot = -37.0520182183616 | etot = -29.9190041159801 +624000 ekin = 3.42459051153803 | erot = 4.10039189185604 | epot = -37.1561365046956 | etot = -29.6311541013015 +625000 ekin = 3.47427533928245 | erot = 4.19316198399255 | epot = -37.3128709391508 | etot = -29.6454336158758 +626000 ekin = 3.59243588690058 | erot = 4.25331544595912 | epot = -37.4538356021372 | etot = -29.6080842692775 +627000 ekin = 3.65834270574552 | erot = 3.84587709669878 | epot = -37.5560189371567 | etot = -30.0517991347124 +628000 ekin = 3.70047562334578 | erot = 3.68821102783487 | epot = -37.6346624168371 | etot = -30.2459757656565 +629000 ekin = 3.73516234913433 | erot = 3.92476956261683 | epot = -37.7008434862915 | etot = -30.0409115745404 +630000 ekin = 3.81181204861757 | erot = 3.95913149926755 | epot = -37.7335643601767 | etot = -29.9626208122916 +631000 ekin = 3.81645534702376 | erot = 3.13210702566919 | epot = -37.7706097068457 | etot = -30.8220473341528 +632000 ekin = 3.83367227377587 | erot = 3.16390787891897 | epot = -37.8179976528052 | etot = -30.8204175001103 +633000 ekin = 3.78875173101134 | erot = 3.28627876080406 | epot = -37.8551980571895 | etot = -30.7801675653741 +634000 ekin = 3.6443572434567 | erot = 3.54689069849334 | epot = -37.8771184407041 | etot = -30.685870498754 +635000 ekin = 3.74927918910692 | erot = 3.50067245026003 | epot = -37.9120332365851 | etot = -30.6620815972182 +636000 ekin = 3.89890106913058 | erot = 3.51590480850449 | epot = -37.9883703460315 | etot = -30.5735644683965 +637000 ekin = 3.98051852239103 | erot = 3.51683885701818 | epot = -38.1188954220066 | etot = -30.6215380425974 +638000 ekin = 4.18679252196735 | erot = 3.48363716100453 | epot = -38.3003898519918 | etot = -30.6299601690199 +639000 ekin = 4.29259370089823 | erot = 3.44532403016775 | epot = -38.5009165327291 | etot = -30.7629988016631 +640000 ekin = 4.33862023546748 | erot = 3.6140024868752 | epot = -38.6627935284696 | etot = -30.710170806127 +641000 ekin = 4.47895119284614 | erot = 3.60758277909088 | epot = -38.7986251266555 | etot = -30.7120911547185 +642000 ekin = 4.48471207018753 | erot = 3.75535910837188 | epot = -38.8636204148756 | etot = -30.6235492363162 +643000 ekin = 4.56445558617346 | erot = 3.81552004634158 | epot = -38.8645537025221 | etot = -30.4845780700071 +644000 ekin = 4.7332947847572 | erot = 3.55885168491642 | epot = -38.8054956282287 | etot = -30.5133491585551 +645000 ekin = 4.69129439625574 | erot = 3.28200064721723 | epot = -38.7015474297407 | etot = -30.7282523862678 +646000 ekin = 4.5858300200132 | erot = 3.40859569463286 | epot = -38.5478616511676 | etot = -30.5534359365215 +647000 ekin = 4.60741071742922 | erot = 3.38831322436686 | epot = -38.3932861693423 | etot = -30.3975622275462 +648000 ekin = 4.51463144345975 | erot = 3.24274100333129 | epot = -38.2758434893351 | etot = -30.518471042544 +649000 ekin = 4.55491099792928 | erot = 3.31738105307143 | epot = -38.2201110845426 | etot = -30.3478190335419 +650000 ekin = 4.67226589728797 | erot = 3.60950811156238 | epot = -38.2202225605506 | etot = -29.9384485517003 +651000 ekin = 4.60851815831642 | erot = 3.77278937705218 | epot = -38.253633099544 | etot = -29.8723255641754 +652000 ekin = 4.67845920019102 | erot = 3.39376240096224 | epot = -38.2868824175934 | etot = -30.2146608164401 +653000 ekin = 4.66844839257092 | erot = 3.83803199311147 | epot = -38.3235322989533 | etot = -29.8170519132709 +654000 ekin = 4.71048953319322 | erot = 3.48299287365118 | epot = -38.3580887397251 | etot = -30.1646063328807 +655000 ekin = 4.59645355598624 | erot = 3.74782025282036 | epot = -38.4145657066931 | etot = -30.0702918978865 +656000 ekin = 4.75902771581103 | erot = 3.81874385847387 | epot = -38.4693742928372 | etot = -29.8916027185523 +657000 ekin = 4.6466802059304 | erot = 3.66656001060126 | epot = -38.4843211797294 | etot = -30.1710809631977 +658000 ekin = 4.55836001875084 | erot = 3.93329833863017 | epot = -38.4803826070965 | etot = -29.9887242497155 +659000 ekin = 4.55537392119735 | erot = 3.62854716021115 | epot = -38.4363459414659 | etot = -30.2524248600574 +660000 ekin = 4.415513333681 | erot = 3.65395590072885 | epot = -38.3663969488347 | etot = -30.2969277144248 +661000 ekin = 4.32449081576482 | erot = 3.7409091571769 | epot = -38.2884247485437 | etot = -30.223024775602 +662000 ekin = 4.23823124010357 | erot = 3.58833666048794 | epot = -38.1946280661735 | etot = -30.368060165582 +663000 ekin = 4.32618520330365 | erot = 3.71369597709404 | epot = -38.0940311251123 | etot = -30.0541499447146 +664000 ekin = 4.30987713127752 | erot = 3.55193027406448 | epot = -38.0118003167728 | etot = -30.1499929114308 +665000 ekin = 4.32971268964141 | erot = 3.40416985470625 | epot = -37.9630121098135 | etot = -30.2291295654658 +666000 ekin = 4.30397058329246 | erot = 3.24563244836278 | epot = -37.9564459426243 | etot = -30.4068429109691 +667000 ekin = 4.23802718761169 | erot = 3.57923047722669 | epot = -37.9111709997968 | etot = -30.0939133349584 +668000 ekin = 4.17750835985179 | erot = 3.42921371885248 | epot = -37.8409684237743 | etot = -30.23424634507 +669000 ekin = 4.10123021238957 | erot = 3.38759831293404 | epot = -37.7732457913401 | etot = -30.2844172660165 +670000 ekin = 3.96563796265774 | erot = 3.59480187806746 | epot = -37.6965941156385 | etot = -30.1361542749133 +671000 ekin = 3.96406262528475 | erot = 3.64073126780244 | epot = -37.5753442355429 | etot = -29.9705503424557 +672000 ekin = 4.04265318678515 | erot = 3.67979591145804 | epot = -37.4296504342376 | etot = -29.7072013359944 +673000 ekin = 3.99224066234878 | erot = 3.52190422085284 | epot = -37.3047157518842 | etot = -29.7905708686826 +674000 ekin = 3.97681715793541 | erot = 3.75368024393795 | epot = -37.1885781675146 | etot = -29.4580807656412 +675000 ekin = 3.85833621087039 | erot = 3.97050815664598 | epot = -37.1417466549722 | etot = -29.3129022874559 +676000 ekin = 3.77676206895617 | erot = 3.79811590545672 | epot = -37.1253534099229 | etot = -29.55047543551 +677000 ekin = 3.78226586281959 | erot = 3.88942769355395 | epot = -37.138562963627 | etot = -29.4668694072535 +678000 ekin = 3.61579087416923 | erot = 3.83629032138265 | epot = -37.1880190743622 | etot = -29.7359378788103 +679000 ekin = 3.59940694058676 | erot = 3.92320694106409 | epot = -37.2411006365046 | etot = -29.7184867548538 +680000 ekin = 3.59936088858668 | erot = 3.59198808770724 | epot = -37.3103059663064 | etot = -30.1189569900125 +681000 ekin = 3.55068173353926 | erot = 3.62032338399716 | epot = -37.3978871586221 | etot = -30.2268820410857 +682000 ekin = 3.64312616149461 | erot = 3.63220095729225 | epot = -37.4824268307594 | etot = -30.2070997119725 +683000 ekin = 3.59147144886471 | erot = 4.00540882269656 | epot = -37.5784304648839 | etot = -29.9815501933227 +684000 ekin = 3.72558767154378 | erot = 4.43134049971583 | epot = -37.6663536443174 | etot = -29.5094254730578 +685000 ekin = 3.75700113340411 | erot = 4.4205179107468 | epot = -37.7011506850387 | etot = -29.5236316408878 +686000 ekin = 3.68716829673498 | erot = 4.29446170846275 | epot = -37.7134415714992 | etot = -29.7318115663015 +687000 ekin = 3.64818503755745 | erot = 4.53150873331275 | epot = -37.711537143075 | etot = -29.5318433722048 +688000 ekin = 3.65898677055768 | erot = 4.19517143645003 | epot = -37.717932414298 | etot = -29.8637742072903 +689000 ekin = 3.62053492938482 | erot = 4.90634872884688 | epot = -37.7254294906479 | etot = -29.1985458324162 +690000 ekin = 3.66313798116701 | erot = 4.56796147260999 | epot = -37.7316773182822 | etot = -29.5005778645052 +691000 ekin = 3.71240687811142 | erot = 4.32729443264309 | epot = -37.6986701891449 | etot = -29.6589688783904 +692000 ekin = 3.77937222983663 | erot = 4.25209713638369 | epot = -37.6463069321163 | etot = -29.614837565896 +693000 ekin = 3.82528389687004 | erot = 4.44391854020412 | epot = -37.5813521083395 | etot = -29.3121496712654 +694000 ekin = 3.77132757417721 | erot = 4.30342910423483 | epot = -37.529253149734 | etot = -29.4544964713219 +695000 ekin = 3.87816824099576 | erot = 3.61664690986643 | epot = -37.4977174174722 | etot = -30.00290226661 +696000 ekin = 4.03561630547949 | erot = 3.14881777436795 | epot = -37.5165237009965 | etot = -30.3320896211491 +697000 ekin = 4.10221303088943 | erot = 2.74688055821585 | epot = -37.6237315563432 | etot = -30.7746379672379 +698000 ekin = 4.33198843808374 | erot = 2.54448976763407 | epot = -37.8109238872742 | etot = -30.9344456815564 +699000 ekin = 4.45835519306672 | erot = 2.83727562812266 | epot = -38.0765099491825 | etot = -30.7808791279931 +700000 ekin = 4.62566765847138 | erot = 3.20413023616691 | epot = -38.366668680577 | etot = -30.5368707859387 +701000 ekin = 4.7119895804198 | erot = 3.20500762759523 | epot = -38.6531148244762 | etot = -30.7361176164611 +702000 ekin = 4.70320353975511 | erot = 3.49669921722524 | epot = -38.9020142648732 | etot = -30.7021115078929 +703000 ekin = 4.71666592176221 | erot = 3.4360587579244 | epot = -39.0983570180766 | etot = -30.94563233839 +704000 ekin = 4.81119997223628 | erot = 3.68842954975269 | epot = -39.2326154199854 | etot = -30.7329858979964 +705000 ekin = 4.76635995985857 | erot = 4.27225880905617 | epot = -39.3045830193539 | etot = -30.2659642504391 +706000 ekin = 4.61239689007865 | erot = 4.45743851438183 | epot = -39.3303553159894 | etot = -30.2605199115289 +707000 ekin = 4.4339240392442 | erot = 5.00090751066084 | epot = -39.3012148785927 | etot = -29.8663833286877 +708000 ekin = 4.49363980378809 | erot = 4.44827137132344 | epot = -39.185594508632 | etot = -30.2436833335204 +709000 ekin = 4.38087413515997 | erot = 4.33993340714001 | epot = -39.0225667156706 | etot = -30.3017591733706 +710000 ekin = 4.30084034805687 | erot = 4.18416076229502 | epot = -38.8018325665079 | etot = -30.3168314561561 +711000 ekin = 4.16061239283927 | erot = 3.75964607710248 | epot = -38.6119256895404 | etot = -30.6916672195987 +712000 ekin = 4.02785073941563 | erot = 3.9187380855626 | epot = -38.5032151267496 | etot = -30.5566263017714 +713000 ekin = 3.91042694307514 | erot = 4.02474708082432 | epot = -38.4555203424355 | etot = -30.5203463185361 +714000 ekin = 3.91972154955273 | erot = 3.86911398530045 | epot = -38.439191113934 | etot = -30.6503555790808 +715000 ekin = 3.7943288518239 | erot = 3.97493955426896 | epot = -38.464893488298 | etot = -30.6956250822051 +716000 ekin = 3.81379173421822 | erot = 4.12773796628725 | epot = -38.5344978321894 | etot = -30.592968131684 +717000 ekin = 3.81338083287865 | erot = 3.91040514076924 | epot = -38.6119475932714 | etot = -30.8881616196235 +718000 ekin = 3.98031853847212 | erot = 3.63481705596705 | epot = -38.678649410417 | etot = -31.0635138159778 +719000 ekin = 3.8566755406953 | erot = 3.54568346865612 | epot = -38.7335222105701 | etot = -31.3311632012187 +720000 ekin = 3.82130999837905 | erot = 3.12899985812948 | epot = -38.8000481793519 | etot = -31.8497383228434 +721000 ekin = 3.84625676410587 | erot = 3.33090070721984 | epot = -38.8362758074818 | etot = -31.6591183361561 +722000 ekin = 3.79224716661399 | erot = 3.20659617994805 | epot = -38.8301147634646 | etot = -31.8312714169026 +723000 ekin = 3.89270036914645 | erot = 3.09341373486911 | epot = -38.7612142662691 | etot = -31.7751001622535 +724000 ekin = 3.88950015267432 | erot = 3.37593260372107 | epot = -38.6472208331853 | etot = -31.3817880767899 +725000 ekin = 3.89253643906726 | erot = 3.36325650610821 | epot = -38.527809683643 | etot = -31.2720167384676 +726000 ekin = 3.77207579735124 | erot = 2.95762270097696 | epot = -38.4162496849588 | etot = -31.6865511866306 +727000 ekin = 3.85895083084016 | erot = 2.69741467226748 | epot = -38.3204112624909 | etot = -31.7640457593832 +728000 ekin = 3.95735248448051 | erot = 2.9120886214562 | epot = -38.2269317498774 | etot = -31.3574906439407 +729000 ekin = 3.90116579496187 | erot = 2.68023881807523 | epot = -38.1837112825913 | etot = -31.6023066695542 +730000 ekin = 3.96318220229617 | erot = 2.52640600275291 | epot = -38.1795006550048 | etot = -31.6899124499557 +731000 ekin = 4.07163559325283 | erot = 2.47524828245717 | epot = -38.2208467965997 | etot = -31.6739629208897 +732000 ekin = 4.1233129439478 | erot = 2.59059397612226 | epot = -38.2785246774241 | etot = -31.5646177573541 +733000 ekin = 4.18393032106832 | erot = 2.72580269413636 | epot = -38.392037043721 | etot = -31.4823040285164 +734000 ekin = 4.22490204001114 | erot = 2.94025387724302 | epot = -38.5577268408556 | etot = -31.3925709236014 +735000 ekin = 4.4163790638128 | erot = 3.39000978300276 | epot = -38.7520895879279 | etot = -30.9457007411124 +736000 ekin = 4.52682105512921 | erot = 3.59384799521515 | epot = -39.0007836443239 | etot = -30.8801145939796 +737000 ekin = 4.54518518822971 | erot = 3.67606395235669 | epot = -39.2431861398733 | etot = -31.0219369992869 +738000 ekin = 4.5411183131362 | erot = 3.87514152367616 | epot = -39.4689573474102 | etot = -31.0526975105979 +739000 ekin = 4.64515651334117 | erot = 3.86830954896682 | epot = -39.6580785017876 | etot = -31.1446124394797 +740000 ekin = 4.59721923359587 | erot = 3.83234514918728 | epot = -39.7800787241316 | etot = -31.3505143413485 +741000 ekin = 4.54920694202201 | erot = 4.22873772666809 | epot = -39.8001498706487 | etot = -31.0222052019586 +742000 ekin = 4.37775553859947 | erot = 4.07719515191239 | epot = -39.77291919362 | etot = -31.3179685031081 +743000 ekin = 4.3556617165814 | erot = 4.19296317409631 | epot = -39.6826493457459 | etot = -31.1340244550682 +744000 ekin = 4.35520781857197 | erot = 4.03027041959899 | epot = -39.5404877687078 | etot = -31.1550095305368 +745000 ekin = 4.22626887984311 | erot = 3.36034348052822 | epot = -39.3612863690873 | etot = -31.774674008716 +746000 ekin = 4.11995949308898 | erot = 3.27667360498754 | epot = -39.1619120183871 | etot = -31.7652789203105 +747000 ekin = 4.14400839200212 | erot = 3.30199438470027 | epot = -38.9827326721257 | etot = -31.5367298954233 +748000 ekin = 4.00468940718665 | erot = 3.14625781984354 | epot = -38.8044398216776 | etot = -31.6534925946474 +749000 ekin = 3.84115389861437 | erot = 2.95470003366606 | epot = -38.6687005011651 | etot = -31.8728465688847 +750000 ekin = 3.65410258827795 | erot = 3.15459365563751 | epot = -38.5278602215806 | etot = -31.7191639776652 +751000 ekin = 3.60281847230518 | erot = 3.24631581000329 | epot = -38.4153933025752 | etot = -31.5662590202667 +752000 ekin = 3.67731217795101 | erot = 3.63832283099237 | epot = -38.3028409880035 | etot = -30.9872059790601 +753000 ekin = 3.57605485188786 | erot = 3.26752665173283 | epot = -38.216520404161 | etot = -31.3729389005403 +754000 ekin = 3.69078656100566 | erot = 3.07077330953207 | epot = -38.2008529421059 | etot = -31.4392930715682 +755000 ekin = 3.70168225637966 | erot = 2.97263399944781 | epot = -38.2287093031121 | etot = -31.5543930472847 +756000 ekin = 3.82302121275981 | erot = 3.17826892909081 | epot = -38.3101319992817 | etot = -31.3088418574311 +757000 ekin = 3.92969183976116 | erot = 3.24398381681727 | epot = -38.4229976799529 | etot = -31.2493220233745 +758000 ekin = 4.01825553851179 | erot = 2.96087889455689 | epot = -38.5603809302419 | etot = -31.5812464971732 +759000 ekin = 4.1594567829226 | erot = 3.31368855914157 | epot = -38.7240687265499 | etot = -31.2509233844857 +760000 ekin = 4.08337495041284 | erot = 3.28527114059582 | epot = -38.8845645171708 | etot = -31.5159184261621 +761000 ekin = 4.14862342701 | erot = 3.30586771709934 | epot = -38.9896780479041 | etot = -31.5351869037948 +762000 ekin = 4.15291891523588 | erot = 3.21578962032623 | epot = -39.035237071941 | etot = -31.6665285363789 +763000 ekin = 4.13154828483799 | erot = 3.3900507889809 | epot = -39.064056495297 | etot = -31.5424574214781 +764000 ekin = 4.11445022984107 | erot = 3.78778087021378 | epot = -39.0692483990251 | etot = -31.1670172989703 +765000 ekin = 3.94937442988368 | erot = 3.99811330721235 | epot = -39.0421921917086 | etot = -31.0947044546125 +766000 ekin = 3.90772961551848 | erot = 4.01819621928476 | epot = -38.9772379154489 | etot = -31.0513120806457 +767000 ekin = 3.91865092379335 | erot = 3.66675942927309 | epot = -38.8570109636997 | etot = -31.2716006106333 +768000 ekin = 3.90455829915367 | erot = 3.57997769181359 | epot = -38.7106990781798 | etot = -31.2261630872126 +769000 ekin = 3.79614462627832 | erot = 3.72589479531036 | epot = -38.5987325117514 | etot = -31.0766930901627 +770000 ekin = 3.84943042371494 | erot = 3.41445940258821 | epot = -38.5242031402412 | etot = -31.260313313938 +771000 ekin = 3.93726861106208 | erot = 3.22573743650862 | epot = -38.4470290210347 | etot = -31.284022973464 +772000 ekin = 3.96999789478603 | erot = 3.15006319998271 | epot = -38.4433830504299 | etot = -31.3233219556611 +773000 ekin = 3.90264203603896 | erot = 3.08286085672449 | epot = -38.4596433115511 | etot = -31.4741404187877 +774000 ekin = 4.05136357587228 | erot = 3.17001936426352 | epot = -38.5137422973686 | etot = -31.2923593572328 +775000 ekin = 4.11418642080986 | erot = 3.81754399179959 | epot = -38.5927804349064 | etot = -30.661050022297 +776000 ekin = 4.11481050991311 | erot = 3.55328099460662 | epot = -38.6754580889835 | etot = -31.0073665844638 +777000 ekin = 4.23423405077874 | erot = 3.581082705526 | epot = -38.7616944176802 | etot = -30.9463776613754 +778000 ekin = 4.22244262963935 | erot = 3.64411855451435 | epot = -38.8420321429421 | etot = -30.9754709587884 +779000 ekin = 4.20492205038599 | erot = 3.89270804286641 | epot = -38.9009656289589 | etot = -30.8033355357065 +780000 ekin = 4.19457435208215 | erot = 3.98994130977104 | epot = -38.9050369874365 | etot = -30.7205213255833 +781000 ekin = 4.33837315790481 | erot = 3.45852422770952 | epot = -38.858660577552 | etot = -31.0617631919377 +782000 ekin = 4.36357496915256 | erot = 3.10010011432264 | epot = -38.7868584055569 | etot = -31.3231833220817 +783000 ekin = 4.42162598039043 | erot = 3.42028138737015 | epot = -38.7233668668894 | etot = -30.8814594991289 +784000 ekin = 4.52915280589042 | erot = 3.46746509226011 | epot = -38.6388342149203 | etot = -30.6422163167698 +785000 ekin = 4.55159402138248 | erot = 3.36141401661284 | epot = -38.5160993571772 | etot = -30.6030913191819 +786000 ekin = 4.4107707826177 | erot = 3.55728141641266 | epot = -38.3921286555455 | etot = -30.4240764565152 +787000 ekin = 4.54739828665105 | erot = 3.81681111076945 | epot = -38.2843232861691 | etot = -29.9201138887486 +788000 ekin = 4.51350891647147 | erot = 3.90594890385671 | epot = -38.2029645190102 | etot = -29.783506698682 +789000 ekin = 4.41183434492797 | erot = 4.01545730842708 | epot = -38.1545360413067 | etot = -29.7272443879517 +790000 ekin = 4.3621929679848 | erot = 4.38022337925409 | epot = -38.1642768248249 | etot = -29.4218604775861 +791000 ekin = 4.36856935453188 | erot = 4.10044084346352 | epot = -38.22190556061 | etot = -29.7528953626146 +792000 ekin = 4.15750522427246 | erot = 4.31220830506834 | epot = -38.3006248567473 | etot = -29.8309113274065 +793000 ekin = 4.04895474142999 | erot = 4.47406069249712 | epot = -38.4166817679431 | etot = -29.893666334016 +794000 ekin = 4.06782077729039 | erot = 4.5423761591342 | epot = -38.549740398153 | etot = -29.9395434617284 +795000 ekin = 4.13325369560992 | erot = 4.67664308533435 | epot = -38.7140310649861 | etot = -29.9041342840418 +796000 ekin = 4.24810673699366 | erot = 4.55090018691374 | epot = -38.8628377912584 | etot = -30.0638308673509 +797000 ekin = 4.47820483480062 | erot = 4.3710582070195 | epot = -39.0073103741375 | etot = -30.1580473323174 +798000 ekin = 4.41687882033674 | erot = 4.03192844801015 | epot = -39.1717655165837 | etot = -30.7229582482368 +799000 ekin = 4.51272621151671 | erot = 3.80275615695399 | epot = -39.326421036722 | etot = -31.0109386682513 +800000 ekin = 4.55406747540001 | erot = 3.86603589563195 | epot = -39.4550921156883 | etot = -31.0349887446563 +801000 ekin = 4.71425753043944 | erot = 4.19401636489447 | epot = -39.54550685129 | etot = -30.6372329559561 +802000 ekin = 4.73096724901053 | erot = 4.66018334519234 | epot = -39.5972922700863 | etot = -30.2061416758834 +803000 ekin = 4.62379738113316 | erot = 4.84687313016553 | epot = -39.6033097238912 | etot = -30.1326392125925 +804000 ekin = 4.73211781117971 | erot = 4.65405100631757 | epot = -39.5980929919843 | etot = -30.2119241744871 +805000 ekin = 4.74990370273775 | erot = 5.03061291222782 | epot = -39.5694988655322 | etot = -29.7889822505666 +806000 ekin = 4.71376969100982 | erot = 4.52737209746849 | epot = -39.5309941756429 | etot = -30.2898523871646 +807000 ekin = 4.86079475139436 | erot = 4.60056901312775 | epot = -39.4997078348835 | etot = -30.0383440703614 +808000 ekin = 4.80209833525355 | erot = 4.45818548395654 | epot = -39.4704788837952 | etot = -30.2101950645852 +809000 ekin = 4.63770011287829 | erot = 4.50410245159981 | epot = -39.4133092695816 | etot = -30.2715067051035 +810000 ekin = 4.5884562354768 | erot = 4.59839740206875 | epot = -39.3630399165046 | etot = -30.1761862789591 +811000 ekin = 4.49885529137743 | erot = 3.9887801293149 | epot = -39.2630135095319 | etot = -30.7753780888396 +812000 ekin = 4.26896362698773 | erot = 3.78568800845431 | epot = -39.1138584925267 | etot = -31.0592068570847 +813000 ekin = 4.13473287838125 | erot = 3.67097615600868 | epot = -38.9684769118809 | etot = -31.1627678774909 +814000 ekin = 3.94776533151707 | erot = 3.94579982777182 | epot = -38.8393181931019 | etot = -30.945753033813 +815000 ekin = 3.90824876714858 | erot = 4.04132924638676 | epot = -38.7551601823022 | etot = -30.8055821687669 +816000 ekin = 3.78701127768462 | erot = 3.90301930977965 | epot = -38.6978803550943 | etot = -31.00784976763 +817000 ekin = 3.66292511898638 | erot = 3.94682412287947 | epot = -38.6270985077426 | etot = -31.0173492658768 +818000 ekin = 3.57247131276286 | erot = 4.1784329766224 | epot = -38.5581000447573 | etot = -30.807195755372 +819000 ekin = 3.53877880324505 | erot = 4.11647252852256 | epot = -38.470998731369 | etot = -30.8157473996014 +820000 ekin = 3.50671598439872 | erot = 4.2563179936087 | epot = -38.3521077332955 | etot = -30.5890737552881 +821000 ekin = 3.53103431342872 | erot = 3.63219688182932 | epot = -38.2011634572155 | etot = -31.0379322619575 +822000 ekin = 3.51951391759943 | erot = 3.61259288561799 | epot = -38.0560993175181 | etot = -30.9239925143007 +823000 ekin = 3.57671320020567 | erot = 3.17979253207746 | epot = -37.8872361758758 | etot = -31.1307304435927 +824000 ekin = 3.52000952110933 | erot = 3.12347116703119 | epot = -37.7532307820924 | etot = -31.1097500939519 +825000 ekin = 3.58955759313317 | erot = 3.15061432333255 | epot = -37.6359982536735 | etot = -30.8958263372078 +826000 ekin = 3.67361585241127 | erot = 3.02327306669 | epot = -37.5692124634558 | etot = -30.8723235443545 +827000 ekin = 3.81109350736614 | erot = 2.85212407416514 | epot = -37.5611625241688 | etot = -30.8979449426375 +828000 ekin = 3.90531542763314 | erot = 2.81227386436725 | epot = -37.5694328663447 | etot = -30.8518435743443 +829000 ekin = 3.84587100054134 | erot = 2.81493449341339 | epot = -37.6070676030483 | etot = -30.9462621090935 +830000 ekin = 3.92673136944215 | erot = 3.15236191191148 | epot = -37.6537469157601 | etot = -30.5746536344065 +831000 ekin = 3.93921284330496 | erot = 3.06450076609936 | epot = -37.7261731649981 | etot = -30.7224595555938 +832000 ekin = 3.97197612374622 | erot = 3.05649894744995 | epot = -37.8221989970108 | etot = -30.7937239258147 +833000 ekin = 3.93725030890251 | erot = 3.02665836452882 | epot = -37.937171835506 | etot = -30.9732631620747 +834000 ekin = 3.98146697711155 | erot = 3.02136079279364 | epot = -38.0629385880238 | etot = -31.0601108181186 +835000 ekin = 4.05052897985959 | erot = 3.17273406713199 | epot = -38.1835463837721 | etot = -30.9602833367805 +836000 ekin = 4.19040397553803 | erot = 3.26946027032966 | epot = -38.300933644763 | etot = -30.8410693988953 +837000 ekin = 4.23633886579814 | erot = 3.17722972050009 | epot = -38.3895940577245 | etot = -30.9760254714262 +838000 ekin = 4.2979004072249 | erot = 3.15450479842831 | epot = -38.4727069904852 | etot = -31.020301784832 +839000 ekin = 4.1827320503791 | erot = 3.33215565016996 | epot = -38.5543306618494 | etot = -31.0394429613003 +840000 ekin = 4.10684077367706 | erot = 3.38230089969601 | epot = -38.6241675017604 | etot = -31.1350258283873 +841000 ekin = 4.23749853699732 | erot = 4.07451157411686 | epot = -38.6954306161323 | etot = -30.3834205050181 +842000 ekin = 4.21536707994271 | erot = 4.23835126074064 | epot = -38.7619078222529 | etot = -30.3081894815695 +843000 ekin = 4.22215504966707 | erot = 4.35771502414032 | epot = -38.8129398935363 | etot = -30.2330698197289 +844000 ekin = 4.30121627933579 | erot = 4.37450016715715 | epot = -38.8385476120778 | etot = -30.1628311655849 +845000 ekin = 4.21550077214613 | erot = 4.14378307005664 | epot = -38.8237568245828 | etot = -30.4644729823801 +846000 ekin = 4.02238016824688 | erot = 4.51654867802969 | epot = -38.7905889780242 | etot = -30.2516601317477 +847000 ekin = 4.01810256512938 | erot = 4.26125017170757 | epot = -38.7339575587521 | etot = -30.4546048219152 +848000 ekin = 3.96232133970733 | erot = 4.11983424179415 | epot = -38.6313622633388 | etot = -30.5492066818373 +849000 ekin = 3.80836560854392 | erot = 4.28564223418282 | epot = -38.48959631527 | etot = -30.3955884725433 +850000 ekin = 3.69578896780274 | erot = 4.39587758868534 | epot = -38.3525607889923 | etot = -30.2608942325043 +851000 ekin = 3.41959969074419 | erot = 4.26064520104068 | epot = -38.1456854690895 | etot = -30.4654405773046 +852000 ekin = 3.30829887930773 | erot = 3.71835542085462 | epot = -37.9409715149429 | etot = -30.9143172147806 +853000 ekin = 3.35508979255709 | erot = 3.37030184945615 | epot = -37.7900455534541 | etot = -31.0646539114409 +854000 ekin = 3.27022944339444 | erot = 3.34212111159848 | epot = -37.7131840806896 | etot = -31.1008335256967 +855000 ekin = 3.1986122719394 | erot = 3.88856216577092 | epot = -37.6928018165187 | etot = -30.6056273788084 +856000 ekin = 3.06768638261931 | erot = 3.9829801102148 | epot = -37.727010473156 | etot = -30.6763439803219 +857000 ekin = 3.0284945827112 | erot = 3.90128373509548 | epot = -37.7894644617561 | etot = -30.8596861439494 +858000 ekin = 3.01766394874129 | erot = 3.81481515545785 | epot = -37.864155422239 | etot = -31.0316763180398 +859000 ekin = 3.04279727315571 | erot = 3.58850792531729 | epot = -37.9147104139937 | etot = -31.2834052155206 +860000 ekin = 3.12250083122178 | erot = 3.47152341944192 | epot = -37.9805991878281 | etot = -31.3865749371644 +861000 ekin = 3.08661234486258 | erot = 3.19104504877415 | epot = -38.0455048743499 | etot = -31.7678474807132 +862000 ekin = 3.21284829409282 | erot = 3.29871938445951 | epot = -38.0992348440439 | etot = -31.5876671654916 +863000 ekin = 3.30782920492319 | erot = 3.18791577959006 | epot = -38.1747149198293 | etot = -31.6789699353161 +864000 ekin = 3.42420257195633 | erot = 2.92388402618492 | epot = -38.2365375033582 | etot = -31.8884509052169 +865000 ekin = 3.34466551527703 | erot = 3.0972998859353 | epot = -38.301208351407 | etot = -31.8592429501947 +866000 ekin = 3.36174635490682 | erot = 3.3198551234471 | epot = -38.3565233653476 | etot = -31.6749218869937 +867000 ekin = 3.421839196855 | erot = 2.79592217571863 | epot = -38.3877893327294 | etot = -32.1700279601558 +868000 ekin = 3.36274087144654 | erot = 2.53957841641307 | epot = -38.4029375195829 | etot = -32.5006182317233 +869000 ekin = 3.40964507660633 | erot = 2.56691032353925 | epot = -38.36070725069 | etot = -32.3841518505444 +870000 ekin = 3.53716918539255 | erot = 2.78671187381857 | epot = -38.3296120297664 | etot = -32.0057309705553 +871000 ekin = 3.59594316640844 | erot = 2.64188707611858 | epot = -38.2798157408161 | etot = -32.0419854982891 +872000 ekin = 3.50734679867103 | erot = 2.53533702817681 | epot = -38.2086073023315 | etot = -32.1659234754836 +873000 ekin = 3.4916725837923 | erot = 2.78144827221659 | epot = -38.1271407877643 | etot = -31.8540199317554 +874000 ekin = 3.51303146719815 | erot = 2.71312702979827 | epot = -38.0371921369836 | etot = -31.8110336399872 +875000 ekin = 3.48945347772522 | erot = 2.94850163157192 | epot = -37.9788388329101 | etot = -31.540883723613 +876000 ekin = 3.56075870692742 | erot = 3.00511197452216 | epot = -37.9138095080296 | etot = -31.34793882658 +877000 ekin = 3.47758786865161 | erot = 3.1639084633419 | epot = -37.8677942057125 | etot = -31.226297873719 +878000 ekin = 3.30311825505464 | erot = 3.03452838302456 | epot = -37.8643582436494 | etot = -31.5267116055702 +879000 ekin = 3.24374156245722 | erot = 3.40785973601244 | epot = -37.8934655456587 | etot = -31.241864247189 +880000 ekin = 3.37573093292728 | erot = 3.29280897525387 | epot = -37.94427513544 | etot = -31.2757352272588 +881000 ekin = 3.39840544569008 | erot = 3.5585281271734 | epot = -38.000888118187 | etot = -31.0439545453235 +882000 ekin = 3.58967670735277 | erot = 3.3599507497553 | epot = -38.026551897189 | etot = -31.0769244400809 +883000 ekin = 3.50982611331089 | erot = 2.96694324238043 | epot = -38.0094926569536 | etot = -31.5327233012623 +884000 ekin = 3.40446481075003 | erot = 3.29501620823909 | epot = -37.9974315131722 | etot = -31.2979504941831 +885000 ekin = 3.35965929451984 | erot = 3.11716654513079 | epot = -38.0104898466533 | etot = -31.5336640070026 +886000 ekin = 3.4398820879568 | erot = 3.03035945423277 | epot = -38.0693633346149 | etot = -31.5991217924253 +887000 ekin = 3.45628684947257 | erot = 3.13318789403751 | epot = -38.1677034351609 | etot = -31.5782286916509 +888000 ekin = 3.56219309594464 | erot = 3.51843891461384 | epot = -38.2809194479114 | etot = -31.2002874373529 +889000 ekin = 3.66415644518222 | erot = 4.27546474777851 | epot = -38.4171028829354 | etot = -30.4774816899746 +890000 ekin = 3.59199164776021 | erot = 4.54716655442229 | epot = -38.5531146541751 | etot = -30.4139564519926 +891000 ekin = 3.48698350789935 | erot = 4.75701182525661 | epot = -38.6580895919219 | etot = -30.414094258766 +892000 ekin = 3.5156285575795 | erot = 4.92508483334396 | epot = -38.7362622656564 | etot = -30.295548874733 +893000 ekin = 3.47661113338826 | erot = 5.21569244219348 | epot = -38.7939526432619 | etot = -30.1016490676802 +894000 ekin = 3.33377890272878 | erot = 5.32415823975917 | epot = -38.7809839614902 | etot = -30.1230468190022 +895000 ekin = 3.43478318369595 | erot = 5.41005154361594 | epot = -38.7354883491901 | etot = -29.8906536218782 +896000 ekin = 3.35681124753247 | erot = 5.27612600451783 | epot = -38.6441447733837 | etot = -30.0112075213334 +897000 ekin = 3.28668538949691 | erot = 5.17803324766006 | epot = -38.5248966927269 | etot = -30.0601780555699 +898000 ekin = 3.28286469703046 | erot = 5.1387437476849 | epot = -38.3749221439183 | etot = -29.9533136992029 +899000 ekin = 3.28106900834727 | erot = 5.02377463132161 | epot = -38.2159550339516 | etot = -29.9111113942827 +900000 ekin = 3.2375487758962 | erot = 4.74128859066627 | epot = -38.0678968923378 | etot = -30.0890595257754 +901000 ekin = 3.13978298302567 | erot = 4.32431292426646 | epot = -37.9137652588161 | etot = -30.449669351524 +902000 ekin = 3.14110495369396 | erot = 3.63711917032585 | epot = -37.7967183247471 | etot = -31.0184942007273 +903000 ekin = 3.11835106948985 | erot = 3.58358384011855 | epot = -37.7069569192994 | etot = -31.005022009691 +904000 ekin = 3.07376219479306 | erot = 3.52931006844845 | epot = -37.659746760624 | etot = -31.0566744973825 +905000 ekin = 3.06812362454382 | erot = 3.78913234205786 | epot = -37.6633180135035 | etot = -30.8060620469019 +906000 ekin = 3.16118254583051 | erot = 3.68210315785587 | epot = -37.7114125889236 | etot = -30.8681268852372 +907000 ekin = 3.05937736690029 | erot = 3.63166351278053 | epot = -37.8094278488434 | etot = -31.1183869691625 +908000 ekin = 3.20197665753497 | erot = 3.64411333350696 | epot = -37.8953945586469 | etot = -31.049304567605 +909000 ekin = 3.13419888287821 | erot = 3.44894287146556 | epot = -37.9553359165691 | etot = -31.3721941622254 +910000 ekin = 3.20114546563037 | erot = 3.42446813676887 | epot = -38.0249179476088 | etot = -31.3993043452096 +911000 ekin = 3.18332024249094 | erot = 3.30496399638702 | epot = -38.1090485606 | etot = -31.620764321722 +912000 ekin = 3.26276595850353 | erot = 3.24471741353574 | epot = -38.2096715613879 | etot = -31.7021881893487 +913000 ekin = 3.26815619138256 | erot = 3.26266624315757 | epot = -38.3821519588595 | etot = -31.8513295243194 +914000 ekin = 3.35412635067739 | erot = 3.33562334375849 | epot = -38.6092123987843 | etot = -31.9194627043485 +915000 ekin = 3.50776663391044 | erot = 3.60910336634357 | epot = -38.8009254120373 | etot = -31.6840554117832 +916000 ekin = 3.52773139010892 | erot = 3.4674530941274 | epot = -38.9707688836107 | etot = -31.9755843993744 +917000 ekin = 3.59076210165245 | erot = 3.4117857351299 | epot = -39.0925719913729 | etot = -32.0900241545906 +918000 ekin = 3.7045685353762 | erot = 3.18226166796498 | epot = -39.1781408185662 | etot = -32.291310615225 +919000 ekin = 3.7803778042616 | erot = 3.08638967761954 | epot = -39.2569196438482 | etot = -32.3901521619671 +920000 ekin = 3.91060781137672 | erot = 3.28711158692169 | epot = -39.3298863351684 | etot = -32.13216693687 +921000 ekin = 3.94747979949415 | erot = 3.453377720589 | epot = -39.3932618134519 | etot = -31.9924042933687 +922000 ekin = 3.94814734356937 | erot = 3.67117615571543 | epot = -39.442934644951 | etot = -31.8236111456662 +923000 ekin = 3.96148195878582 | erot = 4.16418425189008 | epot = -39.4697891977422 | etot = -31.3441229870663 +924000 ekin = 3.93156231463918 | erot = 4.23364521862781 | epot = -39.4747062603531 | etot = -31.3094987270862 +925000 ekin = 3.98364691406514 | erot = 4.37102519058194 | epot = -39.455954311955 | etot = -31.1012822073079 +926000 ekin = 3.9016583484788 | erot = 4.53983917650241 | epot = -39.3838686479858 | etot = -30.9423711230046 +927000 ekin = 3.86159556963871 | erot = 4.93409467569021 | epot = -39.300982283531 | etot = -30.505292038202 +928000 ekin = 3.88113409255633 | erot = 4.54344659797527 | epot = -39.2237313850885 | etot = -30.7991506945569 +929000 ekin = 3.73601262143401 | erot = 4.54159517313976 | epot = -39.0907845737874 | etot = -30.8131767792137 +930000 ekin = 3.62890283946134 | erot = 4.23223960576951 | epot = -38.9310668930158 | etot = -31.0699244477849 +931000 ekin = 3.51130978751943 | erot = 3.75580234575066 | epot = -38.7496742883208 | etot = -31.4825621550507 +932000 ekin = 3.4360478582471 | erot = 3.85916877458121 | epot = -38.6047820584061 | etot = -31.3095654255778 +933000 ekin = 3.34945134482961 | erot = 4.10711762351075 | epot = -38.510851150919 | etot = -31.0542821825786 +934000 ekin = 3.25407370525944 | erot = 4.02198516513935 | epot = -38.4343657155247 | etot = -31.1583068451259 +935000 ekin = 3.15706754617314 | erot = 3.94213624960975 | epot = -38.3842418910869 | etot = -31.285038095304 +936000 ekin = 3.00555649828169 | erot = 4.41385590541793 | epot = -38.3669049397814 | etot = -30.9474925360818 +937000 ekin = 2.92065396617303 | erot = 4.74523400801327 | epot = -38.3453538388337 | etot = -30.6794658646474 +938000 ekin = 2.97141948473083 | erot = 4.76974809222715 | epot = -38.3344331957964 | etot = -30.5932656188384 +939000 ekin = 2.94512706992735 | erot = 4.54496818954263 | epot = -38.3244620131105 | etot = -30.8343667536406 +940000 ekin = 2.88288211336416 | erot = 4.33037795313973 | epot = -38.3226244406597 | etot = -31.1093643741558 +941000 ekin = 3.07298949733874 | erot = 4.38312166999019 | epot = -38.3472582821343 | etot = -30.8911471148054 +942000 ekin = 3.09399973822823 | erot = 4.23262521183808 | epot = -38.3627707290365 | etot = -31.0361457789702 +943000 ekin = 3.06928348074207 | erot = 4.29810120769338 | epot = -38.3654861580835 | etot = -30.998101469648 +944000 ekin = 3.05361136554805 | erot = 4.57752136432057 | epot = -38.3891229370224 | etot = -30.7579902071538 +945000 ekin = 3.10532952733951 | erot = 4.63116672909514 | epot = -38.4481824906829 | etot = -30.7116862342482 +946000 ekin = 3.22536073155712 | erot = 4.97756078019748 | epot = -38.5304457687249 | etot = -30.3275242569703 +947000 ekin = 3.22481791886517 | erot = 4.85505897631128 | epot = -38.6306947506546 | etot = -30.5508178554781 +948000 ekin = 3.31258286730503 | erot = 4.40885070504342 | epot = -38.7111926164559 | etot = -30.9897590441074 +949000 ekin = 3.26341750645552 | erot = 4.50805562556237 | epot = -38.7582101439125 | etot = -30.9867370118946 +950000 ekin = 3.38312193033102 | erot = 4.30600402576272 | epot = -38.7909813747401 | etot = -31.1018554186463 +951000 ekin = 3.45878288324884 | erot = 3.92069079490449 | epot = -38.8089483233273 | etot = -31.429474645174 +952000 ekin = 3.42224118561199 | erot = 3.67807790241712 | epot = -38.8172186174577 | etot = -31.7168995294286 +953000 ekin = 3.53558981303889 | erot = 3.54582501818219 | epot = -38.8376037887753 | etot = -31.7561889575542 +954000 ekin = 3.74081536790968 | erot = 3.65672942044178 | epot = -38.8501623721149 | etot = -31.4526175837635 +955000 ekin = 3.7110092436565 | erot = 3.89616377536048 | epot = -38.8864415175109 | etot = -31.279268498494 +956000 ekin = 3.60593207480456 | erot = 3.60411690044688 | epot = -38.9258365620746 | etot = -31.7157875868231 +957000 ekin = 3.49530434439501 | erot = 3.8241034771156 | epot = -38.9468561104726 | etot = -31.627448288962 +958000 ekin = 3.33025913134867 | erot = 4.09361696296971 | epot = -38.956606995368 | etot = -31.5327309010496 +959000 ekin = 3.2325863398297 | erot = 4.27749630513801 | epot = -38.9400855462526 | etot = -31.4300029012849 +960000 ekin = 3.31834124707632 | erot = 4.19167538415384 | epot = -38.9006120641382 | etot = -31.3905954329081 +961000 ekin = 3.23354004257456 | erot = 4.33974592386025 | epot = -38.8709462828606 | etot = -31.2976603164258 +962000 ekin = 3.27687420354399 | erot = 4.18251799625541 | epot = -38.8399997192037 | etot = -31.3806075194043 +963000 ekin = 3.18724078299274 | erot = 4.29559449615356 | epot = -38.8215635568142 | etot = -31.3387282776679 +964000 ekin = 3.16628639784324 | erot = 4.17929146419551 | epot = -38.8033314242486 | etot = -31.4577535622098 +965000 ekin = 3.23601563824504 | erot = 4.51599223822389 | epot = -38.7801591620084 | etot = -31.0281512855395 +966000 ekin = 3.35348380272829 | erot = 3.96490873951942 | epot = -38.7593006562386 | etot = -31.4409081139909 +967000 ekin = 3.47301428118912 | erot = 3.78771221675284 | epot = -38.7263415939782 | etot = -31.4656150960363 +968000 ekin = 3.51493406845154 | erot = 3.36657292776078 | epot = -38.7364041234232 | etot = -31.8548971272109 +969000 ekin = 3.55243037222546 | erot = 3.66068265314136 | epot = -38.7529284526025 | etot = -31.5398154272357 +970000 ekin = 3.63553363347268 | erot = 3.13050605621035 | epot = -38.8016144947089 | etot = -32.0355748050258 +971000 ekin = 3.62760421034414 | erot = 3.43775684259619 | epot = -38.870763787289 | etot = -31.8054027343487 +972000 ekin = 3.66143241862989 | erot = 4.04556663388647 | epot = -38.9794799026743 | etot = -31.2724808501579 +973000 ekin = 3.7246589822928 | erot = 3.97416581320673 | epot = -39.0667487302084 | etot = -31.3679239347088 +974000 ekin = 3.99953950913791 | erot = 4.13912764019193 | epot = -39.1431741069697 | etot = -31.0045069576398 +975000 ekin = 4.00465817345131 | erot = 3.99525896460893 | epot = -39.1948973492942 | etot = -31.194980211234 +976000 ekin = 4.16803719317624 | erot = 4.27607609453618 | epot = -39.2042146461381 | etot = -30.7601013584257 +977000 ekin = 4.27763535208348 | erot = 4.3578537464676 | epot = -39.1647674598218 | etot = -30.5292783612708 +978000 ekin = 4.21509832146809 | erot = 3.96978575035229 | epot = -39.0661575270878 | etot = -30.8812734552674 +979000 ekin = 4.1121993977163 | erot = 3.86340161937279 | epot = -38.9126163242263 | etot = -30.9370153071372 +980000 ekin = 4.08548639230676 | erot = 3.71918260809163 | epot = -38.7460650378699 | etot = -30.9413960374715 +981000 ekin = 4.02033461236246 | erot = 3.54042819636898 | epot = -38.597187758635 | etot = -31.0364249499036 +982000 ekin = 4.05981657544079 | erot = 3.65178477672055 | epot = -38.4729888125583 | etot = -30.761387460397 +983000 ekin = 4.15649242216497 | erot = 3.62195027480226 | epot = -38.3342599610661 | etot = -30.5558172640988 +984000 ekin = 4.15445943144041 | erot = 3.41256983843898 | epot = -38.1946691276127 | etot = -30.6276398577333 +985000 ekin = 3.8765990108719 | erot = 3.43767805044635 | epot = -38.0505436384558 | etot = -30.7362665771376 +986000 ekin = 3.85786856381243 | erot = 3.30334700587336 | epot = -37.8996934133204 | etot = -30.7384778436346 +987000 ekin = 3.87294863787324 | erot = 3.15398232754985 | epot = -37.7929706719646 | etot = -30.7660397065415 +988000 ekin = 3.93790531951922 | erot = 3.08701498108577 | epot = -37.6532967522442 | etot = -30.6283764516392 +989000 ekin = 3.83115351568816 | erot = 3.07802242316593 | epot = -37.5101193189106 | etot = -30.6009433800565 +990000 ekin = 3.81048959043177 | erot = 3.11196082795564 | epot = -37.3832609771668 | etot = -30.4608105587794 +991000 ekin = 3.71517412131507 | erot = 3.09240412040415 | epot = -37.2833659467137 | etot = -30.4757877049945 +992000 ekin = 3.63849701384077 | erot = 2.99887074192575 | epot = -37.1786754428024 | etot = -30.5413076870359 +993000 ekin = 3.63209056043319 | erot = 3.27649085900159 | epot = -37.0906927302528 | etot = -30.182111310818 +994000 ekin = 3.59828390693157 | erot = 3.83169777268287 | epot = -37.0255816353103 | etot = -29.5955999556959 +995000 ekin = 3.75927077522085 | erot = 3.45385861701398 | epot = -36.9690811728773 | etot = -29.7559517806424 +996000 ekin = 3.7162823443018 | erot = 3.37243499359149 | epot = -36.9421300931431 | etot = -29.8534127552498 +997000 ekin = 3.60416089411945 | erot = 3.31461433836006 | epot = -36.952810875641 | etot = -30.0340356431615 +998000 ekin = 3.71457183702559 | erot = 3.42780251384754 | epot = -37.0325234658195 | etot = -29.8901491149464 +999000 ekin = 3.78703773886275 | erot = 3.63993408891199 | epot = -37.154809159371 | etot = -29.7278373315963 +1000000 ekin = 3.83883486112593 | erot = 3.47192929391939 | epot = -37.2430911050886 | etot = -29.9323269500432 + 1000000 0.10236893 -1.4701186 0.037692055 -1.2847791 5.0290761e-05 64000 +Loop time of 83.1091 on 1 procs for 1000000 steps with 26 atoms + +Performance: 10395.973 tau/day, 12032.377 timesteps/s +99.8% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 74.406 | 74.406 | 74.406 | 0.0 | 89.53 +Bond | 1.6522 | 1.6522 | 1.6522 | 0.0 | 1.99 +Neigh | 0.020569 | 0.020569 | 0.020569 | 0.0 | 0.02 +Comm | 0.20204 | 0.20204 | 0.20204 | 0.0 | 0.24 +Output | 0.23125 | 0.23125 | 0.23125 | 0.0 | 0.28 +Modify | 6.3912 | 6.3912 | 6.3912 | 0.0 | 7.69 +Other | | 0.2061 | | | 0.25 + +Nlocal: 26.0000 ave 26 max 26 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 301.000 ave 301 max 301 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 301 +Ave neighs/atom = 11.576923 +Ave special neighs/atom = 5.0769231 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.8.* nocoeff +System init for write_data ... +Total wall time: 0:01:23 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 new file mode 100644 index 0000000000..d16e7b4935 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 @@ -0,0 +1,1272 @@ +LAMMPS (27 May 2021) +variable number equal 8 +variable ofreq equal 1000 +variable efreq equal 1000 + +variable ntype equal 8 + +variable T equal 0.1 +variable rhos equal 0.2 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 10 delay 0 check yes + +read_data data.duplex4.8type +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 26 atoms + reading velocities ... + 26 velocities + scanning bonds ... + 2 = max bonds/atom + 26 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 24 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +mass * 3.1575 # sets per-type mass if not in data file +set atom * mass 3.1575 # sets per-atom mass +Setting atom values ... + 26 settings made for mass + +group all type 1 8 +26 atoms in group all + +# oxDNA2 bond interactions - FENE backbone +bond_style oxdna2/fene +bond_coeff * 2.0 0.25 0.7564 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxDNA pair interactions +pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh +pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 +pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + +label loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 1%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+3 +variable comp equal 1+3 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 2%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+1 +variable comp equal 2+1 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 3%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 4%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 5%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+3 +variable comp equal 5+3 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 5 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 5 8 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 6%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +variable comp equal ${base}+1 +variable comp equal 6+1 +pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 6 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 6 7 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 7%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop +variable base loop ${ntype} +variable base loop 8 + variable basemod equal ${base}%4 + variable basemod equal 8%4 + if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" + if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" +next base +jump in.duplex4.8type loop + +pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 +pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 +pair_coeff * * oxdna2/dh ${T} ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 ${rhos} 0.815 +pair_coeff * * oxdna2/dh 0.1 0.2 0.815 + +# Langevin dynamics +fix 1 all nve/asphere +fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 ${T} 2.5 457145 angmom 10 +fix 2 all langevin 0.1 0.1 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.8.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 10 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 5.6389877 + ghost atom cutoff = 5.6389877 + binsize = 2.8194939, bins = 15 15 15 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxdna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxdna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxdna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxdna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxdna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 5.638987723814632 (../comm.cpp:739) +0 ekin = 3.74991604702378 | erot = 3.45272678980464 | epot = -37.3742009011421 | etot = -30.1715580643137 +Per MPI rank memory allocation (min/avg/max) = 9.571 | 9.572 | 9.573 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.099997761 -1.4717559 0.03428661 -1.2932417 5.6146609e-05 64000 +1000 ekin = 3.92430268570824 | erot = 3.29540971313705 | epot = -37.4816670091169 | etot = -30.2619546102716 +2000 ekin = 3.88644825046428 | erot = 3.58410925014822 | epot = -37.5871874286304 | etot = -30.1166299280179 +3000 ekin = 3.90603224055461 | erot = 3.78206057452861 | epot = -37.7021302921285 | etot = -30.0140374770453 +4000 ekin = 4.02636555552402 | erot = 3.91677901140303 | epot = -37.8027608694504 | etot = -29.8596163025233 +5000 ekin = 4.05442725401043 | erot = 4.07817807460239 | epot = -37.8494362833427 | etot = -29.7168309547299 +6000 ekin = 4.13499768127483 | erot = 4.03873475277247 | epot = -37.8257365098367 | etot = -29.6520040757894 +7000 ekin = 4.08584129662811 | erot = 3.98502892930338 | epot = -37.744776171106 | etot = -29.6739059451746 +8000 ekin = 4.04473728341539 | erot = 3.70461133282256 | epot = -37.6185211079512 | etot = -29.8691724917132 +9000 ekin = 3.97040375513034 | erot = 3.89171847539017 | epot = -37.4779912856655 | etot = -29.615869055145 +10000 ekin = 4.08064552796877 | erot = 4.10399273710613 | epot = -37.3378150214196 | etot = -29.1531767563447 +11000 ekin = 3.94505548567029 | erot = 4.14758664614567 | epot = -37.2085796341436 | etot = -29.1159375023277 +12000 ekin = 3.88687763742867 | erot = 4.11256727293728 | epot = -37.1168918341093 | etot = -29.1174469237433 +13000 ekin = 3.78376547312035 | erot = 3.94997258779545 | epot = -37.0636475805867 | etot = -29.3299095196709 +14000 ekin = 3.72114827358809 | erot = 3.83862755313067 | epot = -37.0539326083543 | etot = -29.4941567816355 +15000 ekin = 3.63885725366144 | erot = 3.37568559083325 | epot = -37.0775134892158 | etot = -30.0629706447211 +16000 ekin = 3.75926862366823 | erot = 3.47832285528771 | epot = -37.1763229835919 | etot = -29.938731504636 +17000 ekin = 3.80458992549718 | erot = 3.37818714949378 | epot = -37.3270848276044 | etot = -30.1443077526134 +18000 ekin = 3.81685915102048 | erot = 3.82235577807969 | epot = -37.4876996492705 | etot = -29.8484847201703 +19000 ekin = 3.80633274630077 | erot = 3.8039328333736 | epot = -37.6386270441084 | etot = -30.028361464434 +20000 ekin = 3.77027693322165 | erot = 3.97848447130841 | epot = -37.7861726918926 | etot = -30.0374112873625 +21000 ekin = 3.75594248876352 | erot = 3.90400523936658 | epot = -37.9165000666024 | etot = -30.2565523384723 +22000 ekin = 3.81729390633802 | erot = 3.70298358069274 | epot = -38.0211478246462 | etot = -30.5008703376154 +23000 ekin = 3.86462773298721 | erot = 3.52903064555341 | epot = -38.0539868057477 | etot = -30.6603284272071 +24000 ekin = 3.84611190496181 | erot = 3.47876891204866 | epot = -38.0524942369904 | etot = -30.7276134199799 +25000 ekin = 3.88431543220182 | erot = 3.80956733596667 | epot = -38.0090041212112 | etot = -30.3151213530427 +26000 ekin = 3.88520717073552 | erot = 4.04667753560866 | epot = -37.9336134642013 | etot = -30.0017287578571 +27000 ekin = 3.83553778749005 | erot = 4.18222306888362 | epot = -37.8633670830474 | etot = -29.8456062266737 +28000 ekin = 3.83638307293673 | erot = 4.13838046178307 | epot = -37.8079901228044 | etot = -29.8332265880846 +29000 ekin = 3.81360349447094 | erot = 4.16358811310864 | epot = -37.7885827024555 | etot = -29.8113910948759 +30000 ekin = 3.89572360919441 | erot = 4.04566996469674 | epot = -37.7874054211311 | etot = -29.84601184724 +31000 ekin = 3.89393888302718 | erot = 3.55790326104627 | epot = -37.8038131932178 | etot = -30.3519710491444 +32000 ekin = 3.80317271692918 | erot = 3.54273524643272 | epot = -37.8451815180301 | etot = -30.4992735546682 +33000 ekin = 3.78703980355191 | erot = 3.99364624500488 | epot = -37.9406281896734 | etot = -30.1599421411166 +34000 ekin = 3.77142087668807 | erot = 3.88594611308813 | epot = -38.097584352555 | etot = -30.4402173627788 +35000 ekin = 3.71264930628466 | erot = 3.65225843687418 | epot = -38.2835289304067 | etot = -30.9186211872479 +36000 ekin = 3.74220790707641 | erot = 3.95952222810293 | epot = -38.4596915935922 | etot = -30.7579614584129 +37000 ekin = 3.82423101226177 | erot = 4.44859396622365 | epot = -38.6538277887212 | etot = -30.3810028102358 +38000 ekin = 3.69455547696862 | erot = 4.82722829899228 | epot = -38.8348230288023 | etot = -30.3130392528414 +39000 ekin = 3.5954890965849 | erot = 5.03318978839678 | epot = -38.9632877762132 | etot = -30.3346088912316 +40000 ekin = 3.7239082672625 | erot = 4.77008246177599 | epot = -39.0432740898072 | etot = -30.5492833607687 +41000 ekin = 3.71845130286974 | erot = 4.66721188475359 | epot = -39.0678678855713 | etot = -30.6822046979479 +42000 ekin = 3.5469605515821 | erot = 4.50731751167304 | epot = -39.0616854007739 | etot = -31.0074073375187 +43000 ekin = 3.57495163768248 | erot = 4.94852093613523 | epot = -39.0169365666547 | etot = -30.493463992837 +44000 ekin = 3.52915394890506 | erot = 5.14481752350032 | epot = -38.9320102816114 | etot = -30.258038809206 +45000 ekin = 3.36103362047063 | erot = 5.30737062665206 | epot = -38.8074049309155 | etot = -30.1390006837928 +46000 ekin = 3.33204426677158 | erot = 4.63880623753679 | epot = -38.6602813061652 | etot = -30.6894308018569 +47000 ekin = 3.34546960167669 | erot = 4.072379763769 | epot = -38.5241501078281 | etot = -31.1063007423824 +48000 ekin = 3.40049787952112 | erot = 4.05251615432405 | epot = -38.3938498073687 | etot = -30.9408357735235 +49000 ekin = 3.31008896923648 | erot = 4.20737258711336 | epot = -38.2514760468933 | etot = -30.7340144905435 +50000 ekin = 3.27384446847297 | erot = 3.84861240213718 | epot = -38.0781706006623 | etot = -30.9557137300522 +51000 ekin = 3.28837845708164 | erot = 4.03176750511309 | epot = -37.9124524403703 | etot = -30.5923064781756 +52000 ekin = 3.3261261077424 | erot = 3.69449114481263 | epot = -37.7461543084426 | etot = -30.7255370558875 +53000 ekin = 3.24704253260756 | erot = 3.82351300738067 | epot = -37.5996085904181 | etot = -30.5290530504299 +54000 ekin = 3.28722266262306 | erot = 3.86366065026156 | epot = -37.4297798097104 | etot = -30.2788964968257 +55000 ekin = 3.24079189906262 | erot = 3.69908024112639 | epot = -37.2469422361789 | etot = -30.3070700959899 +56000 ekin = 3.183124569803 | erot = 3.47133297155146 | epot = -37.0860684089791 | etot = -30.4316108676246 +57000 ekin = 3.22541795737962 | erot = 3.05594699251087 | epot = -36.9568071104528 | etot = -30.6754421605623 +58000 ekin = 3.32107899021702 | erot = 2.99608132055983 | epot = -36.8451019319952 | etot = -30.5279416212183 +59000 ekin = 3.3775603338752 | erot = 3.02468556348897 | epot = -36.7527120143507 | etot = -30.3504661169865 +60000 ekin = 3.3783851820659 | erot = 2.80486585978131 | epot = -36.6500489307871 | etot = -30.4667978889399 +61000 ekin = 3.4259305825981 | erot = 2.57336693961335 | epot = -36.5598996921942 | etot = -30.5606021699827 +62000 ekin = 3.38330194206295 | erot = 2.48716523240079 | epot = -36.4917506706078 | etot = -30.6212834961441 +63000 ekin = 3.23944564751902 | erot = 2.68514269262901 | epot = -36.4581690118127 | etot = -30.5335806716646 +64000 ekin = 3.12857340842367 | erot = 2.81379000215884 | epot = -36.4694531808169 | etot = -30.5270897702344 +65000 ekin = 3.0972900172278 | erot = 2.97796742393482 | epot = -36.4999099304858 | etot = -30.4246524893232 +66000 ekin = 3.02532625214509 | erot = 2.98352661182224 | epot = -36.5477137384001 | etot = -30.5388608744328 +67000 ekin = 3.14798260660729 | erot = 3.20065089850768 | epot = -36.6320762786642 | etot = -30.2834427735492 +68000 ekin = 3.28121216444371 | erot = 3.27703862715896 | epot = -36.7797333797323 | etot = -30.2214825881296 +69000 ekin = 3.39109863872899 | erot = 3.49453676740748 | epot = -36.9477169900692 | etot = -30.0620815839328 +70000 ekin = 3.52145416968701 | erot = 3.19663795891378 | epot = -37.1459833247571 | etot = -30.4278911961563 +71000 ekin = 3.72588366820837 | erot = 3.11523594110614 | epot = -37.3394708863316 | etot = -30.4983512770171 +72000 ekin = 3.87053189634972 | erot = 3.51504753627359 | epot = -37.5837173340768 | etot = -30.1981379014535 +73000 ekin = 4.043534645073 | erot = 3.57819581965021 | epot = -37.8491002809696 | etot = -30.2273698162464 +74000 ekin = 4.21655599164747 | erot = 3.67972843708688 | epot = -38.0370200626724 | etot = -30.1407356339381 +75000 ekin = 4.2751803734558 | erot = 3.50148075250732 | epot = -38.1503543696657 | etot = -30.3736932437026 +76000 ekin = 4.39260378383777 | erot = 3.17711135808546 | epot = -38.2269779234848 | etot = -30.6572627815615 +77000 ekin = 4.46694156592454 | erot = 3.28356630286401 | epot = -38.2567512319265 | etot = -30.506243363138 +78000 ekin = 4.58031785764229 | erot = 3.27581240698066 | epot = -38.2501645622451 | etot = -30.3940342976221 +79000 ekin = 4.74132912230535 | erot = 3.40062659497661 | epot = -38.2259226034585 | etot = -30.0839668861766 +80000 ekin = 4.84478519554072 | erot = 3.56980153308286 | epot = -38.14766861013 | etot = -29.7330818815064 +81000 ekin = 4.71163727717015 | erot = 3.65201658810459 | epot = -38.0489180007765 | etot = -29.6852641355017 +82000 ekin = 4.62310894573492 | erot = 3.61128178949357 | epot = -37.9515873690417 | etot = -29.7171966338132 +83000 ekin = 4.53890753637813 | erot = 3.79707688079936 | epot = -37.8589639327863 | etot = -29.5229795156088 +84000 ekin = 4.51952558800272 | erot = 3.75897913437636 | epot = -37.8043394039473 | etot = -29.5258346815682 +85000 ekin = 4.44986224636044 | erot = 4.10169839029415 | epot = -37.7952059629819 | etot = -29.2436453263273 +86000 ekin = 4.40335859262171 | erot = 4.18303158637893 | epot = -37.840594671262 | etot = -29.2542044922614 +87000 ekin = 4.34352629789854 | erot = 4.00093225674539 | epot = -37.8981775676818 | etot = -29.5537190130379 +88000 ekin = 4.39692532206221 | erot = 3.88765396717304 | epot = -37.9120170018269 | etot = -29.6274377125917 +89000 ekin = 4.3589540780767 | erot = 4.0687705270632 | epot = -37.8812041939536 | etot = -29.4534795888137 +90000 ekin = 4.20715511673659 | erot = 3.96880041117212 | epot = -37.8268382933969 | etot = -29.6508827654882 +91000 ekin = 4.2202199323169 | erot = 4.12841045745315 | epot = -37.7475084891388 | etot = -29.3988780993687 +92000 ekin = 4.1326498688273 | erot = 3.86635436032376 | epot = -37.6428932571545 | etot = -29.6438890280035 +93000 ekin = 4.05697056146658 | erot = 3.48249980793546 | epot = -37.5034004108467 | etot = -29.9639300414447 +94000 ekin = 3.85560920909744 | erot = 3.51617278195642 | epot = -37.371684822218 | etot = -29.9999028311642 +95000 ekin = 3.7069616782419 | erot = 3.7453999268692 | epot = -37.2425364302767 | etot = -29.7901748251656 +96000 ekin = 3.64541489153227 | erot = 3.55177042583784 | epot = -37.1071295289257 | etot = -29.9099442115556 +97000 ekin = 3.59427366044239 | erot = 3.58237376190961 | epot = -36.9903312497973 | etot = -29.8136838274453 +98000 ekin = 3.36609732779817 | erot = 3.78920076230078 | epot = -36.8893462899042 | etot = -29.7340481998052 +99000 ekin = 3.24308716626432 | erot = 3.98439513504784 | epot = -36.7958275145326 | etot = -29.5683452132204 +100000 ekin = 3.10105716620438 | erot = 3.88380514198999 | epot = -36.7237148853879 | etot = -29.7388525771935 +101000 ekin = 3.05392814208233 | erot = 3.92712981026601 | epot = -36.701962452506 | etot = -29.7209045001576 +102000 ekin = 3.21793305977178 | erot = 4.11601242104532 | epot = -36.7682713932638 | etot = -29.4343259124467 +103000 ekin = 3.29518049820435 | erot = 4.13622147772539 | epot = -36.8839850328129 | etot = -29.4525830568832 +104000 ekin = 3.38349143563889 | erot = 4.1183455666037 | epot = -37.0170458924454 | etot = -29.5152088902028 +105000 ekin = 3.43063719220638 | erot = 4.19281995644327 | epot = -37.150125503217 | etot = -29.5266683545673 +106000 ekin = 3.3930587869785 | erot = 4.59139499879992 | epot = -37.2962927182996 | etot = -29.3118389325211 +107000 ekin = 3.49611625167344 | erot = 4.42190170056941 | epot = -37.4298253792172 | etot = -29.5118074269743 +108000 ekin = 3.59165643487494 | erot = 4.73333858652918 | epot = -37.482137044902 | etot = -29.1571420234978 +109000 ekin = 3.59878557010229 | erot = 5.08720641062802 | epot = -37.4454225962908 | etot = -28.7594306155605 +110000 ekin = 3.52607850054465 | erot = 4.92743402067557 | epot = -37.33464551381 | etot = -28.8811329925897 +111000 ekin = 3.52196404281882 | erot = 4.48970120472559 | epot = -37.2166378630308 | etot = -29.2049726154863 +112000 ekin = 3.64094551226758 | erot = 4.18578082474331 | epot = -37.1356107687899 | etot = -29.3088844317791 +113000 ekin = 3.59908785035488 | erot = 3.81929848767613 | epot = -37.1563156196511 | etot = -29.7379292816201 +114000 ekin = 3.73247165614552 | erot = 3.7191219132616 | epot = -37.1841072802386 | etot = -29.7325137108315 +115000 ekin = 3.81386546938849 | erot = 3.49889872890822 | epot = -37.2616543115737 | etot = -29.948890113277 +116000 ekin = 4.05829999340919 | erot = 3.58390665501405 | epot = -37.4003005682591 | etot = -29.7580939198359 +117000 ekin = 4.27550110925089 | erot = 3.79076820440125 | epot = -37.5923004712666 | etot = -29.5260311576145 +118000 ekin = 4.45490103530269 | erot = 3.77915185795812 | epot = -37.7846946186124 | etot = -29.5506417253515 +119000 ekin = 4.58790399115696 | erot = 3.86870152715706 | epot = -37.9811558924431 | etot = -29.5245503741291 +120000 ekin = 4.92259141545412 | erot = 3.84940365834982 | epot = -38.1382043293411 | etot = -29.3662092555371 +121000 ekin = 5.13183269148667 | erot = 4.03705087488496 | epot = -38.2560800244005 | etot = -29.0871964580288 +122000 ekin = 5.17140868558226 | erot = 3.61810962674133 | epot = -38.3381390234359 | etot = -29.5486207111123 +123000 ekin = 5.28384467069957 | erot = 4.14897954513993 | epot = -38.3803925391061 | etot = -28.9475683232666 +124000 ekin = 5.45144965935832 | erot = 3.74948516195925 | epot = -38.4152715166921 | etot = -29.2143366953745 +125000 ekin = 5.49907232704504 | erot = 3.62957174075197 | epot = -38.4698081948487 | etot = -29.3411641270517 +126000 ekin = 5.81275552922944 | erot = 3.50370762045612 | epot = -38.5369283444346 | etot = -29.2204651947491 +127000 ekin = 5.71810535961462 | erot = 3.50153411217264 | epot = -38.6097648991183 | etot = -29.390125427331 +128000 ekin = 5.59769610955185 | erot = 2.99726680348478 | epot = -38.6545287261786 | etot = -30.059565813142 +129000 ekin = 5.51657182067137 | erot = 3.37515224045319 | epot = -38.6909141535699 | etot = -29.7991900924454 +130000 ekin = 5.46626997343554 | erot = 3.77525421867741 | epot = -38.7059148210791 | etot = -29.4643906289662 +131000 ekin = 5.369877414402 | erot = 3.92459463488634 | epot = -38.6781199948582 | etot = -29.3836479455698 +132000 ekin = 5.13704854270014 | erot = 3.89365302265538 | epot = -38.6113331110915 | etot = -29.580631545736 +133000 ekin = 5.04851208372184 | erot = 4.17613618410306 | epot = -38.4969113589734 | etot = -29.2722630911485 +134000 ekin = 4.96335667475941 | erot = 4.28428652813741 | epot = -38.308416110038 | etot = -29.0607729071412 +135000 ekin = 4.67485522816795 | erot = 3.71485446937039 | epot = -38.0437601659662 | etot = -29.6540504684278 +136000 ekin = 4.4890629916043 | erot = 4.19015103736215 | epot = -37.7533241067258 | etot = -29.0741100777593 +137000 ekin = 4.31371561077616 | erot = 3.47925724303299 | epot = -37.4739407743081 | etot = -29.6809679204989 +138000 ekin = 3.96696543473023 | erot = 3.71675428283175 | epot = -37.2042587721437 | etot = -29.5205390545817 +139000 ekin = 3.59101315513219 | erot = 3.64278698721068 | epot = -36.9457852108051 | etot = -29.7119850684622 +140000 ekin = 3.44095423425017 | erot = 3.49830537198652 | epot = -36.7203613080872 | etot = -29.7811017018505 +141000 ekin = 3.36296546737369 | erot = 3.56983741924066 | epot = -36.4964767451357 | etot = -29.5636738585213 +142000 ekin = 3.18252441669259 | erot = 3.32935464682758 | epot = -36.3244758925308 | etot = -29.8125968290106 +143000 ekin = 3.18465930443846 | erot = 3.56170045589814 | epot = -36.2215210957505 | etot = -29.4751613354139 +144000 ekin = 3.08106725409747 | erot = 3.50261030291633 | epot = -36.1512447258049 | etot = -29.5675671687911 +145000 ekin = 3.08093776365794 | erot = 3.51948185643724 | epot = -36.0863085456317 | etot = -29.4858889255365 +146000 ekin = 3.02030159479387 | erot = 3.3739730546246 | epot = -36.0845314152703 | etot = -29.6902567658518 +147000 ekin = 3.0413907298566 | erot = 3.36603954258596 | epot = -36.1557232229402 | etot = -29.7482929504977 +148000 ekin = 3.14853067203595 | erot = 3.14562859809704 | epot = -36.2494960139439 | etot = -29.9553367438109 +149000 ekin = 3.18195150813314 | erot = 3.58071760906443 | epot = -36.3477640598882 | etot = -29.5850949426907 +150000 ekin = 3.21133048800031 | erot = 3.85389957660328 | epot = -36.4132627454733 | etot = -29.3480326808697 +151000 ekin = 3.3414410423208 | erot = 3.49391537632178 | epot = -36.47829445309 | etot = -29.6429380344474 +152000 ekin = 3.38469121090166 | erot = 3.35926284582918 | epot = -36.5578474424856 | etot = -29.8138933857547 +153000 ekin = 3.52527639525701 | erot = 3.56811727016358 | epot = -36.6674257186129 | etot = -29.5740320531923 +154000 ekin = 3.77924799771095 | erot = 3.5214579525681 | epot = -36.7622601921048 | etot = -29.4615542418258 +155000 ekin = 3.83418008764662 | erot = 3.28305394597573 | epot = -36.8282659682374 | etot = -29.7110319346151 +156000 ekin = 3.87517167307552 | erot = 2.7562101543893 | epot = -36.8507311290664 | etot = -30.2193493016016 +157000 ekin = 3.89846784481937 | erot = 3.03513966490494 | epot = -36.8490467787069 | etot = -29.9154392689826 +158000 ekin = 3.86372390524165 | erot = 3.0673314083842 | epot = -36.8143502444316 | etot = -29.8832949308058 +159000 ekin = 3.87560822586875 | erot = 2.72238394226955 | epot = -36.7720066653759 | etot = -30.1740144972376 +160000 ekin = 3.81659540649487 | erot = 2.79162883042019 | epot = -36.745609213871 | etot = -30.137384976956 +161000 ekin = 3.90364665450438 | erot = 2.85891130626961 | epot = -36.6767188031099 | etot = -29.9141608423359 +162000 ekin = 3.93432840871727 | erot = 3.23277686088047 | epot = -36.60685028113 | etot = -29.4397450115322 +163000 ekin = 3.97425577903338 | erot = 2.70754263327096 | epot = -36.5720643915924 | etot = -29.890265979288 +164000 ekin = 3.91949827572788 | erot = 3.05668804181471 | epot = -36.5812838593575 | etot = -29.6050975418149 +165000 ekin = 3.99425179561608 | erot = 3.29785069907607 | epot = -36.6379374004751 | etot = -29.345834905783 +166000 ekin = 4.02904533815474 | erot = 3.36634066781855 | epot = -36.7340868254029 | etot = -29.3387008194296 +167000 ekin = 4.03733260336922 | erot = 3.51733984448521 | epot = -36.8476519248263 | etot = -29.2929794769719 +168000 ekin = 4.01641387278262 | erot = 3.37538682559192 | epot = -36.9710980220148 | etot = -29.5792973236403 +169000 ekin = 3.94799788749928 | erot = 3.38842418926867 | epot = -37.1207420196424 | etot = -29.7843199428744 +170000 ekin = 3.98944239104452 | erot = 3.56779767670648 | epot = -37.2922600249326 | etot = -29.7350199571816 +171000 ekin = 4.04980262307219 | erot = 3.87308310464248 | epot = -37.4956434312003 | etot = -29.5727577034856 +172000 ekin = 4.10498686244998 | erot = 4.24595756362569 | epot = -37.6879527015205 | etot = -29.3370082754448 +173000 ekin = 4.12919710204796 | erot = 4.28575123018842 | epot = -37.8940672883479 | etot = -29.4791189561115 +174000 ekin = 4.04607401980617 | erot = 4.41784593637473 | epot = -38.1063274639924 | etot = -29.6424075078115 +175000 ekin = 4.13007220306847 | erot = 4.39679134693123 | epot = -38.3139522350302 | etot = -29.7870886850305 +176000 ekin = 4.14146369640392 | erot = 4.2556500250018 | epot = -38.5085743578719 | etot = -30.1114606364662 +177000 ekin = 4.33605278083781 | erot = 4.58687123058824 | epot = -38.6633454116433 | etot = -29.7404214002173 +178000 ekin = 4.32688916484258 | erot = 4.50454813785642 | epot = -38.7700089206445 | etot = -29.9385716179455 +179000 ekin = 4.39331384776139 | erot = 4.88121292734146 | epot = -38.8147888868654 | etot = -29.5402621117625 +180000 ekin = 4.36409495919737 | erot = 4.62653667682629 | epot = -38.7920356589672 | etot = -29.8014040229435 +181000 ekin = 4.40002739116585 | erot = 4.26572305349584 | epot = -38.7320900980018 | etot = -30.0663396533401 +182000 ekin = 4.38584471768771 | erot = 4.03958660380969 | epot = -38.6652721860916 | etot = -30.2398408645942 +183000 ekin = 4.38872118980224 | erot = 4.03920994265183 | epot = -38.5494953603397 | etot = -30.1215642278857 +184000 ekin = 4.58261674670921 | erot = 4.09854761999454 | epot = -38.3858248419668 | etot = -29.7046604752631 +185000 ekin = 4.61324410405521 | erot = 4.15998485211173 | epot = -38.1895073749226 | etot = -29.4162784187557 +186000 ekin = 4.58712030480558 | erot = 3.80292929559519 | epot = -37.9691363595879 | etot = -29.5790867591871 +187000 ekin = 4.49704057160045 | erot = 3.79953063209059 | epot = -37.7563677349904 | etot = -29.4597965312994 +188000 ekin = 4.67801335458777 | erot = 3.94614018085653 | epot = -37.5596730791519 | etot = -28.9355195437076 +189000 ekin = 4.7263502885126 | erot = 3.9798634268042 | epot = -37.3737961852728 | etot = -28.667582469956 +190000 ekin = 4.70422886783179 | erot = 3.76567525080944 | epot = -37.1968328742627 | etot = -28.7269287556214 +191000 ekin = 4.76615905270464 | erot = 4.11771710042017 | epot = -37.0524866708235 | etot = -28.1686105176987 +192000 ekin = 4.66334615993974 | erot = 4.32180108624847 | epot = -36.9281089002544 | etot = -27.9429616540662 +193000 ekin = 4.5422727261274 | erot = 4.37403333624765 | epot = -36.8106507982273 | etot = -27.8943447358523 +194000 ekin = 4.46258388626876 | erot = 4.57094153868298 | epot = -36.7126835627949 | etot = -27.6791581378432 +195000 ekin = 4.26009039309735 | erot = 5.10893274622639 | epot = -36.6717506302945 | etot = -27.3027274909708 +196000 ekin = 4.24016895096483 | erot = 4.95101320260763 | epot = -36.6607739952161 | etot = -27.4695918416436 +197000 ekin = 4.0755550793312 | erot = 5.33731157611758 | epot = -36.6886082622524 | etot = -27.2757416068037 +198000 ekin = 3.9809171395143 | erot = 5.37374733968369 | epot = -36.7238260637154 | etot = -27.3691615845174 +199000 ekin = 4.00067330792124 | erot = 5.3603518042305 | epot = -36.764372481588 | etot = -27.4033473694362 +200000 ekin = 3.91652525768025 | erot = 4.88675678602841 | epot = -36.7730308398536 | etot = -27.969748796145 +201000 ekin = 3.81609915882248 | erot = 4.31400854830177 | epot = -36.7481890160659 | etot = -28.6180813089416 +202000 ekin = 3.71932569397631 | erot = 4.38569878861448 | epot = -36.6956778034213 | etot = -28.5906533208305 +203000 ekin = 3.64290623072102 | erot = 4.37503789459276 | epot = -36.6304609598591 | etot = -28.6125168345453 +204000 ekin = 3.52854777039998 | erot = 4.29732321046279 | epot = -36.5744389849194 | etot = -28.7485680040566 +205000 ekin = 3.4768831982614 | erot = 4.0520539676819 | epot = -36.5314565547125 | etot = -29.0025193887692 +206000 ekin = 3.57867350058535 | erot = 4.28681914674893 | epot = -36.5152410045854 | etot = -28.6497483572511 +207000 ekin = 3.67789472949151 | erot = 4.07649115773262 | epot = -36.4807964879222 | etot = -28.7264106006981 +208000 ekin = 3.75162300302661 | erot = 3.99412890438543 | epot = -36.4719013777701 | etot = -28.7261494703581 +209000 ekin = 3.82882555477005 | erot = 4.07806686544371 | epot = -36.5274965379161 | etot = -28.6206041177023 +210000 ekin = 3.94589957381378 | erot = 4.05524037388615 | epot = -36.6356567037895 | etot = -28.6345167560895 +211000 ekin = 4.07654365300279 | erot = 3.99406586158679 | epot = -36.7715123193752 | etot = -28.7009028047856 +212000 ekin = 4.2840931333187 | erot = 4.41351434873049 | epot = -36.9240266223073 | etot = -28.2264191402581 +213000 ekin = 4.49200123946036 | erot = 4.57752549048046 | epot = -37.0744914076603 | etot = -28.0049646777194 +214000 ekin = 4.68170470060604 | erot = 4.83486386570169 | epot = -37.2372407583261 | etot = -27.7206721920184 +215000 ekin = 4.98081379617958 | erot = 4.46606343482534 | epot = -37.4068324828889 | etot = -27.959955251884 +216000 ekin = 5.16729766417706 | erot = 4.60318830168444 | epot = -37.5464555705166 | etot = -27.7759696046551 +217000 ekin = 5.38386929678608 | erot = 4.7775249437354 | epot = -37.6405601527452 | etot = -27.4791659122238 +218000 ekin = 5.7058164504659 | erot = 4.70370884810713 | epot = -37.6984019699825 | etot = -27.2888766714095 +219000 ekin = 5.88600523163654 | erot = 4.58694924042796 | epot = -37.7125786046508 | etot = -27.2396241325863 +220000 ekin = 6.15427965489048 | erot = 4.4293131697244 | epot = -37.684602076139 | etot = -27.1010092515241 +221000 ekin = 6.20955938016028 | erot = 4.5400172518757 | epot = -37.6213945439902 | etot = -26.8718179119542 +222000 ekin = 6.245684726226 | erot = 4.97311797105747 | epot = -37.5132484834202 | etot = -26.2944457861367 +223000 ekin = 6.23087495739563 | erot = 4.87026240860726 | epot = -37.4093126450279 | etot = -26.308175279025 +224000 ekin = 6.34215727178204 | erot = 4.95416073100327 | epot = -37.3138628835634 | etot = -26.0175448807781 +225000 ekin = 6.34418551658382 | erot = 4.97197547495996 | epot = -37.2296241301022 | etot = -25.9134631385584 +226000 ekin = 6.27234146176852 | erot = 4.71232076169797 | epot = -37.1649091144301 | etot = -26.1802468909636 +227000 ekin = 6.2978205054749 | erot = 4.6427999636898 | epot = -37.1521034204924 | etot = -26.2114829513277 +228000 ekin = 6.45215375342435 | erot = 4.66543105642573 | epot = -37.1176036705896 | etot = -26.0000188607395 +229000 ekin = 6.57609932445515 | erot = 4.31104294387344 | epot = -37.0319087568372 | etot = -26.1447664885086 +230000 ekin = 6.39415967649336 | erot = 4.16613500609569 | epot = -36.9020701489008 | etot = -26.3417754663118 +231000 ekin = 6.06981997767599 | erot = 4.16164382029996 | epot = -36.7672531588273 | etot = -26.5357893608513 +232000 ekin = 6.07851417086657 | erot = 3.9261416963498 | epot = -36.6287349588698 | etot = -26.6240790916534 +233000 ekin = 5.86578448983439 | erot = 3.89415959164456 | epot = -36.4650343354141 | etot = -26.7050902539352 +234000 ekin = 5.66525736866315 | erot = 3.89419060194094 | epot = -36.3317105619271 | etot = -26.772262591323 +235000 ekin = 5.45947253618461 | erot = 3.51915643493529 | epot = -36.187740376365 | etot = -27.2091114052451 +236000 ekin = 5.23839596197821 | erot = 3.35080370425694 | epot = -36.0601413821494 | etot = -27.4709417159143 +237000 ekin = 5.1101503869311 | erot = 3.41418634041018 | epot = -35.9797234474537 | etot = -27.4553867201124 +238000 ekin = 5.07705507560338 | erot = 3.55422258848856 | epot = -35.9558941013151 | etot = -27.3246164372232 +239000 ekin = 5.11036683512679 | erot = 3.60903830571299 | epot = -35.9686036709473 | etot = -27.2491985301075 +240000 ekin = 5.05273101840571 | erot = 3.85355249273444 | epot = -36.0380166955235 | etot = -27.1317331843833 +241000 ekin = 5.09369536459432 | erot = 3.64338000437258 | epot = -36.1343234897528 | etot = -27.3972481207859 +242000 ekin = 5.26488817621371 | erot = 4.01055195692819 | epot = -36.2412063129132 | etot = -26.9657661797713 +243000 ekin = 5.23195261673081 | erot = 4.46546566729792 | epot = -36.3456054296423 | etot = -26.6481871456136 +244000 ekin = 5.2263873943456 | erot = 4.31088904489877 | epot = -36.4415840114132 | etot = -26.9043075721688 +245000 ekin = 5.4485313703965 | erot = 4.1760797727831 | epot = -36.5182986507186 | etot = -26.893687507539 +246000 ekin = 5.514569703999 | erot = 3.74595442038546 | epot = -36.5760003166759 | etot = -27.3154761922915 +247000 ekin = 5.60809096900033 | erot = 4.1530771765417 | epot = -36.6102851986095 | etot = -26.8491170530675 +248000 ekin = 5.44607700345191 | erot = 4.00137483235474 | epot = -36.6173189081378 | etot = -27.1698670723311 +249000 ekin = 5.39824066997525 | erot = 4.00527284085329 | epot = -36.6178595818605 | etot = -27.214346071032 +250000 ekin = 5.40591864200742 | erot = 3.83152692098416 | epot = -36.5913298844141 | etot = -27.3538843214225 +251000 ekin = 5.42515843147862 | erot = 3.74120297831913 | epot = -36.5372880481642 | etot = -27.3709266383664 +252000 ekin = 5.47125756589202 | erot = 3.93923600749381 | epot = -36.471810314552 | etot = -27.0613167411661 +253000 ekin = 5.45280164405867 | erot = 4.07788577485892 | epot = -36.3971958399348 | etot = -26.8665084210172 +254000 ekin = 5.3513601049315 | erot = 4.05065697891602 | epot = -36.3208515747322 | etot = -26.9188344908847 +255000 ekin = 5.26929844479146 | erot = 3.99546469631083 | epot = -36.2503502909161 | etot = -26.9855871498138 +256000 ekin = 5.28023678974977 | erot = 4.22040986008186 | epot = -36.1946445254543 | etot = -26.6939978756227 +257000 ekin = 5.06048081748216 | erot = 4.23177072888008 | epot = -36.1310700373968 | etot = -26.8388184910345 +258000 ekin = 5.04266904507247 | erot = 4.32321520328045 | epot = -36.0647093578741 | etot = -26.6988251095212 +259000 ekin = 4.83091830266297 | erot = 4.34656742782648 | epot = -36.0089991272053 | etot = -26.8315133967159 +260000 ekin = 4.8366999116753 | erot = 4.25709648660373 | epot = -35.9697036974581 | etot = -26.8759072991791 +261000 ekin = 4.77396719262911 | erot = 4.09292214976309 | epot = -35.9054139064698 | etot = -27.0385245640776 +262000 ekin = 4.66601270858316 | erot = 3.73102576614686 | epot = -35.8157479345083 | etot = -27.4187094597782 +263000 ekin = 4.5802706196014 | erot = 3.74679758350907 | epot = -35.763125473781 | etot = -27.4360572706705 +264000 ekin = 4.65921569864806 | erot = 3.90501973344001 | epot = -35.7356757776833 | etot = -27.1714403455952 +265000 ekin = 4.67586149937246 | erot = 3.94654925905539 | epot = -35.7049387943745 | etot = -27.0825280359466 +266000 ekin = 4.69584694538507 | erot = 3.98055672084537 | epot = -35.6673176149256 | etot = -26.9909139486952 +267000 ekin = 4.78499421532903 | erot = 4.03648169158355 | epot = -35.6392507408887 | etot = -26.8177748339762 +268000 ekin = 4.84316914009027 | erot = 3.99860778002458 | epot = -35.6448334716846 | etot = -26.8030565515698 +269000 ekin = 4.90837806472302 | erot = 4.04652570535924 | epot = -35.649642070165 | etot = -26.6947383000828 +270000 ekin = 4.78579400655265 | erot = 4.34179455226949 | epot = -35.6115561484003 | etot = -26.4839675895782 +271000 ekin = 4.85153732395756 | erot = 3.76641259729531 | epot = -35.6137753066569 | etot = -26.9958253854041 +272000 ekin = 4.97803664593748 | erot = 4.19853764559909 | epot = -35.6642256780782 | etot = -26.4876513865416 +273000 ekin = 4.99431287425834 | erot = 4.16775756950281 | epot = -35.7125500141222 | etot = -26.550479570361 +274000 ekin = 5.02755533075287 | erot = 4.06015777810463 | epot = -35.7335253506929 | etot = -26.6458122418354 +275000 ekin = 4.96372481963251 | erot = 4.27522667590908 | epot = -35.7375976828855 | etot = -26.4986461873439 +276000 ekin = 5.07934127118672 | erot = 4.03884457577096 | epot = -35.7684807851678 | etot = -26.6502949382101 +277000 ekin = 5.11065676525152 | erot = 3.89593355388432 | epot = -35.8299825238661 | etot = -26.8233922047303 +278000 ekin = 5.1443449346496 | erot = 4.10431801630134 | epot = -35.9156424264972 | etot = -26.6669794755462 +279000 ekin = 5.13854043459778 | erot = 3.33687958464079 | epot = -35.956728093981 | etot = -27.4813080747424 +280000 ekin = 5.13698711985589 | erot = 3.1321095347808 | epot = -35.9663254349012 | etot = -27.6972287802645 +281000 ekin = 5.12014323326413 | erot = 3.01072130069925 | epot = -35.9687821467587 | etot = -27.8379176127953 +282000 ekin = 5.07487298196239 | erot = 2.78222371236679 | epot = -35.9666224009215 | etot = -28.1095257065923 +283000 ekin = 4.93728532174466 | erot = 2.51682526487924 | epot = -36.0092096947436 | etot = -28.5550991081197 +284000 ekin = 5.10799487537405 | erot = 2.3440616424374 | epot = -36.0766867016227 | etot = -28.6246301838113 +285000 ekin = 5.21438921803052 | erot = 2.42355410917329 | epot = -36.1686025783616 | etot = -28.5306592511578 +286000 ekin = 5.22674428893651 | erot = 2.43127546535983 | epot = -36.2811716154221 | etot = -28.6231518611258 +287000 ekin = 5.42842235635998 | erot = 2.80110266939557 | epot = -36.3926299688273 | etot = -28.1631049430717 +288000 ekin = 5.53841609379908 | erot = 3.04198571498586 | epot = -36.5118610231699 | etot = -27.9314592143849 +289000 ekin = 5.34670403011154 | erot = 3.09938875481729 | epot = -36.6304827875401 | etot = -28.1843900026112 +290000 ekin = 5.34231674745526 | erot = 3.31160144161424 | epot = -36.7456392368764 | etot = -28.0917210478069 +291000 ekin = 5.36188526202275 | erot = 3.45917476353447 | epot = -36.830253723617 | etot = -28.0091936980598 +292000 ekin = 5.47780509141236 | erot = 3.77906726321862 | epot = -36.8842491471661 | etot = -27.6273767925352 +293000 ekin = 5.28302000096918 | erot = 3.57818629599089 | epot = -36.8949841799428 | etot = -28.0337778829827 +294000 ekin = 5.30853543438887 | erot = 3.56263204697633 | epot = -36.882573669786 | etot = -28.0114061884208 +295000 ekin = 5.20536069491219 | erot = 3.77206495855704 | epot = -36.8703913967999 | etot = -27.8929657433306 +296000 ekin = 5.16948391824644 | erot = 3.64242202500146 | epot = -36.8524591521913 | etot = -28.0405532089434 +297000 ekin = 5.1494869829345 | erot = 3.56300071318446 | epot = -36.8077681088429 | etot = -28.0952804127239 +298000 ekin = 5.07831718808035 | erot = 3.56647326916626 | epot = -36.744195155603 | etot = -28.0994046983564 +299000 ekin = 5.07638833142117 | erot = 3.33911289208767 | epot = -36.7050879472256 | etot = -28.2895867237168 +300000 ekin = 5.03413727775456 | erot = 3.74853034027389 | epot = -36.6636621891816 | etot = -27.8809945711531 +301000 ekin = 4.97235848835814 | erot = 3.32835758650091 | epot = -36.6711630757892 | etot = -28.3704470009301 +302000 ekin = 5.00968958710056 | erot = 3.04854259478488 | epot = -36.7093256921451 | etot = -28.6510935102597 +303000 ekin = 5.1292911047111 | erot = 3.0802372254873 | epot = -36.795184172806 | etot = -28.5856558426076 +304000 ekin = 5.16690416140478 | erot = 3.34049274709003 | epot = -36.9126194047394 | etot = -28.4052224962446 +305000 ekin = 5.23349789631498 | erot = 3.46551744359711 | epot = -37.0448370009157 | etot = -28.3458216610036 +306000 ekin = 5.28860974527375 | erot = 3.56105103024499 | epot = -37.1811985422458 | etot = -28.331537766727 +307000 ekin = 5.40125295123197 | erot = 3.87520415097952 | epot = -37.305532344159 | etot = -28.0290752419475 +308000 ekin = 5.46740727789042 | erot = 3.91865002312578 | epot = -37.3892778155261 | etot = -28.0032205145099 +309000 ekin = 5.43990046762827 | erot = 4.00265425349897 | epot = -37.4336308324244 | etot = -27.9910761112972 +310000 ekin = 5.38744019614258 | erot = 3.91760045067575 | epot = -37.4766997166651 | etot = -28.1716590698468 +311000 ekin = 5.54869794564892 | erot = 3.97913763348738 | epot = -37.5380640420292 | etot = -28.0102284628929 +312000 ekin = 5.71519006739901 | erot = 4.09263126769853 | epot = -37.5745318459447 | etot = -27.7667105108472 +313000 ekin = 5.6033160766113 | erot = 3.83543196463871 | epot = -37.6101139619699 | etot = -28.1713659207199 +314000 ekin = 5.51800417081449 | erot = 3.7494474523441 | epot = -37.6279066647947 | etot = -28.3604550416361 +315000 ekin = 5.47833005901023 | erot = 4.08581993263846 | epot = -37.640612435341 | etot = -28.0764624436923 +316000 ekin = 5.33860837296314 | erot = 4.51116644302074 | epot = -37.6217312448188 | etot = -27.7719564288349 +317000 ekin = 5.23941916557637 | erot = 4.78689518832666 | epot = -37.5731600528526 | etot = -27.5468456989496 +318000 ekin = 5.11187775633096 | erot = 4.82958812680045 | epot = -37.5155006216097 | etot = -27.5740347384783 +319000 ekin = 5.22954347525673 | erot = 4.49457407004902 | epot = -37.4371163833057 | etot = -27.7129988379999 +320000 ekin = 5.30878948863381 | erot = 4.92186054084637 | epot = -37.3586788029377 | etot = -27.1280287734575 +321000 ekin = 5.25051542685381 | erot = 4.81963950413314 | epot = -37.312294527991 | etot = -27.242139597004 +322000 ekin = 5.07574443571145 | erot = 4.74007360204254 | epot = -37.2420599117425 | etot = -27.4262418739885 +323000 ekin = 5.02653253509398 | erot = 4.66604787555051 | epot = -37.1620424354781 | etot = -27.4694620248336 +324000 ekin = 5.12999279273078 | erot = 4.55456244400836 | epot = -37.1081993843437 | etot = -27.4236441476046 +325000 ekin = 5.01484863365284 | erot = 5.03270116093522 | epot = -37.0549970668846 | etot = -27.0074472722965 +326000 ekin = 5.15105125743379 | erot = 4.77726330645663 | epot = -37.0062804471441 | etot = -27.0779658832536 +327000 ekin = 5.17373663939365 | erot = 4.75720955177068 | epot = -36.9735735310227 | etot = -27.0426273398583 +328000 ekin = 5.3265809986393 | erot = 4.45847251670642 | epot = -36.9463177254327 | etot = -27.161264210087 +329000 ekin = 5.28491385975242 | erot = 4.2365002087062 | epot = -36.9151642788529 | etot = -27.3937502103943 +330000 ekin = 5.12552135481241 | erot = 4.79027984581669 | epot = -36.8863179466156 | etot = -26.9705167459865 +331000 ekin = 5.12103290586646 | erot = 5.03778117543897 | epot = -36.8413630474537 | etot = -26.6825489661482 +332000 ekin = 5.06929714597599 | erot = 4.90820597157558 | epot = -36.7488012231943 | etot = -26.7712981056427 +333000 ekin = 4.96505468499544 | erot = 5.01335794632771 | epot = -36.6271163009906 | etot = -26.6487036696675 +334000 ekin = 4.99343125906637 | erot = 5.01439694959174 | epot = -36.5036049758879 | etot = -26.4957767672298 +335000 ekin = 4.90069371729849 | erot = 4.54385275511644 | epot = -36.377759964637 | etot = -26.9332134922221 +336000 ekin = 5.07863725672843 | erot = 4.69305135725114 | epot = -36.2629152842743 | etot = -26.4912266702948 +337000 ekin = 4.94799955754099 | erot = 4.52583833193054 | epot = -36.1612360033446 | etot = -26.6873981138731 +338000 ekin = 4.85224868200247 | erot = 4.50041298245536 | epot = -36.0752991866368 | etot = -26.7226375221789 +339000 ekin = 4.72144640536392 | erot = 4.54752039051201 | epot = -35.9970632546959 | etot = -26.7280964588199 +340000 ekin = 4.80943098922142 | erot = 4.34708343509477 | epot = -35.9687361528339 | etot = -26.8122217285177 +341000 ekin = 4.70361214653912 | erot = 4.47793300498467 | epot = -35.9999322617892 | etot = -26.8183871102654 +342000 ekin = 4.760647614817 | erot = 4.66605256976235 | epot = -36.043378412271 | etot = -26.6166782276917 +343000 ekin = 4.67728032528815 | erot = 4.66100839176406 | epot = -35.9211632159817 | etot = -26.5828744989295 +344000 ekin = 4.96339724601292 | erot = 4.93823124551203 | epot = -36.221225061482 | etot = -26.3195965699571 +345000 ekin = 4.92216540601213 | erot = 5.1046016577438 | epot = -36.3841924486031 | etot = -26.3574253848472 +346000 ekin = 4.99792813974919 | erot = 4.77882820289924 | epot = -36.4406602112532 | etot = -26.6639038686048 +347000 ekin = 4.97738387739169 | erot = 4.57238123569558 | epot = -36.4353446283207 | etot = -26.8855795152334 +348000 ekin = 4.92451917191373 | erot = 4.32330547944782 | epot = -36.3741726686484 | etot = -27.1263480172868 +349000 ekin = 4.79018344488603 | erot = 4.64955099606439 | epot = -36.223205179622 | etot = -26.7834707386715 +350000 ekin = 4.74997485376182 | erot = 4.41441619332993 | epot = -36.0086530481282 | etot = -26.8442620010365 +351000 ekin = 4.65861306362181 | erot = 4.54712008187925 | epot = -35.7312651155864 | etot = -26.5255319700854 +352000 ekin = 4.64876538273227 | erot = 4.76138349321479 | epot = -35.450636936112 | etot = -26.0404880601649 +353000 ekin = 4.59253342081085 | erot = 4.29456686626191 | epot = -35.1553683981329 | etot = -26.2682681110601 +354000 ekin = 4.5381016314927 | erot = 4.43945254667789 | epot = -34.9111484982536 | etot = -25.933594320083 +355000 ekin = 4.47391617267677 | erot = 4.20275229581173 | epot = -34.7382448152821 | etot = -26.0615763467936 +356000 ekin = 4.33084740359937 | erot = 4.16589789857719 | epot = -34.645946257664 | etot = -26.1492009554875 +357000 ekin = 4.27639689643637 | erot = 4.49834201135572 | epot = -34.623409347858 | etot = -25.848670440066 +358000 ekin = 4.37058163127658 | erot = 4.62827517810171 | epot = -34.660122927085 | etot = -25.6612661177067 +359000 ekin = 4.33282658147941 | erot = 4.3585277169614 | epot = -34.7355034140379 | etot = -26.0441491155971 +360000 ekin = 4.2302574599471 | erot = 3.73692187296606 | epot = -34.8272714416459 | etot = -26.8600921087327 +361000 ekin = 4.32772510308598 | erot = 3.40799158120822 | epot = -34.9260321184263 | etot = -27.1903154341322 +362000 ekin = 4.43772207587162 | erot = 3.9282425665155 | epot = -35.0362517129443 | etot = -26.6702870705572 +363000 ekin = 4.60059512711759 | erot = 3.7852782080073 | epot = -35.1492303885082 | etot = -26.7633570533833 +364000 ekin = 4.67620778921833 | erot = 3.65656363115961 | epot = -35.2108467629343 | etot = -26.8780753425564 +365000 ekin = 4.68744796027403 | erot = 3.48647035761076 | epot = -35.2579291425392 | etot = -27.0840108246544 +366000 ekin = 4.63171694657446 | erot = 3.80732263161716 | epot = -35.3317328424945 | etot = -26.8926932643029 +367000 ekin = 4.58794520776148 | erot = 4.31664541166342 | epot = -35.411407687399 | etot = -26.5068170679741 +368000 ekin = 4.53697760644357 | erot = 4.37812449310863 | epot = -35.4654560531489 | etot = -26.5503539535967 +369000 ekin = 4.50593348762471 | erot = 4.09682529638636 | epot = -35.502904475486 | etot = -26.9001456914749 +370000 ekin = 4.51011536275126 | erot = 4.41695795738184 | epot = -35.5220659543718 | etot = -26.5949926342387 +371000 ekin = 4.53049860135433 | erot = 4.68112317413008 | epot = -35.5213297387008 | etot = -26.3097079632164 +372000 ekin = 4.42660066351885 | erot = 4.78148611859358 | epot = -35.5227844835439 | etot = -26.3146977014315 +373000 ekin = 4.28146792836402 | erot = 4.87997662616423 | epot = -35.4825501780567 | etot = -26.3211056235285 +374000 ekin = 4.13287464156697 | erot = 4.84001159820239 | epot = -35.4523011025149 | etot = -26.4794148627455 +375000 ekin = 4.1254545194713 | erot = 4.8180743382467 | epot = -35.4637375699461 | etot = -26.5202087122281 +376000 ekin = 3.87506271806603 | erot = 5.35141111797724 | epot = -35.4720072259952 | etot = -26.2455333899519 +377000 ekin = 3.7977056590801 | erot = 5.28013401771242 | epot = -35.5177354201969 | etot = -26.4398957434044 +378000 ekin = 3.64048261255653 | erot = 5.42072423796152 | epot = -35.5808236384767 | etot = -26.5196167879587 +379000 ekin = 3.52386111576647 | erot = 5.97567004606738 | epot = -35.6532146067625 | etot = -26.1536834449286 +380000 ekin = 3.32387900413189 | erot = 6.59135162244889 | epot = -35.7551331169142 | etot = -25.8399024903334 +381000 ekin = 3.31695717077463 | erot = 6.10983514346576 | epot = -35.8815158952862 | etot = -26.4547235810458 +382000 ekin = 3.19546651526133 | erot = 6.36489840256999 | epot = -35.9926058393689 | etot = -26.4322409215376 +383000 ekin = 3.24368169764623 | erot = 6.33114976953635 | epot = -36.0664601033037 | etot = -26.4916286361211 +384000 ekin = 3.20726412806439 | erot = 6.19392941274155 | epot = -36.13258109202 | etot = -26.7313875512141 +385000 ekin = 3.23885859839814 | erot = 6.31552666314694 | epot = -36.1503271354803 | etot = -26.5959418739352 +386000 ekin = 3.16874411708083 | erot = 5.94413881699879 | epot = -36.1310192334958 | etot = -27.0181362994162 +387000 ekin = 3.1549970524927 | erot = 5.48308596050834 | epot = -36.0714221491829 | etot = -27.4333391361819 +388000 ekin = 3.24907989403076 | erot = 5.58200944567837 | epot = -35.9925882356966 | etot = -27.1614988959874 +389000 ekin = 3.39871525437769 | erot = 5.14342534967113 | epot = -35.9262739307719 | etot = -27.384133326723 +390000 ekin = 3.53157771561222 | erot = 5.0660110699086 | epot = -35.908983793516 | etot = -27.3113950079952 +391000 ekin = 3.64602168736988 | erot = 4.88661504875141 | epot = -35.885482230409 | etot = -27.3528454942877 +392000 ekin = 3.79325143536366 | erot = 5.07292816992986 | epot = -35.8524207546015 | etot = -26.986241149308 +393000 ekin = 3.89148460233114 | erot = 5.02930522203665 | epot = -35.795122258631 | etot = -26.8743324342632 +394000 ekin = 3.96458882833181 | erot = 4.47630346760488 | epot = -35.7247928997471 | etot = -27.2839006038104 +395000 ekin = 4.03856036181308 | erot = 4.53784941780792 | epot = -35.6586367417738 | etot = -27.0822269621528 +396000 ekin = 3.99683646706711 | erot = 4.49727898211262 | epot = -35.5718421340357 | etot = -27.077726684856 +397000 ekin = 4.03872005304138 | erot = 4.03153022392527 | epot = -35.5101946272741 | etot = -27.4399443503075 +398000 ekin = 4.01516330520003 | erot = 4.23226303701241 | epot = -35.4578715559685 | etot = -27.2104452137561 +399000 ekin = 4.01922616565289 | erot = 3.71642260619024 | epot = -35.3548490578807 | etot = -27.6192002860376 +400000 ekin = 4.17225085372102 | erot = 4.04093039429602 | epot = -35.2265510847563 | etot = -27.0133698367392 +401000 ekin = 4.1531499643259 | erot = 3.64804961209453 | epot = -35.0943512868027 | etot = -27.2931517103823 +402000 ekin = 4.20245298417996 | erot = 3.70137380667448 | epot = -34.9745627237163 | etot = -27.0707359328619 +403000 ekin = 4.34132456228991 | erot = 3.62891618665791 | epot = -34.8718657472304 | etot = -26.9016249982826 +404000 ekin = 4.42465890243367 | erot = 3.38938035287143 | epot = -34.7967250831428 | etot = -26.9826858278377 +405000 ekin = 4.60663041953486 | erot = 3.44054758174463 | epot = -34.7925257887161 | etot = -26.7453477874366 +406000 ekin = 4.73346375173126 | erot = 3.27915256113194 | epot = -34.8343083282573 | etot = -26.8216920153941 +407000 ekin = 4.82559135473415 | erot = 3.35253133282322 | epot = -34.9059066553788 | etot = -26.7277839678214 +408000 ekin = 4.89298564336964 | erot = 3.47339817729183 | epot = -34.9848536782083 | etot = -26.6184698575468 +409000 ekin = 4.94069048180851 | erot = 3.76649967413607 | epot = -35.0728065521172 | etot = -26.3656163961726 +410000 ekin = 5.0837627829781 | erot = 3.48855890171053 | epot = -35.187607935011 | etot = -26.6152862503224 +411000 ekin = 5.10492342399056 | erot = 3.39152717909369 | epot = -35.2939784996981 | etot = -26.7975278966138 +412000 ekin = 5.2111592148929 | erot = 3.62435455589215 | epot = -35.3853247581651 | etot = -26.54981098738 +413000 ekin = 5.25687541732572 | erot = 3.76308251202569 | epot = -35.4593584594661 | etot = -26.4394005301146 +414000 ekin = 5.1324847249699 | erot = 3.31025282824723 | epot = -35.5393093363061 | etot = -27.0965717830889 +415000 ekin = 5.09217261574528 | erot = 3.59401320391361 | epot = -35.6051617924017 | etot = -26.9189759727428 +416000 ekin = 5.04807348985225 | erot = 3.48392073248423 | epot = -35.6748296719198 | etot = -27.1428354495833 +417000 ekin = 4.99138526936748 | erot = 3.46255923404135 | epot = -35.7531502554471 | etot = -27.2992057520383 +418000 ekin = 5.08999508315138 | erot = 3.44390708246943 | epot = -35.8333696081094 | etot = -27.2994674424886 +419000 ekin = 5.21842750435985 | erot = 3.38325168590963 | epot = -35.8593643490784 | etot = -27.2576851588089 +420000 ekin = 5.28947719533168 | erot = 3.50797044377656 | epot = -35.8848039905133 | etot = -27.0873563514051 +421000 ekin = 5.35268927232197 | erot = 3.36603650801233 | epot = -35.8749221051677 | etot = -27.1561963248334 +422000 ekin = 5.23695191026875 | erot = 3.5384192070691 | epot = -35.889640869454 | etot = -27.1142697521161 +423000 ekin = 5.09577504756812 | erot = 3.67923583037239 | epot = -35.9137595336543 | etot = -27.1387486557138 +424000 ekin = 5.01335188113047 | erot = 3.70110718137013 | epot = -35.9185617531989 | etot = -27.2041026906983 +425000 ekin = 5.05206155589306 | erot = 3.57652002072429 | epot = -35.9081181462489 | etot = -27.2795365696316 +426000 ekin = 4.96532396129214 | erot = 3.38938274590534 | epot = -35.8769982527922 | etot = -27.5222915455948 +427000 ekin = 4.77195218714309 | erot = 3.50252627514185 | epot = -35.7935414010628 | etot = -27.5190629387779 +428000 ekin = 4.81068646615448 | erot = 3.51825958765431 | epot = -35.6664317412178 | etot = -27.337485687409 +429000 ekin = 4.73870321335492 | erot = 3.84986931063852 | epot = -35.48737645591 | etot = -26.8988039319166 +430000 ekin = 4.60213714825158 | erot = 3.45284870606443 | epot = -35.3073410925574 | etot = -27.2523552382414 +431000 ekin = 4.57358006593925 | erot = 3.25422348182535 | epot = -35.1367594918962 | etot = -27.3089559441316 +432000 ekin = 4.5072400368044 | erot = 3.29998192315337 | epot = -35.0290425710883 | etot = -27.2218206111306 +433000 ekin = 4.30860495703181 | erot = 3.42741416873389 | epot = -34.9513402987262 | etot = -27.2153211729605 +434000 ekin = 4.18610269286835 | erot = 3.55059973000668 | epot = -34.9144648758603 | etot = -27.1777624529852 +435000 ekin = 4.12003359590273 | erot = 3.78033374370969 | epot = -34.8780591099565 | etot = -26.9776917703441 +436000 ekin = 3.97313974106111 | erot = 4.05117020636312 | epot = -34.8427841720093 | etot = -26.8184742245851 +437000 ekin = 3.88596008320741 | erot = 4.32902730056047 | epot = -34.8121331683379 | etot = -26.59714578457 +438000 ekin = 4.0300322104638 | erot = 4.35508047283467 | epot = -34.7917492531093 | etot = -26.4066365698108 +439000 ekin = 4.04655148511089 | erot = 4.17322604141044 | epot = -34.7786348227552 | etot = -26.5588572962338 +440000 ekin = 4.02801522674428 | erot = 4.13470601724877 | epot = -34.783993085415 | etot = -26.621271841422 +441000 ekin = 3.9407814794189 | erot = 4.22144190117305 | epot = -34.8185771480924 | etot = -26.6563537675004 +442000 ekin = 3.97730990695624 | erot = 4.24233406975314 | epot = -34.8718962191131 | etot = -26.6522522424037 +443000 ekin = 3.98508138243203 | erot = 4.16122580291752 | epot = -34.9266782585657 | etot = -26.7803710732162 +444000 ekin = 4.00042709081881 | erot = 4.50741850480051 | epot = -34.9630696153483 | etot = -26.455224019729 +445000 ekin = 4.02620459576009 | erot = 4.64580325300967 | epot = -34.9893039643633 | etot = -26.3172961155935 +446000 ekin = 4.01454608720561 | erot = 4.89747165518573 | epot = -34.9969089036747 | etot = -26.0848911612834 +447000 ekin = 3.9634269487331 | erot = 4.85867800390581 | epot = -34.9830933662453 | etot = -26.1609884136064 +448000 ekin = 3.74592315828131 | erot = 5.17578433357899 | epot = -34.9638816619607 | etot = -26.0421741701004 +449000 ekin = 3.73316291077397 | erot = 5.18498661281911 | epot = -34.928043894125 | etot = -26.0098943705319 +450000 ekin = 3.85313039093471 | erot = 4.86926583888851 | epot = -34.871696979835 | etot = -26.1493007500118 +451000 ekin = 4.0635928053116 | erot = 4.99817049859077 | epot = -34.8377147695102 | etot = -25.7759514656078 +452000 ekin = 4.12215980217323 | erot = 4.58488292412152 | epot = -34.8398353293668 | etot = -26.132792603072 +453000 ekin = 4.16332842884585 | erot = 4.32671008371169 | epot = -34.8570499988891 | etot = -26.3670114863315 +454000 ekin = 4.11754892618458 | erot = 4.47415692336241 | epot = -34.8913194738516 | etot = -26.2996136243046 +455000 ekin = 4.22185774995392 | erot = 4.65517828169302 | epot = -34.9334347985056 | etot = -26.0563987668587 +456000 ekin = 4.30177202276186 | erot = 4.77747798616555 | epot = -35.0188770940117 | etot = -25.9396270850843 +457000 ekin = 4.26451460758692 | erot = 4.69009499467403 | epot = -35.1021143238335 | etot = -26.1475047215725 +458000 ekin = 4.31289289804826 | erot = 4.48148846421096 | epot = -35.1135359976452 | etot = -26.319154635386 +459000 ekin = 4.40924309472913 | erot = 4.70052929057904 | epot = -35.3709113999322 | etot = -26.261139014624 +460000 ekin = 4.47691183250362 | erot = 4.50574141189091 | epot = -35.566195356935 | etot = -26.5835421125405 +461000 ekin = 4.43873436995047 | erot = 4.99077626254052 | epot = -35.6310455171601 | etot = -26.2015348846691 +462000 ekin = 4.38932525316334 | erot = 4.94989100042744 | epot = -35.7174404682251 | etot = -26.3782242146343 +463000 ekin = 4.36115268480756 | erot = 5.66229263914062 | epot = -35.7828736923833 | etot = -25.7594283684351 +464000 ekin = 4.32411863133059 | erot = 5.21874712373015 | epot = -35.831817418358 | etot = -26.2889516632972 +465000 ekin = 4.25283049437785 | erot = 4.89311928407883 | epot = -35.8307748329822 | etot = -26.6848250545255 +466000 ekin = 3.97961054012127 | erot = 4.30523919521546 | epot = -35.8019205162795 | etot = -27.5170707809428 +467000 ekin = 3.96957942645049 | erot = 4.02414635207156 | epot = -35.7935881476328 | etot = -27.7998623691107 +468000 ekin = 3.81067149059023 | erot = 3.91311573890038 | epot = -35.8192046044613 | etot = -28.0954173749707 +469000 ekin = 3.82956653035844 | erot = 3.76358708523021 | epot = -35.8554657317423 | etot = -28.2623121161536 +470000 ekin = 3.84315155222981 | erot = 3.46319185355953 | epot = -35.9283028420635 | etot = -28.6219594362741 +471000 ekin = 3.84189885920186 | erot = 3.51787257644774 | epot = -36.0370536568174 | etot = -28.6772822211678 +472000 ekin = 3.86861114122289 | erot = 3.36458500068021 | epot = -36.136832298983 | etot = -28.9036361570799 +473000 ekin = 3.73700168734163 | erot = 3.58329228877658 | epot = -36.2233655143198 | etot = -28.9030715382016 +474000 ekin = 3.82928273613466 | erot = 3.70070391401449 | epot = -36.2919855352817 | etot = -28.7619988851326 +475000 ekin = 3.89544030959981 | erot = 3.76401640046676 | epot = -36.368430738898 | etot = -28.7089740288314 +476000 ekin = 4.08932767113311 | erot = 3.7090790175484 | epot = -36.4684310716285 | etot = -28.670024382947 +477000 ekin = 4.15334136664067 | erot = 3.70899967496142 | epot = -36.5311600367317 | etot = -28.6688189951296 +478000 ekin = 4.07512882728801 | erot = 3.80913887771278 | epot = -36.5715417700018 | etot = -28.687274065001 +479000 ekin = 3.96184225144662 | erot = 3.67584263229307 | epot = -36.6049454628497 | etot = -28.96726057911 +480000 ekin = 3.86072911979592 | erot = 3.85211085064263 | epot = -36.6106292252495 | etot = -28.897789254811 +481000 ekin = 3.78563823255482 | erot = 4.02431409923187 | epot = -36.604468258428 | etot = -28.7945159266413 +482000 ekin = 3.81986353724767 | erot = 3.94457553240232 | epot = -36.555624249585 | etot = -28.791185179935 +483000 ekin = 3.91937069686989 | erot = 3.97985471481289 | epot = -36.4953515335722 | etot = -28.5961261218894 +484000 ekin = 3.90565472316258 | erot = 3.68508276016124 | epot = -36.4265142327187 | etot = -28.8357767493949 +485000 ekin = 3.97067640669119 | erot = 3.52818833629898 | epot = -36.3385351029671 | etot = -28.8396703599769 +486000 ekin = 4.08924338068637 | erot = 3.45150371793016 | epot = -36.2407040808275 | etot = -28.699956982211 +487000 ekin = 4.0776172953027 | erot = 3.69577064303949 | epot = -36.1174543397059 | etot = -28.3440664013637 +488000 ekin = 3.98120330041654 | erot = 4.01179749212316 | epot = -35.9662140009108 | etot = -27.9732132083711 +489000 ekin = 3.94304108511277 | erot = 4.09948585344473 | epot = -35.8365811443669 | etot = -27.7940542058094 +490000 ekin = 3.98200750178095 | erot = 4.1933065556559 | epot = -35.7436522395692 | etot = -27.5683381821323 +491000 ekin = 4.04453601319225 | erot = 4.06864604679556 | epot = -35.6813038605047 | etot = -27.5681218005169 +492000 ekin = 4.10478194610714 | erot = 4.27931273272371 | epot = -35.6201850620968 | etot = -27.2360903832659 +493000 ekin = 4.14218811078641 | erot = 4.30328516242947 | epot = -35.552932172172 | etot = -27.1074588989561 +494000 ekin = 4.15483197917405 | erot = 4.22087230768693 | epot = -35.5007035923698 | etot = -27.1249993055088 +495000 ekin = 4.26671892357318 | erot = 4.21745137304138 | epot = -35.4450128389798 | etot = -26.9608425423653 +496000 ekin = 4.42373869014847 | erot = 3.65535322096903 | epot = -35.3933064942827 | etot = -27.3142145831652 +497000 ekin = 4.57363309591063 | erot = 3.63766344362447 | epot = -35.3630685420949 | etot = -27.1517720025598 +498000 ekin = 4.7241733979428 | erot = 3.40665904233516 | epot = -35.3570714026385 | etot = -27.2262389623605 +499000 ekin = 4.76806375994875 | erot = 3.58204839805272 | epot = -35.3646341268585 | etot = -27.014521968857 +500000 ekin = 4.86803273232483 | erot = 3.40069391727023 | epot = -35.4199817543268 | etot = -27.1512551047318 +501000 ekin = 4.96743307602627 | erot = 3.46724128896305 | epot = -35.4970649677118 | etot = -27.0623906027225 +502000 ekin = 4.91929166862615 | erot = 3.57165212036678 | epot = -35.5889625489512 | etot = -27.0980187599583 +503000 ekin = 4.90703913138678 | erot = 3.86458875313933 | epot = -35.6771862828227 | etot = -26.9055583982966 +504000 ekin = 5.1370533506199 | erot = 3.5369546296831 | epot = -35.7347477259461 | etot = -27.0607397456431 +505000 ekin = 5.23249143944225 | erot = 3.46343104093314 | epot = -35.7820571844966 | etot = -27.0861347041212 +506000 ekin = 5.11675278315717 | erot = 3.7206718650993 | epot = -35.8198968197658 | etot = -26.9824721715093 +507000 ekin = 5.1899390138749 | erot = 4.15215085847695 | epot = -35.8269271672396 | etot = -26.4848372948877 +508000 ekin = 4.9859787822663 | erot = 4.11598571893968 | epot = -35.7826195676286 | etot = -26.6806550664226 +509000 ekin = 4.8941242567771 | erot = 4.30807642739895 | epot = -35.6890852058564 | etot = -26.4868845216804 +510000 ekin = 4.89504815269032 | erot = 4.46013837584195 | epot = -35.5893215666418 | etot = -26.2341350381096 +511000 ekin = 4.85835750083421 | erot = 4.41721118692693 | epot = -35.4748886415727 | etot = -26.1993199538116 +512000 ekin = 4.85632567302005 | erot = 4.58501467870099 | epot = -35.3170557845382 | etot = -25.8757154328171 +513000 ekin = 4.79088228903437 | erot = 4.4189824922301 | epot = -35.1398620511889 | etot = -25.9299972699244 +514000 ekin = 4.84082723167344 | erot = 4.10048582144436 | epot = -34.952894027941 | etot = -26.0115809748232 +515000 ekin = 4.66396867258937 | erot = 3.7079532547263 | epot = -34.8081323279133 | etot = -26.4362104005976 +516000 ekin = 4.4520372226043 | erot = 3.7424161749218 | epot = -34.7399422586774 | etot = -26.5454888611513 +517000 ekin = 4.39320763550332 | erot = 3.61293763489243 | epot = -34.7115969229745 | etot = -26.7054516525788 +518000 ekin = 4.3351626742312 | erot = 3.46685163663689 | epot = -34.7205591716219 | etot = -26.9185448607538 +519000 ekin = 4.32678001120832 | erot = 3.8333130859946 | epot = -34.7543932584755 | etot = -26.5943001612725 +520000 ekin = 4.16017569753314 | erot = 3.99442103376417 | epot = -34.7797387277815 | etot = -26.6251419964842 +521000 ekin = 4.01091284601602 | erot = 4.71227661622732 | epot = -34.8119764016188 | etot = -26.0887869393754 +522000 ekin = 3.9255586814989 | erot = 4.67306017627962 | epot = -34.8638412525408 | etot = -26.2652223947623 +523000 ekin = 4.10629342994203 | erot = 4.236908212199 | epot = -34.9392637364661 | etot = -26.5960620943251 +524000 ekin = 4.16964406138591 | erot = 4.51539305326744 | epot = -35.0302476439308 | etot = -26.3452105292774 +525000 ekin = 4.14574067413465 | erot = 4.59255192964589 | epot = -35.1665459803983 | etot = -26.4282533766178 +526000 ekin = 4.296358047754 | erot = 5.381812036993 | epot = -35.3702076593238 | etot = -25.6920375745768 +527000 ekin = 4.43341423246361 | erot = 5.4208701656542 | epot = -35.5881352754177 | etot = -25.7338508772999 +528000 ekin = 4.65221997264072 | erot = 5.64432261927517 | epot = -35.7907306535609 | etot = -25.494188061645 +529000 ekin = 4.75833001518924 | erot = 6.22279494556947 | epot = -35.9649272181716 | etot = -24.9838022574129 +530000 ekin = 4.85254900576415 | erot = 6.26630645813046 | epot = -36.1175112827238 | etot = -24.9986558188292 +531000 ekin = 4.88314038497982 | erot = 6.22256761998238 | epot = -36.2218727030894 | etot = -25.1161646981272 +532000 ekin = 4.89429192132463 | erot = 6.19376619305432 | epot = -36.2791850407375 | etot = -25.1911269263585 +533000 ekin = 4.98074956905521 | erot = 6.71246035574362 | epot = -36.2873072492241 | etot = -24.5940973244253 +534000 ekin = 5.05914514163862 | erot = 6.72049132345808 | epot = -36.2541186702089 | etot = -24.4744822051122 +535000 ekin = 4.98307281629264 | erot = 6.60876507020625 | epot = -36.1722591997817 | etot = -24.5804213132828 +536000 ekin = 4.92092214615494 | erot = 6.71824597922688 | epot = -36.0492643890656 | etot = -24.4100962636838 +537000 ekin = 4.73594122849286 | erot = 6.46069540815352 | epot = -35.9116294607651 | etot = -24.7149928241187 +538000 ekin = 4.79280389212849 | erot = 6.10794151385203 | epot = -35.7423046160126 | etot = -24.8415592100321 +539000 ekin = 4.77579753855575 | erot = 5.97217188520334 | epot = -35.5336009816514 | etot = -24.7856315578923 +540000 ekin = 4.5934335322059 | erot = 6.0288231594335 | epot = -35.2969540919917 | etot = -24.6746974003523 +541000 ekin = 4.56261508857232 | erot = 5.60884609986387 | epot = -35.074241498478 | etot = -24.9027803100418 +542000 ekin = 4.4230407907828 | erot = 5.24180126466482 | epot = -34.8728664426871 | etot = -25.2080243872395 +543000 ekin = 4.31458565966237 | erot = 5.3064811880571 | epot = -34.6809264080031 | etot = -25.0598595602836 +544000 ekin = 4.16990383767255 | erot = 5.09480741715239 | epot = -34.5077033118771 | etot = -25.2429920570521 +545000 ekin = 4.03506404145806 | erot = 4.95913193735205 | epot = -34.3738505570893 | etot = -25.3796545782792 +546000 ekin = 4.05283758597002 | erot = 4.62357416672456 | epot = -34.2732549004477 | etot = -25.5968431477531 +547000 ekin = 3.91892476341072 | erot = 4.42471065792704 | epot = -34.1888485564159 | etot = -25.8452131350781 +548000 ekin = 3.85923648383023 | erot = 4.18493881932583 | epot = -34.1251823218203 | etot = -26.0810070186642 +549000 ekin = 3.89277095561291 | erot = 4.20183962759824 | epot = -34.0968256559695 | etot = -26.0022150727584 +550000 ekin = 3.88489313663741 | erot = 4.0698735084027 | epot = -34.083498992554 | etot = -26.1287323475139 +551000 ekin = 3.87639970039824 | erot = 4.25043058335786 | epot = -34.0931086790785 | etot = -25.9662783953224 +552000 ekin = 3.88627319211738 | erot = 4.0010203354773 | epot = -34.163860291438 | etot = -26.2765667638433 +553000 ekin = 4.05569156373835 | erot = 3.56403629580258 | epot = -34.2474834864243 | etot = -26.6277556268834 +554000 ekin = 4.25626838001505 | erot = 3.70804766862573 | epot = -34.2954308218042 | etot = -26.3311147731634 +555000 ekin = 4.26487407035246 | erot = 3.78496110408411 | epot = -34.3412268896546 | etot = -26.291391715218 +556000 ekin = 4.24622902964942 | erot = 4.03454820388574 | epot = -34.3344093396383 | etot = -26.0536321061031 +557000 ekin = 4.0731966983783 | erot = 3.86372668854402 | epot = -34.2640157691765 | etot = -26.3270923822542 +558000 ekin = 3.9948930644697 | erot = 3.82027814531928 | epot = -34.1455461859523 | etot = -26.3303749761633 +559000 ekin = 4.00179663426005 | erot = 3.82651776959161 | epot = -33.9924674804782 | etot = -26.1641530766265 +560000 ekin = 3.90938418270034 | erot = 3.49539199637402 | epot = -33.8018928207131 | etot = -26.3971166416387 +561000 ekin = 3.70375196060258 | erot = 3.38165869548275 | epot = -33.615733164291 | etot = -26.5303225082057 +562000 ekin = 3.64392595608231 | erot = 3.67997084627181 | epot = -33.4612560313007 | etot = -26.1373592289466 +563000 ekin = 3.59769761679705 | erot = 3.74125845764523 | epot = -33.3480734777517 | etot = -26.0091174033094 +564000 ekin = 3.58725325354742 | erot = 3.35524020938125 | epot = -33.267517196837 | etot = -26.3250237339083 +565000 ekin = 3.63835964444106 | erot = 3.77402574563878 | epot = -33.240901552366 | etot = -25.8285161622862 +566000 ekin = 3.64384501808566 | erot = 3.77515123487333 | epot = -33.2503593116368 | etot = -25.8313630586779 +567000 ekin = 3.63214417671457 | erot = 3.86854489788161 | epot = -33.2603190278794 | etot = -25.7596299532833 +568000 ekin = 3.76759211619052 | erot = 3.9732101485638 | epot = -33.2947231384409 | etot = -25.5539208736866 +569000 ekin = 3.75607920629751 | erot = 3.91893504114413 | epot = -33.3766443391901 | etot = -25.7016300917484 +570000 ekin = 3.88570178164854 | erot = 3.8701337006161 | epot = -33.4676246266793 | etot = -25.7117891444146 +571000 ekin = 3.91109063039706 | erot = 4.38873366379694 | epot = -33.5301619269313 | etot = -25.2303376327373 +572000 ekin = 3.9135736753704 | erot = 4.54669425634133 | epot = -33.5613071721044 | etot = -25.1010392403927 +573000 ekin = 4.00256460246037 | erot = 4.69928602914644 | epot = -33.547965409059 | etot = -24.8461147774522 +574000 ekin = 4.04557469411573 | erot = 4.85104808888591 | epot = -33.4823141367226 | etot = -24.5856913537209 +575000 ekin = 4.01990448331334 | erot = 4.48360936846642 | epot = -33.4090682352895 | etot = -24.9055543835097 +576000 ekin = 3.8077042063495 | erot = 4.4090298473991 | epot = -33.3559765416156 | etot = -25.139242487867 +577000 ekin = 3.65176770723656 | erot = 4.69770290650885 | epot = -33.3414847753624 | etot = -24.992014161617 +578000 ekin = 3.65416507269697 | erot = 5.09984939028917 | epot = -33.3628873386868 | etot = -24.6088728757007 +579000 ekin = 3.65457514215401 | erot = 4.83085466504536 | epot = -33.4229058723706 | etot = -24.9374760651712 +580000 ekin = 3.61022362260401 | erot = 5.21507039569716 | epot = -33.5257015423967 | etot = -24.7004075240955 +581000 ekin = 3.494914275922 | erot = 5.80898315058267 | epot = -33.6374701054948 | etot = -24.3335726789901 +582000 ekin = 3.45150652331189 | erot = 5.20797294729429 | epot = -33.7413132898266 | etot = -25.0818338192204 +583000 ekin = 3.43883253778127 | erot = 4.99240818298312 | epot = -33.7992206024418 | etot = -25.3679798816774 +584000 ekin = 3.41950743993982 | erot = 5.30429667829813 | epot = -33.8273198616872 | etot = -25.1035157434492 +585000 ekin = 3.52988736379251 | erot = 5.26888625710182 | epot = -33.8562169326841 | etot = -25.0574433117897 +586000 ekin = 3.54522421505632 | erot = 5.15182886320336 | epot = -33.8748034063857 | etot = -25.177750328126 +587000 ekin = 3.64975640444305 | erot = 4.43116878398965 | epot = -33.8790223191809 | etot = -25.7980971307482 +588000 ekin = 3.85787406303013 | erot = 4.33848995606292 | epot = -33.9012642894901 | etot = -25.704900270397 +589000 ekin = 3.94871508842027 | erot = 4.36958758855398 | epot = -33.9512157067312 | etot = -25.632913029757 +590000 ekin = 4.04576150007614 | erot = 4.34777620153041 | epot = -33.9849374243125 | etot = -25.5913997227059 +591000 ekin = 4.13483818439864 | erot = 4.2847530812366 | epot = -33.997537224377 | etot = -25.5779459587418 +592000 ekin = 4.25566804148588 | erot = 4.00241438742632 | epot = -33.9905173022463 | etot = -25.7324348733341 +593000 ekin = 4.26695504286498 | erot = 3.75133860519142 | epot = -33.9824243028368 | etot = -25.9641306547804 +594000 ekin = 4.24513038558001 | erot = 3.88826331815687 | epot = -33.9597952629285 | etot = -25.8264015591916 +595000 ekin = 4.33307108334578 | erot = 3.92609577318101 | epot = -33.9197199407769 | etot = -25.6605530842501 +596000 ekin = 4.23611726585083 | erot = 3.89070717461436 | epot = -33.8740124837555 | etot = -25.7471880432903 +597000 ekin = 4.40233879096545 | erot = 3.99738130824423 | epot = -33.8902431987863 | etot = -25.4905230995766 +598000 ekin = 4.23795477390283 | erot = 4.04526003587962 | epot = -33.9155939268415 | etot = -25.632379117059 +599000 ekin = 4.13745802988963 | erot = 3.88641709707891 | epot = -33.9296772436184 | etot = -25.9058021166499 +600000 ekin = 4.21239990479373 | erot = 3.82373814742806 | epot = -33.9651236246002 | etot = -25.9289855723784 +601000 ekin = 4.31969973340156 | erot = 3.98399943561206 | epot = -34.0172721411617 | etot = -25.7135729721481 +602000 ekin = 4.27803621196591 | erot = 4.02063732656592 | epot = -34.1006984229854 | etot = -25.8020248844535 +603000 ekin = 4.31016670434105 | erot = 4.06109056998793 | epot = -34.2290225355025 | etot = -25.8577652611735 +604000 ekin = 4.35436231281015 | erot = 4.27081433433638 | epot = -34.3693989473761 | etot = -25.7442223002295 +605000 ekin = 4.29263786573535 | erot = 4.35816455016065 | epot = -34.5293522620236 | etot = -25.8785498461276 +606000 ekin = 4.23493766333219 | erot = 4.45889694601915 | epot = -34.6959569640143 | etot = -26.002122354663 +607000 ekin = 4.21589668454704 | erot = 4.35851580050846 | epot = -34.8643734064671 | etot = -26.2899609214116 +608000 ekin = 4.31617609118148 | erot = 4.37118434041818 | epot = -35.0106665625387 | etot = -26.323306130939 +609000 ekin = 4.40054829762706 | erot = 4.09556922746415 | epot = -35.1090427558584 | etot = -26.6129252307672 +610000 ekin = 4.38360179734749 | erot = 4.43080811091103 | epot = -35.1590130940805 | etot = -26.344603185822 +611000 ekin = 4.30911071720803 | erot = 4.66858603342419 | epot = -35.199774136202 | etot = -26.2220773855698 +612000 ekin = 4.38115044343898 | erot = 4.62952065066672 | epot = -35.2189008927589 | etot = -26.2082297986532 +613000 ekin = 4.49640333428286 | erot = 4.73033949191667 | epot = -35.2311946320123 | etot = -26.0044518058127 +614000 ekin = 4.42698019674728 | erot = 4.54387450238911 | epot = -35.2270245654641 | etot = -26.2561698663278 +615000 ekin = 4.3629388204899 | erot = 4.65167437175519 | epot = -35.2500098144353 | etot = -26.2353966221903 +616000 ekin = 4.25552094369014 | erot = 3.96773357990598 | epot = -35.2626465654004 | etot = -27.0393920418043 +617000 ekin = 4.02844203107081 | erot = 3.93306028038353 | epot = -35.3085438772357 | etot = -27.3470415657814 +618000 ekin = 3.91410624199523 | erot = 3.99915504239056 | epot = -35.3773572154983 | etot = -27.4640959311125 +619000 ekin = 3.9294433404095 | erot = 3.65858234543169 | epot = -35.4549579850513 | etot = -27.8669322992101 +620000 ekin = 3.94632769198393 | erot = 4.05357915876527 | epot = -35.5452298743849 | etot = -27.5453230236357 +621000 ekin = 4.00876452457071 | erot = 4.18557952361359 | epot = -35.6568787558286 | etot = -27.4625347076443 +622000 ekin = 3.97770547832547 | erot = 4.20428409244749 | epot = -35.7853832130651 | etot = -27.6033936422921 +623000 ekin = 3.87623409179537 | erot = 4.44200976918119 | epot = -35.9345595163542 | etot = -27.6163156553776 +624000 ekin = 3.81461749379546 | erot = 4.73413928443235 | epot = -36.0610458736418 | etot = -27.512289095414 +625000 ekin = 3.89702417514946 | erot = 4.5196799549034 | epot = -36.1593702506668 | etot = -27.7426661206139 +626000 ekin = 4.0528518195111 | erot = 5.12209714551147 | epot = -36.237370947802 | etot = -27.0624219827794 +627000 ekin = 4.06919694856893 | erot = 5.16853241383708 | epot = -36.2459696084307 | etot = -27.0082402460247 +628000 ekin = 3.97574634490031 | erot = 5.15377915037523 | epot = -36.1860007276678 | etot = -27.0564752323922 +629000 ekin = 3.97847076093763 | erot = 4.98743417354921 | epot = -36.084160296335 | etot = -27.1182553618481 +630000 ekin = 3.82117049554653 | erot = 4.72915936447952 | epot = -35.9627884752431 | etot = -27.4124586152171 +631000 ekin = 3.8646114143111 | erot = 4.86154549635015 | epot = -35.8061457051951 | etot = -27.0799887945339 +632000 ekin = 3.74664734149751 | erot = 4.54810894057716 | epot = -35.6214135997292 | etot = -27.3266573176545 +633000 ekin = 3.70561564688156 | erot = 3.84492477779505 | epot = -35.4366028892496 | etot = -27.886062464573 +634000 ekin = 3.59215409071566 | erot = 3.93871515972519 | epot = -35.2896538627894 | etot = -27.7587846123485 +635000 ekin = 3.50545587494281 | erot = 4.06717110382225 | epot = -35.1730596180138 | etot = -27.6004326392487 +636000 ekin = 3.33094541502758 | erot = 4.07821458070319 | epot = -35.1077038533339 | etot = -27.6985438576031 +637000 ekin = 3.1450521799885 | erot = 4.05756077132578 | epot = -35.1055524080602 | etot = -27.9029394567459 +638000 ekin = 3.09050584392124 | erot = 4.40258652090801 | epot = -35.1570633539873 | etot = -27.6639709891581 +639000 ekin = 3.07687333216972 | erot = 4.16491810908533 | epot = -35.2467836386701 | etot = -28.0049921974151 +640000 ekin = 3.00973730804964 | erot = 4.26924181333289 | epot = -35.3354522376063 | etot = -28.0564731162238 +641000 ekin = 2.94445196408731 | erot = 4.64391413205011 | epot = -35.4644644387943 | etot = -27.8760983426569 +642000 ekin = 2.98442414954527 | erot = 4.99747556124224 | epot = -35.629005703419 | etot = -27.6471059926314 +643000 ekin = 3.20556469531983 | erot = 4.80255317913171 | epot = -35.7795885297912 | etot = -27.7714706553396 +644000 ekin = 3.27488214023669 | erot = 4.64957731616528 | epot = -35.9161733239232 | etot = -27.9917138675212 +645000 ekin = 3.41323831994906 | erot = 4.71321420527498 | epot = -36.0213663956136 | etot = -27.8949138703896 +646000 ekin = 3.56963422518063 | erot = 4.46391006184168 | epot = -36.0597764611991 | etot = -28.0262321741768 +647000 ekin = 3.65146108953654 | erot = 4.34882885781815 | epot = -36.0539738525772 | etot = -28.0536839052225 +648000 ekin = 3.80589253043734 | erot = 4.22505125234539 | epot = -35.9957895068619 | etot = -27.9648457240791 +649000 ekin = 4.01844415748726 | erot = 4.19109412255692 | epot = -35.918006133173 | etot = -27.7084678531288 +650000 ekin = 4.03810277748455 | erot = 3.86362623058827 | epot = -35.8260490160414 | etot = -27.9243200079685 +651000 ekin = 4.1420394457061 | erot = 3.56888807374624 | epot = -35.7087423281368 | etot = -27.9978148086844 +652000 ekin = 4.23250261214613 | erot = 3.18710224409333 | epot = -35.6367851174003 | etot = -28.2171802611608 +653000 ekin = 4.36352642925903 | erot = 3.20148998565931 | epot = -35.6464209942524 | etot = -28.0814045793341 +654000 ekin = 4.52792032439863 | erot = 3.02237039454649 | epot = -35.6995719521279 | etot = -28.1492812331828 +655000 ekin = 4.60546960877418 | erot = 2.96007185178607 | epot = -35.8223013228776 | etot = -28.2567598623174 +656000 ekin = 4.78956137675958 | erot = 3.38896158834532 | epot = -35.9826527468522 | etot = -27.8041297817474 +657000 ekin = 4.78481247088143 | erot = 3.67040934516362 | epot = -36.1522101931014 | etot = -27.6969883770563 +658000 ekin = 4.68735602442142 | erot = 4.10635530609203 | epot = -36.3122539915035 | etot = -27.5185426609901 +659000 ekin = 4.79643464434846 | erot = 4.31091667955153 | epot = -36.4198222001284 | etot = -27.3124708762284 +660000 ekin = 4.65613606555458 | erot = 4.00182169137101 | epot = -36.5017357753368 | etot = -27.8437780184112 +661000 ekin = 4.53939481189358 | erot = 4.39327864100421 | epot = -36.552237956014 | etot = -27.6195645031162 +662000 ekin = 4.62075189021939 | erot = 4.64171304234462 | epot = -36.545875274844 | etot = -27.28341034228 +663000 ekin = 4.60627251324175 | erot = 4.44191382325611 | epot = -36.5358428119652 | etot = -27.4876564754673 +664000 ekin = 4.5322487745738 | erot = 4.69535654969877 | epot = -36.5440045788996 | etot = -27.3163992546271 +665000 ekin = 4.33791904760918 | erot = 4.79511074251709 | epot = -36.5712979957051 | etot = -27.4382682055788 +666000 ekin = 4.01034004769755 | erot = 5.144756302773 | epot = -36.6275167021822 | etot = -27.4724203517116 +667000 ekin = 3.92791037721526 | erot = 5.1180589475915 | epot = -36.7022697315157 | etot = -27.656300406709 +668000 ekin = 3.69207242860475 | erot = 4.95115852091633 | epot = -36.77482844315 | etot = -28.1315974936289 +669000 ekin = 3.52850414694741 | erot = 5.30513713121027 | epot = -36.8468924103787 | etot = -28.013251132221 +670000 ekin = 3.43685158392318 | erot = 5.67353767341462 | epot = -36.8571678878536 | etot = -27.7467786305158 +671000 ekin = 3.37237891900108 | erot = 4.81383151363229 | epot = -36.789877261468 | etot = -28.6036668288346 +672000 ekin = 3.42142864489494 | erot = 4.47410705082113 | epot = -36.6509805759882 | etot = -28.7554448802721 +673000 ekin = 3.47620696197669 | erot = 4.5346881275349 | epot = -36.4695914666357 | etot = -28.4586963771241 +674000 ekin = 3.34015467342445 | erot = 4.56003540036683 | epot = -36.2728042739957 | etot = -28.3726142002044 +675000 ekin = 3.26558121431912 | erot = 4.75716318196968 | epot = -36.081244882487 | etot = -28.0585004861982 +676000 ekin = 3.30557173090105 | erot = 4.66626180335483 | epot = -35.8858133485329 | etot = -27.9139798142771 +677000 ekin = 3.38252137148696 | erot = 4.68979222844271 | epot = -35.7238379181649 | etot = -27.6515243182352 +678000 ekin = 3.33430766992679 | erot = 4.45636421682296 | epot = -35.5898515746292 | etot = -27.7991796878794 +679000 ekin = 3.26716522041086 | erot = 4.1364314169021 | epot = -35.5282160560392 | etot = -28.1246194187263 +680000 ekin = 3.22330491222295 | erot = 4.11355311991395 | epot = -35.5522418172891 | etot = -28.2153837851522 +681000 ekin = 3.27654998707864 | erot = 4.40088508884101 | epot = -35.6343431031162 | etot = -27.9569080271965 +682000 ekin = 3.38403402083093 | erot = 4.64957783602951 | epot = -35.7255960652544 | etot = -27.6919842083939 +683000 ekin = 3.58392532059595 | erot = 4.15499488835509 | epot = -35.8541956283799 | etot = -28.1152754194289 +684000 ekin = 3.63284008875844 | erot = 4.14497212696412 | epot = -36.0448350473468 | etot = -28.2670228316243 +685000 ekin = 3.75538152185827 | erot = 3.95609692494467 | epot = -36.2462524041805 | etot = -28.5347739573775 +686000 ekin = 3.91883145536903 | erot = 3.95298902028762 | epot = -36.4771155861876 | etot = -28.605295110531 +687000 ekin = 4.05299881159346 | erot = 4.06027810523509 | epot = -36.7169526369106 | etot = -28.6036757200821 +688000 ekin = 4.13599667613487 | erot = 4.10331489254492 | epot = -36.9524101670374 | etot = -28.7130985983576 +689000 ekin = 4.25987754434331 | erot = 4.14481492316617 | epot = -37.1900775910787 | etot = -28.7853851235692 +690000 ekin = 4.43074027682691 | erot = 4.04380513304471 | epot = -37.3931354089472 | etot = -28.9185899990756 +691000 ekin = 4.53821721573907 | erot = 3.8050334589901 | epot = -37.5576014163145 | etot = -29.2143507415853 +692000 ekin = 4.64150042779563 | erot = 3.59872997928139 | epot = -37.6895260553266 | etot = -29.4492956482496 +693000 ekin = 4.69075885893268 | erot = 3.47578918601684 | epot = -37.8114874122412 | etot = -29.6449393672917 +694000 ekin = 4.7382251866288 | erot = 3.84263750148522 | epot = -37.9027003996521 | etot = -29.3218377115381 +695000 ekin = 4.75494194628237 | erot = 3.78113333862439 | epot = -37.9681336831645 | etot = -29.4320583982578 +696000 ekin = 4.697866081995 | erot = 3.78526821175916 | epot = -38.0084908312995 | etot = -29.5253565375453 +697000 ekin = 4.69854328160722 | erot = 3.62432955932709 | epot = -38.0258612384494 | etot = -29.7029883975151 +698000 ekin = 4.71023285873083 | erot = 3.64111389234168 | epot = -38.0301547340748 | etot = -29.6788079830023 +699000 ekin = 4.56773244344101 | erot = 3.71983710702471 | epot = -38.0529467082179 | etot = -29.7653771577522 +700000 ekin = 4.43155866208815 | erot = 3.5335546196022 | epot = -38.068583492112 | etot = -30.1034702104217 +701000 ekin = 4.47548631411863 | erot = 3.38963138436185 | epot = -38.0500116139802 | etot = -30.1848939154997 +702000 ekin = 4.46550513017092 | erot = 3.66852889097233 | epot = -38.0164512923389 | etot = -29.8824172711957 +703000 ekin = 4.38742906998922 | erot = 3.97599599383663 | epot = -37.9817705180933 | etot = -29.6183454542675 +704000 ekin = 4.41020682713785 | erot = 3.83147838533244 | epot = -37.9674346241353 | etot = -29.725749411665 +705000 ekin = 4.39308990786526 | erot = 3.75664217186731 | epot = -37.9282520396859 | etot = -29.7785199599533 +706000 ekin = 4.43040906703226 | erot = 4.12756254176834 | epot = -37.8939279543814 | etot = -29.3359563455808 +707000 ekin = 4.51700671633719 | erot = 3.77573523129425 | epot = -37.8444471024425 | etot = -29.5517051548111 +708000 ekin = 4.49065124304644 | erot = 3.88552877103945 | epot = -37.7744800646496 | etot = -29.3983000505637 +709000 ekin = 4.41855498291582 | erot = 3.53582586052254 | epot = -37.6656825257606 | etot = -29.7113016823223 +710000 ekin = 4.40535258977441 | erot = 3.39649502688896 | epot = -37.546693994465 | etot = -29.7448463778016 +711000 ekin = 4.32709544005412 | erot = 3.54995473847997 | epot = -37.3866324258477 | etot = -29.5095822473136 +712000 ekin = 4.40620309391045 | erot = 3.7155744253842 | epot = -37.1793914331046 | etot = -29.05761391381 +713000 ekin = 4.39226105260381 | erot = 3.64956114520254 | epot = -36.9592491146155 | etot = -28.9174269168092 +714000 ekin = 4.3945904765123 | erot = 3.58799428596503 | epot = -36.7844109062829 | etot = -28.8018261438055 +715000 ekin = 4.41458674942753 | erot = 4.01850565037344 | epot = -36.5924446920391 | etot = -28.1593522922382 +716000 ekin = 4.33665938530876 | erot = 3.50452219695681 | epot = -36.4143425377369 | etot = -28.5731609554713 +717000 ekin = 4.18088462864216 | erot = 3.21190204009032 | epot = -36.2481677379304 | etot = -28.8553810691979 +718000 ekin = 4.03231025467992 | erot = 2.91104295996765 | epot = -36.1402693367145 | etot = -29.196916122067 +719000 ekin = 3.97260579411936 | erot = 3.29783620298701 | epot = -36.0849771003507 | etot = -28.8145351032443 +720000 ekin = 3.82567789821418 | erot = 3.46218504309359 | epot = -36.1068353452668 | etot = -28.818972403959 +721000 ekin = 3.83433718059127 | erot = 4.03084036947922 | epot = -36.1868958046435 | etot = -28.321718254573 +722000 ekin = 3.7130087276568 | erot = 3.84736896155859 | epot = -36.2838656104841 | etot = -28.7234879212687 +723000 ekin = 3.74703466957696 | erot = 3.71040850656983 | epot = -36.3812410760553 | etot = -28.9237978999085 +724000 ekin = 3.75607081603443 | erot = 4.02813532874788 | epot = -36.4992818358981 | etot = -28.7150756911158 +725000 ekin = 3.77808990085885 | erot = 4.20966764087265 | epot = -36.6263500488386 | etot = -28.6385925071071 +726000 ekin = 3.99703012102755 | erot = 3.67945861038478 | epot = -36.7651398392487 | etot = -29.0886511078363 +727000 ekin = 4.01741049095273 | erot = 3.72684228835856 | epot = -36.8887239674894 | etot = -29.1444711881781 +728000 ekin = 4.05655244457389 | erot = 3.64411335656528 | epot = -36.9831032192825 | etot = -29.2824374181433 +729000 ekin = 4.15914112670555 | erot = 3.22368867517415 | epot = -37.0758214193937 | etot = -29.692991617514 +730000 ekin = 4.27496625989352 | erot = 3.03434396509935 | epot = -37.1060663359384 | etot = -29.7967561109456 +731000 ekin = 4.35621946146742 | erot = 3.31453862248463 | epot = -37.0811379025023 | etot = -29.4103798185503 +732000 ekin = 4.31460322853858 | erot = 3.19560214587386 | epot = -37.0358028654693 | etot = -29.5255974910568 +733000 ekin = 4.2295226795695 | erot = 3.20037871937962 | epot = -36.9673423522061 | etot = -29.537440953257 +734000 ekin = 4.24709820971147 | erot = 3.10598269123683 | epot = -36.8800091287772 | etot = -29.5269282278289 +735000 ekin = 4.14981162925897 | erot = 3.12549638567468 | epot = -36.7838119752116 | etot = -29.508503960278 +736000 ekin = 4.20814181481824 | erot = 2.91522500178861 | epot = -36.7063833852233 | etot = -29.5830165686164 +737000 ekin = 4.01828120268193 | erot = 2.40495812578651 | epot = -36.6589611248533 | etot = -30.2357217963848 +738000 ekin = 4.01094036028549 | erot = 2.68632566149055 | epot = -36.6548343802808 | etot = -29.9575683585048 +739000 ekin = 4.14661584174142 | erot = 2.59506078530577 | epot = -36.6780631105738 | etot = -29.9363864835266 +740000 ekin = 4.08413039710925 | erot = 2.57365823993747 | epot = -36.7021237291546 | etot = -30.0443350921079 +741000 ekin = 4.10845660619181 | erot = 2.78416335535206 | epot = -36.7754492326706 | etot = -29.8828292711267 +742000 ekin = 4.09068760907163 | erot = 3.09866824560576 | epot = -36.8187451874485 | etot = -29.6293893327711 +743000 ekin = 3.96610963094402 | erot = 3.04878673776408 | epot = -36.8535622197241 | etot = -29.838665851016 +744000 ekin = 3.97087885402719 | erot = 3.04950786237685 | epot = -36.8512621314634 | etot = -29.8308754150594 +745000 ekin = 3.78295099566376 | erot = 3.09154774657146 | epot = -36.8410165021252 | etot = -29.96651775989 +746000 ekin = 3.88442560568396 | erot = 3.15773579416763 | epot = -36.8645704531019 | etot = -29.8224090532503 +747000 ekin = 3.94794600572092 | erot = 3.04363515896551 | epot = -36.9228275975776 | etot = -29.9312464328912 +748000 ekin = 3.94186404778235 | erot = 3.24130800398347 | epot = -37.0438118681966 | etot = -29.8606398164308 +749000 ekin = 3.93262026571516 | erot = 3.71710044171151 | epot = -37.210963278996 | etot = -29.5612425715694 +750000 ekin = 3.82713052636346 | erot = 4.02486049381691 | epot = -37.385471620714 | etot = -29.5334806005336 +751000 ekin = 4.02336237199802 | erot = 4.23099342037285 | epot = -37.5518597142007 | etot = -29.2975039218298 +752000 ekin = 4.06152925020837 | erot = 3.76231639564619 | epot = -37.6809132611595 | etot = -29.8570676153049 +753000 ekin = 4.07859449790949 | erot = 3.97018598947847 | epot = -37.7593004103674 | etot = -29.7105199229794 +754000 ekin = 4.26771269586214 | erot = 4.64006960442373 | epot = -37.8141557249888 | etot = -28.9063734247029 +755000 ekin = 4.26666906965093 | erot = 4.77784474773889 | epot = -37.8576299963078 | etot = -28.8131161789179 +756000 ekin = 4.2913114700946 | erot = 5.38525988164132 | epot = -37.8917845570772 | etot = -28.2152132053412 +757000 ekin = 4.35562563894453 | erot = 5.14819699923274 | epot = -37.8935376948375 | etot = -28.3897150566602 +758000 ekin = 4.22616249374932 | erot = 5.19713356473755 | epot = -37.890171313439 | etot = -28.4668752549521 +759000 ekin = 4.24184449956944 | erot = 5.16496183591484 | epot = -37.8881235068873 | etot = -28.481317171403 +760000 ekin = 4.23424644958301 | erot = 5.47628298706072 | epot = -37.9000330984149 | etot = -28.1895036617712 +761000 ekin = 4.26448749341469 | erot = 5.45907771030503 | epot = -37.9055730645743 | etot = -28.1820078608546 +762000 ekin = 4.22061932798692 | erot = 5.04369074313446 | epot = -37.9108772679031 | etot = -28.6465671967817 +763000 ekin = 4.09989014592102 | erot = 5.10778066514902 | epot = -37.9045250455542 | etot = -28.6968542344841 +764000 ekin = 4.18374834614763 | erot = 5.46818179899514 | epot = -37.8676566747109 | etot = -28.2157265295681 +765000 ekin = 4.08761418374972 | erot = 5.8085838804908 | epot = -37.8033181876409 | etot = -27.9071201234004 +766000 ekin = 4.0399954168056 | erot = 5.48136006660783 | epot = -37.7411893537017 | etot = -28.2198338702883 +767000 ekin = 4.01701285460552 | erot = 5.31665044278829 | epot = -37.6438611160235 | etot = -28.3101978186297 +768000 ekin = 3.97951625206149 | erot = 5.25792422549898 | epot = -37.5214426737382 | etot = -28.2840021961778 +769000 ekin = 3.9904400552595 | erot = 5.21175341266091 | epot = -37.3810973556055 | etot = -28.1789038876851 +770000 ekin = 3.99199742512277 | erot = 5.21810902470249 | epot = -37.1986211065242 | etot = -27.9885146566989 +771000 ekin = 3.82567851870305 | erot = 4.95130845103932 | epot = -36.9906650314374 | etot = -28.213678061695 +772000 ekin = 3.72123202682396 | erot = 4.74084322348116 | epot = -36.7445513213713 | etot = -28.2824760710662 +773000 ekin = 3.61186619870637 | erot = 4.48764169415196 | epot = -36.4404296879 | etot = -28.3409217950417 +774000 ekin = 3.5323856332149 | erot = 4.0851560641829 | epot = -36.1430482929722 | etot = -28.5255065955744 +775000 ekin = 3.61960121968643 | erot = 4.03007080844262 | epot = -35.8636424209038 | etot = -28.2139703927748 +776000 ekin = 3.50131397859944 | erot = 3.82783005287474 | epot = -35.5938202085534 | etot = -28.2646761770792 +777000 ekin = 3.4086720204846 | erot = 3.85221546935551 | epot = -35.4006619567329 | etot = -28.1397744668928 +778000 ekin = 3.45838031028943 | erot = 3.51853820068418 | epot = -35.2979750992092 | etot = -28.3210565882356 +779000 ekin = 3.42307480042057 | erot = 3.59321040457246 | epot = -35.2809430031764 | etot = -28.2646577981833 +780000 ekin = 3.42440692402825 | erot = 3.60521054559613 | epot = -35.3411249792481 | etot = -28.3115075096237 +781000 ekin = 3.46934151467246 | erot = 3.84731508491177 | epot = -35.4518670976751 | etot = -28.1352104980909 +782000 ekin = 3.5271040668097 | erot = 4.28376670942143 | epot = -35.595026056589 | etot = -27.7841552803579 +783000 ekin = 3.61729821661169 | erot = 4.75537078140916 | epot = -35.7562125383807 | etot = -27.3835435403599 +784000 ekin = 3.5836655359854 | erot = 4.1138012313496 | epot = -35.8708728516423 | etot = -28.1734060843073 +785000 ekin = 3.63226984987313 | erot = 4.14613629449608 | epot = -35.9549809353083 | etot = -28.1765747909391 +786000 ekin = 3.55353155352361 | erot = 3.96170523540214 | epot = -36.0104316125812 | etot = -28.4951948236555 +787000 ekin = 3.65679390509628 | erot = 4.13482060006033 | epot = -36.0644977241106 | etot = -28.272883218954 +788000 ekin = 3.86757699285448 | erot = 4.10779053552829 | epot = -36.0997261456416 | etot = -28.1243586172588 +789000 ekin = 3.93645468275084 | erot = 4.27766163431728 | epot = -36.1406694170053 | etot = -27.9265530999371 +790000 ekin = 3.99051031327637 | erot = 3.95340487784933 | epot = -36.2018617372706 | etot = -28.257946546145 +791000 ekin = 4.10452718423621 | erot = 3.99235351847229 | epot = -36.2624115283487 | etot = -28.1655308256402 +792000 ekin = 4.33302884516885 | erot = 3.8304429162738 | epot = -36.335701261074 | etot = -28.1722294996313 +793000 ekin = 4.59966330091451 | erot = 3.74212535974463 | epot = -36.4314410279318 | etot = -28.0896523672727 +794000 ekin = 4.70509453522008 | erot = 3.7325457155236 | epot = -36.5039677226926 | etot = -28.0663274719489 +795000 ekin = 4.8237350135353 | erot = 3.69936645898633 | epot = -36.5467302591204 | etot = -28.0236287865987 +796000 ekin = 5.02825099690258 | erot = 3.65845895224835 | epot = -36.5441938749373 | etot = -27.8574839257863 +797000 ekin = 4.98369350470464 | erot = 3.33483563015714 | epot = -36.5302539300605 | etot = -28.2117247951988 +798000 ekin = 5.04627515833455 | erot = 3.251844315584 | epot = -36.5269098314607 | etot = -28.2287903575422 +799000 ekin = 4.96165968599494 | erot = 3.39539196017299 | epot = -36.5580084896278 | etot = -28.2009568434598 +800000 ekin = 4.96087289523802 | erot = 3.54932033291718 | epot = -36.6052154994154 | etot = -28.0950222712602 +801000 ekin = 4.96148873220024 | erot = 3.39995120227887 | epot = -36.6619752973816 | etot = -28.3005353629025 +802000 ekin = 4.86744715226323 | erot = 3.35338258088299 | epot = -36.6942224647938 | etot = -28.4733927316476 +803000 ekin = 4.75056128639553 | erot = 3.25410486957708 | epot = -36.7045390401517 | etot = -28.6998728841791 +804000 ekin = 4.78109129200108 | erot = 3.0776597288298 | epot = -36.698526519421 | etot = -28.8397754985901 +805000 ekin = 4.82892493818665 | erot = 3.27499533781798 | epot = -36.6737874267413 | etot = -28.5698671507367 +806000 ekin = 4.74542372520114 | erot = 3.18323237798552 | epot = -36.6406513076392 | etot = -28.7119952044525 +807000 ekin = 4.64766139287985 | erot = 3.38424960796022 | epot = -36.6476730883982 | etot = -28.6157620875581 +808000 ekin = 4.45707835864346 | erot = 3.35175675914227 | epot = -36.7022500935515 | etot = -28.8934149757658 +809000 ekin = 4.32670887591497 | erot = 3.3204635551547 | epot = -36.7741824114222 | etot = -29.1270099803525 +810000 ekin = 4.19642960492062 | erot = 3.20396083815671 | epot = -36.8832195227742 | etot = -29.4828290796969 +811000 ekin = 4.18603442116872 | erot = 3.54097838794675 | epot = -37.0402774324897 | etot = -29.3132646233742 +812000 ekin = 4.3319099162396 | erot = 3.67977508148913 | epot = -37.2334955671967 | etot = -29.221810569468 +813000 ekin = 4.46701990899706 | erot = 3.84749046887719 | epot = -37.4770063129616 | etot = -29.1624959350873 +814000 ekin = 4.70593563863212 | erot = 4.02074050200669 | epot = -37.7739765579907 | etot = -29.0473004173519 +815000 ekin = 4.61635561952459 | erot = 4.30893882425418 | epot = -38.0622407069025 | etot = -29.1369462631237 +816000 ekin = 4.66419241223221 | erot = 4.43348416466983 | epot = -38.3533945439932 | etot = -29.2557179670912 +817000 ekin = 4.61492034782011 | erot = 4.8589683614048 | epot = -38.6054729848476 | etot = -29.1315842756226 +818000 ekin = 4.69361355558547 | erot = 4.57560992803662 | epot = -38.8141140205618 | etot = -29.5448905369397 +819000 ekin = 4.99561997491401 | erot = 4.59057590873866 | epot = -38.986131465386 | etot = -29.3999355817333 +820000 ekin = 5.14251771001076 | erot = 4.38257454602465 | epot = -39.1119793527868 | etot = -29.5868870967514 +821000 ekin = 5.21211790510897 | erot = 3.7649363964534 | epot = -39.1791873910089 | etot = -30.2021330894465 +822000 ekin = 5.2276374734314 | erot = 3.8199393472184 | epot = -39.2257832500633 | etot = -30.1782064294135 +823000 ekin = 5.20824824630017 | erot = 3.61818509207455 | epot = -39.2577442235125 | etot = -30.4313108851377 +824000 ekin = 5.29481176258827 | erot = 3.61607107182776 | epot = -39.2930045776047 | etot = -30.3821217431886 +825000 ekin = 5.34590564278664 | erot = 3.4760580167516 | epot = -39.3020776711423 | etot = -30.4801140116041 +826000 ekin = 5.38005087585455 | erot = 3.56002985231027 | epot = -39.2878928900547 | etot = -30.3478121618899 +827000 ekin = 5.38251681844102 | erot = 3.31581026558379 | epot = -39.283897328375 | etot = -30.5855702443502 +828000 ekin = 5.30162295798549 | erot = 2.79999506814083 | epot = -39.2990437954937 | etot = -31.1974257693674 +829000 ekin = 5.34935471298301 | erot = 2.6338075385136 | epot = -39.3079384502704 | etot = -31.3247761987738 +830000 ekin = 5.15642397228145 | erot = 2.78944963382923 | epot = -39.3294203636002 | etot = -31.3835467574896 +831000 ekin = 5.04271329110473 | erot = 3.07984504895606 | epot = -39.3562191308944 | etot = -31.2336607908336 +832000 ekin = 5.04415123872855 | erot = 3.36917057661115 | epot = -39.3458026730645 | etot = -30.9324808577248 +833000 ekin = 4.97652700754261 | erot = 3.11016826810616 | epot = -39.3003589046717 | etot = -31.2136636290229 +834000 ekin = 4.66785324148471 | erot = 2.98799062968103 | epot = -39.2007615011679 | etot = -31.5449176300022 +835000 ekin = 4.4196794841071 | erot = 3.24754240638097 | epot = -39.0370935965117 | etot = -31.3698717060237 +836000 ekin = 4.1939950117267 | erot = 3.40709899396284 | epot = -38.8824429433984 | etot = -31.2813489377089 +837000 ekin = 4.05102708476636 | erot = 3.50403284169154 | epot = -38.7291298465769 | etot = -31.174069920119 +838000 ekin = 3.94991363719784 | erot = 3.82377156946596 | epot = -38.5557937558062 | etot = -30.7821085491424 +839000 ekin = 3.74326665318806 | erot = 3.97324655976055 | epot = -38.364381604374 | etot = -30.6478683914254 +840000 ekin = 3.7035157452831 | erot = 3.5124488621716 | epot = -38.1559200259235 | etot = -30.9399554184688 +841000 ekin = 3.60547887438446 | erot = 3.69151206404978 | epot = -37.9552189953856 | etot = -30.6582280569514 +842000 ekin = 3.38591284746056 | erot = 3.48115901302566 | epot = -37.7647482919521 | etot = -30.8976764314659 +843000 ekin = 3.11807787995921 | erot = 3.24962582172021 | epot = -37.5931200484574 | etot = -31.225416346778 +844000 ekin = 3.03125896851729 | erot = 3.10915311466668 | epot = -37.4053554848136 | etot = -31.2649434016296 +845000 ekin = 2.84759324027404 | erot = 3.53115382226703 | epot = -37.2260086331777 | etot = -30.8472615706367 +846000 ekin = 2.83613069836942 | erot = 3.41497522988127 | epot = -37.085320604792 | etot = -30.8342146765413 +847000 ekin = 2.82518542790909 | erot = 3.92646137605455 | epot = -36.9740965925522 | etot = -30.2224497885886 +848000 ekin = 2.8035610196741 | erot = 3.75897131812056 | epot = -36.8749675315763 | etot = -30.3124351937817 +849000 ekin = 2.84159199816875 | erot = 3.65493979263097 | epot = -36.7798908055852 | etot = -30.2833590147855 +850000 ekin = 2.91517374365839 | erot = 3.25543936029153 | epot = -36.7388454898332 | etot = -30.5682323858832 +851000 ekin = 3.08764953673805 | erot = 3.74455145978084 | epot = -36.722364218189 | etot = -29.8901632216702 +852000 ekin = 3.20356705871957 | erot = 3.86422941824788 | epot = -36.7413165099185 | etot = -29.6735200329511 +853000 ekin = 3.25796036952423 | erot = 4.25509323905633 | epot = -36.7658517979734 | etot = -29.2527981893928 +854000 ekin = 3.57244822927295 | erot = 4.1896974412388 | epot = -36.8021340521276 | etot = -29.0399883816159 +855000 ekin = 3.61706783412956 | erot = 4.16292249791868 | epot = -36.8626923862697 | etot = -29.0827020542215 +856000 ekin = 3.78538239756072 | erot = 4.11253551603666 | epot = -36.9244661414333 | etot = -29.0265482278359 +857000 ekin = 3.7817884765619 | erot = 4.13628071929874 | epot = -37.0292483027729 | etot = -29.1111791069122 +858000 ekin = 3.79767899411331 | erot = 4.25390024597203 | epot = -37.1883443366328 | etot = -29.1367650965475 +859000 ekin = 3.79646558910377 | erot = 4.39490149089977 | epot = -37.3423128301967 | etot = -29.1509457501932 +860000 ekin = 3.86711139340926 | erot = 4.91957560544857 | epot = -37.4915022932785 | etot = -28.7048152944207 +861000 ekin = 3.99177075241504 | erot = 4.92589410247942 | epot = -37.5868681074784 | etot = -28.6692032525839 +862000 ekin = 4.0977748877086 | erot = 4.85487231115065 | epot = -37.6175250863704 | etot = -28.6648778875111 +863000 ekin = 4.13925231113692 | erot = 4.50896117392355 | epot = -37.5986086016775 | etot = -28.950395116617 +864000 ekin = 4.14764866587724 | erot = 4.42487018235684 | epot = -37.5204132439163 | etot = -28.9478943956823 +865000 ekin = 4.14664914911426 | erot = 4.25648196395736 | epot = -37.3939280409738 | etot = -28.9907969279022 +866000 ekin = 4.14214320133934 | erot = 4.18089045470177 | epot = -37.217946082973 | etot = -28.8949124269318 +867000 ekin = 4.2533355578306 | erot = 3.91180056252889 | epot = -37.0368358637666 | etot = -28.8716997434071 +868000 ekin = 4.25544635673827 | erot = 4.03934502097174 | epot = -36.892523740773 | etot = -28.597732363063 +869000 ekin = 4.24112681076909 | erot = 4.01454747654454 | epot = -36.8084367274645 | etot = -28.5527624401508 +870000 ekin = 4.33478513328131 | erot = 3.78349131069572 | epot = -36.7681636745504 | etot = -28.6498872305733 +871000 ekin = 4.17502061004023 | erot = 3.95421063049773 | epot = -36.7899780247081 | etot = -28.6607467841701 +872000 ekin = 4.17603847735526 | erot = 3.83768938083062 | epot = -36.8688005631066 | etot = -28.8550727049207 +873000 ekin = 4.41693719639203 | erot = 4.07505566261082 | epot = -36.9767379853334 | etot = -28.4847451263305 +874000 ekin = 4.41295334009184 | erot = 4.18394759912804 | epot = -37.1369142438381 | etot = -28.5400133046182 +875000 ekin = 4.52955334955961 | erot = 4.19580464694757 | epot = -37.3370998777392 | etot = -28.611741881232 +876000 ekin = 4.61247068682171 | erot = 4.50897081856651 | epot = -37.5248349335733 | etot = -28.4033934281851 +877000 ekin = 4.76533246609024 | erot = 4.08201826718837 | epot = -37.6873606048119 | etot = -28.8400098715333 +878000 ekin = 4.8610970109619 | erot = 4.033155729642 | epot = -37.8092910984767 | etot = -28.9150383578728 +879000 ekin = 4.93322526419523 | erot = 3.94479688455364 | epot = -37.8433128250758 | etot = -28.965290676327 +880000 ekin = 4.91177719282767 | erot = 3.90966953329197 | epot = -37.7988935874806 | etot = -28.9774468613609 +881000 ekin = 4.87595051611486 | erot = 3.76638474532604 | epot = -37.6791282073033 | etot = -29.0367929458624 +882000 ekin = 4.80398792776863 | erot = 3.52725045146498 | epot = -37.4958553191656 | etot = -29.164616939932 +883000 ekin = 4.56372183806134 | erot = 3.17268134770781 | epot = -37.3026048485108 | etot = -29.5662016627417 +884000 ekin = 4.38408070690848 | erot = 2.95287988074379 | epot = -37.1164899885588 | etot = -29.7795294009065 +885000 ekin = 4.2140126763182 | erot = 3.28627816383894 | epot = -36.942394624606 | etot = -29.4421037844489 +886000 ekin = 3.94208450896381 | erot = 3.61827008671528 | epot = -36.8244889717495 | etot = -29.2641343760704 +887000 ekin = 3.76025689669878 | erot = 3.89282193563174 | epot = -36.7542446517018 | etot = -29.1011658193713 +888000 ekin = 3.58518173626509 | erot = 4.10918051627072 | epot = -36.7235080282654 | etot = -29.0291457757296 +889000 ekin = 3.52227905599303 | erot = 4.53948895643315 | epot = -36.7423345916829 | etot = -28.6805665792567 +890000 ekin = 3.48725850687851 | erot = 4.9165184567076 | epot = -36.8110749451072 | etot = -28.4072979815211 +891000 ekin = 3.51807183016932 | erot = 5.36785996032727 | epot = -36.9187079043847 | etot = -28.0327761138882 +892000 ekin = 3.486514414829 | erot = 5.25687644163098 | epot = -37.0005216584193 | etot = -28.2571308019593 +893000 ekin = 3.51467838155448 | erot = 5.65149044087548 | epot = -37.0594453420589 | etot = -27.8932765196289 +894000 ekin = 3.45974654612958 | erot = 5.22169711042558 | epot = -37.102064267985 | etot = -28.4206206114299 +895000 ekin = 3.57216437063937 | erot = 5.40895067977451 | epot = -37.1028729086238 | etot = -28.1217578582099 +896000 ekin = 3.56655921068659 | erot = 5.69090228219611 | epot = -37.0708217415226 | etot = -27.8133602486399 +897000 ekin = 3.57757547803441 | erot = 5.90228049359103 | epot = -36.985951453297 | etot = -27.5060954816716 +898000 ekin = 3.52295514054554 | erot = 5.8453836024045 | epot = -36.8484715408739 | etot = -27.4801327979239 +899000 ekin = 3.42191869064122 | erot = 5.47174915922149 | epot = -36.6856616378138 | etot = -27.7919937879511 +900000 ekin = 3.45720121517251 | erot = 5.5997377251197 | epot = -36.5148133918243 | etot = -27.4578744515321 +901000 ekin = 3.51607619901873 | erot = 5.88763510779633 | epot = -36.2859464010554 | etot = -26.8822350942404 +902000 ekin = 3.56087621117599 | erot = 5.17399063106631 | epot = -36.0621785767821 | etot = -27.3273117345398 +903000 ekin = 3.56470936099584 | erot = 5.07361698005476 | epot = -35.8794588183591 | etot = -27.2411324773085 +904000 ekin = 3.64294879518974 | erot = 5.28022715353087 | epot = -35.7543216612797 | etot = -26.8311457125591 +905000 ekin = 3.72447152602649 | erot = 5.02657007424407 | epot = -35.658280490972 | etot = -26.9072388907014 +906000 ekin = 3.7591413367746 | erot = 4.63070748715657 | epot = -35.6129995043961 | etot = -27.2231506804649 +907000 ekin = 4.00046169414905 | erot = 4.63743176602948 | epot = -35.6087015116484 | etot = -26.9708080514698 +908000 ekin = 3.98050966425778 | erot = 4.23795607914778 | epot = -35.6020003534093 | etot = -27.3835346100038 +909000 ekin = 4.14488755713113 | erot = 3.77771446920632 | epot = -35.5819012555779 | etot = -27.6592992292404 +910000 ekin = 4.18878899263847 | erot = 3.85878998652442 | epot = -35.5853308204837 | etot = -27.5377518413208 +911000 ekin = 4.15448454865027 | erot = 3.93063753948133 | epot = -35.6075046071671 | etot = -27.5223825190355 +912000 ekin = 4.30922033403085 | erot = 4.53644215925813 | epot = -35.6368602869792 | etot = -26.7911977936902 +913000 ekin = 4.42050627097881 | erot = 4.36559538893036 | epot = -35.6635505470016 | etot = -26.8774488870924 +914000 ekin = 4.640384167071 | erot = 4.57708989772434 | epot = -35.6621612967503 | etot = -26.4446872319549 +915000 ekin = 4.71121950508134 | erot = 4.34018648406978 | epot = -35.6015140360078 | etot = -26.5501080468567 +916000 ekin = 4.67735943326423 | erot = 4.0723772918907 | epot = -35.4903050476411 | etot = -26.7405683224862 +917000 ekin = 4.78142703706188 | erot = 4.20198791892984 | epot = -35.3917685265255 | etot = -26.4083535705337 +918000 ekin = 4.77421198697552 | erot = 4.42971373988936 | epot = -35.2582637676415 | etot = -26.0543380407766 +919000 ekin = 4.73422216253545 | erot = 4.77044814340035 | epot = -35.0931913565727 | etot = -25.5885210506369 +920000 ekin = 4.64583700130455 | erot = 4.69774436792038 | epot = -34.9395895324828 | etot = -25.5960081632579 +921000 ekin = 4.61516328270518 | erot = 4.43350879426847 | epot = -34.8128426462836 | etot = -25.7641705693099 +922000 ekin = 4.55621337364702 | erot = 4.21768777753359 | epot = -34.7312720351653 | etot = -25.9573708839847 +923000 ekin = 4.59034826680647 | erot = 4.50920703076125 | epot = -34.7044992141191 | etot = -25.6049439165514 +924000 ekin = 4.58356240196665 | erot = 4.62074320796166 | epot = -34.7126986327387 | etot = -25.5083930228104 +925000 ekin = 4.53220072801023 | erot = 4.79254817721209 | epot = -34.7588998026814 | etot = -25.4341508974591 +926000 ekin = 4.55832715206815 | erot = 5.00471911281168 | epot = -34.8080246038137 | etot = -25.2449783389339 +927000 ekin = 4.62575171089295 | erot = 4.71181044830442 | epot = -34.8667293476304 | etot = -25.529167188433 +928000 ekin = 4.68657375207003 | erot = 4.76234601746771 | epot = -34.915949836791 | etot = -25.4670300672533 +929000 ekin = 4.7061028915664 | erot = 5.07097104655604 | epot = -34.9791697926744 | etot = -25.202095854552 +930000 ekin = 4.79474071813729 | erot = 5.21915381885274 | epot = -35.0589708185177 | etot = -25.0450762815277 +931000 ekin = 4.69039359230418 | erot = 5.48593447848777 | epot = -35.1099047138343 | etot = -24.9335766430423 +932000 ekin = 4.71110094603637 | erot = 5.47204685356053 | epot = -35.1612846037812 | etot = -24.9781368041843 +933000 ekin = 4.7636965267817 | erot = 5.41370570081805 | epot = -35.2317575147297 | etot = -25.05435528713 +934000 ekin = 4.8364389439216 | erot = 5.2350863141415 | epot = -35.3109086743972 | etot = -25.2393834163341 +935000 ekin = 4.76586014730834 | erot = 5.228655408338 | epot = -35.3670038676022 | etot = -25.3724883119559 +936000 ekin = 4.7459923218976 | erot = 5.40903849081579 | epot = -35.4141584031058 | etot = -25.2591275903924 +937000 ekin = 4.7066536683933 | erot = 5.90535300927756 | epot = -35.4573569432673 | etot = -24.8453502655964 +938000 ekin = 4.73520980049429 | erot = 5.48994015212968 | epot = -35.4717259493542 | etot = -25.2465759967302 +939000 ekin = 4.66471904112943 | erot = 5.58667162801301 | epot = -35.4363389851247 | etot = -25.1849483159823 +940000 ekin = 4.73670308439586 | erot = 5.59502045341196 | epot = -35.3410735898338 | etot = -25.0093500520259 +941000 ekin = 4.56546752366747 | erot = 5.16939612930364 | epot = -35.2196425314888 | etot = -25.4847788785177 +942000 ekin = 4.36600564083038 | erot = 4.55609433699296 | epot = -35.0782455188793 | etot = -26.156145541056 +943000 ekin = 4.27680501591152 | erot = 4.77186490926151 | epot = -34.9346146494734 | etot = -25.8859447243004 +944000 ekin = 4.17576408255027 | erot = 4.64476704064174 | epot = -34.7936442239037 | etot = -25.9731131007117 +945000 ekin = 4.08165692512656 | erot = 4.64307958397957 | epot = -34.7241648822034 | etot = -25.9994283730973 +946000 ekin = 3.9823833768563 | erot = 4.33903183997624 | epot = -34.720898188062 | etot = -26.3994829712295 +947000 ekin = 4.11312487406737 | erot = 4.25698162025429 | epot = -34.8023164533845 | etot = -26.4322099590628 +948000 ekin = 4.03905965505087 | erot = 4.28038925265714 | epot = -34.928198667426 | etot = -26.608749759718 +949000 ekin = 4.12081251669323 | erot = 4.40083354096753 | epot = -35.1348098866843 | etot = -26.6131638290236 +950000 ekin = 4.19947300195308 | erot = 4.46892156641812 | epot = -35.3299547862415 | etot = -26.6615602178703 +951000 ekin = 4.28802819219167 | erot = 4.3680742443603 | epot = -35.5595339264167 | etot = -26.9034314898647 +952000 ekin = 4.44618066979822 | erot = 4.88998578447886 | epot = -35.776264591199 | etot = -26.4400981369219 +953000 ekin = 4.53022835549443 | erot = 4.90684636989333 | epot = -35.9402525430781 | etot = -26.5031778176903 +954000 ekin = 4.65793433636178 | erot = 4.95789701943152 | epot = -36.1007223995856 | etot = -26.4848910437923 +955000 ekin = 4.68472849923193 | erot = 4.84778271057121 | epot = -36.2250094081872 | etot = -26.692498198384 +956000 ekin = 4.83489144923702 | erot = 4.61252423076074 | epot = -36.2912267944626 | etot = -26.8438111144649 +957000 ekin = 4.83158754758543 | erot = 4.06427874835662 | epot = -36.3314048744461 | etot = -27.4355385785041 +958000 ekin = 4.95872508890491 | erot = 3.86764289322934 | epot = -36.3554965538449 | etot = -27.5291285717106 +959000 ekin = 4.88220034385557 | erot = 3.76501141985199 | epot = -36.3703754351835 | etot = -27.7231636714759 +960000 ekin = 4.96739750076083 | erot = 3.70143986321351 | epot = -36.3537104260526 | etot = -27.6848730620782 +961000 ekin = 5.05073619223015 | erot = 3.58723306284219 | epot = -36.3292284086185 | etot = -27.6912591535462 +962000 ekin = 5.10220917296402 | erot = 3.43365806618123 | epot = -36.292660732266 | etot = -27.7567934931207 +963000 ekin = 5.25727455724231 | erot = 3.39047088285751 | epot = -36.2233249912108 | etot = -27.5755795511109 +964000 ekin = 5.33892942752122 | erot = 3.38850636488222 | epot = -36.1631800361608 | etot = -27.4357442437574 +965000 ekin = 5.29707309584692 | erot = 3.40709075904033 | epot = -36.114647791191 | etot = -27.4104839363038 +966000 ekin = 5.27380254283779 | erot = 3.34984185029608 | epot = -36.0934598827398 | etot = -27.4698154896059 +967000 ekin = 5.19975037009087 | erot = 3.54967607074493 | epot = -36.1222651146705 | etot = -27.3728386738347 +968000 ekin = 5.22098509097161 | erot = 3.38920040678115 | epot = -36.1570868906189 | etot = -27.5469013928661 +969000 ekin = 5.01248198517091 | erot = 3.26201512253216 | epot = -36.2130447987696 | etot = -27.9385476910665 +970000 ekin = 4.97914863237121 | erot = 3.76343819077309 | epot = -36.2895058744048 | etot = -27.5469190512605 +971000 ekin = 5.04224300192755 | erot = 3.59024832311355 | epot = -36.3590409977773 | etot = -27.7265496727362 +972000 ekin = 5.05787332232144 | erot = 3.83558558676212 | epot = -36.3997125264357 | etot = -27.5062536173522 +973000 ekin = 5.01777031588903 | erot = 3.27986497682672 | epot = -36.416683733591 | etot = -28.1190484408752 +974000 ekin = 4.96186842907965 | erot = 3.23479851019082 | epot = -36.4352005399287 | etot = -28.2385336006583 +975000 ekin = 4.97224363278484 | erot = 3.35077904927885 | epot = -36.455709806026 | etot = -28.1326871239623 +976000 ekin = 5.01625531380467 | erot = 3.41837200675027 | epot = -36.4643526378165 | etot = -28.0297253172615 +977000 ekin = 5.04359880486621 | erot = 3.40669885598948 | epot = -36.4673967616861 | etot = -28.0170991008304 +978000 ekin = 4.96814116021997 | erot = 3.3988542289389 | epot = -36.4671439769023 | etot = -28.1001485877434 +979000 ekin = 4.68494120169423 | erot = 3.87226166481182 | epot = -36.4696261904956 | etot = -27.9124233239896 +980000 ekin = 4.80514576213004 | erot = 3.73614562894118 | epot = -36.4753768381447 | etot = -27.9340854470735 +981000 ekin = 4.85375109376568 | erot = 4.35522911700057 | epot = -36.4902775794649 | etot = -27.2812973686986 +982000 ekin = 4.79648806853534 | erot = 4.15595945903824 | epot = -36.5084812040043 | etot = -27.5560336764307 +983000 ekin = 4.75907969484559 | erot = 4.43556787871588 | epot = -36.5083539693089 | etot = -27.3137063957474 +984000 ekin = 4.81598118844461 | erot = 4.52957555705406 | epot = -36.5383410952792 | etot = -27.1927843497806 +985000 ekin = 4.87924474651563 | erot = 4.3163097901408 | epot = -36.5777006480737 | etot = -27.3821461114172 +986000 ekin = 4.77128314225264 | erot = 4.12408981491538 | epot = -36.5819281400493 | etot = -27.6865551828813 +987000 ekin = 4.70900566206954 | erot = 4.08922713836853 | epot = -36.5892891612702 | etot = -27.7910563608322 +988000 ekin = 4.69685644927805 | erot = 4.03217145235649 | epot = -36.6289948782911 | etot = -27.8999669766566 +989000 ekin = 4.56955203825868 | erot = 4.16364650343098 | epot = -36.6885496975511 | etot = -27.9553511558614 +990000 ekin = 4.56207337975407 | erot = 3.92865148644803 | epot = -36.7375440238769 | etot = -28.2468191576748 +991000 ekin = 4.45863269474038 | erot = 3.99370804360135 | epot = -36.8046932644695 | etot = -28.3523525261278 +992000 ekin = 4.52516169638379 | erot = 4.19036473784521 | epot = -36.90459516699 | etot = -28.189068732761 +993000 ekin = 4.26593637771868 | erot = 4.55899726308546 | epot = -37.028392229238 | etot = -28.2034585884339 +994000 ekin = 4.14968593988764 | erot = 4.67871188882305 | epot = -37.1561829580787 | etot = -28.327785129368 +995000 ekin = 4.20875361665793 | erot = 4.51127733270572 | epot = -37.2858931380942 | etot = -28.5658621887305 +996000 ekin = 4.10968366764503 | erot = 4.2587192792391 | epot = -37.3745810703572 | etot = -29.006178123473 +997000 ekin = 4.00616178452013 | erot = 4.48911641516102 | epot = -37.4314666701193 | etot = -28.9361884704382 +998000 ekin = 4.02180091280217 | erot = 4.35841167717868 | epot = -37.4443636100146 | etot = -29.0641510200337 +999000 ekin = 4.07504562976173 | erot = 4.26230873450589 | epot = -37.4098012996895 | etot = -29.0724469354219 +1000000 ekin = 3.90433765201102 | erot = 4.668818882285 | epot = -37.3063332342176 | etot = -28.7331766999216 + 1000000 0.10411567 -1.4674304 0.032571422 -1.2846921 -6.6175275e-05 64000 +Loop time of 50.1084 on 4 procs for 1000000 steps with 26 atoms + +Performance: 17242.621 tau/day, 19956.737 timesteps/s +99.6% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 23.546 | 32.709 | 41.497 | 153.6 | 65.28 +Bond | 0.51019 | 0.67522 | 0.82925 | 17.7 | 1.35 +Neigh | 0.014865 | 0.014889 | 0.014927 | 0.0 | 0.03 +Comm | 4.26 | 12.866 | 21.787 | 239.8 | 25.68 +Output | 0.13375 | 0.1515 | 0.15811 | 2.6 | 0.30 +Modify | 1.6128 | 2.2213 | 2.8367 | 40.6 | 4.43 +Other | | 1.47 | | | 2.93 + +Nlocal: 6.50000 ave 10 max 3 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Nghost: 19.5000 ave 23 max 16 min +Histogram: 2 0 0 0 0 0 0 0 0 2 +Neighs: 131.000 ave 195 max 67 min +Histogram: 2 0 0 0 0 0 0 0 0 2 + +Total # of neighbors = 524 +Ave neighs/atom = 20.153846 +Ave special neighs/atom = 5.0769231 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.8.* nocoeff +System init for write_data ... +Total wall time: 0:00:50 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++1 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++1 deleted file mode 100644 index 8f9e9b299e..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++1 +++ /dev/null @@ -1,244 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 10000 -variable efreq equal 10000 - -variable ntype equal 4 - -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 10 delay 0 check yes - -read_data data.duplex4.4type - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 26 atoms - reading velocities ... - 26 velocities - 26 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 24 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.003 seconds -mass * 3.1575 # sets per-type mass if not in data file -set atom * mass 3.1575 # sets per-atom mass - 26 settings made for mass - -group all type 1 4 -26 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - -label loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 1%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+3 -variable comp equal 1+3 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.4type loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 2%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+1 -variable comp equal 2+1 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -next base -jump in.duplex4.4type loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 3%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.4type loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 4%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.4type loop - -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 0.2 0.815 -pair_coeff * * oxdna2/dh 0.1 0.2 0.815 - -# Langevin dynamics -fix 1 all nve/asphere -fix 2 all langevin ${T} ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 0.1 25.0 457145 angmom 10 - -timestep 1e-4 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 10000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -dump out all custom ${ofreq} out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.1.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump_modify out sort id -dump_modify out format line "%d %d %d %13.6le %13.6le %13.6le %d %d %d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le " - -#restart 10000 config0_restart config1_restart - -run 100000 -Neighbor list info ... - update every 10 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 4.6389877 - ghost atom cutoff = 4.6389877 - binsize = 2.3194939, bins = 18 18 18 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 4.638987723814632 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -41.6285382417448 | etot = -41.6285382417448 -Per MPI rank memory allocation (min/avg/max) = 9.771 | 9.771 | 9.771 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.6384018 0.037304147 -1.6010976 6.7769766e-05 -10000 ekin = 0.876675896491307 | erot = 3.01631310953192 | epot = -43.6949424313443 | etot = -39.8019534253211 -20000 ekin = 1.02178060459022 | erot = 1.54107635735041 | epot = -40.2257383206528 | etot = -37.6628813587121 -30000 ekin = 1.77819697871127 | erot = 2.67180081099997 | epot = -40.9840548186678 | etot = -36.5340570289565 -40000 ekin = 2.55095642638533 | erot = 2.97955929579275 | epot = -40.0756048400153 | etot = -34.5450891178372 -50000 ekin = 2.43321388920862 | erot = 3.63137266285959 | epot = -39.3718897377946 | etot = -33.3073031857264 -60000 ekin = 2.51123200110303 | erot = 3.95693243683571 | epot = -38.8877878920178 | etot = -32.4196234540791 -70000 ekin = 3.33444097207872 | erot = 4.12593683683079 | epot = -38.7679893452499 | etot = -31.3076115363404 -80000 ekin = 3.41969296989344 | erot = 3.46589964095079 | epot = -37.5712487729465 | etot = -30.6856561621023 -90000 ekin = 3.53106755106414 | erot = 3.40955821292295 | epot = -35.9319384430368 | etot = -28.9913126790497 -100000 ekin = 3.47860763041501 | erot = 3.95117534418391 | epot = -37.6128506757402 | etot = -30.1830677011413 - 100000 0.09276287 -1.4972391 0.050590991 -1.3128555 0.00017815014 -Loop time of 7.33046 on 1 procs for 100000 steps with 26 atoms - -Performance: 117864.395 tau/day, 13641.712 timesteps/s -99.8% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 6.4814 | 6.4814 | 6.4814 | 0.0 | 88.42 -Bond | 0.16262 | 0.16262 | 0.16262 | 0.0 | 2.22 -Neigh | 4.2e-05 | 4.2e-05 | 4.2e-05 | 0.0 | 0.00 -Comm | 0.019555 | 0.019555 | 0.019555 | 0.0 | 0.27 -Output | 0.00131 | 0.00131 | 0.00131 | 0.0 | 0.02 -Modify | 0.64596 | 0.64596 | 0.64596 | 0.0 | 8.81 -Other | | 0.01961 | | | 0.27 - -Nlocal: 26.0 ave 26.0 max 26.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 299.0 ave 299.0 max 299.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 299 -Ave neighs/atom = 11.5 -Ave special neighs/atom = 5.076923076923077 -Neighbor list builds = 2 -Dangerous builds = 0 - -#write_restart config.${number}.* - - -Total wall time: 0:00:07 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++4 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++4 deleted file mode 100644 index ae55b4c3ae..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.4type.g++4 +++ /dev/null @@ -1,244 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 10000 -variable efreq equal 10000 - -variable ntype equal 4 - -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 10 delay 0 check yes - -read_data data.duplex4.4type - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 26 atoms - reading velocities ... - 26 velocities - 26 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 24 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.004 seconds -mass * 3.1575 # sets per-type mass if not in data file -set atom * mass 3.1575 # sets per-atom mass - 26 settings made for mass - -group all type 1 4 -26 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - -label loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 1%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+3 -variable comp equal 1+3 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.4type loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 2%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+1 -variable comp equal 2+1 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -next base -jump in.duplex4.4type loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 3%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.4type loop -variable base loop ${ntype} -variable base loop 4 - variable basemod equal ${base}%4 - variable basemod equal 4%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.4type loop - -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 0.2 0.815 -pair_coeff * * oxdna2/dh 0.1 0.2 0.815 - -# Langevin dynamics -fix 1 all nve/asphere -fix 2 all langevin ${T} ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 0.1 25.0 457145 angmom 10 - -timestep 1e-4 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 10000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -dump out all custom ${ofreq} out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.1.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump_modify out sort id -dump_modify out format line "%d %d %d %13.6le %13.6le %13.6le %d %d %d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le " - -#restart 10000 config0_restart config1_restart - -run 100000 -Neighbor list info ... - update every 10 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 4.6389877 - ghost atom cutoff = 4.6389877 - binsize = 2.3194939, bins = 18 18 18 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 4.638987723814632 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -41.6285382417448 | etot = -41.6285382417448 -Per MPI rank memory allocation (min/avg/max) = 9.756 | 9.813 | 9.871 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.6384018 0.037304147 -1.6010976 6.7769766e-05 -10000 ekin = 0.705506935391957 | erot = 3.21864563172922 | epot = -44.0640899615318 | etot = -40.1399373944106 -20000 ekin = 1.16547426389222 | erot = 1.69259899672632 | epot = -41.827511978894 | etot = -38.9694387182755 -30000 ekin = 2.07592540045025 | erot = 2.81661265099434 | epot = -41.8258727293348 | etot = -36.9333346778902 -40000 ekin = 3.0352692177735 | erot = 2.43995587980307 | epot = -41.3155342467788 | etot = -35.8403091492022 -50000 ekin = 2.69044710203348 | erot = 2.86176633025683 | epot = -40.5544750556414 | etot = -35.0022616233511 -60000 ekin = 2.90956639769978 | erot = 2.84679944563592 | epot = -39.7474408128141 | etot = -33.9910749694784 -70000 ekin = 1.89941118514544 | erot = 3.71508585194422 | epot = -38.9575890625426 | etot = -33.3430920254529 -80000 ekin = 2.43472912058895 | erot = 3.11589280920166 | epot = -39.844809532279 | etot = -34.2941876024883 -90000 ekin = 2.3759389593227 | erot = 3.25835921096947 | epot = -38.913072246407 | etot = -33.2787740761149 -100000 ekin = 3.23901515322217 | erot = 3.3464944524431 | epot = -38.6302041314432 | etot = -32.044694525778 - 100000 0.086373737 -1.5432369 0.057459797 -1.3611996 7.7958353e-05 -Loop time of 6.09292 on 4 procs for 100000 steps with 26 atoms - -Performance: 141803.976 tau/day, 16412.497 timesteps/s -99.7% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 0.047712 | 2.5625 | 5.2874 | 157.3 | 42.06 -Bond | 0.007398 | 0.053166 | 0.10097 | 19.8 | 0.87 -Neigh | 1.8e-05 | 1.8e-05 | 1.8e-05 | 0.0 | 0.00 -Comm | 0.29205 | 2.9624 | 5.4188 | 143.0 | 48.62 -Output | 0.000866 | 0.00099325 | 0.001303 | 0.0 | 0.02 -Modify | 0.016247 | 0.18354 | 0.37524 | 39.2 | 3.01 -Other | | 0.3303 | | | 5.42 - -Nlocal: 6.5 ave 14.0 max 0.0 min -Histogram: 2 0 0 0 0 0 0 0 1 1 -Nghost: 18.5 ave 24.0 max 12.0 min -Histogram: 1 1 0 0 0 0 0 0 0 2 -Neighs: 113.75 ave 239.0 max 0.0 min -Histogram: 2 0 0 0 0 0 0 0 0 2 - -Total # of neighbors = 455 -Ave neighs/atom = 17.5 -Ave special neighs/atom = 5.076923076923077 -Neighbor list builds = 1 -Dangerous builds = 0 - -#write_restart config.${number}.* - - -Total wall time: 0:00:06 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++1 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++1 deleted file mode 100644 index 023fef7073..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++1 +++ /dev/null @@ -1,286 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 10000 -variable efreq equal 10000 - -variable ntype equal 8 - -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 10 delay 0 check yes - -read_data data.duplex4.8type - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 26 atoms - reading velocities ... - 26 velocities - 26 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 24 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.002 seconds -mass * 3.1575 # sets per-type mass if not in data file -set atom * mass 3.1575 # sets per-atom mass - 26 settings made for mass - -group all type 1 8 -26 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - -label loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 1%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+3 -variable comp equal 1+3 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 2%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+1 -variable comp equal 2+1 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 3%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 4%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 5%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+3 -variable comp equal 5+3 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 5 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 5 8 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 6%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+1 -variable comp equal 6+1 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 6 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 6 7 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 7%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 8%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop - -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 0.2 0.815 -pair_coeff * * oxdna2/dh 0.1 0.2 0.815 - -# Langevin dynamics -fix 1 all nve/asphere -fix 2 all langevin ${T} ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 0.1 25.0 457145 angmom 10 - -timestep 1e-4 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 10000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -dump out all custom ${ofreq} out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.1.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump_modify out sort id -dump_modify out format line "%d %d %d %13.6le %13.6le %13.6le %d %d %d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le " - -#restart 10000 config0_restart config1_restart - -run 100000 -Neighbor list info ... - update every 10 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 4.6389877 - ghost atom cutoff = 4.6389877 - binsize = 2.3194939, bins = 18 18 18 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 4.638987723814632 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -41.6285382417448 | etot = -41.6285382417448 -Per MPI rank memory allocation (min/avg/max) = 9.771 | 9.771 | 9.771 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.6384018 0.037304147 -1.6010976 6.7769766e-05 -10000 ekin = 0.876675896491307 | erot = 3.01631310953192 | epot = -43.6949424313443 | etot = -39.8019534253211 -20000 ekin = 1.02178060459022 | erot = 1.54107635735041 | epot = -40.2257383206528 | etot = -37.6628813587121 -30000 ekin = 1.77819697871127 | erot = 2.67180081099997 | epot = -40.9840548186678 | etot = -36.5340570289565 -40000 ekin = 2.55095642638533 | erot = 2.97955929579275 | epot = -40.0756048400153 | etot = -34.5450891178372 -50000 ekin = 2.43321388920862 | erot = 3.63137266285959 | epot = -39.3718897377946 | etot = -33.3073031857264 -60000 ekin = 2.51123200110303 | erot = 3.95693243683571 | epot = -38.8877878920178 | etot = -32.4196234540791 -70000 ekin = 3.33444097207872 | erot = 4.12593683683079 | epot = -38.7679893452499 | etot = -31.3076115363404 -80000 ekin = 3.41969296989344 | erot = 3.46589964095079 | epot = -37.5712487729465 | etot = -30.6856561621023 -90000 ekin = 3.53106755106414 | erot = 3.40955821292295 | epot = -35.9319384430368 | etot = -28.9913126790497 -100000 ekin = 3.47860763041501 | erot = 3.95117534418391 | epot = -37.6128506757402 | etot = -30.1830677011413 - 100000 0.09276287 -1.4972391 0.050590991 -1.3128555 0.00017815014 -Loop time of 7.44606 on 1 procs for 100000 steps with 26 atoms - -Performance: 116034.458 tau/day, 13429.914 timesteps/s -99.7% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 6.5843 | 6.5843 | 6.5843 | 0.0 | 88.43 -Bond | 0.16149 | 0.16149 | 0.16149 | 0.0 | 2.17 -Neigh | 4.3e-05 | 4.3e-05 | 4.3e-05 | 0.0 | 0.00 -Comm | 0.022595 | 0.022595 | 0.022595 | 0.0 | 0.30 -Output | 0.001492 | 0.001492 | 0.001492 | 0.0 | 0.02 -Modify | 0.65313 | 0.65313 | 0.65313 | 0.0 | 8.77 -Other | | 0.02299 | | | 0.31 - -Nlocal: 26.0 ave 26.0 max 26.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 299.0 ave 299.0 max 299.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 299 -Ave neighs/atom = 11.5 -Ave special neighs/atom = 5.076923076923077 -Neighbor list builds = 2 -Dangerous builds = 0 - -#write_restart config.${number}.* - - -Total wall time: 0:00:07 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++4 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++4 deleted file mode 100644 index c8c3f748f9..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.30Jun20.duplex4.8type.g++4 +++ /dev/null @@ -1,286 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 1 -variable ofreq equal 10000 -variable efreq equal 10000 - -variable ntype equal 8 - -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 10 delay 0 check yes - -read_data data.duplex4.8type - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 26 atoms - reading velocities ... - 26 velocities - 26 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 24 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.004 seconds -mass * 3.1575 # sets per-type mass if not in data file -set atom * mass 3.1575 # sets per-atom mass - 26 settings made for mass - -group all type 1 8 -26 atoms in group all - -# oxDNA bond interactions - FENE backbone -bond_style oxdna2/fene -bond_coeff * 2.0 0.25 0.7564 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxDNA pair interactions -pair_style hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/coaxstk oxdna2/dh -pair_coeff * * oxdna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxdna2/stk seqdep ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/stk seqdep 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.75 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65 -pair_coeff * * oxdna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - -label loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 1%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+3 -variable comp equal 1+3 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 2%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+1 -variable comp equal 2+1 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 3%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 4%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 5%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+3 -variable comp equal 5+3 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 5 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 5 8 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 6%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -variable comp equal ${base}+1 -variable comp equal 6+1 -pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 6 ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 6 7 oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 7%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop -variable base loop ${ntype} -variable base loop 8 - variable basemod equal ${base}%4 - variable basemod equal 8%4 - if "${basemod} == 1" then "variable comp equal ${base}+3" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" - if "${basemod} == 2" then "variable comp equal ${base}+1" "pair_coeff ${base} ${comp} oxdna2/hbond seqdep 1.0678 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45" -next base -jump in.duplex4.8type loop - -pair_coeff * * oxdna2/xstk 47.5 0.575 0.675 0.495 0.655 2.25 0.791592653589793 0.58 1.7 1.0 0.68 1.7 1.0 0.68 1.5 0 0.65 1.7 0.875 0.68 1.7 0.875 0.68 -pair_coeff * * oxdna2/coaxstk 58.5 0.4 0.6 0.22 0.58 2.0 2.891592653589793 0.65 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 40.0 3.116592653589793 -pair_coeff * * oxdna2/dh ${T} 0.2 0.815 -pair_coeff * * oxdna2/dh 0.1 0.2 0.815 - -# Langevin dynamics -fix 1 all nve/asphere -fix 2 all langevin ${T} ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 ${T} 25.0 457145 angmom 10 -fix 2 all langevin 0.1 0.1 25.0 457145 angmom 10 - -timestep 1e-4 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 10000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -dump out all custom ${ofreq} out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.${number}.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump out all custom 10000 out.1.txt id mol type x y z ix iy iz c_quat[1] c_quat[2] c_quat[3] c_quat[4] vx vy vz -dump_modify out sort id -dump_modify out format line "%d %d %d %13.6le %13.6le %13.6le %d %d %d %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le %13.6le " - -#restart 10000 config0_restart config1_restart - -run 100000 -Neighbor list info ... - update every 10 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 4.6389877 - ghost atom cutoff = 4.6389877 - binsize = 2.3194939, bins = 18 18 18 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxdna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxdna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxdna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxdna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxdna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxdna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 4.638987723814632 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -41.6285382417448 | etot = -41.6285382417448 -Per MPI rank memory allocation (min/avg/max) = 9.756 | 9.813 | 9.871 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -1.6384018 0.037304147 -1.6010976 6.7769766e-05 -10000 ekin = 0.705506935391957 | erot = 3.21864563172922 | epot = -44.0640899615318 | etot = -40.1399373944106 -20000 ekin = 1.16547426389222 | erot = 1.69259899672632 | epot = -41.827511978894 | etot = -38.9694387182755 -30000 ekin = 2.07592540045025 | erot = 2.81661265099434 | epot = -41.8258727293348 | etot = -36.9333346778902 -40000 ekin = 3.0352692177735 | erot = 2.43995587980307 | epot = -41.3155342467788 | etot = -35.8403091492022 -50000 ekin = 2.69044710203348 | erot = 2.86176633025683 | epot = -40.5544750556414 | etot = -35.0022616233511 -60000 ekin = 2.90956639769978 | erot = 2.84679944563592 | epot = -39.7474408128141 | etot = -33.9910749694784 -70000 ekin = 1.89941118514544 | erot = 3.71508585194422 | epot = -38.9575890625426 | etot = -33.3430920254529 -80000 ekin = 2.43472912058895 | erot = 3.11589280920166 | epot = -39.844809532279 | etot = -34.2941876024883 -90000 ekin = 2.3759389593227 | erot = 3.25835921096947 | epot = -38.913072246407 | etot = -33.2787740761149 -100000 ekin = 3.23901515322217 | erot = 3.3464944524431 | epot = -38.6302041314432 | etot = -32.044694525778 - 100000 0.086373737 -1.5432369 0.057459797 -1.3611996 7.7958353e-05 -Loop time of 6.15993 on 4 procs for 100000 steps with 26 atoms - -Performance: 140261.437 tau/day, 16233.963 timesteps/s -99.7% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 0.049533 | 2.573 | 5.3124 | 157.6 | 41.77 -Bond | 0.007709 | 0.055244 | 0.10383 | 20.2 | 0.90 -Neigh | 1.8e-05 | 1.875e-05 | 1.9e-05 | 0.0 | 0.00 -Comm | 0.32774 | 3.0114 | 5.4815 | 142.5 | 48.89 -Output | 0.000925 | 0.0010595 | 0.00137 | 0.6 | 0.02 -Modify | 0.016369 | 0.18492 | 0.37491 | 39.3 | 3.00 -Other | | 0.3343 | | | 5.43 - -Nlocal: 6.5 ave 14.0 max 0.0 min -Histogram: 2 0 0 0 0 0 0 0 1 1 -Nghost: 18.5 ave 24.0 max 12.0 min -Histogram: 1 1 0 0 0 0 0 0 0 2 -Neighs: 113.75 ave 239.0 max 0.0 min -Histogram: 2 0 0 0 0 0 0 0 0 2 - -Total # of neighbors = 455 -Ave neighs/atom = 17.5 -Ave special neighs/atom = 5.076923076923077 -Neighbor list builds = 1 -Dangerous builds = 0 - -#write_restart config.${number}.* - - -Total wall time: 0:00:06 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/data.duplex2 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/data.duplex2 new file mode 100644 index 0000000000..8c985708ca --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/data.duplex2 @@ -0,0 +1,91 @@ +LAMMPS data file via write_data, version 27 May 2021 + +16 atoms +4 atom types +13 bonds +1 bond types +16 ellipsoids + +-20 20 xlo xhi +-20 20 ylo yhi +-20 20 zlo zhi + +Masses + +1 3.1575 +2 3.1575 +3 3.1575 +4 3.1575 + +Atoms # hybrid + +1 1 -0.6133472972454725 -0.657478171669766 0.36065226351201896 1 1 3.7269849963023267 0 0 0 +2 2 -0.45262764247356363 -1.0030650534345913 0.7258693379233347 1 1 3.7269849963023267 0 0 0 +3 3 -0.0988342108522641 -1.239775807128057 1.069462285786363 1 1 3.7269849963023267 0 0 0 +4 4 0.2937771854299732 -1.2579750924899842 1.4258916086606965 1 1 3.7269849963023267 0 0 0 +5 1 0.6286896795685137 -1.0183343395119744 1.7689346339672825 1 1 3.7269849963023267 0 0 0 +6 2 0.7901522619067926 -0.6766341805565266 2.1540160705495754 1 1 3.7269849963023267 0 0 0 +7 3 0.7115777184886863 -0.40195579325143455 2.569568683291525 1 1 3.7269849963023267 0 0 0 +8 4 0.46973310377005234 -0.30251697967107033 3.0668007117519216 1 1 3.7269849963023267 0 0 0 +9 1 0.4056113349449848 -1.443775499211898 3.0590726503341124 2 1 3.7269849963023267 0 0 0 +10 2 -0.032028429059287516 -1.2947520971164723 2.7201071151392187 2 1 3.7269849963023267 0 0 0 +11 3 -0.31613855112314065 -0.908414175906161 2.4125207871782006 2 1 3.7269849963023267 0 0 0 +12 4 -0.38939391251821 -0.4866605488242819 2.006177777000426 2 1 3.7269849963023267 0 0 0 +13 1 -0.06232643040853296 -0.07155965522127403 1.5593206052730733 3 1 3.7269849963023267 0 0 0 +14 2 0.17884090390913376 -0.05516721349427172 1.021273149730912 3 1 3.7269849963023267 0 0 0 +15 3 0.4513439961906 -0.23795607383274572 0.5957328539615993 3 1 3.7269849963023267 0 0 0 +16 4 0.5077649359807965 -0.5565625134533538 0.1655875784458841 3 1 3.7269849963023267 0 0 0 + +Velocities + +1 0.05386890022865587 0.02262922525602673 0.24882291144736746 0.1772010258006941 -0.29588531700001014 -0.2624137503614725 +2 -0.03995003075629463 0.26969511063701984 -0.18986454548195664 -0.030614539375968176 -0.11769518931480599 0.040074702426473215 +3 -0.20784535295201376 -0.13628722357673043 -0.06062477950201746 -0.03676034584820381 -0.06308707793373186 -0.14798601576087625 +4 -0.23969824181316998 -0.5624721730878831 0.032474422905036715 -0.16523645965016515 0.2860623077030974 0.33543519753105877 +5 -0.16114897356828353 -0.22889697470760145 -0.13553324962649563 0.07151030852881342 -0.09415592891043179 0.13422881539312292 +6 -0.04701706588477693 0.19216715585110036 0.14588242791297215 0.09218622989776322 -0.5640128930702024 0.09287105657777776 +7 0.05098438305112513 -0.038459555522009595 -0.14244196285749675 0.3479046835475834 0.4244922695910593 -0.13582882604358357 +8 0.37827971348411926 -0.04953992506010833 0.1626392045834847 0.0442887659636129 0.07868414126013584 -0.12713600444325032 +9 0.04912038408665491 0.041260647318716696 0.012223856334495234 0.03282916621721876 -0.00012670547095256 0.155978785417696 +10 0.1939216183073483 0.11075235485381942 -0.0405050516019971 -0.17008135001813812 -0.4563093565840761 -0.30318513627039506 +11 -0.351360733920646 -0.18822419067535692 0.36147938199051305 -0.3708221604627426 -0.49108381825941216 0.09435948331955418 +12 -0.1188642917357977 0.22355282456551884 0.009265586122144348 -0.28230100188858365 0.10276485660828892 0.10175233476780697 +13 -0.1446616296238799 -0.11552059909787235 0.1331477187595642 -0.25498721890374343 0.2754663721641154 0.05806416868630132 +14 0.051547120035862544 -0.36611026510775635 -0.06630782880801242 -0.11999847173316518 0.0684476892288605 0.2161595932308759 +15 -0.20214244962091388 0.23341226933559608 0.008133374252278069 -0.17013911124135248 0.01870292260510287 -0.2682954134361106 +16 -0.19202131162868008 -0.08105295741355378 -0.0469350810885074 0.017332107652647588 -0.32876588862807693 0.1085334141225924 + +Bonds + +1 1 1 2 +2 1 2 3 +3 1 3 4 +4 1 4 5 +5 1 5 6 +6 1 6 7 +7 1 7 8 +8 1 9 10 +9 1 10 11 +10 1 11 12 +11 1 13 14 +12 1 14 15 +13 1 15 16 + +Ellipsoids + +1 1.173984503142341 1.173984503142341 1.173984503142341 0.9964752158482045 -0.053253555733239796 0.011391163807102514 -0.06380787090289707 +2 1.173984503142341 1.173984503142341 1.173984503142341 0.9369923833143513 0.11220716044648564 0.06732538499716349 0.3239168400846305 +3 1.173984503142341 1.173984503142341 1.173984503142341 0.797964932091827 0.14473096354527873 0.18374142699366386 0.5554673737937029 +4 1.173984503142341 1.173984503142341 1.173984503142341 0.5660864821344559 0.14688275499481052 0.09873742533340191 0.8051226439917721 +5 1.173984503142341 1.173984503142341 1.173984503142341 0.2533023785125306 0.12062313161679827 0.08583012223905846 0.9559922359911086 +6 1.173984503142341 1.173984503142341 1.173984503142341 -0.03855807343534716 0.08405913137017908 0.02236505169306371 0.9954632800204194 +7 1.173984503142341 1.173984503142341 1.173984503142341 -0.45592844330248017 0.1004550065061007 -0.052524745294758785 0.8827679181910482 +8 1.173984503142341 1.173984503142341 1.173984503142341 0.768021221540491 -0.009582139884533599 0.03658677589040892 -0.63930665074644 +9 1.173984503142341 1.173984503142341 1.173984503142341 -0.23299975754512345 0.688686395231341 0.6747873944883376 -0.12682324016841584 +10 1.173984503142341 1.173984503142341 1.173984503142341 -0.24662061871907232 0.8744456399178389 0.39370836087823996 -0.13970261209395163 +11 1.173984503142341 1.173984503142341 1.173984503142341 -0.087475900850909 0.977367602388229 0.14493549113095577 -0.12686307572668784 +12 1.173984503142341 1.173984503142341 1.173984503142341 -0.03181169300779214 0.9634374984140112 -0.2442360692534371 -0.10547485630879185 +13 1.173984503142341 1.173984503142341 1.173984503142341 -0.032786070696572266 0.7922941528811777 -0.6084214170523915 -0.03191282109962717 +14 1.173984503142341 1.173984503142341 1.173984503142341 0.047188686288341455 0.6316396208287698 -0.7737349519945348 0.011783095844627799 +15 1.173984503142341 1.173984503142341 1.173984503142341 -0.05869980642620335 -0.34229358203414423 0.9376740835056508 0.012519965878508689 +16 1.173984503142341 1.173984503142341 1.173984503142341 -0.08582818143150042 0.0008707732197394232 0.9939540921464659 -0.0684691735853161 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/in.duplex4 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/in.duplex2 similarity index 67% rename from examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/in.duplex4 rename to examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/in.duplex2 index 5d5e2cd177..09061269ff 100644 --- a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/in.duplex4 +++ b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/in.duplex2 @@ -1,7 +1,8 @@ -variable number equal 4 +variable number equal 2 variable ofreq equal 1000 variable efreq equal 1000 variable T equal 0.1 +variable rhos equal 0.5 units lj @@ -11,14 +12,14 @@ newton off boundary p p p -atom_style hybrid bond ellipsoid +atom_style hybrid bond ellipsoid oxdna atom_modify sort 0 1.0 # Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin +neighbor 2.0 bin neigh_modify every 1 delay 0 check yes -read_data data.duplex4 +read_data data.duplex2 set atom * mass 3.1575 @@ -31,38 +32,27 @@ special_bonds lj 0 1 1 # oxRNA2 pair interactions pair_style hybrid/overlay oxrna2/excv oxrna2/stk oxrna2/hbond oxrna2/xstk oxrna2/coaxstk oxrna2/dh - pair_coeff * * oxrna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 pair_coeff * * oxrna2/stk seqdep ${T} 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 pair_coeff * * oxrna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 pair_coeff 1 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 pair_coeff 2 3 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 pair_coeff 3 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxrna2/xstk 59.9626 0.5 0.6 0.42 0.58 2.25 0.505 0.58 1.7 1.266 0.68 1.7 1.266 0.68 1.7 0.309 0.68 1.7 0.309 0.68 +pair_coeff * * oxrna2/xstk 59.9626 0.5 0.6 0.42 0.58 2.25 0.505 0.58 1.7 1.266 0.68 1.7 1.266 0.68 1.7 0.309 0.68 1.7 0.309 0.68 pair_coeff * * oxrna2/coaxstk 80 0.5 0.6 0.42 0.58 2.0 2.592 0.65 1.3 0.151 0.8 0.9 0.685 0.95 0.9 0.685 0.95 2.0 -0.65 2.0 -0.65 -pair_coeff * * oxrna2/dh ${T} 0.5 1.02455 +pair_coeff * * oxrna2/dh ${T} ${rhos} 1.02455 # NVE ensemble -#fix 1 all nve/dotc/langevin 0.1 0.1 0.03 457145 angmom 10 -#fix 1 all nve/dot fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 timestep 1e-5 #comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" +compute quat all property/atom quatw quati quatj quatk compute erot all erotate/asphere compute ekin all ke @@ -73,10 +63,10 @@ variable epot equal c_epot variable etot equal c_erot+c_ekin+c_epot fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f" +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" run 1000000 -#write_restart config.${number}.* +write_data last_config.${number}.* nocoeff diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 new file mode 100644 index 0000000000..a3fe688104 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 @@ -0,0 +1,1182 @@ +LAMMPS (27 May 2021) +variable number equal 2 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.5 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex2 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 1 by 1 MPI processor grid + reading atoms ... + 16 atoms + reading velocities ... + 16 velocities + scanning bonds ... + 2 = max bonds/atom + 16 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 13 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + read_data CPU = 0.003 seconds + +set atom * mass 3.1575 +Setting atom values ... + 16 settings made for mass + +group all type 1 4 +16 atoms in group all + +# oxRNA2 bond interactions - FENE backbone +bond_style oxrna2/fene +bond_coeff * 2.0 0.25 0.761070781051 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxRNA2 pair interactions +pair_style hybrid/overlay oxrna2/excv oxrna2/stk oxrna2/hbond oxrna2/xstk oxrna2/coaxstk oxrna2/dh +pair_coeff * * oxrna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxrna2/stk seqdep ${T} 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 +pair_coeff * * oxrna2/stk seqdep 0.1 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 +pair_coeff * * oxrna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 3 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxrna2/xstk 59.9626 0.5 0.6 0.42 0.58 2.25 0.505 0.58 1.7 1.266 0.68 1.7 1.266 0.68 1.7 0.309 0.68 1.7 0.309 0.68 +pair_coeff * * oxrna2/coaxstk 80 0.5 0.6 0.42 0.58 2.0 2.592 0.65 1.3 0.151 0.8 0.9 0.685 0.95 0.9 0.685 0.95 2.0 -0.65 2.0 -0.65 +pair_coeff * * oxrna2/dh ${T} ${rhos} 1.02455 +pair_coeff * * oxrna2/dh 0.1 ${rhos} 1.02455 +pair_coeff * * oxrna2/dh 0.1 0.5 1.02455 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.2.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 4.3014979 + ghost atom cutoff = 4.3014979 + binsize = 2.150749, bins = 19 19 19 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxrna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxrna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxrna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxrna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxrna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 4.301497916929199 (../comm.cpp:739) +0 ekin = 2.70475393009871 | erot = 2.80172072918779 | epot = -11.1349465280231 | etot = -5.62847186873664 +Per MPI rank memory allocation (min/avg/max) = 9.597 | 9.597 | 9.597 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.12021129 -0.7299505 0.034016337 -0.52688704 5.1214421e-05 64000 +1000 ekin = 2.74425239815418 | erot = 2.79065458610894 | epot = -11.163378852689 | etot = -5.62847186842592 +2000 ekin = 2.78841691867037 | erot = 2.77992540099535 | epot = -11.1968141877249 | etot = -5.62847186805919 +3000 ekin = 2.83938215410024 | erot = 2.77185117591642 | epot = -11.2397051978033 | etot = -5.62847186778665 +4000 ekin = 2.89876217830266 | erot = 2.76816783884241 | epot = -11.295401884792 | etot = -5.62847186764698 +5000 ekin = 2.96742170720772 | erot = 2.76919345829433 | epot = -11.3650870331989 | etot = -5.62847186769686 +6000 ekin = 3.04563007371043 | erot = 2.77376672268246 | epot = -11.4478686641706 | etot = -5.6284718677777 +7000 ekin = 3.13407886898542 | erot = 2.78065913591454 | epot = -11.5432098726293 | etot = -5.62847186772937 +8000 ekin = 3.23400863287747 | erot = 2.78938863934855 | epot = -11.651869139893 | etot = -5.628471867667 +9000 ekin = 3.34625998930262 | erot = 2.80019523753782 | epot = -11.7749270943235 | etot = -5.62847186748305 +10000 ekin = 3.47220350616338 | erot = 2.81464622815281 | epot = -11.9153216015116 | etot = -5.62847186719543 +11000 ekin = 3.61341090096022 | erot = 2.83541090219848 | epot = -12.0772936703878 | etot = -5.62847186722912 +12000 ekin = 3.76971728921065 | erot = 2.8651661044909 | epot = -12.2633552607298 | etot = -5.62847186702824 +13000 ekin = 3.9410557771447 | erot = 2.90597306806356 | epot = -12.4755007121564 | etot = -5.62847186694816 +14000 ekin = 4.1273074489676 | erot = 2.95952862137382 | epot = -12.7153079373022 | etot = -5.62847186696076 +15000 ekin = 4.32776706381553 | erot = 3.02701108512253 | epot = -12.9832500158852 | etot = -5.62847186694718 +16000 ekin = 4.54139695680688 | erot = 3.10924468066181 | epot = -13.2791135046204 | etot = -5.62847186715173 +17000 ekin = 4.76575661763827 | erot = 3.20604355373095 | epot = -13.60027203892 | etot = -5.62847186755078 +18000 ekin = 4.99700491214688 | erot = 3.31611869568271 | epot = -13.9415954758898 | etot = -5.62847186806021 +19000 ekin = 5.23048108112194 | erot = 3.43700077146765 | epot = -14.2959537213472 | etot = -5.62847186875764 +20000 ekin = 5.46074742513061 | erot = 3.56463156086408 | epot = -14.6538508556014 | etot = -5.62847186960667 +21000 ekin = 5.68087058007138 | erot = 3.6925677668172 | epot = -15.0019102179231 | etot = -5.62847187103448 +22000 ekin = 5.88327619983881 | erot = 3.81252322503562 | epot = -15.3242712967755 | etot = -5.62847187190108 +23000 ekin = 6.06249979951993 | erot = 3.91720950057677 | epot = -15.6081811728147 | etot = -5.62847187271797 +24000 ekin = 6.21449712377439 | erot = 4.00104081543187 | epot = -15.8440098121104 | etot = -5.62847187290417 +25000 ekin = 6.33853277809256 | erot = 4.06184542619888 | epot = -16.0288500769828 | etot = -5.62847187269139 +26000 ekin = 6.43627737187013 | erot = 4.10076278430851 | epot = -16.1655120283938 | etot = -5.62847187221521 +27000 ekin = 6.51092447972029 | erot = 4.12134483746817 | epot = -16.2607411888241 | etot = -5.62847187163564 +28000 ekin = 6.56622100976686 | erot = 4.12827111510824 | epot = -16.3229639959506 | etot = -5.6284718710755 +29000 ekin = 6.60587340002397 | erot = 4.12622173833907 | epot = -16.3605670089492 | etot = -5.62847187058613 +30000 ekin = 6.63335580501832 | erot = 4.11921545444659 | epot = -16.3810431296794 | etot = -5.62847187021445 +31000 ekin = 6.65211888589275 | erot = 4.10999678317537 | epot = -16.3905875389834 | etot = -5.6284718699153 +32000 ekin = 6.66584763664878 | erot = 4.10024297795107 | epot = -16.3945624842072 | etot = -5.6284718696074 +33000 ekin = 6.67923227191034 | erot = 4.09129207413372 | epot = -16.398996215263 | etot = -5.62847186921898 +34000 ekin = 6.69756137216837 | erot = 4.08414768607671 | epot = -16.4101809271347 | etot = -5.62847186888963 +35000 ekin = 6.72589628312087 | erot = 4.07950228497955 | epot = -16.4338704366878 | etot = -5.62847186858736 +36000 ekin = 6.76908557113719 | erot = 4.07778615492117 | epot = -16.4753435944361 | etot = -5.62847186837779 +37000 ekin = 6.83097506213407 | erot = 4.07899014040672 | epot = -16.5384370708783 | etot = -5.62847186833747 +38000 ekin = 6.91354703253175 | erot = 4.08242106390425 | epot = -16.6244399649597 | etot = -5.62847186852366 +39000 ekin = 7.01626065739836 | erot = 4.08652171942794 | epot = -16.7312542457771 | etot = -5.62847186895078 +40000 ekin = 7.13573792258332 | erot = 4.08884404540015 | epot = -16.8530538375758 | etot = -5.62847186959231 +41000 ekin = 7.26614194134516 | erot = 4.08627042537781 | epot = -16.9808842370343 | etot = -5.62847187031131 +42000 ekin = 7.40051154120589 | erot = 4.07546023443119 | epot = -17.1044436466277 | etot = -5.6284718709906 +43000 ekin = 7.5315743714369 | erot = 4.05344655359662 | epot = -17.2134927965849 | etot = -5.62847187155142 +44000 ekin = 7.65268317567644 | erot = 4.01819177227261 | epot = -17.2993468198234 | etot = -5.62847187187434 +45000 ekin = 7.75845343306886 | erot = 3.96898510895805 | epot = -17.3559104142066 | etot = -5.62847187217966 +46000 ekin = 7.84504377034637 | erot = 3.9045490306483 | epot = -17.3780646733318 | etot = -5.62847187233708 +47000 ekin = 7.91002390820626 | erot = 3.82478596555235 | epot = -17.3632817459108 | etot = -5.62847187215216 +48000 ekin = 7.95195705456502 | erot = 3.73154439390043 | epot = -17.3119733204129 | etot = -5.62847187194745 +49000 ekin = 7.97001825706863 | erot = 3.62752007295082 | epot = -17.2260102016185 | etot = -5.62847187159907 +50000 ekin = 7.96375756700425 | erot = 3.51726958365141 | epot = -17.1094990215452 | etot = -5.62847187088955 +51000 ekin = 7.93280761300434 | erot = 3.40827188497866 | epot = -16.9695513688031 | etot = -5.62847187082008 +52000 ekin = 7.87656811744185 | erot = 3.30207418532559 | epot = -16.8071141735586 | etot = -5.62847187079121 +53000 ekin = 7.795310125419 | erot = 3.1983998481543 | epot = -16.6221818441147 | etot = -5.62847187054139 +54000 ekin = 7.68952609570327 | erot = 3.09980185481832 | epot = -16.4177998208245 | etot = -5.62847187030293 +55000 ekin = 7.55966222141087 | erot = 3.00897426989542 | epot = -16.1971083614499 | etot = -5.62847187014361 +56000 ekin = 7.4059412450799 | erot = 2.92802865182262 | epot = -15.9624417669772 | etot = -5.62847187007467 +57000 ekin = 7.22816598141979 | erot = 2.85836584281792 | epot = -15.7150036943479 | etot = -5.62847187011019 +58000 ekin = 7.02573051397593 | erot = 2.80066522322033 | epot = -15.4548676074193 | etot = -5.62847187022304 +59000 ekin = 6.80455077165106 | erot = 2.75651944712028 | epot = -15.1895420860964 | etot = -5.62847186732507 +60000 ekin = 6.57760251691499 | erot = 2.72731501678731 | epot = -14.9333893991692 | etot = -5.62847186546688 +61000 ekin = 5.9988405319001 | erot = 2.65010269791697 | epot = -14.2774150331152 | etot = -5.62847180329812 +62000 ekin = 5.82217958652213 | erot = 2.65058478195178 | epot = -14.1012361774604 | etot = -5.62847180898654 +63000 ekin = 6.00993174210244 | erot = 2.71143483466418 | epot = -14.3498384845184 | etot = -5.62847190775179 +64000 ekin = 5.85096985050363 | erot = 2.71173917624734 | epot = -14.1911809366075 | etot = -5.6284719098565 +65000 ekin = 5.6795980144273 | erot = 2.70731630130173 | epot = -14.0153862253963 | etot = -5.62847190966731 +66000 ekin = 5.49812382731701 | erot = 2.69646895132523 | epot = -13.8230646880631 | etot = -5.6284719094209 +67000 ekin = 5.31011188753142 | erot = 2.67901331172422 | epot = -13.6175971082583 | etot = -5.62847190900269 +68000 ekin = 5.11964229582584 | erot = 2.6562219727344 | epot = -13.4043361770527 | etot = -5.62847190849249 +69000 ekin = 4.93067975207848 | erot = 2.63014135225734 | epot = -13.189293012493 | etot = -5.62847190815717 +70000 ekin = 4.7469738661748 | erot = 2.60347312706346 | epot = -12.9789189008751 | etot = -5.6284719076368 +71000 ekin = 4.57222133259563 | erot = 2.5797158979897 | epot = -12.7804091377444 | etot = -5.62847190715907 +72000 ekin = 4.40959648507777 | erot = 2.5622829592253 | epot = -12.6003513510616 | etot = -5.62847190675855 +73000 ekin = 4.261700095739 | erot = 2.55406076080147 | epot = -12.4442327629949 | etot = -5.62847190645442 +74000 ekin = 4.13052949790815 | erot = 2.55713155841199 | epot = -12.3161329625866 | etot = -5.62847190626649 +75000 ekin = 4.0158819282887 | erot = 2.56608801434103 | epot = -12.2104419139898 | etot = -5.62847197136009 +76000 ekin = 3.95904625854752 | erot = 2.44184942386052 | epot = -12.0293675901711 | etot = -5.62847190776301 +77000 ekin = 4.02755960266358 | erot = 2.46007159499075 | epot = -12.1161031098039 | etot = -5.6284719121496 +78000 ekin = 3.9878543994381 | erot = 2.49596945534626 | epot = -12.1122957670966 | etot = -5.62847191231222 +79000 ekin = 3.96575767721423 | erot = 2.54200842335473 | epot = -12.1362380131154 | etot = -5.62847191254644 +80000 ekin = 3.95961954869549 | erot = 2.59604589435614 | epot = -12.1841373558849 | etot = -5.62847191283329 +81000 ekin = 3.96734100032337 | erot = 2.65577062232368 | epot = -12.2515835357817 | etot = -5.62847191313468 +82000 ekin = 3.98651997822116 | erot = 2.71892569307098 | epot = -12.333917584723 | etot = -5.62847191343086 +83000 ekin = 4.01459300302737 | erot = 2.78352190390212 | epot = -12.4265868206359 | etot = -5.62847191370646 +84000 ekin = 4.04956210608545 | erot = 2.84796629664432 | epot = -12.5260003165345 | etot = -5.62847191380469 +85000 ekin = 4.09049341026859 | erot = 2.91104365381114 | epot = -12.630008978118 | etot = -5.62847191403825 +86000 ekin = 4.13484812560041 | erot = 2.97201165419102 | epot = -12.7353316940204 | etot = -5.62847191422894 +87000 ekin = 4.18003829184646 | erot = 3.03078479878299 | epot = -12.8392950049954 | etot = -5.6284719143659 +88000 ekin = 4.22360704724732 | erot = 3.08796574000335 | epot = -12.9400447017002 | etot = -5.62847191444958 +89000 ekin = 4.26326024607322 | erot = 3.14481288279498 | epot = -13.0365450433359 | etot = -5.62847191446774 +90000 ekin = 4.29588111790616 | erot = 3.20341713777027 | epot = -13.1277701703301 | etot = -5.62847191465365 +91000 ekin = 4.31697784577813 | erot = 3.26736040230169 | epot = -13.2128101626458 | etot = -5.62847191456593 +92000 ekin = 4.32507837347579 | erot = 3.33931601944573 | epot = -13.2928663075902 | etot = -5.62847191466873 +93000 ekin = 4.31872212432196 | erot = 3.4203654191679 | epot = -13.367559458178 | etot = -5.62847191468809 +94000 ekin = 4.29660005793293 | erot = 3.51205694754416 | epot = -13.4371289201541 | etot = -5.628471914677 +95000 ekin = 4.25789021838842 | erot = 3.61606475666855 | epot = -13.502426889667 | etot = -5.62847191461008 +96000 ekin = 4.202536619265 | erot = 3.73412422729675 | epot = -13.5651327610313 | etot = -5.62847191446956 +97000 ekin = 4.13146529060015 | erot = 3.86803037439311 | epot = -13.6279675793419 | etot = -5.62847191434862 +98000 ekin = 4.04669071975352 | erot = 4.01885670334744 | epot = -13.6940193371953 | etot = -5.62847191409434 +99000 ekin = 3.95128630061895 | erot = 4.18772840013478 | epot = -13.7674866145626 | etot = -5.62847191380887 +100000 ekin = 3.84921784883058 | erot = 4.37558821791295 | epot = -13.8532779802874 | etot = -5.6284719135439 +101000 ekin = 3.74501223923284 | erot = 4.58258429231803 | epot = -13.9560684449145 | etot = -5.62847191336366 +102000 ekin = 3.64330024870551 | erot = 4.80764134110135 | epot = -14.0794135031373 | etot = -5.62847191333048 +103000 ekin = 3.54831662006251 | erot = 5.04811575607568 | epot = -14.2249042896175 | etot = -5.62847191347927 +104000 ekin = 3.46349772064904 | erot = 5.29960820358518 | epot = -14.3915778382037 | etot = -5.62847191396945 +105000 ekin = 3.39136254536234 | erot = 5.55507704360061 | epot = -14.5749115034251 | etot = -5.62847191446211 +106000 ekin = 3.33356403744371 | erot = 5.80718759325009 | epot = -14.769223545484 | etot = -5.62847191479015 +107000 ekin = 3.29209861353664 | erot = 6.0490668738683 | epot = -14.9696374027455 | etot = -5.62847191534052 +108000 ekin = 3.26748487341077 | erot = 6.27418243659792 | epot = -15.170139225863 | etot = -5.62847191585429 +109000 ekin = 3.25930506886577 | erot = 6.4758541724441 | epot = -15.3636311580692 | etot = -5.62847191675935 +110000 ekin = 3.26568272829079 | erot = 6.64602097208024 | epot = -15.5401756176986 | etot = -5.62847191732761 +111000 ekin = 3.28520059172608 | erot = 6.77857539600436 | epot = -15.6922479055269 | etot = -5.62847191779651 +112000 ekin = 3.31659315707429 | erot = 6.86862760564071 | epot = -15.8136926809252 | etot = -5.62847191821021 +113000 ekin = 3.35860144230931 | erot = 6.91335224014943 | epot = -15.9004256006577 | etot = -5.62847191819896 +114000 ekin = 3.41073468124679 | erot = 6.91406610981318 | epot = -15.9532727088343 | etot = -5.62847191777429 +115000 ekin = 3.47381531534282 | erot = 6.87643065686506 | epot = -15.9787178894078 | etot = -5.6284719171999 +116000 ekin = 3.54886437558777 | erot = 6.80711139529212 | epot = -15.9844476879582 | etot = -5.62847191707831 +117000 ekin = 3.63467409204953 | erot = 6.71320827683675 | epot = -15.9763542854632 | etot = -5.62847191657691 +118000 ekin = 3.72815555523563 | erot = 6.60276001485649 | epot = -15.9593874864267 | etot = -5.62847191633455 +119000 ekin = 3.82420980363922 | erot = 6.48288858478337 | epot = -15.9355703049694 | etot = -5.6284719165468 +120000 ekin = 3.9179774835722 | erot = 6.35662792089898 | epot = -15.903077321228 | etot = -5.62847191675683 +121000 ekin = 4.00591742044035 | erot = 6.22468993027099 | epot = -15.8590792676431 | etot = -5.62847191693177 +122000 ekin = 4.08550270322369 | erot = 6.08676575288901 | epot = -15.8007403736371 | etot = -5.62847191752443 +123000 ekin = 4.15433540908377 | erot = 5.94071572290345 | epot = -15.7235230494646 | etot = -5.62847191747738 +124000 ekin = 4.21272085203604 | erot = 5.78590733869432 | epot = -15.6271001078552 | etot = -5.62847191712487 +125000 ekin = 4.26325970413188 | erot = 5.62467373686564 | epot = -15.5164053575234 | etot = -5.62847191652588 +126000 ekin = 4.30880597980511 | erot = 5.46113290467099 | epot = -15.3984108007452 | etot = -5.62847191626906 +127000 ekin = 4.35136313111028 | erot = 5.29960307371338 | epot = -15.2794381205813 | etot = -5.62847191575761 +128000 ekin = 4.39391383900504 | erot = 5.14386269106645 | epot = -15.1662484454473 | etot = -5.62847191537579 +129000 ekin = 4.43858036063655 | erot = 4.99693296064707 | epot = -15.0639852363964 | etot = -5.62847191511278 +130000 ekin = 4.48619887382534 | erot = 4.86092637377901 | epot = -14.9755971627246 | etot = -5.62847191512025 +131000 ekin = 4.53629967746113 | erot = 4.73552279955471 | epot = -14.9002943921703 | etot = -5.62847191515449 +132000 ekin = 4.58794392436761 | erot = 4.62012473201883 | epot = -14.8365405715611 | etot = -5.62847191517469 +133000 ekin = 4.63977927970873 | erot = 4.51475331813956 | epot = -14.7830045130166 | etot = -5.62847191516832 +134000 ekin = 4.69096227444649 | erot = 4.41936571520108 | epot = -14.7387999047824 | etot = -5.62847191513484 +135000 ekin = 4.74083332632074 | erot = 4.33399770983627 | epot = -14.7033029512379 | etot = -5.62847191508091 +136000 ekin = 4.78901374177409 | erot = 4.25873574864794 | epot = -14.6762214054334 | etot = -5.62847191501132 +137000 ekin = 4.83519033966281 | erot = 4.19345584709283 | epot = -14.657118101864 | etot = -5.6284719151084 +138000 ekin = 4.87857190019259 | erot = 4.13759960010467 | epot = -14.644643415365 | etot = -5.62847191506772 +139000 ekin = 4.9193390426864 | erot = 4.09041841408124 | epot = -14.6382293717807 | etot = -5.6284719150131 +140000 ekin = 4.95802132610715 | erot = 4.05108530565741 | epot = -14.637578546733 | etot = -5.62847191496842 +141000 ekin = 4.99519923255351 | erot = 4.01864210163599 | epot = -14.6423132491265 | etot = -5.628471914937 +142000 ekin = 5.0313403186539 | erot = 3.99210960072426 | epot = -14.6519218343063 | etot = -5.62847191492815 +143000 ekin = 5.06663282814611 | erot = 3.97056100872215 | epot = -14.6656657518145 | etot = -5.62847191494626 +144000 ekin = 5.10088003253975 | erot = 3.95318385936622 | epot = -14.6825358068963 | etot = -5.62847191499035 +145000 ekin = 5.13347728619419 | erot = 3.9393331843263 | epot = -14.7012823855752 | etot = -5.62847191505467 +146000 ekin = 5.16346418937039 | erot = 3.92856945833553 | epot = -14.7205055628366 | etot = -5.62847191513069 +147000 ekin = 5.18962884502116 | erot = 3.92067778970093 | epot = -14.7387785499314 | etot = -5.62847191520936 +148000 ekin = 5.2106363010504 | erot = 3.91566839447777 | epot = -14.7547766108106 | etot = -5.62847191528238 +149000 ekin = 5.22515818277311 | erot = 3.91376203384939 | epot = -14.7673921319653 | etot = -5.62847191534284 +150000 ekin = 5.23199081771441 | erot = 3.91536756918858 | epot = -14.7758303022875 | etot = -5.62847191538449 +151000 ekin = 5.23025857434895 | erot = 3.92102977399556 | epot = -14.7797602637297 | etot = -5.62847191538523 +152000 ekin = 5.21970456277633 | erot = 3.93136599417313 | epot = -14.7795424723193 | etot = -5.6284719153698 +153000 ekin = 5.20020715643948 | erot = 3.94729684643011 | epot = -14.7759759181577 | etot = -5.6284719152881 +154000 ekin = 5.17219962280906 | erot = 3.96989664945426 | epot = -14.7705681875103 | etot = -5.62847191524698 +155000 ekin = 5.13597939415209 | erot = 4.00025654377895 | epot = -14.7647078530831 | etot = -5.6284719151521 +156000 ekin = 5.09227456538809 | erot = 4.03969792967878 | epot = -14.7604444100931 | etot = -5.62847191502624 +157000 ekin = 5.04214374655822 | erot = 4.08965648366389 | epot = -14.7602721451221 | etot = -5.62847191489998 +158000 ekin = 4.98664076893724 | erot = 4.15175637520643 | epot = -14.766869058914 | etot = -5.62847191477032 +159000 ekin = 4.92656708226378 | erot = 4.22693785976717 | epot = -14.7819768568016 | etot = -5.62847191477063 +160000 ekin = 4.86235166664991 | erot = 4.31524574981774 | epot = -14.8060693313531 | etot = -5.6284719148854 +161000 ekin = 4.79340744408421 | erot = 4.41634192155712 | epot = -14.8382212806378 | etot = -5.6284719149965 +162000 ekin = 4.71931679137199 | erot = 4.52911647420319 | epot = -14.8769051807429 | etot = -5.62847191516769 +163000 ekin = 4.63965178837921 | erot = 4.65170333188739 | epot = -14.9198270356117 | etot = -5.62847191534509 +164000 ekin = 4.55406399624322 | erot = 4.78166301740344 | epot = -14.9641989292966 | etot = -5.62847191564991 +165000 ekin = 4.46213996067444 | erot = 4.91530272158902 | epot = -15.0059145982048 | etot = -5.62847191594139 +166000 ekin = 4.36388109534855 | erot = 5.04805357548587 | epot = -15.0404065870407 | etot = -5.62847191620628 +167000 ekin = 4.2599504684242 | erot = 5.17511068522257 | epot = -15.0635330700694 | etot = -5.62847191642261 +168000 ekin = 4.15154354282108 | erot = 5.29182746831898 | epot = -15.071842927712 | etot = -5.62847191657198 +169000 ekin = 4.04026084727468 | erot = 5.3941174772808 | epot = -15.0628502412099 | etot = -5.62847191665442 +170000 ekin = 3.92797723838317 | erot = 5.47890367159895 | epot = -15.0353528265939 | etot = -5.62847191661181 +171000 ekin = 3.81680551395809 | erot = 5.54460219961126 | epot = -14.989879630019 | etot = -5.62847191644964 +172000 ekin = 3.70912194360867 | erot = 5.59119877272675 | epot = -14.9287926324949 | etot = -5.62847191615949 +173000 ekin = 3.60767008609974 | erot = 5.62020496675997 | epot = -14.8563469686161 | etot = -5.62847191575636 +174000 ekin = 3.51593123142685 | erot = 5.63484613588073 | epot = -14.7792492818557 | etot = -5.62847191454812 +175000 ekin = 3.43946966413873 | erot = 5.64148825119093 | epot = -14.7094298295813 | etot = -5.62847191425169 +176000 ekin = 3.38149964340019 | erot = 5.64304584979603 | epot = -14.653017407222 | etot = -5.62847191402579 +177000 ekin = 3.3442630428033 | erot = 5.64075589500549 | epot = -14.6134908517392 | etot = -5.62847191393037 +178000 ekin = 3.32907821318129 | erot = 5.63429171925337 | epot = -14.5918418466206 | etot = -5.62847191418592 +179000 ekin = 3.33553286829347 | erot = 5.6208870874151 | epot = -14.5848918700472 | etot = -5.62847191433866 +180000 ekin = 3.36333384277243 | erot = 5.59827011329198 | epot = -14.5900758706826 | etot = -5.6284719146182 +181000 ekin = 3.41118322744684 | erot = 5.56369949232846 | epot = -14.6033546347478 | etot = -5.62847191497248 +182000 ekin = 3.47666657813912 | erot = 5.51442909119383 | epot = -14.6195675846747 | etot = -5.62847191534179 +183000 ekin = 3.55646627297106 | erot = 5.44847615754748 | epot = -14.633414346125 | etot = -5.62847191560643 +184000 ekin = 3.64671110623883 | erot = 5.36528131962498 | epot = -14.6404643416898 | etot = -5.62847191582594 +185000 ekin = 3.74294243854229 | erot = 5.26596644090118 | epot = -14.637380795357 | etot = -5.62847191591353 +186000 ekin = 3.84064021177402 | erot = 5.15359326678923 | epot = -14.6227053944195 | etot = -5.62847191585629 +187000 ekin = 3.93563840594996 | erot = 5.03296537332422 | epot = -14.5970756949477 | etot = -5.62847191567352 +188000 ekin = 4.02444308409284 | erot = 4.91004205202591 | epot = -14.5629570515398 | etot = -5.62847191542107 +189000 ekin = 4.10437481570296 | erot = 4.79101157925947 | epot = -14.5238583101447 | etot = -5.6284719151823 +190000 ekin = 4.17348832619979 | erot = 4.68117061833031 | epot = -14.4831308595833 | etot = -5.62847191505317 +191000 ekin = 4.2302884539443 | erot = 4.58386192798786 | epot = -14.4426222970223 | etot = -5.62847191509015 +192000 ekin = 4.27358054060644 | erot = 4.49984530057507 | epot = -14.401897756479 | etot = -5.62847191529753 +193000 ekin = 4.24592911993984 | erot = 4.46741799187496 | epot = -14.341819022691 | etot = -5.62847191087621 +194000 ekin = 4.19994174150951 | erot = 4.47173701960618 | epot = -14.3001506793668 | etot = -5.62847191825108 +195000 ekin = 4.19981139522192 | erot = 4.40365513590342 | epot = -14.2319384423487 | etot = -5.6284719112234 +196000 ekin = 4.18831859749961 | erot = 4.32821378408543 | epot = -14.1450042928948 | etot = -5.62847191130971 +197000 ekin = 4.16445522600507 | erot = 4.24686919663374 | epot = -14.0397963337823 | etot = -5.62847191114348 +198000 ekin = 4.13074920372974 | erot = 4.15919636754571 | epot = -13.9184174820235 | etot = -5.62847191074804 +199000 ekin = 4.0906207473621 | erot = 4.06700829109831 | epot = -13.7861009486908 | etot = -5.62847191023037 +200000 ekin = 4.04792338687241 | erot = 3.97356549445347 | epot = -13.6499607909698 | etot = -5.62847190964388 +201000 ekin = 4.00668244919815 | erot = 3.88277215508982 | epot = -13.5179265133902 | etot = -5.62847190910223 +202000 ekin = 3.97063392471763 | erot = 3.79828207702091 | epot = -13.39738791041 | etot = -5.62847190867151 +203000 ekin = 3.94283665189413 | erot = 3.72290259923763 | epot = -13.2942111595175 | etot = -5.62847190838577 +204000 ekin = 3.9254074337218 | erot = 3.65835216262356 | epot = -13.2122315045955 | etot = -5.62847190825009 +205000 ekin = 3.91946432177319 | erot = 3.60562062220884 | epot = -13.1535568521707 | etot = -5.62847190818863 +206000 ekin = 3.92515912499438 | erot = 3.56510062726531 | epot = -13.1187316605142 | etot = -5.62847190825449 +207000 ekin = 3.94166066189579 | erot = 3.53643554885013 | epot = -13.106568119127 | etot = -5.62847190838106 +208000 ekin = 3.96741904659629 | erot = 3.51909285318893 | epot = -13.1149838083206 | etot = -5.62847190853536 +209000 ekin = 3.99456273872661 | erot = 3.50083315850366 | epot = -13.1238678065897 | etot = -5.62847190935947 +210000 ekin = 4.04796401860243 | erot = 3.4916895489081 | epot = -13.1681254815361 | etot = -5.62847191402561 +211000 ekin = 4.09773342715978 | erot = 3.49304812012827 | epot = -13.2192534546331 | etot = -5.62847190734504 +212000 ekin = 4.14205596974334 | erot = 3.50221111647769 | epot = -13.2727389936869 | etot = -5.6284719074659 +213000 ekin = 4.18461227969207 | erot = 3.51992604962334 | epot = -13.3330102373213 | etot = -5.62847190800588 +214000 ekin = 4.22291801220966 | erot = 3.54318058637875 | epot = -13.3945705067373 | etot = -5.62847190814888 +215000 ekin = 4.25639069943993 | erot = 3.57018634832855 | epot = -13.4550489560043 | etot = -5.62847190823587 +216000 ekin = 4.2851705613071 | erot = 3.59920416165292 | epot = -13.5128466312779 | etot = -5.62847190831789 +217000 ekin = 4.3095145789128 | erot = 3.62862634730473 | epot = -13.5666128346059 | etot = -5.62847190838833 +218000 ekin = 4.33022749097504 | erot = 3.65639118247524 | epot = -13.615090581929 | etot = -5.62847190847876 +219000 ekin = 4.34822739188717 | erot = 3.68015661121684 | epot = -13.6568559116869 | etot = -5.62847190858288 +220000 ekin = 4.36437280258302 | erot = 3.69755509928667 | epot = -13.6903998105148 | etot = -5.62847190864514 +221000 ekin = 4.37954317243381 | erot = 3.70660976824472 | epot = -13.7146248493703 | etot = -5.62847190869173 +222000 ekin = 4.39451292717047 | erot = 3.70596363375557 | epot = -13.7289484695947 | etot = -5.62847190866862 +223000 ekin = 4.41008213188947 | erot = 3.69513355487642 | epot = -13.7336875953398 | etot = -5.62847190857388 +224000 ekin = 4.42678943726192 | erot = 3.67466536393742 | epot = -13.7299267097393 | etot = -5.62847190853996 +225000 ekin = 4.44460701700921 | erot = 3.64600909388212 | epot = -13.7190880192605 | etot = -5.62847190836919 +226000 ekin = 4.47380092381823 | erot = 3.58830814099014 | epot = -13.6905809780385 | etot = -5.62847191323016 +227000 ekin = 4.56056009802773 | erot = 3.47269306832678 | epot = -13.6617250773524 | etot = -5.62847191099789 +228000 ekin = 4.61083327531156 | erot = 3.40803816011208 | epot = -13.6473433475474 | etot = -5.62847191212373 +229000 ekin = 4.63150013168063 | erot = 3.35898149000683 | epot = -13.6189535337045 | etot = -5.628471912017 +230000 ekin = 4.65431068144105 | erot = 3.31343017818392 | epot = -13.5962127716262 | etot = -5.6284719120012 +231000 ekin = 4.67934821404914 | erot = 3.27332737527072 | epot = -13.5811475014857 | etot = -5.62847191216587 +232000 ekin = 4.70592354946384 | erot = 3.23944506667453 | epot = -13.5738405284603 | etot = -5.62847191232193 +233000 ekin = 4.73271416122613 | erot = 3.21144788525716 | epot = -13.5726339590425 | etot = -5.62847191255921 +234000 ekin = 4.75943444985121 | erot = 3.19078729233493 | epot = -13.5786936545781 | etot = -5.62847191239191 +235000 ekin = 4.7864224181817 | erot = 3.1802119397668 | epot = -13.5951062703947 | etot = -5.62847191244615 +236000 ekin = 4.81315037988305 | erot = 3.18017325334793 | epot = -13.6217955456975 | etot = -5.62847191246647 +237000 ekin = 4.83923297185637 | erot = 3.19145400453311 | epot = -13.6591588888804 | etot = -5.62847191249091 +238000 ekin = 4.8648758593188 | erot = 3.21481908800212 | epot = -13.7081668597345 | etot = -5.62847191241355 +239000 ekin = 4.89063931715006 | erot = 3.25114955281917 | epot = -13.7702607826829 | etot = -5.62847191271366 +240000 ekin = 4.91656145052602 | erot = 3.29901781218761 | epot = -13.8440511754903 | etot = -5.62847191277668 +241000 ekin = 4.94245255089395 | erot = 3.35699698381439 | epot = -13.9279214477111 | etot = -5.62847191300273 +242000 ekin = 4.96767380346174 | erot = 3.42365009425844 | epot = -14.0197958109202 | etot = -5.62847191320004 +243000 ekin = 5.00573446223425 | erot = 3.47030260471584 | epot = -14.1045089792095 | etot = -5.62847191225937 +244000 ekin = 5.06987350319776 | erot = 3.50985787352901 | epot = -14.2082032932938 | etot = -5.62847191656705 +245000 ekin = 5.08405115957742 | erot = 3.57323736718779 | epot = -14.2857604930736 | etot = -5.62847196630843 +246000 ekin = 5.13867281568721 | erot = 3.53022410786793 | epot = -14.2973688418941 | etot = -5.62847191833901 +247000 ekin = 5.24446071734879 | erot = 3.63707192639566 | epot = -14.5100045566461 | etot = -5.62847191290161 +248000 ekin = 5.23528120841798 | erot = 3.74023330973858 | epot = -14.6039864311642 | etot = -5.62847191300765 +249000 ekin = 5.21260078435232 | erot = 3.83729795660013 | epot = -14.6783706538235 | etot = -5.62847191287108 +250000 ekin = 5.17839081250377 | erot = 3.9274900033362 | epot = -14.7343527284458 | etot = -5.62847191260579 +251000 ekin = 5.13586036334033 | erot = 4.0110834535743 | epot = -14.7754157290643 | etot = -5.6284719121497 +252000 ekin = 5.08918292106526 | erot = 4.09018694184289 | epot = -14.8078417745573 | etot = -5.62847191164914 +253000 ekin = 5.04264218495503 | erot = 4.16759058211673 | epot = -14.8387046782788 | etot = -5.62847191120704 +254000 ekin = 4.99116344078943 | erot = 4.24248912287616 | epot = -14.8621245493479 | etot = -5.62847198568228 +255000 ekin = 4.72637462799754 | erot = 4.24407837663792 | epot = -14.5989249326008 | etot = -5.62847192796534 +256000 ekin = 4.59834109997962 | erot = 4.36369782209853 | epot = -14.5905108364853 | etot = -5.62847191440716 +257000 ekin = 4.77089539877238 | erot = 4.60066315314524 | epot = -15.0000305289775 | etot = -5.62847197705984 +258000 ekin = 4.8570424299005 | erot = 4.66807324376092 | epot = -15.1535875814136 | etot = -5.62847190775215 +259000 ekin = 4.89901811472201 | erot = 4.72718635920946 | epot = -15.2546763808543 | etot = -5.6284719069228 +260000 ekin = 4.94107094739232 | erot = 4.79406863685795 | epot = -15.3636114914084 | etot = -5.62847190715817 +261000 ekin = 4.98242309074786 | erot = 4.86508628581133 | epot = -15.4759812846185 | etot = -5.62847190805928 +262000 ekin = 5.01659840998387 | erot = 4.93871137847814 | epot = -15.5837816973619 | etot = -5.62847190889992 +263000 ekin = 5.03982661194348 | erot = 5.00983839411822 | epot = -15.6781369155683 | etot = -5.62847190950662 +264000 ekin = 5.0473269634971 | erot = 5.07389667598774 | epot = -15.7496955495902 | etot = -5.62847191010535 +265000 ekin = 5.03448807084938 | erot = 5.12688367713197 | epot = -15.7898436586188 | etot = -5.6284719106374 +266000 ekin = 4.9977343895948 | erot = 5.16480683531726 | epot = -15.7910131359604 | etot = -5.62847191104839 +267000 ekin = 4.9350849740613 | erot = 5.18388050750233 | epot = -15.7474373928655 | etot = -5.6284719113019 +268000 ekin = 4.84654531470769 | erot = 5.18063468558991 | epot = -15.6556519116805 | etot = -5.62847191138294 +269000 ekin = 4.73423214274556 | erot = 5.15198859731975 | epot = -15.5146926513545 | etot = -5.62847191128923 +270000 ekin = 4.60224202248444 | erot = 5.09540688817063 | epot = -15.3261208188922 | etot = -5.62847190823709 +271000 ekin = 4.45636876654843 | erot = 5.00923317388348 | epot = -15.0940738481978 | etot = -5.62847190776587 +272000 ekin = 4.30375505735369 | erot = 4.89315778304375 | epot = -14.8253847474932 | etot = -5.62847190709576 +273000 ekin = 4.15244061479806 | erot = 4.74862648123472 | epot = -14.5295390022931 | etot = -5.62847190626036 +274000 ekin = 4.01137482334333 | erot = 4.57896672456557 | epot = -14.2188134532218 | etot = -5.62847190531292 +275000 ekin = 3.87388872892464 | erot = 4.38950805795244 | epot = -13.8918687169895 | etot = -5.6284719301124 +276000 ekin = 3.7082814835016 | erot = 4.18975567950172 | epot = -13.5265090654672 | etot = -5.62847190246385 +277000 ekin = 3.7402518794014 | erot = 3.98894405210621 | epot = -13.3576678645653 | etot = -5.6284719330577 +278000 ekin = 3.74221760775357 | erot = 3.7703854369202 | epot = -13.1410749479138 | etot = -5.62847190324001 +279000 ekin = 3.75220115766677 | erot = 3.5579033181483 | epot = -12.938576379456 | etot = -5.6284719036409 +280000 ekin = 3.77561814014463 | erot = 3.3578165449272 | epot = -12.7619065883795 | etot = -5.62847190330772 +281000 ekin = 3.81272927484692 | erot = 3.17409695196483 | epot = -12.6152981298176 | etot = -5.62847190300587 +282000 ekin = 3.86501988036713 | erot = 3.00952640155182 | epot = -12.503018184206 | etot = -5.62847190228705 +283000 ekin = 3.9362890040686 | erot = 2.86613168182077 | epot = -12.4308925881252 | etot = -5.62847190223582 +284000 ekin = 4.02702703050248 | erot = 2.74480306500238 | epot = -12.4003019979014 | etot = -5.62847190239652 +285000 ekin = 4.14139706639939 | erot = 2.64599110157981 | epot = -12.4158600691656 | etot = -5.62847190118639 +286000 ekin = 4.28525774918125 | erot = 2.56950762489294 | epot = -12.4832372763209 | etot = -5.62847190224672 +287000 ekin = 4.44987555795525 | erot = 2.5149381006836 | epot = -12.5932855609563 | etot = -5.62847190231741 +288000 ekin = 4.63520922264803 | erot = 2.48100112555659 | epot = -12.744682251547 | etot = -5.62847190334237 +289000 ekin = 4.83125797005639 | erot = 2.46527241539591 | epot = -12.9250022896872 | etot = -5.62847190423491 +290000 ekin = 5.02763799219549 | erot = 2.46542435681899 | epot = -13.1215342541 | etot = -5.6284719050855 +291000 ekin = 5.21465468575924 | erot = 2.47913524144599 | epot = -13.3222618329691 | etot = -5.62847190576391 +292000 ekin = 5.3847234879029 | erot = 2.50416430329084 | epot = -13.517359697432 | etot = -5.62847190623821 +293000 ekin = 5.53302487062993 | erot = 2.53823701976372 | epot = -13.6997337969552 | etot = -5.6284719065615 +294000 ekin = 5.65718701899563 | erot = 2.57877496353037 | epot = -13.8644338893367 | etot = -5.62847190681068 +295000 ekin = 5.75652780496736 | erot = 2.62269919784114 | epot = -14.0076989098374 | etot = -5.62847190702888 +296000 ekin = 5.83139499491576 | erot = 2.66652171228997 | epot = -14.1263886144134 | etot = -5.62847190720766 +297000 ekin = 5.88282356332315 | erot = 2.70675614330105 | epot = -14.2180516139345 | etot = -5.62847190731032 +298000 ekin = 5.91239748765354 | erot = 2.74048494300751 | epot = -14.28135433797 | etot = -5.62847190730891 +299000 ekin = 5.92208198046629 | erot = 2.7658529930204 | epot = -14.316406880692 | etot = -5.62847190720535 +300000 ekin = 5.91390942018959 | erot = 2.78233336188536 | epot = -14.3247146891001 | etot = -5.62847190702514 +301000 ekin = 5.88962133511467 | erot = 2.79074353675826 | epot = -14.3088367786671 | etot = -5.62847190679412 +302000 ekin = 5.85048781421153 | erot = 2.79307875791624 | epot = -14.2720384786503 | etot = -5.62847190652251 +303000 ekin = 5.79743517877201 | erot = 2.79223225552499 | epot = -14.2181393405065 | etot = -5.62847190620952 +304000 ekin = 5.73124340760714 | erot = 2.79262915089218 | epot = -14.1523444641626 | etot = -5.6284719056633 +305000 ekin = 5.65258268469942 | erot = 2.79940899091102 | epot = -14.0804635809916 | etot = -5.6284719053812 +306000 ekin = 5.56254653523126 | erot = 2.81503734235127 | epot = -14.0060557827405 | etot = -5.62847190515797 +307000 ekin = 5.46251129680734 | erot = 2.84075892386061 | epot = -13.9317421257017 | etot = -5.6284719050337 +308000 ekin = 5.35391293499779 | erot = 2.87633235164085 | epot = -13.8587171916706 | etot = -5.62847190503193 +309000 ekin = 5.2380500741146 | erot = 2.9199694072312 | epot = -13.7864913863811 | etot = -5.6284719050353 +310000 ekin = 5.11613875822227 | erot = 2.96880482959777 | epot = -13.7134154931058 | etot = -5.62847190528572 +311000 ekin = 4.98925852659027 | erot = 3.01839769775414 | epot = -13.6361281298119 | etot = -5.62847190546746 +312000 ekin = 4.85867326621938 | erot = 3.06421411593107 | epot = -13.5513592877722 | etot = -5.62847190562172 +313000 ekin = 4.7258511266702 | erot = 3.1023659032956 | epot = -13.4566889356293 | etot = -5.62847190566349 +314000 ekin = 4.59293421045906 | erot = 3.13002199528668 | epot = -13.3514281113023 | etot = -5.62847190555656 +315000 ekin = 4.4627066997121 | erot = 3.1458895038724 | epot = -13.2370681089019 | etot = -5.62847190531736 +316000 ekin = 4.33845457033799 | erot = 3.1501698931791 | epot = -13.1170963685019 | etot = -5.62847190498479 +317000 ekin = 4.22370149066824 | erot = 3.14429402986985 | epot = -12.9964674251447 | etot = -5.62847190460657 +318000 ekin = 4.12188681800263 | erot = 3.13056754977998 | epot = -12.8809262720081 | etot = -5.62847190422546 +319000 ekin = 4.03607214171397 | erot = 3.11184182787036 | epot = -12.7763858734547 | etot = -5.62847190387036 +320000 ekin = 3.96873641008349 | erot = 3.09128048611739 | epot = -12.6884887997534 | etot = -5.62847190355248 +321000 ekin = 3.92167797368866 | erot = 3.07226107993941 | epot = -12.6224109568985 | etot = -5.6284719032704 +322000 ekin = 3.89600971422094 | erot = 3.05833648374314 | epot = -12.5828181009917 | etot = -5.62847190302759 +323000 ekin = 3.89216326551481 | erot = 3.05323078719935 | epot = -12.5738659555504 | etot = -5.62847190283626 +324000 ekin = 3.90971752720339 | erot = 3.06065920136955 | epot = -12.5988486315721 | etot = -5.62847190299919 +325000 ekin = 3.94474197766764 | erot = 3.08325557841874 | epot = -12.6564694593348 | etot = -5.62847190324846 +326000 ekin = 3.99225791211204 | erot = 3.12131666195002 | epot = -12.7420464778336 | etot = -5.62847190377152 +327000 ekin = 4.04715751818241 | erot = 3.17277573872173 | epot = -12.8484051614778 | etot = -5.62847190457363 +328000 ekin = 4.10306827948992 | erot = 3.23289809100065 | epot = -12.9644382760915 | etot = -5.6284719056009 +329000 ekin = 4.15294077796389 | erot = 3.29460254685397 | epot = -13.0760152314918 | etot = -5.62847190667399 +330000 ekin = 4.19046086377944 | erot = 3.34957314357915 | epot = -13.1685059148607 | etot = -5.62847190750214 +331000 ekin = 4.2118793670419 | erot = 3.38989153265597 | epot = -13.2302428076658 | etot = -5.62847190796793 +332000 ekin = 4.21589857653174 | erot = 3.41075094374202 | epot = -13.2551214281287 | etot = -5.62847190785492 +333000 ekin = 4.20485265999827 | erot = 3.41174399824639 | epot = -13.2450685654392 | etot = -5.62847190719455 +334000 ekin = 4.1843536827594 | erot = 3.39692225044426 | epot = -13.2097478393623 | etot = -5.6284719061587 +335000 ekin = 4.16205455861251 | erot = 3.37367623594548 | epot = -13.1642026995451 | etot = -5.62847190498714 +336000 ekin = 4.1460949142031 | erot = 3.3509330966684 | epot = -13.1254999147759 | etot = -5.62847190390443 +337000 ekin = 4.14364358930878 | erot = 3.33736964606301 | epot = -13.1094851384434 | etot = -5.62847190307165 +338000 ekin = 4.15982493122452 | erot = 3.33968220643248 | epot = -13.1279790403876 | etot = -5.6284719027306 +339000 ekin = 4.19714166715088 | erot = 3.36120406394892 | epot = -13.1868176337066 | etot = -5.62847190260677 +340000 ekin = 4.25518474380122 | erot = 3.4039445653472 | epot = -13.2876012119478 | etot = -5.62847190279942 +341000 ekin = 4.33079125359022 | erot = 3.46797257818314 | epot = -13.4272357350123 | etot = -5.62847190323897 +342000 ekin = 4.41854745257256 | erot = 3.55173943759823 | epot = -13.5987587940178 | etot = -5.62847190384704 +343000 ekin = 4.51153864836906 | erot = 3.65250494550473 | epot = -13.7925154984214 | etot = -5.62847190454758 +344000 ekin = 4.60219231316278 | erot = 3.76671918647694 | epot = -13.997383404895 | etot = -5.62847190525523 +345000 ekin = 4.68312343518434 | erot = 3.89042211424212 | epot = -14.2020174553304 | etot = -5.62847190590392 +346000 ekin = 4.74786790538395 | erot = 4.01955036383398 | epot = -14.3958901756605 | etot = -5.62847190644256 +347000 ekin = 4.79150376885031 | erot = 4.15019529883626 | epot = -14.570170974482 | etot = -5.62847190679546 +348000 ekin = 4.81117855584605 | erot = 4.27877359763711 | epot = -14.7184240605328 | etot = -5.62847190704966 +349000 ekin = 4.80564918858633 | erot = 4.40205662691615 | epot = -14.8361777226707 | etot = -5.62847190716826 +350000 ekin = 4.77545945328664 | erot = 4.51714564004611 | epot = -14.9210770005263 | etot = -5.62847190719351 +351000 ekin = 4.72262273321912 | erot = 4.62116010887816 | epot = -14.9722547493018 | etot = -5.62847190720455 +352000 ekin = 4.65007958814178 | erot = 4.71078593020453 | epot = -14.9893374256266 | etot = -5.62847190728032 +353000 ekin = 4.56109157465487 | erot = 4.78180335583479 | epot = -14.9713668379528 | etot = -5.62847190746318 +354000 ekin = 4.45876151246763 | erot = 4.82895979647041 | epot = -14.9161932166616 | etot = -5.62847190772354 +355000 ekin = 4.34584612945812 | erot = 4.84663553108592 | epot = -14.8209535684691 | etot = -5.62847190792508 +356000 ekin = 4.22495470321296 | erot = 4.83038190908695 | epot = -14.6838085201897 | etot = -5.62847190788983 +357000 ekin = 4.09903296595125 | erot = 4.77873075093683 | epot = -14.5062356243708 | etot = -5.62847190748272 +358000 ekin = 3.97178667556286 | erot = 4.69444561049642 | epot = -14.2947041927689 | etot = -5.62847190670957 +359000 ekin = 3.8476729892966 | erot = 4.58431182213742 | epot = -14.0604567171869 | etot = -5.6284719057529 +360000 ekin = 3.73136439808726 | erot = 4.45746613157886 | epot = -13.8173024344245 | etot = -5.6284719047584 +361000 ekin = 3.62758093165404 | erot = 4.32379064505613 | epot = -13.5798434807421 | etot = -5.62847190403191 +362000 ekin = 3.54294892306447 | erot = 4.19358097114755 | epot = -13.3650017978897 | etot = -5.62847190367769 +363000 ekin = 3.47837311691063 | erot = 4.07207692082534 | epot = -13.1789219412937 | etot = -5.62847190355768 +364000 ekin = 3.43225009805705 | erot = 3.96193194141938 | epot = -13.0226539430639 | etot = -5.62847190358748 +365000 ekin = 3.40198388463041 | erot = 3.86460642705461 | epot = -12.8950622153704 | etot = -5.62847190368535 +366000 ekin = 3.38451833851882 | erot = 3.78104622244732 | epot = -12.7940364647476 | etot = -5.62847190378146 +367000 ekin = 3.37682483157754 | erot = 3.71218000857372 | epot = -12.7174767439928 | etot = -5.62847190384158 +368000 ekin = 3.37625204138126 | erot = 3.65912147822725 | epot = -12.6638454234616 | etot = -5.62847190385309 +369000 ekin = 3.38074636726359 | erot = 3.62312680344336 | epot = -12.6323450745323 | etot = -5.62847190382536 +370000 ekin = 3.38894636698295 | erot = 3.60538856636925 | epot = -12.6228068371721 | etot = -5.62847190381985 +371000 ekin = 3.40011634059559 | erot = 3.6067233363779 | epot = -12.6353115807203 | etot = -5.62847190374679 +372000 ekin = 3.41430323562447 | erot = 3.62748920223736 | epot = -12.6702643415601 | etot = -5.62847190369825 +373000 ekin = 3.43217624795184 | erot = 3.66740997408352 | epot = -12.7280581255783 | etot = -5.62847190354296 +374000 ekin = 3.45538314685729 | erot = 3.72532070766163 | epot = -12.8091757581464 | etot = -5.62847190362742 +375000 ekin = 3.48458983102994 | erot = 3.79950576965856 | epot = -12.9125675044443 | etot = -5.62847190375577 +376000 ekin = 3.51994630863055 | erot = 3.88772077541103 | epot = -13.0361389879669 | etot = -5.62847190392536 +377000 ekin = 3.56162263238966 | erot = 3.98718032086514 | epot = -13.1772748573483 | etot = -5.62847190409348 +378000 ekin = 3.61009229018706 | erot = 4.09470007581098 | epot = -13.3332642703023 | etot = -5.62847190430421 +379000 ekin = 3.66621939251756 | erot = 4.20668278515704 | epot = -13.5013740821171 | etot = -5.6284719044425 +380000 ekin = 3.73222313434711 | erot = 4.31893025305218 | epot = -13.6796252922782 | etot = -5.6284719048789 +381000 ekin = 3.80656943723105 | erot = 4.42661769094334 | epot = -13.8616590336251 | etot = -5.62847190545074 +382000 ekin = 3.88594558525596 | erot = 4.52459411505487 | epot = -14.0390116063945 | etot = -5.62847190608362 +383000 ekin = 3.96695089999006 | erot = 4.6074743389479 | epot = -14.2028971456622 | etot = -5.6284719067242 +384000 ekin = 4.04619645067071 | erot = 4.66967915257488 | epot = -14.3443475105423 | etot = -5.62847190729674 +385000 ekin = 4.12092029136871 | erot = 4.70599192062502 | epot = -14.4553841196635 | etot = -5.62847190766981 +386000 ekin = 4.18945537162048 | erot = 4.71237691681024 | epot = -14.5303041965371 | etot = -5.6284719081064 +387000 ekin = 4.24770733744385 | erot = 4.68531871644071 | epot = -14.5614979619391 | etot = -5.62847190805457 +388000 ekin = 4.29400518231676 | erot = 4.62433064765631 | epot = -14.5468077376841 | etot = -5.62847190771105 +389000 ekin = 4.32973751034707 | erot = 4.53230747815749 | epot = -14.4905168956691 | etot = -5.62847190716457 +390000 ekin = 4.35696496431921 | erot = 4.41432356915973 | epot = -14.3997604400478 | etot = -5.62847190656889 +391000 ekin = 4.37768888460159 | erot = 4.27672755001584 | epot = -14.2828883405545 | etot = -5.62847190593708 +392000 ekin = 4.39398588700028 | erot = 4.12625191225844 | epot = -14.1487097046389 | etot = -5.62847190538021 +393000 ekin = 4.40738241117469 | erot = 3.96936593196301 | epot = -14.0052202479613 | etot = -5.62847190482363 +394000 ekin = 4.41937568154892 | erot = 3.81285278687849 | epot = -13.8607003730906 | etot = -5.62847190466318 +395000 ekin = 4.42988768163888 | erot = 3.66065946576215 | epot = -13.7190190519324 | etot = -5.62847190453133 +396000 ekin = 4.43847476588974 | erot = 3.51525603215528 | epot = -13.5822027024369 | etot = -5.62847190439185 +397000 ekin = 4.44517728396978 | erot = 3.3789151277788 | epot = -13.4525643159655 | etot = -5.62847190421697 +398000 ekin = 4.45064950026053 | erot = 3.25392386318775 | epot = -13.333045267445 | etot = -5.62847190399669 +399000 ekin = 4.45613851377508 | erot = 3.1426965188145 | epot = -13.2273069363885 | etot = -5.62847190379889 +400000 ekin = 4.46297608305882 | erot = 3.04745583064984 | epot = -13.1389038172541 | etot = -5.62847190354543 +401000 ekin = 4.4727554600185 | erot = 2.97053701410719 | epot = -13.0717643774856 | etot = -5.62847190335986 +402000 ekin = 4.48672336701126 | erot = 2.91396522579777 | epot = -13.0291604961498 | etot = -5.62847190334076 +403000 ekin = 4.50482841072425 | erot = 2.87870251809156 | epot = -13.0120028324313 | etot = -5.62847190361552 +404000 ekin = 4.52484325730512 | erot = 2.86379686214208 | epot = -13.0171120236989 | etot = -5.62847190425173 +405000 ekin = 4.54178669953347 | erot = 2.865351205685 | epot = -13.0356098106956 | etot = -5.62847190547714 +406000 ekin = 4.54812186977296 | erot = 2.87565623453583 | epot = -13.0522500109057 | etot = -5.62847190659687 +407000 ekin = 4.53567765662224 | erot = 2.88781666333792 | epot = -13.0519662273823 | etot = -5.6284719074221 +408000 ekin = 4.4980683987241 | erot = 2.89717319275447 | epot = -13.0237134991285 | etot = -5.62847190764996 +409000 ekin = 4.43289041825228 | erot = 2.90293173430014 | epot = -12.9642940598285 | etot = -5.62847190727608 +410000 ekin = 4.34222243511571 | erot = 2.907845717641 | epot = -12.8785400593029 | etot = -5.62847190654618 +411000 ekin = 4.23122328981815 | erot = 2.91632332330752 | epot = -12.7760185189212 | etot = -5.62847190579552 +412000 ekin = 4.10591302468899 | erot = 2.93234263226303 | epot = -12.6667275621878 | etot = -5.62847190523582 +413000 ekin = 3.97147909136044 | erot = 2.95826875338062 | epot = -12.5582197496474 | etot = -5.62847190490633 +414000 ekin = 3.83169645328768 | erot = 2.9948721544054 | epot = -12.4550405124367 | etot = -5.62847190474364 +415000 ekin = 3.6891555688651 | erot = 3.04191716153679 | epot = -12.3595446350677 | etot = -5.62847190466582 +416000 ekin = 3.54575553257446 | erot = 3.09878213613395 | epot = -12.273009573321 | etot = -5.62847190461262 +417000 ekin = 3.4031527114646 | erot = 3.16484246791805 | epot = -12.1964670839352 | etot = -5.62847190455257 +418000 ekin = 3.2630625387357 | erot = 3.23960054554213 | epot = -12.1311349887514 | etot = -5.62847190447353 +419000 ekin = 3.12743539446411 | erot = 3.32265867811468 | epot = -12.0785659769522 | etot = -5.62847190437341 +420000 ekin = 2.99854685248433 | erot = 3.41362396345561 | epot = -12.0406427201965 | etot = -5.62847190425657 +421000 ekin = 2.8790171249261 | erot = 3.51197880379119 | epot = -12.0194678328541 | etot = -5.62847190413685 +422000 ekin = 2.77174596052497 | erot = 3.61690112203241 | epot = -12.0171189865995 | etot = -5.6284719040421 +423000 ekin = 2.67973794664943 | erot = 3.72700827485983 | epot = -12.0352181255247 | etot = -5.62847190401542 +424000 ekin = 2.60579870928978 | erot = 3.84002717527953 | epot = -12.0742977886825 | etot = -5.62847190411323 +425000 ekin = 2.55208954527813 | erot = 3.95244167892761 | epot = -12.1330031286051 | etot = -5.62847190439931 +426000 ekin = 2.51954653045088 | erot = 4.05920212806556 | epot = -12.2072205634469 | etot = -5.62847190493043 +427000 ekin = 2.50725893891138 | erot = 4.15363681829288 | epot = -12.2893676629198 | etot = -5.62847190571556 +428000 ekin = 2.51210485175689 | erot = 4.22782399613665 | epot = -12.3684007545436 | etot = -5.62847190665006 +429000 ekin = 2.52911833233697 | erot = 4.2737736907183 | epot = -12.4313639305362 | etot = -5.6284719074809 +430000 ekin = 2.55284926701683 | erot = 4.28551618826417 | epot = -12.4668373631705 | etot = -5.62847190788946 +431000 ekin = 2.57924139420927 | erot = 4.26142412036794 | epot = -12.4691374222607 | etot = -5.6284719076835 +432000 ekin = 2.60692475467972 | erot = 4.20541068246265 | epot = -12.44080734408 | etot = -5.62847190693765 +433000 ekin = 2.63712842983791 | erot = 4.12604912501302 | epot = -12.3916494607872 | etot = -5.62847190593631 +434000 ekin = 2.67245542242985 | erot = 4.03405948921243 | epot = -12.3349868166314 | etot = -5.6284719049891 +435000 ekin = 2.71543854641989 | erot = 3.93961255970565 | epot = -12.2835230104102 | etot = -5.62847190428466 +436000 ekin = 2.76760991343227 | erot = 3.85063248522813 | epot = -12.2467143025376 | etot = -5.62847190387721 +437000 ekin = 2.8292051567323 | erot = 3.77223859649821 | epot = -12.2299156569577 | etot = -5.62847190372722 +438000 ekin = 2.89929820060249 | erot = 3.7070750997431 | epot = -12.2348452041141 | etot = -5.62847190376851 +439000 ekin = 2.97609334156584 | erot = 3.6559037238806 | epot = -12.2604689693874 | etot = -5.62847190394097 +440000 ekin = 3.05720906613854 | erot = 3.61815200782747 | epot = -12.303832978167 | etot = -5.62847190420102 +441000 ekin = 3.1398967282964 | erot = 3.59232302398487 | epot = -12.3606916567996 | etot = -5.62847190451835 +442000 ekin = 3.22119927519208 | erot = 3.57626892518812 | epot = -12.4259401052542 | etot = -5.62847190487397 +443000 ekin = 3.29807867302421 | erot = 3.5673797299487 | epot = -12.4939303082205 | etot = -5.6284719052476 +444000 ekin = 3.36753883944261 | erot = 3.56276348926376 | epot = -12.5587742343254 | etot = -5.62847190561903 +445000 ekin = 3.42676046581308 | erot = 3.55942025918125 | epot = -12.6146526309603 | etot = -5.62847190596595 +446000 ekin = 3.47324383647127 | erot = 3.55443462308419 | epot = -12.6561503658249 | etot = -5.62847190626945 +447000 ekin = 3.50497354376538 | erot = 3.54511419619435 | epot = -12.6785596464668 | etot = -5.62847190650708 +448000 ekin = 3.5205621308358 | erot = 3.52974100710101 | epot = -12.6787750444576 | etot = -5.6284719065208 +449000 ekin = 3.51939696591144 | erot = 3.50705904511163 | epot = -12.654927917629 | etot = -5.62847190660589 +450000 ekin = 3.50164536053703 | erot = 3.47565071066306 | epot = -12.6057679778004 | etot = -5.62847190660035 +451000 ekin = 3.4682479070786 | erot = 3.43472151203002 | epot = -12.5314413256108 | etot = -5.62847190650218 +452000 ekin = 3.42090312736728 | erot = 3.38414558729872 | epot = -12.4335206209786 | etot = -5.62847190631264 +453000 ekin = 3.36201791828429 | erot = 3.32449206046017 | epot = -12.3149818847815 | etot = -5.62847190603699 +454000 ekin = 3.29463316060487 | erot = 3.25701739819663 | epot = -12.1801224644864 | etot = -5.6284719056849 +455000 ekin = 3.2223327489859 | erot = 3.18360703277374 | epot = -12.0344116870298 | etot = -5.62847190527019 +456000 ekin = 3.14914248628389 | erot = 3.1066699219853 | epot = -11.8842843130808 | etot = -5.62847190481165 +457000 ekin = 3.0793973717258 | erot = 3.02894564058875 | epot = -11.7368149166548 | etot = -5.62847190434023 +458000 ekin = 3.01756413267452 | erot = 2.95322108562799 | epot = -11.5992571221551 | etot = -5.62847190385259 +459000 ekin = 2.96810632523009 | erot = 2.88249754736279 | epot = -11.4790757759985 | etot = -5.62847190340562 +460000 ekin = 2.93513889002095 | erot = 2.81955267520888 | epot = -11.3831634682652 | etot = -5.6284719030354 +461000 ekin = 2.92205746387525 | erot = 2.7666923490783 | epot = -11.3172217157336 | etot = -5.62847190278005 +462000 ekin = 2.93114290149457 | erot = 2.72556812595561 | epot = -11.2851829301233 | etot = -5.6284719026731 +463000 ekin = 2.96319319679395 | erot = 2.69703193761103 | epot = -11.288697037142 | etot = -5.62847190273704 +464000 ekin = 3.01726238568113 | erot = 2.68105615129806 | epot = -11.3267904399551 | etot = -5.62847190297594 +465000 ekin = 3.09058398931695 | erot = 2.67674994758621 | epot = -11.3958058402738 | etot = -5.62847190337063 +466000 ekin = 3.17872270899957 | erot = 2.68248866699804 | epot = -11.489683279879 | etot = -5.62847190388135 +467000 ekin = 3.27594114495932 | erot = 2.69614045585002 | epot = -11.6005535052649 | etot = -5.6284719044556 +468000 ekin = 3.37571282133761 | erot = 2.71534026239567 | epot = -11.7195249887735 | etot = -5.6284719050402 +469000 ekin = 3.47128178262778 | erot = 2.7377467976262 | epot = -11.8375004858446 | etot = -5.62847190559065 +470000 ekin = 3.55617737699106 | erot = 2.76123628660843 | epot = -11.9458855696743 | etot = -5.62847190607478 +471000 ekin = 3.62463309399701 | erot = 2.78402790003451 | epot = -12.0371329005012 | etot = -5.62847190646968 +472000 ekin = 3.67190559892461 | erot = 2.80477124778385 | epot = -12.1051487534659 | etot = -5.62847190675745 +473000 ekin = 3.69451868440951 | erot = 2.82263116140768 | epot = -12.145621752738 | etot = -5.62847190692085 +474000 ekin = 3.69045746331418 | erot = 2.83737882568526 | epot = -12.1563081959457 | etot = -5.62847190694629 +475000 ekin = 3.65932116350768 | erot = 2.84946541726958 | epot = -12.1372584876029 | etot = -5.62847190682564 +476000 ekin = 3.60242486138673 | erot = 2.8600401649875 | epot = -12.0909369329348 | etot = -5.62847190656053 +477000 ekin = 3.52282746240149 | erot = 2.87088465735749 | epot = -12.0221840259214 | etot = -5.62847190616243 +478000 ekin = 3.42525452630285 | erot = 2.88424967270373 | epot = -11.9379761046732 | etot = -5.62847190566661 +479000 ekin = 3.31588349739548 | erot = 2.90254646896433 | epot = -11.8469018714766 | etot = -5.62847190511681 +480000 ekin = 3.2019294924653 | erot = 2.92801081390987 | epot = -11.7584122109543 | etot = -5.62847190457915 +481000 ekin = 3.0910210684156 | erot = 2.96227510040754 | epot = -11.6817680729574 | etot = -5.62847190413424 +482000 ekin = 2.99039932402286 | erot = 3.0059083936905 | epot = -11.6247796215779 | etot = -5.62847190386453 +483000 ekin = 2.90605693345808 | erot = 3.05799802963961 | epot = -11.592526866934 | etot = -5.62847190383634 +484000 ekin = 2.84200171525942 | erot = 3.11586840863149 | epot = -11.5863420279703 | etot = -5.62847190407938 +485000 ekin = 2.81072036470051 | erot = 3.03665546467488 | epot = -11.4758477219126 | etot = -5.62847189253722 +486000 ekin = 2.99172671788758 | erot = 2.89028588608681 | epot = -11.5104845147026 | etot = -5.62847191072822 +487000 ekin = 3.04661020884121 | erot = 2.89516257154487 | epot = -11.570244686021 | etot = -5.62847190563488 +488000 ekin = 3.02813445463 | erot = 2.9175581417469 | epot = -11.5741645019129 | etot = -5.62847190553598 +489000 ekin = 3.02918173190651 | erot = 2.94703274341716 | epot = -11.6046863809266 | etot = -5.62847190560288 +490000 ekin = 3.04920929976127 | erot = 2.98299921438025 | epot = -11.6606804199631 | etot = -5.62847190582156 +491000 ekin = 3.08564623422967 | erot = 3.02458607701 | epot = -11.7387042173596 | etot = -5.62847190611991 +492000 ekin = 3.13426650215683 | erot = 3.07113014036604 | epot = -11.8338685489617 | etot = -5.62847190643878 +493000 ekin = 3.19024782356761 | erot = 3.12246736374655 | epot = -11.9411870939609 | etot = -5.62847190664674 +494000 ekin = 3.24418110402754 | erot = 3.17757093524548 | epot = -12.0502240477908 | etot = -5.62847200851778 +495000 ekin = 3.12930691885668 | erot = 3.12025770002207 | epot = -11.8780365337095 | etot = -5.62847191483072 +496000 ekin = 3.38154400854628 | erot = 3.12702216680309 | epot = -12.1370381395603 | etot = -5.6284719642109 +497000 ekin = 3.53796334303899 | erot = 3.21345240183637 | epot = -12.3798876661138 | etot = -5.62847192123843 +498000 ekin = 3.54725242244754 | erot = 3.3127481569391 | epot = -12.4884725006426 | etot = -5.62847192125599 +499000 ekin = 3.54686752392577 | erot = 3.42936350670757 | epot = -12.6047029519806 | etot = -5.6284719213473 +500000 ekin = 3.53611629144012 | erot = 3.5621447184836 | epot = -12.7267329314377 | etot = -5.62847192151396 +501000 ekin = 3.51474019583912 | erot = 3.70831240062115 | epot = -12.8515245182196 | etot = -5.62847192175937 +502000 ekin = 3.48291543616965 | erot = 3.86351597857756 | epot = -12.9749033367392 | etot = -5.62847192199196 +503000 ekin = 3.44167367984362 | erot = 4.02200657194786 | epot = -13.0921521741401 | etot = -5.62847192234864 +504000 ekin = 3.39166561938215 | erot = 4.17733332041883 | epot = -13.1974708625427 | etot = -5.62847192274173 +505000 ekin = 3.33344269451075 | erot = 4.32266370126612 | epot = -13.2845783189097 | etot = -5.62847192313282 +506000 ekin = 3.26726906279832 | erot = 4.45157764163063 | epot = -13.3473186278291 | etot = -5.62847192340013 +507000 ekin = 3.19388361649876 | erot = 4.55898983228577 | epot = -13.3813453722705 | etot = -5.62847192348593 +508000 ekin = 3.11462724049333 | erot = 4.64207406471296 | epot = -13.3851732285416 | etot = -5.62847192333527 +509000 ekin = 3.03154551890378 | erot = 4.7008320264318 | epot = -13.3608494682921 | etot = -5.62847192295648 +510000 ekin = 2.94513058611812 | erot = 4.73730594221542 | epot = -13.3109084508205 | etot = -5.62847192248693 +511000 ekin = 2.85640718494606 | erot = 4.75516581382221 | epot = -13.2400449206904 | etot = -5.62847192192215 +512000 ekin = 2.76854482525136 | erot = 4.75962991523102 | epot = -13.1566466618477 | etot = -5.62847192136531 +513000 ekin = 2.68465921483057 | erot = 4.75599513194296 | epot = -13.0691262676726 | etot = -5.6284719208991 +514000 ekin = 2.60745568314055 | erot = 4.74870168659942 | epot = -12.9846292903236 | etot = -5.62847192058367 +515000 ekin = 2.53899080263876 | erot = 4.74082869238932 | epot = -12.9082914154344 | etot = -5.62847192040632 +516000 ekin = 2.48057862896529 | erot = 4.73416754063632 | epot = -12.8432180899589 | etot = -5.62847192035728 +517000 ekin = 2.43281299020053 | erot = 4.72933651073047 | epot = -12.7906214213348 | etot = -5.62847192040378 +518000 ekin = 2.39567246200523 | erot = 4.72611868195825 | epot = -12.7502630644689 | etot = -5.62847192050539 +519000 ekin = 2.36868008077252 | erot = 4.72386163460167 | epot = -12.7210136359953 | etot = -5.62847192062108 +520000 ekin = 2.35109068031693 | erot = 4.72186744279644 | epot = -12.7014300438287 | etot = -5.6284719207153 +521000 ekin = 2.34207426124088 | erot = 4.71970227703855 | epot = -12.6902484590462 | etot = -5.62847192076676 +522000 ekin = 2.34085858396855 | erot = 4.71735113731658 | epot = -12.6866816420588 | etot = -5.62847192077371 +523000 ekin = 2.34541603965411 | erot = 4.65571671269724 | epot = -12.6296046828338 | etot = -5.62847193048247 +524000 ekin = 2.39460269540065 | erot = 4.54409239676948 | epot = -12.5671670124494 | etot = -5.62847192027929 +525000 ekin = 2.51755565348139 | erot = 4.49060445326918 | epot = -12.6366320324754 | etot = -5.62847192572488 +526000 ekin = 2.63891940339899 | erot = 4.49670026132054 | epot = -12.7640916025052 | etot = -5.62847193778565 +527000 ekin = 2.6813055707917 | erot = 4.50503337381134 | epot = -12.8148108746973 | etot = -5.62847193009429 +528000 ekin = 2.71450795011646 | erot = 4.51098798634719 | epot = -12.8539678666578 | etot = -5.62847193019411 +529000 ekin = 2.74727192395392 | erot = 4.51402301147703 | epot = -12.8897668656952 | etot = -5.62847193026422 +530000 ekin = 2.77952118315639 | erot = 4.51256666257021 | epot = -12.9205597760171 | etot = -5.62847193029047 +531000 ekin = 2.81130699780534 | erot = 4.50555264770546 | epot = -12.94533157578 | etot = -5.62847193026921 +532000 ekin = 2.8427455322915 | erot = 4.49253106983453 | epot = -12.9637485323352 | etot = -5.62847193020913 +533000 ekin = 2.8739331377113 | erot = 4.47361780236023 | epot = -12.9760228702018 | etot = -5.62847193013024 +534000 ekin = 2.90486933808867 | erot = 4.44928844618011 | epot = -12.9826297143247 | etot = -5.62847193005592 +535000 ekin = 2.93541519866179 | erot = 4.42010482066211 | epot = -12.9839919493258 | etot = -5.62847193000187 +536000 ekin = 2.96529830148253 | erot = 4.38649798396238 | epot = -12.9802682154175 | etot = -5.62847192997261 +537000 ekin = 2.99415467151137 | erot = 4.34867665836684 | epot = -12.9713032598312 | etot = -5.62847192995302 +538000 ekin = 3.02158801649141 | erot = 4.30669342609836 | epot = -12.9567533725424 | etot = -5.62847192995266 +539000 ekin = 3.04722844372971 | erot = 4.26048951905113 | epot = -12.9361898927295 | etot = -5.6284719299487 +540000 ekin = 3.07077963643188 | erot = 4.21000980478769 | epot = -12.9092613711513 | etot = -5.62847192993171 +541000 ekin = 3.09204730615951 | erot = 4.1553506158546 | epot = -12.8758698519111 | etot = -5.62847192989701 +542000 ekin = 3.11094831332664 | erot = 4.09682671838313 | epot = -12.8362469615538 | etot = -5.62847192984404 +543000 ekin = 3.12750284881959 | erot = 4.03499383130505 | epot = -12.7909686099003 | etot = -5.62847192977567 +544000 ekin = 3.14181233917185 | erot = 3.97062692619834 | epot = -12.740911195071 | etot = -5.6284719297008 +545000 ekin = 3.15402369277451 | erot = 3.90462208415743 | epot = -12.6871177065597 | etot = -5.62847192962772 +546000 ekin = 3.16427777376711 | erot = 3.83809465726173 | epot = -12.6308443605884 | etot = -5.62847192955952 +547000 ekin = 3.17263245314557 | erot = 3.77248542235981 | epot = -12.5735898050378 | etot = -5.62847192953238 +548000 ekin = 3.17905114127096 | erot = 3.70842416473845 | epot = -12.5159472355489 | etot = -5.62847192953947 +549000 ekin = 3.18335924851634 | erot = 3.64619443421479 | epot = -12.4580256122707 | etot = -5.6284719295396 +550000 ekin = 3.18506506659006 | erot = 3.58603484426971 | epot = -12.3995718405133 | etot = -5.62847192965355 +551000 ekin = 3.18354118865114 | erot = 3.52751972612761 | epot = -12.339532844571 | etot = -5.62847192979223 +552000 ekin = 3.17814056098796 | erot = 3.46973317227236 | epot = -12.2763456631941 | etot = -5.62847192993373 +553000 ekin = 3.16816249046617 | erot = 3.41187716291749 | epot = -12.2085115834286 | etot = -5.62847193004495 +554000 ekin = 3.15297464055059 | erot = 3.3536338689097 | epot = -12.1350804395488 | etot = -5.62847193008849 +555000 ekin = 3.13218065540938 | erot = 3.29554931590078 | epot = -12.0562019013401 | etot = -5.62847193002996 +556000 ekin = 3.10581995741923 | erot = 3.239328904532 | epot = -11.973620791798 | etot = -5.62847192984672 +557000 ekin = 3.07457883896461 | erot = 3.18795403306403 | epot = -11.8910048015599 | etot = -5.62847192953126 +558000 ekin = 3.03998262652355 | erot = 3.14553707334849 | epot = -11.813991628982 | etot = -5.62847192910991 +559000 ekin = 3.00450378984156 | erot = 3.11693712835965 | epot = -11.7499128467833 | etot = -5.62847192858208 +560000 ekin = 2.97145203622217 | erot = 3.1075818198538 | epot = -11.7075057840995 | etot = -5.62847192802354 +561000 ekin = 2.94451934101954 | erot = 3.1226726975339 | epot = -11.6956639661186 | etot = -5.62847192756517 +562000 ekin = 2.92714140957828 | erot = 3.16633554921903 | epot = -11.7219488860465 | etot = -5.62847192724921 +563000 ekin = 2.92206147626411 | erot = 3.24077054353436 | epot = -11.791303946999 | etot = -5.62847192720053 +564000 ekin = 2.93031627655366 | erot = 3.3456341095489 | epot = -11.9044223136038 | etot = -5.62847192750128 +565000 ekin = 2.9506871229223 | erot = 3.47751232962104 | epot = -12.0566713806986 | etot = -5.6284719281553 +566000 ekin = 2.97962685521271 | erot = 3.62985521355648 | epot = -12.2379539978956 | etot = -5.6284719291264 +567000 ekin = 3.01171593575608 | erot = 3.79324477337326 | epot = -12.4334326394462 | etot = -5.62847193031686 +568000 ekin = 3.04054477447765 | erot = 3.95610049173114 | epot = -12.6251171977979 | etot = -5.6284719315891 +569000 ekin = 3.05981811079938 | erot = 4.10576505734827 | epot = -12.7940551009318 | etot = -5.62847193278418 +570000 ekin = 3.06446758298878 | erot = 4.22987220710644 | epot = -12.9228117238377 | etot = -5.62847193374246 +571000 ekin = 3.05159191042571 | erot = 4.31782950107407 | epot = -12.9978933458268 | etot = -5.62847193432701 +572000 ekin = 3.02108996841121 | erot = 4.36217384041968 | epot = -13.0117357432802 | etot = -5.62847193444927 +573000 ekin = 2.97589592648261 | erot = 4.35953364446362 | epot = -12.963901505034 | etot = -5.62847193408773 +574000 ekin = 2.92177260949754 | erot = 4.31098813646067 | epot = -12.8612326792579 | etot = -5.6284719332997 +575000 ekin = 2.86675845148244 | erot = 4.22206447601528 | epot = -12.717294857537 | etot = -5.62847193003927 +576000 ekin = 2.82238695047027 | erot = 4.11002108697591 | epot = -12.5608799669646 | etot = -5.62847192951847 +577000 ekin = 2.79586021291389 | erot = 3.98405314230884 | epot = -12.4083852843111 | etot = -5.62847192908835 +578000 ekin = 2.79062678653061 | erot = 3.84816173897011 | epot = -12.2672604543497 | etot = -5.62847192884899 +579000 ekin = 2.8072787676975 | erot = 3.70630768394865 | epot = -12.1420583804789 | etot = -5.62847192883276 +580000 ekin = 2.84308800289758 | erot = 3.56147502219919 | epot = -12.0330349543963 | etot = -5.62847192929951 +581000 ekin = 2.89275945174485 | erot = 3.41677708034905 | epot = -11.9380084614678 | etot = -5.62847192937395 +582000 ekin = 2.94948274103835 | erot = 3.27852635627925 | epot = -11.8564810267612 | etot = -5.62847192944361 +583000 ekin = 3.00600312785704 | erot = 3.1533950786452 | epot = -11.7878701359294 | etot = -5.62847192942714 +584000 ekin = 3.0561587030715 | erot = 3.04800743030949 | epot = -11.7326380626837 | etot = -5.62847192930273 +585000 ekin = 3.09596263912471 | erot = 2.96828908151033 | epot = -11.6927236497277 | etot = -5.62847192909268 +586000 ekin = 3.12407298202873 | erot = 2.91878541588222 | epot = -11.6713303267394 | etot = -5.62847192882846 +587000 ekin = 3.1417461422428 | erot = 2.90225430092797 | epot = -11.6724723717095 | etot = -5.62847192853876 +588000 ekin = 3.15240031625394 | erot = 2.91960613643246 | epot = -11.7004783809487 | etot = -5.62847192826232 +589000 ekin = 3.16081808259797 | erot = 2.97006448175089 | epot = -11.7593544923902 | etot = -5.62847192804131 +590000 ekin = 3.17204827388439 | erot = 3.05134069929102 | epot = -11.8518609010921 | etot = -5.62847192791673 +591000 ekin = 3.19150299842536 | erot = 3.16015018734832 | epot = -11.9801251137674 | etot = -5.6284719279937 +592000 ekin = 3.22264872306185 | erot = 3.29204057519177 | epot = -12.1431612265723 | etot = -5.62847192831868 +593000 ekin = 3.26585695466981 | erot = 3.44092346941487 | epot = -12.3352523529449 | etot = -5.6284719288602 +594000 ekin = 3.31918005198706 | erot = 3.59965335604983 | epot = -12.5473053376027 | etot = -5.62847192956579 +595000 ekin = 3.37897127085281 | erot = 3.76045843945238 | epot = -12.7679016405963 | etot = -5.62847193029108 +596000 ekin = 3.43824068580398 | erot = 3.91359738328686 | epot = -12.980310001717 | etot = -5.62847193262616 +597000 ekin = 3.48744876799044 | erot = 4.04782437863043 | epot = -13.1637450798808 | etot = -5.62847193325989 +598000 ekin = 3.52187002170255 | erot = 4.15698580426831 | epot = -13.307327759585 | etot = -5.62847193361412 +599000 ekin = 3.53831455071624 | erot = 4.23767846711066 | epot = -13.4044649515128 | etot = -5.62847193368587 +600000 ekin = 3.53510970428707 | erot = 4.28920847103936 | epot = -13.4527901088444 | etot = -5.62847193351797 +601000 ekin = 3.51191041815786 | erot = 4.31320178192802 | epot = -13.4535841332659 | etot = -5.62847193318003 +602000 ekin = 3.46937521143574 | erot = 4.31295152736691 | epot = -13.4107986715493 | etot = -5.62847193274661 +603000 ekin = 3.40882221238013 | erot = 4.29270411924618 | epot = -13.3299982639056 | etot = -5.62847193227927 +604000 ekin = 3.33194570978559 | erot = 4.2570524585947 | epot = -13.2174701001989 | etot = -5.62847193181861 +605000 ekin = 3.24062643783893 | erot = 4.21052248032778 | epot = -13.0796208495513 | etot = -5.62847193138458 +606000 ekin = 3.13683319322064 | erot = 4.15735875790268 | epot = -12.9226638821045 | etot = -5.62847193098114 +607000 ekin = 3.02259481106322 | erot = 4.1014670376604 | epot = -12.752533779326 | etot = -5.62847193060236 +608000 ekin = 2.90001652257406 | erot = 4.04645475149492 | epot = -12.5749432043072 | etot = -5.62847193023822 +609000 ekin = 2.7713172880563 | erot = 3.99571460773251 | epot = -12.3955038256672 | etot = -5.62847192987839 +610000 ekin = 2.63886938888094 | erot = 3.95250622983135 | epot = -12.219847548229 | etot = -5.6284719295167 +611000 ekin = 2.50524882248118 | erot = 3.92003293769894 | epot = -12.0537536890432 | etot = -5.6284719288631 +612000 ekin = 2.3738208727921 | erot = 3.90218869845917 | epot = -11.9044814997854 | etot = -5.62847192853414 +613000 ekin = 2.24769613360649 | erot = 3.9018678874184 | epot = -11.77803594925 | etot = -5.6284719282251 +614000 ekin = 2.12975142860158 | erot = 3.92103062107246 | epot = -11.6792539776525 | etot = -5.62847192797845 +615000 ekin = 2.02283676460709 | erot = 3.9608005682159 | epot = -11.6121092606515 | etot = -5.62847192782847 +616000 ekin = 1.92967019040109 | erot = 4.02099162177929 | epot = -11.579133739989 | etot = -5.62847192780864 +617000 ekin = 1.85273791854346 | erot = 4.09974474399252 | epot = -11.5809545904839 | etot = -5.62847192794792 +618000 ekin = 1.79420296287054 | erot = 4.19322703618216 | epot = -11.6159019273126 | etot = -5.62847192825989 +619000 ekin = 1.75583197419359 | erot = 4.29552606643173 | epot = -11.6798299693548 | etot = -5.62847192872946 +620000 ekin = 1.73895870088423 | erot = 4.39891672371453 | epot = -11.7663473539013 | etot = -5.6284719293025 +621000 ekin = 1.74449834705652 | erot = 4.49462250663369 | epot = -11.867592783578 | etot = -5.62847192988775 +622000 ekin = 1.77300875716763 | erot = 4.57403518090684 | epot = -11.9755158684539 | etot = -5.62847193037939 +623000 ekin = 1.82476626655654 | erot = 4.63011744395741 | epot = -12.0833556412062 | etot = -5.62847193069226 +624000 ekin = 1.89980556085527 | erot = 4.65854151395705 | epot = -12.1868190056079 | etot = -5.62847193079563 +625000 ekin = 1.99788930996706 | erot = 4.658170601646 | epot = -12.2845318423309 | etot = -5.62847193071786 +626000 ekin = 2.11841938996678 | erot = 4.63077870088668 | epot = -12.3776700213792 | etot = -5.62847193052572 +627000 ekin = 2.26034340488758 | erot = 4.58024268392336 | epot = -12.4690580190999 | etot = -5.62847193028892 +628000 ekin = 2.42211143970931 | erot = 4.51161612048185 | epot = -12.5621994902529 | etot = -5.62847193006177 +629000 ekin = 2.60047669400347 | erot = 4.43316974503215 | epot = -12.6621183684369 | etot = -5.62847192940126 +630000 ekin = 2.75035748991735 | erot = 4.31003905744608 | epot = -12.6888685130675 | etot = -5.62847196570411 +631000 ekin = 2.81471524132015 | erot = 4.11774535986825 | epot = -12.5609325369493 | etot = -5.62847193576088 +632000 ekin = 2.9586755220506 | erot = 4.07926707201668 | epot = -12.6664145269351 | etot = -5.62847193286781 +633000 ekin = 3.21010693581923 | erot = 4.20581326814194 | epot = -13.0443921660353 | etot = -5.62847196207413 +634000 ekin = 3.41641131487995 | erot = 4.25928215924009 | epot = -13.304165410488 | etot = -5.62847193636795 +635000 ekin = 3.57385274065781 | erot = 4.24018711595442 | epot = -13.4425117937506 | etot = -5.62847193713836 +636000 ekin = 3.71894531185721 | erot = 4.21896102697364 | epot = -13.5663782768054 | etot = -5.62847193797452 +637000 ekin = 3.84555962844625 | erot = 4.19009538986558 | epot = -13.6641269569819 | etot = -5.62847193867003 +638000 ekin = 3.94874232724621 | erot = 4.14881281920061 | epot = -13.7260270854857 | etot = -5.6284719390389 +639000 ekin = 4.02564653206276 | erot = 4.09271382113576 | epot = -13.7468322922034 | etot = -5.62847193900491 +640000 ekin = 4.07582551377061 | erot = 4.02260436112642 | epot = -13.7269018135144 | etot = -5.62847193861737 +641000 ekin = 4.10019063778084 | erot = 3.94203419560204 | epot = -13.6706967718469 | etot = -5.62847193846401 +642000 ekin = 4.0992358601055 | erot = 3.85569636504571 | epot = -13.5834041630362 | etot = -5.62847193788503 +643000 ekin = 4.07616079997735 | erot = 3.76850329627695 | epot = -13.473136033615 | etot = -5.62847193736071 +644000 ekin = 4.03483546325761 | erot = 3.6842853840609 | epot = -13.3475927842648 | etot = -5.62847193694628 +645000 ekin = 3.97939693555572 | erot = 3.60521279241213 | epot = -13.2130816645928 | etot = -5.62847193662499 +646000 ekin = 3.914241574152 | erot = 3.53197746510563 | epot = -13.0746909755998 | etot = -5.62847193634215 +647000 ekin = 3.84412108375504 | erot = 3.46430751170712 | epot = -12.9369005316455 | etot = -5.62847193618331 +648000 ekin = 3.77442093470216 | erot = 3.40030625094633 | epot = -12.8031991215143 | etot = -5.62847193586579 +649000 ekin = 3.71064844421026 | erot = 3.33902116856895 | epot = -12.6781415483232 | etot = -5.62847193554397 +650000 ekin = 3.65777288978035 | erot = 3.28036981757215 | epot = -12.566614642624 | etot = -5.62847193527149 +651000 ekin = 3.61962254765 | erot = 3.22458240430774 | epot = -12.4726768870525 | etot = -5.62847193509476 +652000 ekin = 3.59838866990065 | erot = 3.17201593040562 | epot = -12.3988765353386 | etot = -5.62847193503232 +653000 ekin = 3.59447660065128 | erot = 3.12302902485726 | epot = -12.3459775605759 | etot = -5.62847193506737 +654000 ekin = 3.60674141924375 | erot = 3.07797678369351 | epot = -12.313190138097 | etot = -5.62847193515974 +655000 ekin = 3.6329884131546 | erot = 3.03728497078528 | epot = -12.2987453192105 | etot = -5.62847193527063 +656000 ekin = 3.67052655532243 | erot = 3.00147990300574 | epot = -12.3004783937154 | etot = -5.62847193538727 +657000 ekin = 3.71734630707259 | erot = 2.97084073554712 | epot = -12.3166589780138 | etot = -5.62847193539409 +658000 ekin = 3.75778663170118 | erot = 2.94872940849709 | epot = -12.3349879989872 | etot = -5.62847195878893 +659000 ekin = 3.70128994164513 | erot = 2.99267200652722 | epot = -12.3224338839004 | etot = -5.62847193572804 +660000 ekin = 3.77980484677394 | erot = 3.05081678593039 | epot = -12.4590935967804 | etot = -5.62847196407602 +661000 ekin = 3.87674047130434 | erot = 3.02043722447083 | epot = -12.5256496411378 | etot = -5.62847194536264 +662000 ekin = 3.96189665312228 | erot = 2.9729451066035 | epot = -12.5633137060314 | etot = -5.62847194630559 +663000 ekin = 4.03233992124012 | erot = 2.90724728967908 | epot = -12.5680591572493 | etot = -5.62847194633005 +664000 ekin = 4.08703350789502 | erot = 2.82371074128155 | epot = -12.5392161949875 | etot = -5.62847194581096 +665000 ekin = 4.13016908284495 | erot = 2.72591755767246 | epot = -12.4845585855709 | etot = -5.62847194505346 +666000 ekin = 4.16485763703889 | erot = 2.62158318065064 | epot = -12.4149127617649 | etot = -5.62847194407538 +667000 ekin = 4.19388444244747 | erot = 2.5204804655618 | epot = -12.3428368513263 | etot = -5.62847194331707 +668000 ekin = 4.21970111376775 | erot = 2.43117566536091 | epot = -12.2793487218942 | etot = -5.62847194276556 +669000 ekin = 4.24419480075555 | erot = 2.35970998750672 | epot = -12.2323767306686 | etot = -5.62847194240629 +670000 ekin = 4.26650932853713 | erot = 2.31009212975349 | epot = -12.2050734005681 | etot = -5.62847194227748 +671000 ekin = 4.28028750593881 | erot = 2.28394068948421 | epot = -12.192700137648 | etot = -5.62847194222501 +672000 ekin = 4.28604953828195 | erot = 2.2808770094442 | epot = -12.1953984899153 | etot = -5.62847194218917 +673000 ekin = 4.28538320994761 | erot = 2.29981058114364 | epot = -12.2136657332365 | etot = -5.62847194214521 +674000 ekin = 4.28032637899501 | erot = 2.33931519995972 | epot = -12.2481135210592 | etot = -5.62847194210451 +675000 ekin = 4.27310613156474 | erot = 2.39770546337526 | epot = -12.2992835370552 | etot = -5.62847194211517 +676000 ekin = 4.26563141856059 | erot = 2.47283047860335 | epot = -12.3669338394392 | etot = -5.62847194227529 +677000 ekin = 4.25873601035467 | erot = 2.56159475141872 | epot = -12.448802704407 | etot = -5.62847194263361 +678000 ekin = 4.2515438341777 | erot = 2.65951246668713 | epot = -12.5395282441051 | etot = -5.62847194324031 +679000 ekin = 4.24120573471807 | erot = 2.76057514757248 | epot = -12.6302528263307 | etot = -5.62847194404019 +680000 ekin = 4.22320051186228 | erot = 2.85770689110643 | epot = -12.7093793478391 | etot = -5.62847194487038 +681000 ekin = 4.19242845455841 | erot = 2.94400272552496 | epot = -12.7649031255833 | etot = -5.62847194549996 +682000 ekin = 4.14477706340556 | erot = 3.01435956391996 | epot = -12.7876085730722 | etot = -5.62847194574666 +683000 ekin = 4.07850194581341 | erot = 3.06669689312527 | epot = -12.7736707845003 | etot = -5.6284719455616 +684000 ekin = 3.98766788583267 | erot = 3.09062770660156 | epot = -12.706767542821 | etot = -5.62847195038674 +685000 ekin = 3.8760997603181 | erot = 3.07213118865403 | epot = -12.5767028926492 | etot = -5.62847194367705 +686000 ekin = 3.78865422790986 | erot = 3.05379982538352 | epot = -12.4709259956439 | etot = -5.62847194235048 +687000 ekin = 3.7288563812245 | erot = 3.05128310405213 | epot = -12.408611432508 | etot = -5.62847194723138 +688000 ekin = 3.65488085466451 | erot = 3.04382149773097 | epot = -12.3271742987358 | etot = -5.62847194634028 +689000 ekin = 3.57606770149366 | erot = 3.03834252507491 | epot = -12.2428821722026 | etot = -5.62847194563407 +690000 ekin = 3.51634425567094 | erot = 3.04775260797855 | epot = -12.1925688087709 | etot = -5.62847194512142 +691000 ekin = 3.47971445752948 | erot = 3.07622358479915 | epot = -12.1844099871964 | etot = -5.62847194486774 +692000 ekin = 3.46765181268596 | erot = 3.12642449717242 | epot = -12.2225482547928 | etot = -5.62847194493445 +693000 ekin = 3.47854301565517 | erot = 3.19918358097393 | epot = -12.3061985419641 | etot = -5.62847194533503 +694000 ekin = 3.50760869812599 | erot = 3.2934044104255 | epot = -12.4294850545637 | etot = -5.6284719460122 +695000 ekin = 3.54747029174784 | erot = 3.40637947899957 | epot = -12.5823217175954 | etot = -5.62847194684794 +696000 ekin = 3.58927155174932 | erot = 3.53441505478472 | epot = -12.7521585542382 | etot = -5.6284719477042 +697000 ekin = 3.62399868532267 | erot = 3.67347767287036 | epot = -12.9259483066525 | etot = -5.62847194845942 +698000 ekin = 3.64429609765447 | erot = 3.81929275578106 | epot = -13.0920608025405 | etot = -5.62847194910502 +699000 ekin = 3.64411727660344 | erot = 3.96826912270823 | epot = -13.2408583488323 | etot = -5.62847194952066 +700000 ekin = 3.61972386486613 | erot = 4.11779628896031 | epot = -13.3659921035143 | etot = -5.62847194968783 +701000 ekin = 3.57045543141783 | erot = 4.26605645103649 | epot = -13.4649838321906 | etot = -5.6284719497363 +702000 ekin = 3.49917622959634 | erot = 4.41037029478515 | epot = -13.5380184739931 | etot = -5.62847194961158 +703000 ekin = 3.41079978159128 | erot = 4.54773448459995 | epot = -13.5870062155707 | etot = -5.62847194937949 +704000 ekin = 3.31149657263073 | erot = 4.67560464070122 | epot = -13.6155731624158 | etot = -5.62847194908389 +705000 ekin = 3.208079030569 | erot = 4.79162132869341 | epot = -13.6281723080447 | etot = -5.62847194878226 +706000 ekin = 3.10702043908273 | erot = 4.89365607485804 | epot = -13.6291484624854 | etot = -5.62847194854463 +707000 ekin = 3.01353531424254 | erot = 4.97967086400049 | epot = -13.6216781266835 | etot = -5.62847194844046 +708000 ekin = 2.93091332961603 | erot = 5.04739802040938 | epot = -13.6067832985419 | etot = -5.62847194851649 +709000 ekin = 2.86026033891818 | erot = 5.09399325378486 | epot = -13.5827255414769 | etot = -5.62847194877389 +710000 ekin = 2.80069789554938 | erot = 5.11589857280283 | epot = -13.5450684175111 | etot = -5.6284719491589 +711000 ekin = 2.74994326422268 | erot = 5.10911210216224 | epot = -13.4875273159535 | etot = -5.62847194956863 +712000 ekin = 2.70509857042167 | erot = 5.06990681741588 | epot = -13.4034773377164 | etot = -5.6284719498788 +713000 ekin = 2.66343594258145 | erot = 4.99582282577925 | epot = -13.2877307183444 | etot = -5.6284719499837 +714000 ekin = 2.62297982883473 | erot = 4.88658411822028 | epot = -13.1380358968879 | etot = -5.62847194983286 +715000 ekin = 2.58275404776271 | erot = 4.74456650518315 | epot = -12.9557925023948 | etot = -5.62847194944894 +716000 ekin = 2.54267933996016 | erot = 4.57461726476494 | epot = -12.7457685536363 | etot = -5.62847194891119 +717000 ekin = 2.5033469203234 | erot = 4.38348005467583 | epot = -12.5152989229978 | etot = -5.62847194799853 +718000 ekin = 2.46867182063301 | erot = 4.18280619312982 | epot = -12.2799499615047 | etot = -5.62847194774182 +719000 ekin = 2.44027484673925 | erot = 3.97913844296029 | epot = -12.0478852371905 | etot = -5.628471947491 +720000 ekin = 2.41790751040199 | erot = 3.77617089319515 | epot = -11.8225503508476 | etot = -5.6284719472505 +721000 ekin = 2.40130900330153 | erot = 3.57751641390117 | epot = -11.6072973642256 | etot = -5.62847194702291 +722000 ekin = 2.39001969448122 | erot = 3.3862093336106 | epot = -11.4047009751078 | etot = -5.62847194701602 +723000 ekin = 2.38288808222113 | erot = 3.20447847619705 | epot = -11.2158385051369 | etot = -5.62847194671873 +724000 ekin = 2.38038137261199 | erot = 3.03585463105936 | epot = -11.0447079501193 | etot = -5.62847194644795 +725000 ekin = 2.38334904386777 | erot = 2.88343528888341 | epot = -10.8952562789589 | etot = -5.62847194620774 +726000 ekin = 2.39277988819888 | erot = 2.74974572537002 | epot = -10.770997559572 | etot = -5.62847194600309 +727000 ekin = 2.40968215743344 | erot = 2.63676770312689 | epot = -10.6749218064005 | etot = -5.62847194584012 +728000 ekin = 2.42515138002469 | erot = 2.54412147907801 | epot = -10.5977448184551 | etot = -5.62847195935242 +729000 ekin = 2.40297855344215 | erot = 2.51475999952154 | epot = -10.5462104923917 | etot = -5.62847193942804 +730000 ekin = 2.46310039286495 | erot = 2.54088838271553 | epot = -10.6324607145563 | etot = -5.62847193897584 +731000 ekin = 2.53308642096613 | erot = 2.54954386947211 | epot = -10.711102229505 | etot = -5.62847193906673 +732000 ekin = 2.61398262093143 | erot = 2.5802487460585 | epot = -10.822703306265 | etot = -5.62847193927504 +733000 ekin = 2.70404858445948 | erot = 2.63167940201831 | epot = -10.9641999261219 | etot = -5.62847193964411 +734000 ekin = 2.80051950065896 | erot = 2.7013292984616 | epot = -11.130320739341 | etot = -5.62847194022042 +735000 ekin = 2.89941283715917 | erot = 2.78510796769434 | epot = -11.312992745887 | etot = -5.62847194103353 +736000 ekin = 2.99560133056514 | erot = 2.87741009023047 | epot = -11.5014833618905 | etot = -5.62847194109488 +737000 ekin = 3.08481605479911 | erot = 2.97524489366734 | epot = -11.6885328904478 | etot = -5.62847194198136 +738000 ekin = 3.16217862812249 | erot = 3.07317374875599 | epot = -11.8638243196778 | etot = -5.62847194279929 +739000 ekin = 3.22336037209491 | erot = 3.16493875126528 | epot = -12.0167710667071 | etot = -5.62847194334687 +740000 ekin = 3.26585131613638 | erot = 3.24522139632786 | epot = -12.1395446568944 | etot = -5.62847194443018 +741000 ekin = 3.28375382499279 | erot = 3.29991441187171 | epot = -12.2121401812924 | etot = -5.62847194442793 +742000 ekin = 3.27631313143846 | erot = 3.3240861171076 | epot = -12.2288711924857 | etot = -5.6284719439396 +743000 ekin = 3.24737724800463 | erot = 3.32046927276587 | epot = -12.1963184639691 | etot = -5.62847194319862 +744000 ekin = 3.20210603611902 | erot = 3.29401551194478 | epot = -12.1245934904807 | etot = -5.62847194241693 +745000 ekin = 3.14567705897692 | erot = 3.25033567018705 | epot = -12.0244846708759 | etot = -5.62847194171191 +746000 ekin = 3.08279906283019 | erot = 3.19521988704382 | epot = -11.9064908907384 | etot = -5.62847194086443 +747000 ekin = 3.01768881746883 | erot = 3.13473855330661 | epot = -11.7808993111576 | etot = -5.62847194038213 +748000 ekin = 2.95302867441137 | erot = 3.07321432162006 | epot = -11.6547149359761 | etot = -5.62847193994465 +749000 ekin = 2.89104396144326 | erot = 3.01469856715425 | epot = -11.5342144681276 | etot = -5.62847193953008 +750000 ekin = 2.83379417430614 | erot = 2.96315742665335 | epot = -11.4254235400924 | etot = -5.62847193913296 +751000 ekin = 2.78329891283332 | erot = 2.92241777463976 | epot = -11.3341886262355 | etot = -5.62847193876246 +752000 ekin = 2.74156846320063 | erot = 2.89600799331209 | epot = -11.266048394949 | etot = -5.62847193843623 +753000 ekin = 2.71056677633252 | erot = 2.88693753461072 | epot = -11.2259762491218 | etot = -5.62847193817852 +754000 ekin = 2.69212502656379 | erot = 2.8974312596522 | epot = -11.2180282242366 | etot = -5.62847193802059 +755000 ekin = 2.68776538359871 | erot = 2.92849871106126 | epot = -11.2447360327333 | etot = -5.62847193807333 +756000 ekin = 2.69845743031605 | erot = 2.97938409378998 | epot = -11.3063134623401 | etot = -5.62847193823404 +757000 ekin = 2.72458496411422 | erot = 3.04788425640591 | epot = -11.4009411591564 | etot = -5.62847193863626 +758000 ekin = 2.76540921277961 | erot = 3.12962823298844 | epot = -11.523509385085 | etot = -5.62847193931699 +759000 ekin = 2.8186834205773 | erot = 3.21794575410196 | epot = -11.6651011149394 | etot = -5.62847194026013 +760000 ekin = 2.88053746469875 | erot = 3.30429272414901 | epot = -11.8133021301939 | etot = -5.62847194134618 +761000 ekin = 2.94600007662043 | erot = 3.37947250565271 | epot = -11.9539445245983 | etot = -5.62847194232513 +762000 ekin = 3.01037281069867 | erot = 3.43568700389847 | epot = -12.0745317574868 | etot = -5.6284719428897 +763000 ekin = 3.07103775518422 | erot = 3.46881600092524 | epot = -12.1683256989529 | etot = -5.62847194284345 +764000 ekin = 3.12866395060911 | erot = 3.47975039715677 | epot = -12.2368862900023 | etot = -5.62847194223643 +765000 ekin = 3.18696433111185 | erot = 3.47390232181757 | epot = -12.2893385942623 | etot = -5.62847194133286 +766000 ekin = 3.25112146438474 | erot = 3.45917589095791 | epot = -12.3387692957924 | etot = -5.62847194044976 +767000 ekin = 3.32577328188977 | erot = 3.44357056043203 | epot = -12.3978157821425 | etot = -5.62847193982066 +768000 ekin = 3.4134183336462 | erot = 3.43342634965397 | epot = -12.4753166228542 | etot = -5.62847193955402 +769000 ekin = 3.51361597928388 | erot = 3.43258837720667 | epot = -12.5746762961495 | etot = -5.628471939659 +770000 ekin = 3.62296220584402 | erot = 3.44225950948084 | epot = -12.6936936554077 | etot = -5.62847194008282 +771000 ekin = 3.67754209849416 | erot = 3.42051682715851 | epot = -12.7265308934616 | etot = -5.62847196780898 +772000 ekin = 3.59351734054848 | erot = 3.35849685486605 | epot = -12.5804861289567 | etot = -5.62847193354221 +773000 ekin = 3.58504863443413 | erot = 3.48413941929281 | epot = -12.6976599869986 | etot = -5.62847193327161 +774000 ekin = 3.6955624666272 | erot = 3.75600381554418 | epot = -13.0800382509718 | etot = -5.62847196880046 +775000 ekin = 3.75799646994502 | erot = 3.87395641002164 | epot = -13.2604248525124 | etot = -5.6284719725457 +776000 ekin = 3.76514931014297 | erot = 3.89275295601426 | epot = -13.2863742388756 | etot = -5.62847197271834 +777000 ekin = 3.74852837941783 | erot = 3.88975944389829 | epot = -13.2667597956642 | etot = -5.6284719723481 +778000 ekin = 3.71300754026198 | erot = 3.86527182184886 | epot = -13.2067513337439 | etot = -5.62847197163307 +779000 ekin = 3.66665793080371 | erot = 3.82295167554327 | epot = -13.1180815768782 | etot = -5.62847197053126 +780000 ekin = 3.6197277314815 | erot = 3.76957330498926 | epot = -13.0177730057584 | etot = -5.62847196928763 +781000 ekin = 3.58276242526763 | erot = 3.71368279686272 | epot = -12.9249171903313 | etot = -5.62847196820099 +782000 ekin = 3.56434384287052 | erot = 3.663446216256 | epot = -12.8562620266381 | etot = -5.62847196751157 +783000 ekin = 3.569070833758 | erot = 3.62459601372342 | epot = -12.8221388149365 | etot = -5.62847196745505 +784000 ekin = 3.59655578171477 | erot = 3.59908724263203 | epot = -12.8241149921578 | etot = -5.628471967811 +785000 ekin = 3.64263842874724 | erot = 3.58559579679555 | epot = -12.8567061940348 | etot = -5.628471968492 +786000 ekin = 3.70061363559346 | erot = 3.58032714296196 | epot = -12.9094127478413 | etot = -5.62847196928587 +787000 ekin = 3.76290289520346 | erot = 3.57827846498719 | epot = -12.9696533302383 | etot = -5.62847197004765 +788000 ekin = 3.82230691235523 | erot = 3.57432079346976 | epot = -13.0250996764999 | etot = -5.62847197067496 +789000 ekin = 3.87288355994426 | erot = 3.56402750529852 | epot = -13.0653830363495 | etot = -5.62847197110668 +790000 ekin = 3.91054381107001 | erot = 3.54422213352492 | epot = -13.0832379158633 | etot = -5.62847197126834 +791000 ekin = 3.93344679983575 | erot = 3.51333982582914 | epot = -13.0752585968492 | etot = -5.62847197118435 +792000 ekin = 3.94193166979322 | erot = 3.47142235483933 | epot = -13.041825995538 | etot = -5.6284719709054 +793000 ekin = 3.93805337465015 | erot = 3.41982689853169 | epot = -12.9863522436869 | etot = -5.62847197050506 +794000 ekin = 3.92496167504177 | erot = 3.36081973487931 | epot = -12.914253379975 | etot = -5.62847197005388 +795000 ekin = 3.90631843202764 | erot = 3.29713731843621 | epot = -12.8319277200719 | etot = -5.62847196960807 +796000 ekin = 3.88587920094623 | erot = 3.2315810082019 | epot = -12.7459321783521 | etot = -5.62847196920401 +797000 ekin = 3.86724402826997 | erot = 3.16668037665964 | epot = -12.6623963737923 | etot = -5.62847196886266 +798000 ekin = 3.85371944458176 | erot = 3.10446220744812 | epot = -12.5866536206206 | etot = -5.62847196859071 +799000 ekin = 3.84821326129611 | erot = 3.04637406894326 | epot = -12.5230592986259 | etot = -5.62847196838653 +800000 ekin = 3.85308746119908 | erot = 2.99338091153568 | epot = -12.4749403409776 | etot = -5.62847196824285 +801000 ekin = 3.86994742120005 | erot = 2.94620265084506 | epot = -12.444622040199 | etot = -5.6284719681539 +802000 ekin = 3.89938743556193 | erot = 2.90559564242602 | epot = -12.4334550461071 | etot = -5.62847196811911 +803000 ekin = 3.94077451983175 | erot = 2.8725536318446 | epot = -12.441800119818 | etot = -5.62847196814163 +804000 ekin = 3.99217445543376 | erot = 2.84833794173038 | epot = -12.4689843653885 | etot = -5.62847196822432 +805000 ekin = 4.05048829026687 | erot = 2.83432176470912 | epot = -12.5132820233421 | etot = -5.62847196836608 +806000 ekin = 4.11178329751052 | erot = 2.83170980353165 | epot = -12.5719650696039 | etot = -5.62847196856174 +807000 ekin = 4.17172086390648 | erot = 2.84122318457455 | epot = -12.6414160172863 | etot = -5.62847196880528 +808000 ekin = 4.22595471214784 | erot = 2.86283161284251 | epot = -12.7172582940824 | etot = -5.62847196909201 +809000 ekin = 4.27041103455395 | erot = 2.89559061414517 | epot = -12.7944736181159 | etot = -5.62847196941681 +810000 ekin = 4.3014357915028 | erot = 2.93761851690391 | epot = -12.8675262781752 | etot = -5.62847196976853 +811000 ekin = 4.31585912480079 | erot = 2.9862278240649 | epot = -12.930558918992 | etot = -5.62847197012628 +812000 ekin = 4.31104963118775 | erot = 3.0381997476329 | epot = -12.9777213492781 | etot = -5.62847197045748 +813000 ekin = 4.28501152838114 | erot = 3.0901583710543 | epot = -13.0036418701586 | etot = -5.62847197072312 +814000 ekin = 4.23653530230676 | erot = 3.13897206756234 | epot = -13.0039793407554 | etot = -5.62847197088632 +815000 ekin = 4.16537042737931 | erot = 3.18209773865592 | epot = -12.9759401369568 | etot = -5.62847197092152 +816000 ekin = 4.07236517435923 | erot = 3.21779646432864 | epot = -12.9186336095086 | etot = -5.62847197082074 +817000 ekin = 3.95951977391364 | erot = 3.24518380278537 | epot = -12.8331755472951 | etot = -5.62847197059607 +818000 ekin = 3.82991762635876 | erot = 3.26412066883377 | epot = -12.7225102654719 | etot = -5.62847197027939 +819000 ekin = 3.68753356656504 | erot = 3.274989029105 | epot = -12.590994565573 | etot = -5.62847196990294 +820000 ekin = 3.53699106730962 | erot = 3.27842149090396 | epot = -12.4438845277236 | etot = -5.62847196950999 +821000 ekin = 3.38323613805522 | erot = 3.27505502164331 | epot = -12.2867631288311 | etot = -5.62847196913258 +822000 ekin = 3.23123737393496 | erot = 3.26537695352475 | epot = -12.1250862962494 | etot = -5.62847196878966 +823000 ekin = 3.08574116249628 | erot = 3.24970236664698 | epot = -11.9639154976287 | etot = -5.62847196848548 +824000 ekin = 2.95109919834906 | erot = 3.22828590270062 | epot = -11.8078570692609 | etot = -5.62847196821119 +825000 ekin = 2.83117167296369 | erot = 3.20152981083048 | epot = -11.6611734517467 | etot = -5.62847196795251 +826000 ekin = 2.72929448949813 | erot = 3.17021233016805 | epot = -11.5279787873624 | etot = -5.62847196769619 +827000 ekin = 2.64828540338987 | erot = 3.13564460937196 | epot = -11.4124019802009 | etot = -5.62847196743903 +828000 ekin = 2.5904526875204 | erot = 3.09968027863752 | epot = -11.3186049333498 | etot = -5.6284719671919 +829000 ekin = 2.55756748988894 | erot = 3.06454892028369 | epot = -11.2505883771529 | etot = -5.62847196698028 +830000 ekin = 2.55077388386594 | erot = 3.03254604850139 | epot = -11.2117918992051 | etot = -5.62847196683773 +831000 ekin = 2.57043726045413 | erot = 3.00566097437001 | epot = -11.2045702016212 | etot = -5.62847196679708 +832000 ekin = 2.61596871090219 | erot = 2.98524787914233 | epot = -11.229688556925 | etot = -5.6284719668805 +833000 ekin = 2.68568117813862 | erot = 2.97182255651397 | epot = -11.2859757017456 | etot = -5.62847196709305 +834000 ekin = 2.77673678084328 | erot = 2.96502424281942 | epot = -11.3702329910841 | etot = -5.62847196742142 +835000 ekin = 2.88522064267949 | erot = 2.96372965159491 | epot = -11.4774222621122 | etot = -5.62847196783783 +836000 ekin = 3.0063398455796 | erot = 2.96626860503604 | epot = -11.6010804189229 | etot = -5.62847196830727 +837000 ekin = 3.13471078894618 | erot = 2.970671332171 | epot = -11.7338540899128 | etot = -5.62847196879559 +838000 ekin = 3.26467977004394 | erot = 2.9748901905619 | epot = -11.86804192988 | etot = -5.62847196927416 +839000 ekin = 3.39062362138979 | erot = 2.97696578858225 | epot = -11.9960613796947 | etot = -5.62847196972267 +840000 ekin = 3.50719614194999 | erot = 2.97513773435446 | epot = -12.1108058464317 | etot = -5.6284719701272 +841000 ekin = 3.60951430409246 | erot = 2.96792302618422 | epot = -12.2059093007524 | etot = -5.62847197047575 +842000 ekin = 3.69330308348183 | erot = 2.95419217455893 | epot = -12.2759672287961 | etot = -5.62847197075532 +843000 ekin = 3.75502928038789 | erot = 2.93326272963042 | epot = -12.3167639809676 | etot = -5.6284719709493 +844000 ekin = 3.79205095730746 | erot = 2.90501003271159 | epot = -12.3255329610568 | etot = -5.6284719710377 +845000 ekin = 3.80278826958941 | erot = 2.86997708316237 | epot = -12.3012373237539 | etot = -5.62847197100208 +846000 ekin = 3.78689078342828 | erot = 2.82944607152358 | epot = -12.2448088257836 | etot = -5.6284719708317 +847000 ekin = 3.74534923732902 | erot = 2.78543387912981 | epot = -12.1592550869891 | etot = -5.62847197053025 +848000 ekin = 3.68048960888628 | erot = 2.74058491148344 | epot = -12.0495464904896 | etot = -5.62847197011993 +849000 ekin = 3.59580402255204 | erot = 2.69795473402186 | epot = -11.9222307262171 | etot = -5.62847196964325 +850000 ekin = 3.49561210989736 | erot = 2.66069826229511 | epot = -11.7847823413462 | etot = -5.62847196915371 +851000 ekin = 3.38460421148492 | erot = 2.63169878929639 | epot = -11.6447749694902 | etot = -5.62847196870891 +852000 ekin = 3.26735834604579 | erot = 2.61319105427311 | epot = -11.5090213686769 | etot = -5.62847196835798 +853000 ekin = 3.14792970804226 | erot = 2.60644045917402 | epot = -11.3828421353463 | etot = -5.62847196813006 +854000 ekin = 3.0296172146285 | erot = 2.61155167678953 | epot = -11.2696408594426 | etot = -5.62847196802458 +855000 ekin = 2.91497870617726 | erot = 2.62749311879696 | epot = -11.1709437929948 | etot = -5.62847196802053 +856000 ekin = 2.80592683617268 | erot = 2.65229723507084 | epot = -11.086696039322 | etot = -5.6284719680785 +857000 ekin = 2.70394323081684 | erot = 2.68342637125215 | epot = -11.015841570225 | etot = -5.62847196815598 +858000 ekin = 2.61028084993387 | erot = 2.71820874456432 | epot = -10.9569615627179 | etot = -5.62847196821974 +859000 ekin = 2.52608469656868 | erot = 2.75423459875954 | epot = -10.9087912635804 | etot = -5.6284719682522 +860000 ekin = 2.45241725307689 | erot = 2.78962480136954 | epot = -10.8705140226977 | etot = -5.62847196825129 +861000 ekin = 2.39021948293556 | erot = 2.8231315036545 | epot = -10.8418229548166 | etot = -5.62847196822653 +862000 ekin = 2.34025129519653 | erot = 2.8540794641069 | epot = -10.8228027274973 | etot = -5.62847196819388 +863000 ekin = 2.30304188808604 | erot = 2.8821927766783 | epot = -10.8137066329357 | etot = -5.62847196817133 +864000 ekin = 2.27886006044868 | erot = 2.90737073908666 | epot = -10.8147027677094 | etot = -5.62847196817405 +865000 ekin = 2.26770197216494 | erot = 2.92947677509682 | epot = -10.8256507154733 | etot = -5.62847196821149 +866000 ekin = 2.26929189271583 | erot = 2.94819404278774 | epot = -10.845957903789 | etot = -5.62847196828544 +867000 ekin = 2.28309242201064 | erot = 2.96298089342183 | epot = -10.8745452838223 | etot = -5.62847196838983 +868000 ekin = 2.30832281686981 | erot = 2.97313399123391 | epot = -10.9099287766154 | etot = -5.62847196851167 +869000 ekin = 2.34398135142967 | erot = 2.97793980556504 | epot = -10.9503931256294 | etot = -5.62847196863466 +870000 ekin = 2.38886744731908 | erot = 2.9768680983503 | epot = -10.9942075144143 | etot = -5.62847196874495 +871000 ekin = 2.44159861772528 | erot = 2.96974175433465 | epot = -11.0398123408954 | etot = -5.62847196883551 +872000 ekin = 2.50061961565798 | erot = 2.95681803701343 | epot = -11.0859096215799 | etot = -5.62847196890848 +873000 ekin = 2.56420808097439 | erot = 2.93874614067396 | epot = -11.131426190622 | etot = -5.62847196897363 +874000 ekin = 2.63049126981213 | erot = 2.91641905790467 | epot = -11.175382296758 | etot = -5.62847196904118 +875000 ekin = 2.69749664404329 | erot = 2.8907906901858 | epot = -11.2167593033423 | etot = -5.62847196911322 +876000 ekin = 2.7632574083448 | erot = 2.86275138579259 | epot = -11.254480763316 | etot = -5.62847196917864 +877000 ekin = 2.82597857024908 | erot = 2.83312911642634 | epot = -11.2875796558883 | etot = -5.62847196921292 +878000 ekin = 2.88426505992131 | erot = 2.80282960058492 | epot = -11.3155666296436 | etot = -5.62847196913737 +879000 ekin = 2.93899285456266 | erot = 2.7740255772711 | epot = -11.3414904007463 | etot = -5.62847196891249 +880000 ekin = 2.99074429445928 | erot = 2.7490446637777 | epot = -11.3682609271798 | etot = -5.62847196894281 +881000 ekin = 3.03734868933224 | erot = 2.72816458071191 | epot = -11.3939852388255 | etot = -5.62847196878133 +882000 ekin = 3.07935286284048 | erot = 2.71303253503703 | epot = -11.4208573664922 | etot = -5.62847196861465 +883000 ekin = 3.11756797041403 | erot = 2.70517731839467 | epot = -11.4512172572897 | etot = -5.62847196848101 +884000 ekin = 3.1528025280678 | erot = 2.70569769606158 | epot = -11.4869721925354 | etot = -5.62847196840606 +885000 ekin = 3.18571613165263 | erot = 2.71504911547609 | epot = -11.5292372155319 | etot = -5.62847196840319 +886000 ekin = 3.21676773348757 | erot = 2.73290580068261 | epot = -11.5781455026473 | etot = -5.62847196847712 +887000 ekin = 3.24623562385912 | erot = 2.75806669107831 | epot = -11.632774283569 | etot = -5.62847196863155 +888000 ekin = 3.27425941974037 | erot = 2.78837179675785 | epot = -11.6911031853683 | etot = -5.62847196887008 +889000 ekin = 3.3008647884799 | erot = 2.82064068491639 | epot = -11.7499774425873 | etot = -5.62847196919104 +890000 ekin = 3.32596924830188 | erot = 2.8507143996669 | epot = -11.8051556175416 | etot = -5.62847196957287 +891000 ekin = 3.34941253195838 | erot = 2.87373382366803 | epot = -11.8516183255886 | etot = -5.62847196996221 +892000 ekin = 3.37107523516432 | erot = 2.88476437049021 | epot = -11.8843115759264 | etot = -5.62847197027186 +893000 ekin = 3.39111185056978 | erot = 2.87974242668336 | epot = -11.8993262476569 | etot = -5.62847197040377 +894000 ekin = 3.41023212865337 | erot = 2.85650829435345 | epot = -11.8952123932958 | etot = -5.62847197028898 +895000 ekin = 3.42987730811632 | erot = 2.8155349942695 | epot = -11.873884272311 | etot = -5.62847196992517 +896000 ekin = 3.45214148913016 | erot = 2.7600121308566 | epot = -11.840625589371 | etot = -5.62847196938424 +897000 ekin = 3.47941735546095 | erot = 2.69521466345503 | epot = -11.803103987699 | etot = -5.628471968783 +898000 ekin = 3.51352961973772 | erot = 2.62737086718366 | epot = -11.7693724683296 | etot = -5.62847198140817 +899000 ekin = 3.48893911372815 | erot = 2.56291214058034 | epot = -11.6803232237633 | etot = -5.62847196945482 +900000 ekin = 3.45535689263727 | erot = 2.55015985129894 | epot = -11.6339887062865 | etot = -5.62847196235031 +901000 ekin = 3.50186288090734 | erot = 2.58894159238171 | epot = -11.7192764490665 | etot = -5.62847197577748 +902000 ekin = 3.56610213565302 | erot = 2.58196928643146 | epot = -11.7765433946361 | etot = -5.62847197255161 +903000 ekin = 3.62814875834234 | erot = 2.56232070352388 | epot = -11.8189414347917 | etot = -5.62847197292552 +904000 ekin = 3.6911239479288 | erot = 2.552476384214 | epot = -11.8720723055553 | etot = -5.62847197341246 +905000 ekin = 3.75091280589186 | erot = 2.54985569682935 | epot = -11.9292404766422 | etot = -5.628471973921 +906000 ekin = 3.8032250685699 | erot = 2.55191272418001 | epot = -11.9836097670979 | etot = -5.62847197434795 +907000 ekin = 3.84434229176419 | erot = 2.55683360446427 | epot = -12.029647870835 | etot = -5.62847197460657 +908000 ekin = 3.87190064590388 | erot = 2.56394104674777 | epot = -12.0643136673071 | etot = -5.62847197465545 +909000 ekin = 3.88547927778207 | erot = 2.57365301057682 | epot = -12.0876042628693 | etot = -5.6284719745104 +910000 ekin = 3.88680451384616 | erot = 2.58702435622899 | epot = -12.1023008443096 | etot = -5.62847197423442 +911000 ekin = 3.87951720733514 | erot = 2.60508796196012 | epot = -12.113077143204 | etot = -5.62847197390879 +912000 ekin = 3.86859234124604 | erot = 2.62827701247635 | epot = -12.1253413273305 | etot = -5.62847197360815 +913000 ekin = 3.85955913702666 | erot = 2.65612234800617 | epot = -12.1441534584224 | etot = -5.62847197338953 +914000 ekin = 3.85765974659174 | erot = 2.68725904635078 | epot = -12.1733907656271 | etot = -5.62847197268462 +915000 ekin = 3.86988559266746 | erot = 2.72155495790258 | epot = -12.2199125234306 | etot = -5.62847197286055 +916000 ekin = 3.89721211346838 | erot = 2.75899199543555 | epot = -12.2846760821703 | etot = -5.62847197326639 +917000 ekin = 3.93597306443113 | erot = 2.79756616404038 | epot = -12.3620112021776 | etot = -5.62847197370609 +918000 ekin = 3.98211349688365 | erot = 2.83523643659879 | epot = -12.4458219076339 | etot = -5.62847197415145 +919000 ekin = 4.03109884291744 | erot = 2.8693998294584 | epot = -12.5289706479572 | etot = -5.62847197558134 +920000 ekin = 4.07575006831304 | erot = 2.89203459093893 | epot = -12.5962566351513 | etot = -5.62847197589932 +921000 ekin = 4.11121320159991 | erot = 2.8996370575207 | epot = -12.6393222357595 | etot = -5.6284719766389 +922000 ekin = 4.12946329113093 | erot = 2.8910149125728 | epot = -12.6489501806141 | etot = -5.62847197691034 +923000 ekin = 4.12574551620118 | erot = 2.86656720003828 | epot = -12.6207846931349 | etot = -5.62847197689544 +924000 ekin = 4.0980625569279 | erot = 2.82817436939836 | epot = -12.5547089029588 | etot = -5.62847197663253 +925000 ekin = 4.04683813061977 | erot = 2.77889166025841 | epot = -12.4542017670983 | etot = -5.6284719762201 +926000 ekin = 3.97415980827213 | erot = 2.7224048551034 | epot = -12.3250366391405 | etot = -5.62847197576501 +927000 ekin = 3.88290109597355 | erot = 2.66247239441167 | epot = -12.1738454657142 | etot = -5.628471975329 +928000 ekin = 3.7761917261226 | erot = 2.60258197161579 | epot = -12.0072456726475 | etot = -5.62847197490908 +929000 ekin = 3.65741733985558 | erot = 2.54590496225226 | epot = -11.8317942765687 | etot = -5.62847197446088 +930000 ekin = 3.53056331439201 | erot = 2.49545263409286 | epot = -11.6544879224273 | etot = -5.62847197394242 +931000 ekin = 3.40054525982254 | erot = 2.45429284840673 | epot = -11.4833100812613 | etot = -5.62847197303199 +932000 ekin = 3.27351307385926 | erot = 2.4281214285064 | epot = -11.3301064749993 | etot = -5.62847197263363 +933000 ekin = 3.1547941288807 | erot = 2.42017428768359 | epot = -11.2034403887959 | etot = -5.6284719722316 +934000 ekin = 3.04934557269559 | erot = 2.43124949800217 | epot = -11.1090670425772 | etot = -5.62847197187946 +935000 ekin = 2.96178382764498 | erot = 2.46165171578676 | epot = -11.0519075150532 | etot = -5.62847197162141 +936000 ekin = 2.89581269402263 | erot = 2.51113391191419 | epot = -11.03541857742 | etot = -5.62847197148319 +937000 ekin = 2.85385879505556 | erot = 2.5788978601622 | epot = -11.0612286266873 | etot = -5.62847197146952 +938000 ekin = 2.83694342970363 | erot = 2.66364816115637 | epot = -11.1290635624289 | etot = -5.62847197156892 +939000 ekin = 2.8447669620069 | erot = 2.76369076607099 | epot = -11.2369296998344 | etot = -5.62847197175653 +940000 ekin = 2.87595320433365 | erot = 2.87707537754526 | epot = -11.3815005538769 | etot = -5.62847197199802 +941000 ekin = 2.92838858110334 | erot = 3.00178159602945 | epot = -11.5586421493877 | etot = -5.62847197225486 +942000 ekin = 2.99958691451742 | erot = 3.13593595373153 | epot = -11.7639948407407 | etot = -5.62847197249174 +943000 ekin = 3.08701486062517 | erot = 3.27802583948734 | epot = -11.9935126727952 | etot = -5.62847197268272 +944000 ekin = 3.18658687194688 | erot = 3.42629435655057 | epot = -12.2413532023889 | etot = -5.62847197389142 +945000 ekin = 3.29120912163075 | erot = 3.57701253366733 | epot = -12.4966936297096 | etot = -5.62847197441153 +946000 ekin = 3.39621217450377 | erot = 3.72637389338014 | epot = -12.7510580428887 | etot = -5.62847197500476 +947000 ekin = 3.49687303161659 | erot = 3.86977321150428 | epot = -12.995118218816 | etot = -5.62847197569508 +948000 ekin = 3.58827211310905 | erot = 4.00151346913667 | epot = -13.2182575587303 | etot = -5.62847197648454 +949000 ekin = 3.66536645558403 | erot = 4.11475106184004 | epot = -13.4085894947607 | etot = -5.62847197733668 +950000 ekin = 3.72323942075286 | erot = 4.20180191863669 | epot = -13.5535133175596 | etot = -5.62847197817002 +951000 ekin = 3.75754185745605 | erot = 4.25489778335397 | epot = -13.640911619673 | etot = -5.62847197886299 +952000 ekin = 3.76507381729662 | erot = 4.26734583679003 | epot = -13.660891633365 | etot = -5.62847197927839 +953000 ekin = 3.74438822435714 | erot = 4.23487585516235 | epot = -13.6077360588184 | etot = -5.62847197929889 +954000 ekin = 3.69625243000309 | erot = 4.15681815360206 | epot = -13.4815425624724 | etot = -5.62847197886724 +955000 ekin = 3.62380420284723 | erot = 4.03673171691482 | epot = -13.2890078977725 | etot = -5.62847197801043 +956000 ekin = 3.52555336700899 | erot = 3.8807380512619 | epot = -13.0347633979112 | etot = -5.62847197964028 +957000 ekin = 3.39894638986493 | erot = 3.70474137723537 | epot = -12.7321597416831 | etot = -5.62847197458277 +958000 ekin = 3.27782879423858 | erot = 3.53760737373846 | epot = -12.4439081409366 | etot = -5.62847197295959 +959000 ekin = 3.17835028686343 | erot = 3.38602207781495 | epot = -12.192844339492 | etot = -5.62847197481363 +960000 ekin = 3.09019087928103 | erot = 3.23509493538441 | epot = -11.9537577911203 | etot = -5.62847197645485 +961000 ekin = 3.00426259316327 | erot = 3.08248133569913 | epot = -11.7152159044103 | etot = -5.62847197554792 +962000 ekin = 2.92693479924967 | erot = 2.94805480855373 | epot = -11.5034615831379 | etot = -5.62847197533446 +963000 ekin = 2.85972055591546 | erot = 2.83488454517476 | epot = -11.323077076119 | etot = -5.62847197502879 +964000 ekin = 2.80427359411467 | erot = 2.74583973121403 | epot = -11.1785853001788 | etot = -5.62847197485006 +965000 ekin = 2.76170821973113 | erot = 2.68249826104574 | epot = -11.0726784555729 | etot = -5.62847197479599 +966000 ekin = 2.73254763820473 | erot = 2.64503832973914 | epot = -11.0060579428183 | etot = -5.62847197487444 +967000 ekin = 2.71665522014275 | erot = 2.63218922323769 | epot = -10.9773164184706 | etot = -5.62847197509013 +968000 ekin = 2.71315992358637 | erot = 2.64124364135887 | epot = -10.9828755403748 | etot = -5.6284719754296 +969000 ekin = 2.72046614525188 | erot = 2.66825860579762 | epot = -11.0171967269043 | etot = -5.62847197585485 +970000 ekin = 2.7363957888058 | erot = 2.70848274056211 | epot = -11.0733505056801 | etot = -5.62847197631217 +971000 ekin = 2.75849383087266 | erot = 2.75695664100323 | epot = -11.1439224485372 | etot = -5.62847197666126 +972000 ekin = 2.78540546217067 | erot = 2.80984083649779 | epot = -11.2237182756023 | etot = -5.62847197693383 +973000 ekin = 2.81581408813093 | erot = 2.86412704650895 | epot = -11.3084131117582 | etot = -5.62847197711836 +974000 ekin = 2.84847995007392 | erot = 2.91762904174479 | epot = -11.3945809690272 | etot = -5.62847197720854 +975000 ekin = 2.88260770675907 | erot = 2.96920774094647 | epot = -11.480287424912 | etot = -5.62847197720644 +976000 ekin = 2.90702474308763 | erot = 3.01964918949845 | epot = -11.555145934177 | etot = -5.62847200159089 +977000 ekin = 2.82994037303446 | erot = 3.10467594931735 | epot = -11.5630883002056 | etot = -5.6284719778538 +978000 ekin = 2.82908361995948 | erot = 3.22546638766101 | epot = -11.6830220113422 | etot = -5.62847200372169 +979000 ekin = 2.83706100078567 | erot = 3.25481873071872 | epot = -11.7203517215879 | etot = -5.62847199008348 +980000 ekin = 2.83601345096319 | erot = 3.27042511585167 | epot = -11.7349105569336 | etot = -5.62847199011874 +981000 ekin = 2.82679467472268 | erot = 3.27908746102754 | epot = -11.7343541259104 | etot = -5.62847199016015 +982000 ekin = 2.80889457046917 | erot = 3.28090658381986 | epot = -11.7182731444936 | etot = -5.62847199020456 +983000 ekin = 2.78208898618241 | erot = 3.27578647185869 | epot = -11.6863474482718 | etot = -5.62847199023068 +984000 ekin = 2.74660136864529 | erot = 3.26353952423134 | epot = -11.6386128830805 | etot = -5.62847199020383 +985000 ekin = 2.70333214411892 | erot = 3.24411391026867 | epot = -11.5759180444744 | etot = -5.62847199008681 +986000 ekin = 2.65408912736903 | erot = 3.21786526493321 | epot = -11.500426382155 | etot = -5.62847198985273 +987000 ekin = 2.57871632039566 | erot = 3.1724727902318 | epot = -11.3796611049636 | etot = -5.62847199433612 +988000 ekin = 2.53018926295006 | erot = 3.15315340607823 | epot = -11.3118146709826 | etot = -5.62847200195436 +989000 ekin = 2.49566278163332 | erot = 3.12952117396304 | epot = -11.2536559475413 | etot = -5.6284719919449 +990000 ekin = 2.46227182454259 | erot = 3.09741757789058 | epot = -11.1881613938229 | etot = -5.62847199138973 +991000 ekin = 2.44592299191521 | erot = 3.07158095018047 | epot = -11.1459759332225 | etot = -5.6284719911268 +992000 ekin = 2.4517428150834 | erot = 3.05611048477739 | epot = -11.1363252907874 | etot = -5.62847199092665 +993000 ekin = 2.48099671630818 | erot = 3.05281518173765 | epot = -11.1622838888188 | etot = -5.62847199077294 +994000 ekin = 2.53415670191708 | erot = 3.0635915442888 | epot = -11.2262202368932 | etot = -5.62847199068736 +995000 ekin = 2.61088853279327 | erot = 3.09015398608656 | epot = -11.3295145095591 | etot = -5.62847199067929 +996000 ekin = 2.71011819684934 | erot = 3.13378298765858 | epot = -11.4723731752586 | etot = -5.62847199075068 +997000 ekin = 2.83015603301196 | erot = 3.19515267788909 | epot = -11.6537807018024 | etot = -5.62847199090133 +998000 ekin = 2.96878571674253 | erot = 3.27423191440698 | epot = -11.8714896222901 | etot = -5.62847199114063 +999000 ekin = 3.12322522735956 | erot = 3.37022004814537 | epot = -12.1219172669997 | etot = -5.62847199149473 +1000000 ekin = 3.28990650652431 | erot = 3.48146010808984 | epot = -12.3998386066208 | etot = -5.62847199200668 + 1000000 0.14621807 -0.83009398 0.055104069 -0.56937076 4.8223734e-05 64000 +Loop time of 29.9827 on 1 procs for 1000000 steps with 16 atoms + +Performance: 28816.629 tau/day, 33352.580 timesteps/s +99.7% CPU use with 1 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 26.195 | 26.195 | 26.195 | 0.0 | 87.37 +Bond | 0.93416 | 0.93416 | 0.93416 | 0.0 | 3.12 +Neigh | 0.013798 | 0.013798 | 0.013798 | 0.0 | 0.05 +Comm | 0.18361 | 0.18361 | 0.18361 | 0.0 | 0.61 +Output | 0.14593 | 0.14593 | 0.14593 | 0.0 | 0.49 +Modify | 2.2241 | 2.2241 | 2.2241 | 0.0 | 7.42 +Other | | 0.2862 | | | 0.95 + +Nlocal: 16.0000 ave 16 max 16 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Nghost: 0.00000 ave 0 max 0 min +Histogram: 1 0 0 0 0 0 0 0 0 0 +Neighs: 106.000 ave 106 max 106 min +Histogram: 1 0 0 0 0 0 0 0 0 0 + +Total # of neighbors = 106 +Ave neighs/atom = 6.6250000 +Ave special neighs/atom = 3.7500000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.2.* nocoeff +System init for write_data ... +Total wall time: 0:00:29 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 new file mode 100644 index 0000000000..bbca5e3594 --- /dev/null +++ b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 @@ -0,0 +1,1182 @@ +LAMMPS (27 May 2021) +variable number equal 2 +variable ofreq equal 1000 +variable efreq equal 1000 +variable T equal 0.1 +variable rhos equal 0.5 + +units lj + +dimension 3 + +newton off + +boundary p p p + +atom_style hybrid bond ellipsoid oxdna +WARNING: Atom style hybrid defines both, per-type and per-atom masses; both must be set, but only per-atom masses will be used (../atom_vec_hybrid.cpp:157) +atom_modify sort 0 1.0 + +# Pair interactions require lists of neighbours to be calculated +neighbor 2.0 bin +neigh_modify every 1 delay 0 check yes + +read_data data.duplex2 +Reading data file ... + orthogonal box = (-20.000000 -20.000000 -20.000000) to (20.000000 20.000000 20.000000) + 1 by 2 by 2 MPI processor grid + reading atoms ... + 16 atoms + reading velocities ... + 16 velocities + scanning bonds ... + 2 = max bonds/atom + 16 ellipsoids + reading bonds ... +Setting oxDNA 3'->5' bond directionality ... + 13 bonds +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 0 0 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.001 seconds + read_data CPU = 0.005 seconds + +set atom * mass 3.1575 +Setting atom values ... + 16 settings made for mass + +group all type 1 4 +16 atoms in group all + +# oxRNA2 bond interactions - FENE backbone +bond_style oxrna2/fene +bond_coeff * 2.0 0.25 0.761070781051 +special_bonds lj 0 1 1 +Finding 1-2 1-3 1-4 neighbors ... + special bond factors lj: 0 1 1 + special bond factors coul: 0 0 0 + 2 = max # of 1-2 neighbors + 2 = max # of 1-3 neighbors + 4 = max # of 1-4 neighbors + 6 = max # of special neighbors + special bonds CPU = 0.000 seconds + +# oxRNA2 pair interactions +pair_style hybrid/overlay oxrna2/excv oxrna2/stk oxrna2/hbond oxrna2/xstk oxrna2/coaxstk oxrna2/dh +pair_coeff * * oxrna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 +pair_coeff * * oxrna2/stk seqdep ${T} 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 +pair_coeff * * oxrna2/stk seqdep 0.1 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 +pair_coeff * * oxrna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 1 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 2 3 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff 3 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 +pair_coeff * * oxrna2/xstk 59.9626 0.5 0.6 0.42 0.58 2.25 0.505 0.58 1.7 1.266 0.68 1.7 1.266 0.68 1.7 0.309 0.68 1.7 0.309 0.68 +pair_coeff * * oxrna2/coaxstk 80 0.5 0.6 0.42 0.58 2.0 2.592 0.65 1.3 0.151 0.8 0.9 0.685 0.95 0.9 0.685 0.95 2.0 -0.65 2.0 -0.65 +pair_coeff * * oxrna2/dh ${T} ${rhos} 1.02455 +pair_coeff * * oxrna2/dh 0.1 ${rhos} 1.02455 +pair_coeff * * oxrna2/dh 0.1 0.5 1.02455 + +# NVE ensemble +fix 1 all nve/asphere +#fix 2 all langevin ${T} ${T} 2.5 457145 angmom 10 + +timestep 1e-5 + +#comm_style tiled +fix 3 all balance 1000 1.03 shift xyz 10 1.03 +comm_modify cutoff 3.8 + +compute quat all property/atom quatw quati quatj quatk + +compute erot all erotate/asphere +compute ekin all ke +compute epot all pe +variable erot equal c_erot +variable ekin equal c_ekin +variable epot equal c_epot +variable etot equal c_erot+c_ekin+c_epot +fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes +fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes + +dump out all custom ${ofreq} out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.${number}.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump out all custom 1000 out.2.lammpstrj id mol type x y z ix iy iz vx vy vz c_quat[1] c_quat[2] c_quat[3] c_quat[4] angmomx angmomy angmomz +dump_modify out sort id +dump_modify out format line "%d %d %d %22.15le %22.15le %22.15le %d %d %d %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le %22.15le" + +run 1000000 +Neighbor list info ... + update every 1 steps, delay 0 steps, check yes + max neighbors/atom: 2000, page size: 100000 + master list distance cutoff = 4.3014979 + ghost atom cutoff = 4.3014979 + binsize = 2.150749, bins = 19 19 19 + 5 neighbor lists, perpetual/occasional/extra = 5 0 0 + (1) pair oxrna2/excv, perpetual + attributes: half, newton off + pair build: half/bin/newtoff + stencil: full/bin/3d + bin: standard + (2) pair oxrna2/hbond, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (3) pair oxrna2/xstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (4) pair oxrna2/coaxstk, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none + (5) pair oxrna2/dh, perpetual, copy from (1) + attributes: half, newton off + pair build: copy + stencil: none + bin: none +WARNING: Communication cutoff adjusted to 4.301497916929199 (../comm.cpp:739) +0 ekin = 2.70475393009871 | erot = 2.80172072918779 | epot = -11.1349465280232 | etot = -5.62847186873667 +Per MPI rank memory allocation (min/avg/max) = 9.578 | 9.607 | 9.692 Mbytes +Step Temp E_pair E_mol TotEng Press Volume + 0 0.12021129 -0.7299505 0.034016337 -0.52688704 5.1214421e-05 64000 +1000 ekin = 2.74425239815417 | erot = 2.79065458610893 | epot = -11.1633788526891 | etot = -5.62847186842597 +2000 ekin = 2.78841691867035 | erot = 2.77992540099535 | epot = -11.196814187725 | etot = -5.62847186805934 +3000 ekin = 2.83938215410022 | erot = 2.77185117591643 | epot = -11.2397051978034 | etot = -5.62847186778672 +4000 ekin = 2.89876217830263 | erot = 2.76816783884241 | epot = -11.295401884792 | etot = -5.62847186764698 +5000 ekin = 2.96742170720769 | erot = 2.76919345829434 | epot = -11.3650870331989 | etot = -5.6284718676969 +6000 ekin = 3.0456300737104 | erot = 2.77376672268247 | epot = -11.4478686641706 | etot = -5.62847186777774 +7000 ekin = 3.13407886898538 | erot = 2.78065913591456 | epot = -11.5432098726293 | etot = -5.6284718677294 +8000 ekin = 3.23400863287743 | erot = 2.78938863934857 | epot = -11.651869139893 | etot = -5.628471867667 +9000 ekin = 3.34625998930257 | erot = 2.80019523753784 | epot = -11.7749270943234 | etot = -5.62847186748303 +10000 ekin = 3.47220350616334 | erot = 2.81464622815281 | epot = -11.9153216015116 | etot = -5.62847186719543 +11000 ekin = 3.61341090096017 | erot = 2.83541090219849 | epot = -12.0772936703878 | etot = -5.62847186722916 +12000 ekin = 3.76971728921061 | erot = 2.8651661044909 | epot = -12.2633552607299 | etot = -5.62847186702835 +13000 ekin = 3.94105577714466 | erot = 2.90597306806357 | epot = -12.4755007121565 | etot = -5.62847186694831 +14000 ekin = 4.12730744896755 | erot = 2.95952862137382 | epot = -12.7153079373023 | etot = -5.62847186696097 +15000 ekin = 4.32776706381547 | erot = 3.02701108512254 | epot = -12.9832500158854 | etot = -5.62847186694737 +16000 ekin = 4.5413969568068 | erot = 3.10924468066181 | epot = -13.2791135046205 | etot = -5.62847186715189 +17000 ekin = 4.76575661763817 | erot = 3.20604355373095 | epot = -13.60027203892 | etot = -5.62847186755086 +18000 ekin = 4.99700491214677 | erot = 3.31611869568271 | epot = -13.9415954758897 | etot = -5.62847186806025 +19000 ekin = 5.23048108112183 | erot = 3.43700077146766 | epot = -14.2959537213472 | etot = -5.62847186875769 +20000 ekin = 5.46074742513047 | erot = 3.56463156086409 | epot = -14.6538508556014 | etot = -5.6284718696068 +21000 ekin = 5.68087058007123 | erot = 3.6925677668172 | epot = -15.0019102179231 | etot = -5.62847187103462 +22000 ekin = 5.88327619983863 | erot = 3.81252322503562 | epot = -15.3242712967755 | etot = -5.62847187190124 +23000 ekin = 6.06249979951972 | erot = 3.91720950057676 | epot = -15.6081811728146 | etot = -5.62847187271808 +24000 ekin = 6.21449712377417 | erot = 4.00104081543186 | epot = -15.8440098121103 | etot = -5.62847187290429 +25000 ekin = 6.33853277809233 | erot = 4.06184542619887 | epot = -16.0288500769827 | etot = -5.62847187269152 +26000 ekin = 6.43627737186988 | erot = 4.1007627843085 | epot = -16.1655120283937 | etot = -5.62847187221534 +27000 ekin = 6.51092447972002 | erot = 4.12134483746818 | epot = -16.260741188824 | etot = -5.6284718716358 +28000 ekin = 6.56622100976658 | erot = 4.12827111510827 | epot = -16.3229639959506 | etot = -5.62847187107576 +29000 ekin = 6.60587340002369 | erot = 4.12622173833913 | epot = -16.3605670089492 | etot = -5.62847187058634 +30000 ekin = 6.63335580501806 | erot = 4.11921545444668 | epot = -16.3810431296794 | etot = -5.62847187021464 +31000 ekin = 6.6521188858925 | erot = 4.10999678317548 | epot = -16.3905875389833 | etot = -5.62847186991534 +32000 ekin = 6.66584763664854 | erot = 4.10024297795119 | epot = -16.3945624842073 | etot = -5.62847186960755 +33000 ekin = 6.67923227191012 | erot = 4.09129207413386 | epot = -16.3989962152632 | etot = -5.62847186921922 +34000 ekin = 6.69756137216817 | erot = 4.08414768607684 | epot = -16.4101809271348 | etot = -5.62847186888979 +35000 ekin = 6.72589628312068 | erot = 4.07950228497966 | epot = -16.4338704366879 | etot = -5.62847186858753 +36000 ekin = 6.76908557113702 | erot = 4.07778615492126 | epot = -16.4753435944364 | etot = -5.62847186837807 +37000 ekin = 6.83097506213393 | erot = 4.07899014040679 | epot = -16.5384370708785 | etot = -5.62847186833777 +38000 ekin = 6.91354703253162 | erot = 4.08242106390429 | epot = -16.6244399649598 | etot = -5.62847186852385 +39000 ekin = 7.01626065739823 | erot = 4.08652171942795 | epot = -16.7312542457771 | etot = -5.62847186895093 +40000 ekin = 7.13573792258319 | erot = 4.08884404540012 | epot = -16.8530538375758 | etot = -5.62847186959248 +41000 ekin = 7.26614194134504 | erot = 4.08627042537772 | epot = -16.9808842370342 | etot = -5.62847187031142 +42000 ekin = 7.40051154120578 | erot = 4.07546023443106 | epot = -17.1044436466274 | etot = -5.62847187099058 +43000 ekin = 7.53157437143681 | erot = 4.05344655359643 | epot = -17.2134927965845 | etot = -5.62847187155127 +44000 ekin = 7.65268317567638 | erot = 4.01819177227237 | epot = -17.299346819823 | etot = -5.62847187187422 +45000 ekin = 7.75845343306884 | erot = 3.96898510895776 | epot = -17.3559104142062 | etot = -5.62847187217958 +46000 ekin = 7.84504377034639 | erot = 3.90454903064797 | epot = -17.3780646733313 | etot = -5.62847187233698 +47000 ekin = 7.91002390820631 | erot = 3.824785965552 | epot = -17.3632817459103 | etot = -5.62847187215201 +48000 ekin = 7.95195705456511 | erot = 3.73154439390009 | epot = -17.3119733204125 | etot = -5.62847187194732 +49000 ekin = 7.97001825706877 | erot = 3.6275200729505 | epot = -17.2260102016182 | etot = -5.62847187159896 +50000 ekin = 7.96375756700445 | erot = 3.51726958365113 | epot = -17.109499021545 | etot = -5.62847187088944 +51000 ekin = 7.9328076130046 | erot = 3.40827188497842 | epot = -16.969551368803 | etot = -5.62847187081996 +52000 ekin = 7.87656811744218 | erot = 3.30207418532543 | epot = -16.8071141735587 | etot = -5.62847187079108 +53000 ekin = 7.79531012541938 | erot = 3.19839984815422 | epot = -16.6221818441149 | etot = -5.62847187054131 +54000 ekin = 7.6895260957037 | erot = 3.09980185481832 | epot = -16.4177998208249 | etot = -5.62847187030289 +55000 ekin = 7.55966222141136 | erot = 3.00897426989547 | epot = -16.1971083614504 | etot = -5.62847187014361 +56000 ekin = 7.40594124508043 | erot = 2.92802865182272 | epot = -15.9624417669779 | etot = -5.62847187007474 +57000 ekin = 7.22816598142035 | erot = 2.85836584281806 | epot = -15.7150036943487 | etot = -5.62847187011032 +58000 ekin = 7.0257305139765 | erot = 2.80066522322048 | epot = -15.4548676074202 | etot = -5.62847187022325 +59000 ekin = 6.80455077165163 | erot = 2.75651944712042 | epot = -15.1895420860973 | etot = -5.62847186732528 +60000 ekin = 6.57760251691554 | erot = 2.72731501678744 | epot = -14.9333893991701 | etot = -5.62847186546714 +61000 ekin = 5.99884053190202 | erot = 2.6501026979173 | epot = -14.2774150331173 | etot = -5.628471803298 +62000 ekin = 5.82217958652088 | erot = 2.65058478195153 | epot = -14.1012361774594 | etot = -5.62847180898695 +63000 ekin = 6.00993174210254 | erot = 2.7114348346641 | epot = -14.3498384845188 | etot = -5.62847190775213 +64000 ekin = 5.8509698505037 | erot = 2.71173917624717 | epot = -14.1911809366077 | etot = -5.62847190985684 +65000 ekin = 5.67959801442735 | erot = 2.70731630130145 | epot = -14.0153862253965 | etot = -5.62847190966768 +66000 ekin = 5.49812382731704 | erot = 2.69646895132486 | epot = -13.8230646880631 | etot = -5.62847190942121 +67000 ekin = 5.31011188753145 | erot = 2.67901331172376 | epot = -13.6175971082583 | etot = -5.62847190900305 +68000 ekin = 5.11964229582587 | erot = 2.65622197273386 | epot = -13.4043361770526 | etot = -5.62847190849287 +69000 ekin = 4.93067975207852 | erot = 2.63014135225674 | epot = -13.1892930124928 | etot = -5.62847190815752 +70000 ekin = 4.74697386617485 | erot = 2.60347312706283 | epot = -12.9789189008748 | etot = -5.62847190763715 +71000 ekin = 4.57222133259569 | erot = 2.57971589798906 | epot = -12.7804091377443 | etot = -5.62847190715951 +72000 ekin = 4.40959648507785 | erot = 2.56228295922467 | epot = -12.6003513510615 | etot = -5.62847190675897 +73000 ekin = 4.26170009573909 | erot = 2.55406076080087 | epot = -12.4442327629948 | etot = -5.62847190645487 +74000 ekin = 4.13052949790825 | erot = 2.55713155841143 | epot = -12.3161329625866 | etot = -5.62847190626696 +75000 ekin = 4.01588192828881 | erot = 2.56608801434057 | epot = -12.2104419139901 | etot = -5.62847197136067 +76000 ekin = 3.95904625854741 | erot = 2.44184942386022 | epot = -12.0293675901711 | etot = -5.62847190776351 +77000 ekin = 4.02755960266361 | erot = 2.46007159499036 | epot = -12.116103109804 | etot = -5.62847191215006 +78000 ekin = 3.98785439943812 | erot = 2.49596945534594 | epot = -12.1122957670967 | etot = -5.62847191231265 +79000 ekin = 3.96575767721423 | erot = 2.54200842335447 | epot = -12.1362380131155 | etot = -5.62847191254684 +80000 ekin = 3.95961954869548 | erot = 2.59604589435592 | epot = -12.1841373558852 | etot = -5.62847191283377 +81000 ekin = 3.96734100032333 | erot = 2.65577062232351 | epot = -12.2515835357819 | etot = -5.6284719131351 +82000 ekin = 3.98651997822109 | erot = 2.71892569307084 | epot = -12.3339175847232 | etot = -5.62847191343124 +83000 ekin = 4.01459300302727 | erot = 2.78352190390199 | epot = -12.4265868206361 | etot = -5.62847191370683 +84000 ekin = 4.04956210608531 | erot = 2.8479662966442 | epot = -12.5260003165345 | etot = -5.62847191380503 +85000 ekin = 4.09049341026842 | erot = 2.91104365381102 | epot = -12.6300089781181 | etot = -5.62847191403861 +86000 ekin = 4.13484812560019 | erot = 2.9720116541909 | epot = -12.7353316940204 | etot = -5.62847191422934 +87000 ekin = 4.1800382918462 | erot = 3.03078479878285 | epot = -12.8392950049954 | etot = -5.62847191436634 +88000 ekin = 4.22360704724701 | erot = 3.0879657400032 | epot = -12.9400447017002 | etot = -5.62847191445002 +89000 ekin = 4.26326024607288 | erot = 3.14481288279481 | epot = -13.036545043336 | etot = -5.62847191446827 +90000 ekin = 4.29588111790582 | erot = 3.20341713777007 | epot = -13.12777017033 | etot = -5.62847191465414 +91000 ekin = 4.3169778457778 | erot = 3.26736040230148 | epot = -13.2128101626457 | etot = -5.62847191456645 +92000 ekin = 4.32507837347549 | erot = 3.3393160194455 | epot = -13.2928663075901 | etot = -5.62847191466915 +93000 ekin = 4.31872212432171 | erot = 3.42036541916765 | epot = -13.3675594581779 | etot = -5.62847191468857 +94000 ekin = 4.29660005793273 | erot = 3.51205694754388 | epot = -13.4371289201541 | etot = -5.62847191467748 +95000 ekin = 4.25789021838828 | erot = 3.61606475666823 | epot = -13.5024268896672 | etot = -5.62847191461066 +96000 ekin = 4.20253661926493 | erot = 3.73412422729639 | epot = -13.5651327610314 | etot = -5.6284719144701 +97000 ekin = 4.13146529060017 | erot = 3.8680303743927 | epot = -13.627967579342 | etot = -5.62847191434911 +98000 ekin = 4.04669071975362 | erot = 4.01885670334698 | epot = -13.6940193371954 | etot = -5.62847191409479 +99000 ekin = 3.95128630061912 | erot = 4.18772840013427 | epot = -13.7674866145627 | etot = -5.62847191380928 +100000 ekin = 3.84921784883081 | erot = 4.37558821791238 | epot = -13.8532779802875 | etot = -5.62847191354432 +101000 ekin = 3.74501223923312 | erot = 4.58258429231741 | epot = -13.9560684449146 | etot = -5.62847191336403 +102000 ekin = 3.64330024870582 | erot = 4.80764134110067 | epot = -14.0794135031374 | etot = -5.62847191333087 +103000 ekin = 3.54831662006285 | erot = 5.04811575607496 | epot = -14.2249042896175 | etot = -5.62847191347966 +104000 ekin = 3.4634977206494 | erot = 5.29960820358444 | epot = -14.3915778382037 | etot = -5.62847191396988 +105000 ekin = 3.39136254536271 | erot = 5.55507704359984 | epot = -14.5749115034251 | etot = -5.62847191446257 +106000 ekin = 3.33356403744409 | erot = 5.80718759324928 | epot = -14.7692235454839 | etot = -5.62847191479058 +107000 ekin = 3.29209861353699 | erot = 6.0490668738674 | epot = -14.9696374027453 | etot = -5.62847191534095 +108000 ekin = 3.26748487341106 | erot = 6.2741824365969 | epot = -15.1701392258627 | etot = -5.62847191585477 +109000 ekin = 3.25930506886601 | erot = 6.47585417244292 | epot = -15.3636311580687 | etot = -5.62847191675981 +110000 ekin = 3.26568272829098 | erot = 6.64602097207883 | epot = -15.5401756176979 | etot = -5.62847191732811 +111000 ekin = 3.28520059172619 | erot = 6.77857539600267 | epot = -15.692247905526 | etot = -5.62847191779711 +112000 ekin = 3.31659315707433 | erot = 6.86862760563874 | epot = -15.8136926809238 | etot = -5.6284719182107 +113000 ekin = 3.3586014423093 | erot = 6.91335224014723 | epot = -15.900425600656 | etot = -5.6284719181995 +114000 ekin = 3.41073468124676 | erot = 6.91406610981085 | epot = -15.9532727088324 | etot = -5.62847191777475 +115000 ekin = 3.47381531534278 | erot = 6.87643065686273 | epot = -15.9787178894058 | etot = -5.62847191720034 +116000 ekin = 3.54886437558773 | erot = 6.8071113952899 | epot = -15.9844476879565 | etot = -5.62847191707888 +117000 ekin = 3.6346740920495 | erot = 6.71320827683473 | epot = -15.9763542854618 | etot = -5.62847191657758 +118000 ekin = 3.72815555523563 | erot = 6.60276001485475 | epot = -15.9593874864256 | etot = -5.62847191633521 +119000 ekin = 3.82420980363925 | erot = 6.48288858478196 | epot = -15.9355703049686 | etot = -5.62847191654741 +120000 ekin = 3.91797748357223 | erot = 6.35662792089788 | epot = -15.9030773212275 | etot = -5.62847191675741 +121000 ekin = 4.00591742044039 | erot = 6.22468993027016 | epot = -15.8590792676428 | etot = -5.62847191693228 +122000 ekin = 4.08550270322373 | erot = 6.08676575288842 | epot = -15.8007403736371 | etot = -5.62847191752491 +123000 ekin = 4.15433540908383 | erot = 5.9407157229031 | epot = -15.7235230494648 | etot = -5.6284719174779 +124000 ekin = 4.21272085203612 | erot = 5.78590733869413 | epot = -15.6271001078557 | etot = -5.62847191712543 +125000 ekin = 4.26325970413196 | erot = 5.6246737368656 | epot = -15.5164053575241 | etot = -5.6284719165265 +126000 ekin = 4.3088059798051 | erot = 5.46113290467105 | epot = -15.3984108007459 | etot = -5.62847191626975 +127000 ekin = 4.35136313111014 | erot = 5.29960307371348 | epot = -15.279438120582 | etot = -5.62847191575839 +128000 ekin = 4.39391383900474 | erot = 5.14386269106651 | epot = -15.1662484454477 | etot = -5.62847191537649 +129000 ekin = 4.43858036063608 | erot = 4.99693296064701 | epot = -15.0639852363966 | etot = -5.62847191511354 +130000 ekin = 4.48619887382468 | erot = 4.86092637377882 | epot = -14.9755971627245 | etot = -5.62847191512104 +131000 ekin = 4.53629967746032 | erot = 4.73552279955439 | epot = -14.90029439217 | etot = -5.62847191515529 +132000 ekin = 4.58794392436667 | erot = 4.62012473201844 | epot = -14.8365405715605 | etot = -5.62847191517544 +133000 ekin = 4.63977927970769 | erot = 4.51475331813915 | epot = -14.7830045130158 | etot = -5.628471915169 +134000 ekin = 4.69096227444539 | erot = 4.41936571520071 | epot = -14.7387999047816 | etot = -5.62847191513551 +135000 ekin = 4.74083332631961 | erot = 4.33399770983601 | epot = -14.7033029512372 | etot = -5.62847191508159 +136000 ekin = 4.78901374177297 | erot = 4.25873574864783 | epot = -14.6762214054327 | etot = -5.62847191501192 +137000 ekin = 4.83519033966169 | erot = 4.1934558470929 | epot = -14.6571181018635 | etot = -5.62847191510893 +138000 ekin = 4.87857190019151 | erot = 4.13759960010494 | epot = -14.6446434153646 | etot = -5.62847191506818 +139000 ekin = 4.91933904268535 | erot = 4.0904184140817 | epot = -14.6382293717806 | etot = -5.62847191501353 +140000 ekin = 4.95802132610616 | erot = 4.05108530565804 | epot = -14.6375785467331 | etot = -5.62847191496892 +141000 ekin = 4.99519923255259 | erot = 4.01864210163677 | epot = -14.6423132491268 | etot = -5.62847191493745 +142000 ekin = 5.03134031865305 | erot = 3.99210960072515 | epot = -14.6519218343068 | etot = -5.62847191492855 +143000 ekin = 5.06663282814537 | erot = 3.97056100872312 | epot = -14.6656657518152 | etot = -5.6284719149467 +144000 ekin = 5.10088003253911 | erot = 3.95318385936722 | epot = -14.6825358068971 | etot = -5.62847191499075 +145000 ekin = 5.13347728619368 | erot = 3.93933318432728 | epot = -14.701282385576 | etot = -5.62847191505505 +146000 ekin = 5.16346418936999 | erot = 3.92856945833647 | epot = -14.7205055628375 | etot = -5.62847191513103 +147000 ekin = 5.18962884502086 | erot = 3.92067778970179 | epot = -14.7387785499324 | etot = -5.62847191520974 +148000 ekin = 5.21063630105021 | erot = 3.91566839447851 | epot = -14.7547766108115 | etot = -5.62847191528273 +149000 ekin = 5.22515818277301 | erot = 3.91376203384998 | epot = -14.7673921319662 | etot = -5.62847191534317 +150000 ekin = 5.23199081771441 | erot = 3.91536756918901 | epot = -14.7758303022882 | etot = -5.6284719153848 +151000 ekin = 5.23025857434906 | erot = 3.92102977399581 | epot = -14.7797602637304 | etot = -5.62847191538551 +152000 ekin = 5.21970456277655 | erot = 3.93136599417317 | epot = -14.7795424723198 | etot = -5.62847191537006 +153000 ekin = 5.20020715643981 | erot = 3.94729684642996 | epot = -14.7759759181581 | etot = -5.62847191528838 +154000 ekin = 5.17219962280951 | erot = 3.96989664945392 | epot = -14.7705681875107 | etot = -5.62847191524726 +155000 ekin = 5.13597939415266 | erot = 4.00025654377844 | epot = -14.7647078530835 | etot = -5.62847191515243 +156000 ekin = 5.0922745653888 | erot = 4.03969792967814 | epot = -14.7604444100935 | etot = -5.62847191502654 +157000 ekin = 5.04214374655907 | erot = 4.08965648366315 | epot = -14.7602721451224 | etot = -5.62847191490022 +158000 ekin = 4.9866407689382 | erot = 4.15175637520563 | epot = -14.7668690589144 | etot = -5.62847191477059 +159000 ekin = 4.92656708226485 | erot = 4.22693785976636 | epot = -14.7819768568022 | etot = -5.62847191477095 +160000 ekin = 4.86235166665109 | erot = 4.31524574981695 | epot = -14.8060693313538 | etot = -5.62847191488572 +161000 ekin = 4.79340744408544 | erot = 4.4163419215564 | epot = -14.8382212806386 | etot = -5.62847191499671 +162000 ekin = 4.71931679137324 | erot = 4.52911647420256 | epot = -14.8769051807437 | etot = -5.62847191516795 +163000 ekin = 4.63965178838042 | erot = 4.65170333188688 | epot = -14.9198270356127 | etot = -5.62847191534538 +164000 ekin = 4.55406399624433 | erot = 4.78166301740306 | epot = -14.9641989292976 | etot = -5.62847191565024 +165000 ekin = 4.46213996067538 | erot = 4.91530272158872 | epot = -15.0059145982058 | etot = -5.62847191594168 +166000 ekin = 4.36388109534925 | erot = 5.04805357548563 | epot = -15.0404065870414 | etot = -5.62847191620655 +167000 ekin = 4.25995046842461 | erot = 5.17511068522234 | epot = -15.0635330700698 | etot = -5.62847191642284 +168000 ekin = 4.15154354282116 | erot = 5.29182746831874 | epot = -15.0718429277121 | etot = -5.62847191657216 +169000 ekin = 4.04026084727443 | erot = 5.39411747728052 | epot = -15.0628502412095 | etot = -5.62847191665458 +170000 ekin = 3.92797723838258 | erot = 5.47890367159862 | epot = -15.0353528265931 | etot = -5.62847191661195 +171000 ekin = 3.81680551395717 | erot = 5.54460219961085 | epot = -14.9898796300178 | etot = -5.62847191644981 +172000 ekin = 3.70912194360747 | erot = 5.59119877272625 | epot = -14.9287926324934 | etot = -5.62847191615965 +173000 ekin = 3.60767008609829 | erot = 5.62020496675939 | epot = -14.8563469686142 | etot = -5.62847191575651 +174000 ekin = 3.51593123142523 | erot = 5.63484613588012 | epot = -14.7792492818537 | etot = -5.62847191454837 +175000 ekin = 3.43946966413698 | erot = 5.64148825119033 | epot = -14.7094298295793 | etot = -5.62847191425196 +176000 ekin = 3.38149964339841 | erot = 5.64304584979551 | epot = -14.6530174072201 | etot = -5.62847191402616 +177000 ekin = 3.34426304280155 | erot = 5.6407558950051 | epot = -14.6134908517374 | etot = -5.62847191393072 +178000 ekin = 3.32907821317965 | erot = 5.63429171925317 | epot = -14.5918418466191 | etot = -5.62847191418632 +179000 ekin = 3.335532868292 | erot = 5.62088708741513 | epot = -14.5848918700463 | etot = -5.62847191433917 +180000 ekin = 3.36333384277115 | erot = 5.59827011329225 | epot = -14.5900758706821 | etot = -5.62847191461865 +181000 ekin = 3.4111832274458 | erot = 5.56369949232898 | epot = -14.6033546347477 | etot = -5.6284719149729 +182000 ekin = 3.47666657813831 | erot = 5.51442909119458 | epot = -14.6195675846751 | etot = -5.62847191534219 +183000 ekin = 3.55646627297047 | erot = 5.44847615754844 | epot = -14.6334143461259 | etot = -5.62847191560695 +184000 ekin = 3.64671110623843 | erot = 5.36528131962605 | epot = -14.6404643416911 | etot = -5.62847191582664 +185000 ekin = 3.74294243854203 | erot = 5.26596644090231 | epot = -14.6373807953587 | etot = -5.62847191591432 +186000 ekin = 3.84064021177386 | erot = 5.15359326679041 | epot = -14.6227053944214 | etot = -5.62847191585716 +187000 ekin = 3.93563840594985 | erot = 5.03296537332542 | epot = -14.5970756949497 | etot = -5.62847191567439 +188000 ekin = 4.02444308409274 | erot = 4.91004205202712 | epot = -14.5629570515419 | etot = -5.62847191542199 +189000 ekin = 4.10437481570285 | erot = 4.79101157926071 | epot = -14.5238583101468 | etot = -5.62847191518322 +190000 ekin = 4.17348832619967 | erot = 4.68117061833162 | epot = -14.4831308595854 | etot = -5.62847191505416 +191000 ekin = 4.23028845394417 | erot = 4.58386192798927 | epot = -14.4426222970246 | etot = -5.62847191509118 +192000 ekin = 4.2735805406063 | erot = 4.49984530057659 | epot = -14.4018977564815 | etot = -5.62847191529862 +193000 ekin = 4.2459291199379 | erot = 4.46741799187819 | epot = -14.3418190226935 | etot = -5.62847191087741 +194000 ekin = 4.19994174150901 | erot = 4.47173701960833 | epot = -14.3001506793695 | etot = -5.62847191825219 +195000 ekin = 4.19981139522181 | erot = 4.40365513590497 | epot = -14.2319384423513 | etot = -5.6284719112245 +196000 ekin = 4.18831859749951 | erot = 4.328213784087 | epot = -14.1450042928974 | etot = -5.62847191131092 +197000 ekin = 4.16445522600501 | erot = 4.2468691966353 | epot = -14.0397963337849 | etot = -5.62847191114461 +198000 ekin = 4.1307492037297 | erot = 4.15919636754727 | epot = -13.918417482026 | etot = -5.62847191074906 +199000 ekin = 4.09062074736211 | erot = 4.06700829109988 | epot = -13.7861009486933 | etot = -5.62847191023133 +200000 ekin = 4.04792338687249 | erot = 3.97356549445504 | epot = -13.6499607909724 | etot = -5.62847190964484 +201000 ekin = 4.00668244919831 | erot = 3.88277215509139 | epot = -13.5179265133929 | etot = -5.62847190910321 +202000 ekin = 3.9706339247179 | erot = 3.79828207702256 | epot = -13.397387910413 | etot = -5.62847190867254 +203000 ekin = 3.94283665189453 | erot = 3.72290259923935 | epot = -13.2942111595207 | etot = -5.62847190838679 +204000 ekin = 3.92540743372236 | erot = 3.65835216262537 | epot = -13.2122315045988 | etot = -5.62847190825109 +205000 ekin = 3.91946432177392 | erot = 3.60562062221077 | epot = -13.1535568521744 | etot = -5.62847190818971 +206000 ekin = 3.92515912499527 | erot = 3.56510062726736 | epot = -13.1187316605182 | etot = -5.6284719082556 +207000 ekin = 3.94166066189686 | erot = 3.53643554885231 | epot = -13.1065681191313 | etot = -5.62847190838215 +208000 ekin = 3.96741904659752 | erot = 3.51909285319121 | epot = -13.1149838083252 | etot = -5.62847190853646 +209000 ekin = 3.99456273872773 | erot = 3.5008331585052 | epot = -13.1238678065935 | etot = -5.62847190936053 +210000 ekin = 4.04796401860463 | erot = 3.49168954891055 | epot = -13.1681254815419 | etot = -5.62847191402673 +211000 ekin = 4.09773342716127 | erot = 3.49304812013042 | epot = -13.2192534546379 | etot = -5.62847190734618 +212000 ekin = 4.14205596974498 | erot = 3.50221111647982 | epot = -13.2727389936918 | etot = -5.62847190746705 +213000 ekin = 4.18461227969386 | erot = 3.51992604962542 | epot = -13.3330102373263 | etot = -5.628471908007 +214000 ekin = 4.2229180122116 | erot = 3.54318058638071 | epot = -13.3945705067423 | etot = -5.62847190814997 +215000 ekin = 4.25639069944202 | erot = 3.57018634833031 | epot = -13.4550489560092 | etot = -5.62847190823688 +216000 ekin = 4.28517056130931 | erot = 3.59920416165437 | epot = -13.5128466312826 | etot = -5.62847190831891 +217000 ekin = 4.30951457891511 | erot = 3.62862634730577 | epot = -13.5666128346102 | etot = -5.62847190838931 +218000 ekin = 4.3302274909774 | erot = 3.65639118247571 | epot = -13.6150905819329 | etot = -5.62847190847977 +219000 ekin = 4.34822739188957 | erot = 3.68015661121664 | epot = -13.6568559116901 | etot = -5.62847190858389 +220000 ekin = 4.36437280258544 | erot = 3.69755509928573 | epot = -13.6903998105173 | etot = -5.62847190864617 +221000 ekin = 4.37954317243622 | erot = 3.70660976824299 | epot = -13.714624849372 | etot = -5.62847190869276 +222000 ekin = 4.39451292717286 | erot = 3.70596363375308 | epot = -13.7289484695955 | etot = -5.62847190866958 +223000 ekin = 4.41008213189184 | erot = 3.69513355487323 | epot = -13.7336875953399 | etot = -5.62847190857482 +224000 ekin = 4.42678943726429 | erot = 3.67466536393368 | epot = -13.7299267097388 | etot = -5.62847190854085 +225000 ekin = 4.4446070170116 | erot = 3.64600909387798 | epot = -13.7190880192597 | etot = -5.62847190837011 +226000 ekin = 4.47380092382402 | erot = 3.58830814097906 | epot = -13.6905809780341 | etot = -5.62847191323106 +227000 ekin = 4.56056009803676 | erot = 3.4726930683181 | epot = -13.6617250773541 | etot = -5.62847191099925 +228000 ekin = 4.6108332753125 | erot = 3.40803816010796 | epot = -13.6473433475456 | etot = -5.62847191212517 +229000 ekin = 4.63150013168171 | erot = 3.35898149000328 | epot = -13.6189535337034 | etot = -5.62847191201845 +230000 ekin = 4.65431068144226 | erot = 3.31343017818105 | epot = -13.596212771626 | etot = -5.62847191200268 +231000 ekin = 4.67934821405043 | erot = 3.27332737526856 | epot = -13.5811475014864 | etot = -5.62847191216743 +232000 ekin = 4.70592354946518 | erot = 3.23944506667318 | epot = -13.5738405284619 | etot = -5.6284719123235 +233000 ekin = 4.73271416122752 | erot = 3.21144788525661 | epot = -13.5726339590448 | etot = -5.62847191256071 +234000 ekin = 4.75943444985266 | erot = 3.19078729233522 | epot = -13.5786936545813 | etot = -5.62847191239342 +235000 ekin = 4.78642241818323 | erot = 3.1802119397679 | epot = -13.5951062703988 | etot = -5.62847191244764 +236000 ekin = 4.81315037988461 | erot = 3.18017325334985 | epot = -13.6217955457024 | etot = -5.62847191246799 +237000 ekin = 4.83923297185794 | erot = 3.19145400453578 | epot = -13.6591588888862 | etot = -5.62847191249251 +238000 ekin = 4.86487585932032 | erot = 3.21481908800548 | epot = -13.708166859741 | etot = -5.62847191241519 +239000 ekin = 4.89063931715144 | erot = 3.25114955282307 | epot = -13.7702607826898 | etot = -5.62847191271528 +240000 ekin = 4.91656145052717 | erot = 3.29901781219184 | epot = -13.8440511754972 | etot = -5.62847191277818 +241000 ekin = 4.94245255089475 | erot = 3.35699698381876 | epot = -13.9279214477177 | etot = -5.62847191300422 +242000 ekin = 4.96767380346211 | erot = 3.42365009426279 | epot = -14.0197958109264 | etot = -5.62847191320152 +243000 ekin = 5.0057344622477 | erot = 3.47030260470028 | epot = -14.1045089792089 | etot = -5.62847191226096 +244000 ekin = 5.06987350320887 | erot = 3.50985787352608 | epot = -14.2082032933033 | etot = -5.6284719165684 +245000 ekin = 5.08405115957487 | erot = 3.57323736718718 | epot = -14.2857604930717 | etot = -5.62847196630966 +246000 ekin = 5.13867281568981 | erot = 3.5302241078692 | epot = -14.2973688418991 | etot = -5.62847191834013 +247000 ekin = 5.24446071734626 | erot = 3.6370719263987 | epot = -14.5100045566477 | etot = -5.62847191290278 +248000 ekin = 5.23528120841493 | erot = 3.74023330974172 | epot = -14.6039864311655 | etot = -5.62847191300886 +249000 ekin = 5.21260078434886 | erot = 3.83729795660351 | epot = -14.6783706538247 | etot = -5.62847191287231 +250000 ekin = 5.17839081250001 | erot = 3.92749000333999 | epot = -14.734352728447 | etot = -5.62847191260704 +251000 ekin = 5.13586036333638 | erot = 4.01108345357868 | epot = -14.7754157290661 | etot = -5.628471912151 +252000 ekin = 5.0891829210612 | erot = 4.09018694184797 | epot = -14.8078417745596 | etot = -5.62847191165043 +253000 ekin = 5.04264218495095 | erot = 4.16759058212263 | epot = -14.838704678282 | etot = -5.62847191120844 +254000 ekin = 4.99116344078048 | erot = 4.24248912288112 | epot = -14.8621245493453 | etot = -5.62847198568369 +255000 ekin = 4.72637462797871 | erot = 4.24407837664264 | epot = -14.5989249325882 | etot = -5.6284719279668 +256000 ekin = 4.5983410999774 | erot = 4.36369782211666 | epot = -14.5905108365033 | etot = -5.62847191440919 +257000 ekin = 4.77089539877151 | erot = 4.60066315316504 | epot = -15.0000305289983 | etot = -5.62847197706171 +258000 ekin = 4.85704242989419 | erot = 4.66807324377228 | epot = -15.1535875814204 | etot = -5.62847190775396 +259000 ekin = 4.89901811471739 | erot = 4.72718635922047 | epot = -15.2546763808625 | etot = -5.62847190692464 +260000 ekin = 4.94107094738747 | erot = 4.79406863686981 | epot = -15.3636114914173 | etot = -5.62847190716002 +261000 ekin = 4.98242309074267 | erot = 4.86508628582396 | epot = -15.4759812846277 | etot = -5.6284719080611 +262000 ekin = 5.01659840997846 | erot = 4.93871137849118 | epot = -15.5837816973714 | etot = -5.62847190890171 +263000 ekin = 5.03982661193798 | erot = 5.00983839413087 | epot = -15.6781369155771 | etot = -5.62847190950828 +264000 ekin = 5.04732696349148 | erot = 5.07389667599964 | epot = -15.7496955495982 | etot = -5.62847191010705 +265000 ekin = 5.03448807084358 | erot = 5.12688367714283 | epot = -15.7898436586255 | etot = -5.62847191063912 +266000 ekin = 4.99773438958879 | erot = 5.16480683532682 | epot = -15.7910131359658 | etot = -5.62847191105018 +267000 ekin = 4.93508497405503 | erot = 5.18388050751039 | epot = -15.7474373928691 | etot = -5.62847191130366 +268000 ekin = 4.84654531470116 | erot = 5.18063468559632 | epot = -15.6556519116821 | etot = -5.62847191138465 +269000 ekin = 4.7342321427388 | erot = 5.15198859732445 | epot = -15.5146926513542 | etot = -5.62847191129093 +270000 ekin = 4.60224202247752 | erot = 5.09540688817357 | epot = -15.3261208188898 | etot = -5.62847190823866 +271000 ekin = 4.45636876654147 | erot = 5.0092331738847 | epot = -15.0940738481936 | etot = -5.62847190776746 +272000 ekin = 4.30375505734686 | erot = 4.89315778304338 | epot = -14.8253847474875 | etot = -5.62847190709727 +273000 ekin = 4.15244061479158 | erot = 4.74862648123289 | epot = -14.5295390022864 | etot = -5.62847190626192 +274000 ekin = 4.01137482333751 | erot = 4.57896672456254 | epot = -14.2188134532144 | etot = -5.62847190531435 +275000 ekin = 3.87388872891805 | erot = 4.38950805794852 | epot = -13.8918687169804 | etot = -5.62847193011386 +276000 ekin = 3.70828148349795 | erot = 4.18975567949746 | epot = -13.5265090654603 | etot = -5.62847190246493 +277000 ekin = 3.74025187940053 | erot = 3.98894405210149 | epot = -13.3576678645607 | etot = -5.62847193305864 +278000 ekin = 3.74221760775279 | erot = 3.77038543691523 | epot = -13.1410749479091 | etot = -5.62847190324104 +279000 ekin = 3.75220115766707 | erot = 3.55790331814348 | epot = -12.9385763794525 | etot = -5.62847190364194 +280000 ekin = 3.77561814014602 | erot = 3.35781654492272 | epot = -12.7619065883775 | etot = -5.6284719033088 +281000 ekin = 3.81272927484946 | erot = 3.17409695196084 | epot = -12.6152981298173 | etot = -5.62847190300698 +282000 ekin = 3.8650198803709 | erot = 3.00952640154842 | epot = -12.5030181842075 | etot = -5.62847190228818 +283000 ekin = 3.93628900407371 | erot = 2.86613168181802 | epot = -12.4308925881286 | etot = -5.62847190223686 +284000 ekin = 4.02702703050937 | erot = 2.74480306500037 | epot = -12.4003019979073 | etot = -5.62847190239756 +285000 ekin = 4.14139706640688 | erot = 2.64599110157868 | epot = -12.415860069173 | etot = -5.62847190118749 +286000 ekin = 4.28525774918737 | erot = 2.56950762489262 | epot = -12.4832372763276 | etot = -5.62847190224757 +287000 ekin = 4.44987555796033 | erot = 2.51493810068412 | epot = -12.5932855609626 | etot = -5.62847190231813 +288000 ekin = 4.63520922265196 | erot = 2.48100112555789 | epot = -12.744682251553 | etot = -5.62847190334311 +289000 ekin = 4.83125797005919 | erot = 2.46527241539785 | epot = -12.9250022896926 | etot = -5.6284719042356 +290000 ekin = 5.02763799219706 | erot = 2.46542435682136 | epot = -13.1215342541046 | etot = -5.62847190508614 +291000 ekin = 5.21465468575957 | erot = 2.47913524144863 | epot = -13.3222618329728 | etot = -5.62847190576458 +292000 ekin = 5.38472348790202 | erot = 2.5041643032936 | epot = -13.5173596974345 | etot = -5.62847190623886 +293000 ekin = 5.53302487062802 | erot = 2.53823701976651 | epot = -13.6997337969567 | etot = -5.6284719065622 +294000 ekin = 5.65718701899293 | erot = 2.57877496353312 | epot = -13.8644338893377 | etot = -5.62847190681162 +295000 ekin = 5.75652780496415 | erot = 2.62269919784384 | epot = -14.0076989098378 | etot = -5.62847190702984 +296000 ekin = 5.83139499491232 | erot = 2.66652171229258 | epot = -14.1263886144137 | etot = -5.62847190720875 +297000 ekin = 5.88282356331969 | erot = 2.70675614330348 | epot = -14.2180516139344 | etot = -5.62847190731125 +298000 ekin = 5.91239748765017 | erot = 2.74048494300967 | epot = -14.2813543379696 | etot = -5.62847190730976 +299000 ekin = 5.92208198046302 | erot = 2.7658529930222 | epot = -14.3164068806914 | etot = -5.62847190720614 +300000 ekin = 5.91390942018638 | erot = 2.78233336188674 | epot = -14.324714689099 | etot = -5.62847190702586 +301000 ekin = 5.88962133511142 | erot = 2.7907435367592 | epot = -14.3088367786656 | etot = -5.62847190679494 +302000 ekin = 5.85048781420819 | erot = 2.79307875791685 | epot = -14.2720384786482 | etot = -5.62847190652318 +303000 ekin = 5.79743517876854 | erot = 2.79223225552545 | epot = -14.2181393405041 | etot = -5.62847190621011 +304000 ekin = 5.73124340760361 | erot = 2.79262915089269 | epot = -14.1523444641601 | etot = -5.62847190566384 +305000 ekin = 5.6525826846959 | erot = 2.79940899091188 | epot = -14.0804635809897 | etot = -5.62847190538192 +306000 ekin = 5.56254653522781 | erot = 2.81503734235279 | epot = -14.0060557827393 | etot = -5.62847190515871 +307000 ekin = 5.46251129680399 | erot = 2.84075892386306 | epot = -13.9317421257015 | etot = -5.62847190503446 +308000 ekin = 5.35391293499449 | erot = 2.87633235164438 | epot = -13.8587171916715 | etot = -5.62847190503264 +309000 ekin = 5.2380500741113 | erot = 2.91996940723583 | epot = -13.7864913863831 | etot = -5.62847190503601 +310000 ekin = 5.11613875821884 | erot = 2.96880482960341 | epot = -13.7134154931087 | etot = -5.62847190528648 +311000 ekin = 4.98925852658652 | erot = 3.01839769776058 | epot = -13.6361281298153 | etot = -5.62847190546825 +312000 ekin = 4.85867326621518 | erot = 3.06421411593807 | epot = -13.5513592877758 | etot = -5.62847190562251 +313000 ekin = 4.72585112666549 | erot = 3.10236590330291 | epot = -13.4566889356326 | etot = -5.62847190566415 +314000 ekin = 4.59293421045381 | erot = 3.13002199529404 | epot = -13.3514281113052 | etot = -5.62847190555729 +315000 ekin = 4.4627066997064 | erot = 3.14588950387965 | epot = -13.2370681089042 | etot = -5.62847190531813 +316000 ekin = 4.33845457033203 | erot = 3.15016989318611 | epot = -13.1170963685038 | etot = -5.62847190498567 +317000 ekin = 4.22370149066224 | erot = 3.14429402987658 | epot = -12.9964674251464 | etot = -5.62847190460756 +318000 ekin = 4.12188681799686 | erot = 3.13056754978643 | epot = -12.8809262720098 | etot = -5.62847190422654 +319000 ekin = 4.03607214170871 | erot = 3.11184182787653 | epot = -12.7763858734568 | etot = -5.62847190387152 +320000 ekin = 3.96873641007907 | erot = 3.09128048612339 | epot = -12.688488799756 | etot = -5.62847190355351 +321000 ekin = 3.92167797368546 | erot = 3.07226107994542 | epot = -12.6224109569023 | etot = -5.62847190327139 +322000 ekin = 3.8960097142194 | erot = 3.05833648374953 | epot = -12.5828181009975 | etot = -5.62847190302861 +323000 ekin = 3.89216326551543 | erot = 3.0532307872066 | epot = -12.5738659555595 | etot = -5.62847190283749 +324000 ekin = 3.90971752720657 | erot = 3.06065920137825 | epot = -12.5988486315853 | etot = -5.62847190300047 +325000 ekin = 3.94474197767268 | erot = 3.08325557842916 | epot = -12.6564694593518 | etot = -5.62847190324995 +326000 ekin = 3.99225791211897 | erot = 3.12131666196214 | epot = -12.742046477854 | etot = -5.62847190377287 +327000 ekin = 4.047157518191 | erot = 3.17277573873514 | epot = -12.8484051615009 | etot = -5.62847190457475 +328000 ekin = 4.10306827949969 | erot = 3.2328980910145 | epot = -12.964438276116 | etot = -5.62847190560186 +329000 ekin = 4.15294077797405 | erot = 3.29460254686706 | epot = -13.076015231516 | etot = -5.62847190667492 +330000 ekin = 4.1904608637893 | erot = 3.34957314359003 | epot = -13.1685059148823 | etot = -5.62847190750294 +331000 ekin = 4.21187936705087 | erot = 3.38989153266343 | epot = -13.2302428076831 | etot = -5.62847190796882 +332000 ekin = 4.21589857653964 | erot = 3.41075094374536 | epot = -13.2551214281407 | etot = -5.62847190785568 +333000 ekin = 4.20485266000532 | erot = 3.41174399824562 | epot = -13.2450685654464 | etot = -5.62847190719542 +334000 ekin = 4.18435368276617 | erot = 3.39692225044008 | epot = -13.2097478393658 | etot = -5.62847190615951 +335000 ekin = 4.16205455861975 | erot = 3.37367623593909 | epot = -13.1642026995469 | etot = -5.62847190498801 +336000 ekin = 4.14609491421151 | erot = 3.35093309666115 | epot = -13.1254999147779 | etot = -5.62847190390525 +337000 ekin = 4.14364358931889 | erot = 3.3373696460562 | epot = -13.1094851384478 | etot = -5.62847190307275 +338000 ekin = 4.15982493123665 | erot = 3.33968220642664 | epot = -13.1279790403949 | etot = -5.62847190273164 +339000 ekin = 4.19714166716502 | erot = 3.36120406394443 | epot = -13.1868176337171 | etot = -5.6284719026077 +340000 ekin = 4.25518474381703 | erot = 3.40394456534442 | epot = -13.2876012119618 | etot = -5.62847190280037 +341000 ekin = 4.33079125360721 | erot = 3.46797257818222 | epot = -13.4272357350295 | etot = -5.62847190324003 +342000 ekin = 4.41854745259014 | erot = 3.55173943759921 | epot = -13.5987587940374 | etot = -5.62847190384803 +343000 ekin = 4.51153864838651 | erot = 3.65250494550752 | epot = -13.7925154984427 | etot = -5.62847190454867 +344000 ekin = 4.60219231317934 | erot = 3.76671918648138 | epot = -13.9973834049171 | etot = -5.6284719052564 +345000 ekin = 4.68312343519931 | erot = 3.89042211424799 | epot = -14.2020174553524 | etot = -5.62847190590513 +346000 ekin = 4.74786790539669 | erot = 4.01955036384103 | epot = -14.3958901756814 | etot = -5.62847190644372 +347000 ekin = 4.79150376886026 | erot = 4.15019529884424 | epot = -14.5701709745013 | etot = -5.62847190679678 +348000 ekin = 4.81117855585283 | erot = 4.27877359764576 | epot = -14.7184240605496 | etot = -5.62847190705096 +349000 ekin = 4.80564918858973 | erot = 4.40205662692522 | epot = -14.8361777226847 | etot = -5.62847190716974 +350000 ekin = 4.77545945328669 | erot = 4.51714564005536 | epot = -14.9210770005372 | etot = -5.62847190719515 +351000 ekin = 4.72262273321602 | erot = 4.62116010888737 | epot = -14.9722547493095 | etot = -5.62847190720615 +352000 ekin = 4.65007958813589 | erot = 4.71078593021341 | epot = -14.9893374256312 | etot = -5.62847190728187 +353000 ekin = 4.56109157464666 | erot = 4.78180335584297 | epot = -14.9713668379544 | etot = -5.62847190746476 +354000 ekin = 4.45876151245766 | erot = 4.82895979647749 | epot = -14.9161932166601 | etot = -5.62847190772498 +355000 ekin = 4.34584612944697 | erot = 4.84663553109143 | epot = -14.8209535684649 | etot = -5.62847190792654 +356000 ekin = 4.22495470320128 | erot = 4.83038190909052 | epot = -14.6838085201832 | etot = -5.62847190789137 +357000 ekin = 4.09903296593978 | erot = 4.77873075093834 | epot = -14.5062356243625 | etot = -5.62847190748435 +358000 ekin = 3.97178667555237 | erot = 4.694445610496 | epot = -14.2947041927595 | etot = -5.62847190671115 +359000 ekin = 3.84767298928786 | erot = 4.58431182213549 | epot = -14.0604567171777 | etot = -5.6284719057544 +360000 ekin = 3.73136439808096 | erot = 4.45746613157599 | epot = -13.817302434417 | etot = -5.62847190476002 +361000 ekin = 3.62758093165083 | erot = 4.32379064505304 | epot = -13.5798434807374 | etot = -5.62847190403352 +362000 ekin = 3.54294892306474 | erot = 4.19358097114481 | epot = -13.3650017978889 | etot = -5.62847190367933 +363000 ekin = 3.47837311691428 | erot = 4.07207692082325 | epot = -13.1789219412969 | etot = -5.62847190355939 +364000 ekin = 3.43225009806373 | erot = 3.961931941418 | epot = -13.0226539430709 | etot = -5.62847190358919 +365000 ekin = 3.40198388463965 | erot = 3.86460642705396 | epot = -12.8950622153806 | etot = -5.62847190368699 +366000 ekin = 3.38451833853004 | erot = 3.78104622244734 | epot = -12.7940364647605 | etot = -5.62847190378312 +367000 ekin = 3.37682483159018 | erot = 3.71218000857436 | epot = -12.7174767440077 | etot = -5.62847190384314 +368000 ekin = 3.37625204139483 | erot = 3.65912147822851 | epot = -12.663845423478 | etot = -5.62847190385467 +369000 ekin = 3.38074636727773 | erot = 3.62312680344527 | epot = -12.6323450745499 | etot = -5.62847190382689 +370000 ekin = 3.38894636699741 | erot = 3.6053885663719 | epot = -12.6228068371906 | etot = -5.62847190382132 +371000 ekin = 3.40011634061024 | erot = 3.60672333638143 | epot = -12.6353115807398 | etot = -5.62847190374812 +372000 ekin = 3.41430323563923 | erot = 3.62748920224192 | epot = -12.6702643415807 | etot = -5.62847190369956 +373000 ekin = 3.43217624796659 | erot = 3.66740997408926 | epot = -12.7280581256002 | etot = -5.62847190354439 +374000 ekin = 3.45538314687178 | erot = 3.7253207076687 | epot = -12.8091757581692 | etot = -5.62847190362873 +375000 ekin = 3.48458983104435 | erot = 3.79950576966702 | epot = -12.9125675044683 | etot = -5.62847190375694 +376000 ekin = 3.51994630864513 | erot = 3.88772077542083 | epot = -13.0361389879923 | etot = -5.62847190392634 +377000 ekin = 3.56162263240472 | erot = 3.9871803208762 | epot = -13.1772748573754 | etot = -5.62847190409448 +378000 ekin = 3.61009229020311 | erot = 4.09470007582312 | epot = -13.3332642703315 | etot = -5.62847190430525 +379000 ekin = 3.6662193925352 | erot = 4.20668278517003 | epot = -13.5013740821488 | etot = -5.62847190444354 +380000 ekin = 3.73222313436681 | erot = 4.31893025306561 | epot = -13.6796252923123 | etot = -5.6284719048799 +381000 ekin = 3.80656943725205 | erot = 4.42661769095661 | epot = -13.8616590336604 | etot = -5.6284719054517 +382000 ekin = 3.88594558527767 | erot = 4.52459411506728 | epot = -14.0390116064294 | etot = -5.62847190608449 +383000 ekin = 3.96695090001183 | erot = 4.60747433895868 | epot = -14.2028971456956 | etot = -5.62847190672509 +384000 ekin = 4.04619645069185 | erot = 4.66967915258317 | epot = -14.3443475105725 | etot = -5.6284719072975 +385000 ekin = 4.12092029138874 | erot = 4.70599192062998 | epot = -14.4553841196892 | etot = -5.62847190767044 +386000 ekin = 4.18945537163874 | erot = 4.71237691681113 | epot = -14.5303041965569 | etot = -5.628471908107 +387000 ekin = 4.24770733745816 | erot = 4.6853187164366 | epot = -14.5614979619499 | etot = -5.62847190805516 +388000 ekin = 4.29400518232716 | erot = 4.62433064764756 | epot = -14.5468077376865 | etot = -5.62847190771175 +389000 ekin = 4.3297375103539 | erot = 4.53230747814506 | epot = -14.4905168956645 | etot = -5.62847190716558 +390000 ekin = 4.35696496432295 | erot = 4.41432356914497 | epot = -14.3997604400378 | etot = -5.62847190656983 +391000 ekin = 4.37768888460278 | erot = 4.27672755000021 | epot = -14.282888340541 | etot = -5.62847190593804 +392000 ekin = 4.39398588699936 | erot = 4.12625191224331 | epot = -14.1487097046239 | etot = -5.62847190538126 +393000 ekin = 4.40738241117201 | erot = 3.96936593194957 | epot = -14.0052202479462 | etot = -5.62847190482465 +394000 ekin = 4.41937568154471 | erot = 3.81285278686775 | epot = -13.8607003730767 | etot = -5.62847190466425 +395000 ekin = 4.42988768163289 | erot = 3.6606594657542 | epot = -13.7190190519195 | etot = -5.62847190453239 +396000 ekin = 4.4384747658818 | erot = 3.51525603215002 | epot = -13.582202702425 | etot = -5.62847190439317 +397000 ekin = 4.44517728395988 | erot = 3.37891512777609 | epot = -13.4525643159543 | etot = -5.62847190421834 +398000 ekin = 4.45064950024889 | erot = 3.25392386318741 | epot = -13.3330452674345 | etot = -5.62847190399817 +399000 ekin = 4.45613851376204 | erot = 3.14269651881636 | epot = -13.2273069363788 | etot = -5.62847190380041 +400000 ekin = 4.46297608304487 | erot = 3.04745583065375 | epot = -13.1389038172455 | etot = -5.6284719035469 +401000 ekin = 4.47275546000428 | erot = 2.97053701411307 | epot = -13.0717643774785 | etot = -5.6284719033612 +402000 ekin = 4.4867233669973 | erot = 2.91396522580546 | epot = -13.0291604961449 | etot = -5.62847190334216 +403000 ekin = 4.50482841071081 | erot = 2.8787025181007 | epot = -13.0120028324284 | etot = -5.62847190361687 +404000 ekin = 4.52484325729189 | erot = 2.86379686215192 | epot = -13.017112023697 | etot = -5.62847190425317 +405000 ekin = 4.54178669951965 | erot = 2.86535120569479 | epot = -13.035609810693 | etot = -5.62847190547854 +406000 ekin = 4.54812186975737 | erot = 2.87565623454465 | epot = -13.0522500109003 | etot = -5.62847190659829 +407000 ekin = 4.53567765660364 | erot = 2.88781666334504 | epot = -13.0519662273722 | etot = -5.62847190742353 +408000 ekin = 4.49806839870186 | erot = 2.89717319275991 | epot = -13.0237134991132 | etot = -5.62847190765146 +409000 ekin = 4.43289041822661 | erot = 2.90293173430488 | epot = -12.964294059809 | etot = -5.62847190727752 +410000 ekin = 4.34222243508758 | erot = 2.90784571764664 | epot = -12.8785400592817 | etot = -5.62847190654747 +411000 ekin = 4.23122328978881 | erot = 2.91632332331574 | epot = -12.7760185189013 | etot = -5.62847190579679 +412000 ekin = 4.10591302465951 | erot = 2.93234263227515 | epot = -12.6667275621717 | etot = -5.628471905237 +413000 ekin = 3.97147909133151 | erot = 2.9582687533974 | epot = -12.5582197496364 | etot = -5.62847190490748 +414000 ekin = 3.83169645325956 | erot = 2.9948721544271 | epot = -12.4550405124313 | etot = -5.6284719047446 +415000 ekin = 3.68915556883775 | erot = 3.04191716156322 | epot = -12.3595446350678 | etot = -5.62847190466682 +416000 ekin = 3.54575553254762 | erot = 3.09878213616461 | epot = -12.2730095733257 | etot = -5.62847190461351 +417000 ekin = 3.40315271143793 | erot = 3.16484246795223 | epot = -12.1964670839435 | etot = -5.62847190455339 +418000 ekin = 3.26306253870884 | erot = 3.23960054557895 | epot = -12.1311349887621 | etot = -5.62847190447429 +419000 ekin = 3.12743539443673 | erot = 3.32265867815324 | epot = -12.078565976964 | etot = -5.62847190437406 +420000 ekin = 2.99854685245618 | erot = 3.413623963495 | epot = -12.0406427202084 | etot = -5.62847190425726 +421000 ekin = 2.87901712489708 | erot = 3.51197880383063 | epot = -12.0194678328653 | etot = -5.62847190413762 +422000 ekin = 2.7717459604952 | erot = 3.61690112207128 | epot = -12.0171189866093 | etot = -5.62847190404282 +423000 ekin = 2.67973794661924 | erot = 3.72700827489768 | epot = -12.0352181255331 | etot = -5.62847190401615 +424000 ekin = 2.60579870925969 | erot = 3.84002717531602 | epot = -12.0742977886897 | etot = -5.62847190411396 +425000 ekin = 2.55208954524874 | erot = 3.95244167896246 | epot = -12.1330031286114 | etot = -5.62847190440024 +426000 ekin = 2.5195465304227 | erot = 4.05920212809832 | epot = -12.2072205634524 | etot = -5.62847190493139 +427000 ekin = 2.50725893888466 | erot = 4.15363681832286 | epot = -12.2893676629242 | etot = -5.62847190571666 +428000 ekin = 2.5121048517315 | erot = 4.2278239961629 | epot = -12.3684007545458 | etot = -5.62847190665139 +429000 ekin = 2.52911833231243 | erot = 4.27377369073984 | epot = -12.4313639305347 | etot = -5.62847190748239 +430000 ekin = 2.55284926699264 | erot = 4.28551618828037 | epot = -12.4668373631639 | etot = -5.62847190789086 +431000 ekin = 2.57924139418519 | erot = 4.2614241203789 | epot = -12.4691374222491 | etot = -5.62847190768504 +432000 ekin = 2.60692475465593 | erot = 4.20541068246933 | epot = -12.4408073440645 | etot = -5.62847190693923 +433000 ekin = 2.63712842981491 | erot = 4.12604912501693 | epot = -12.3916494607697 | etot = -5.62847190593788 +434000 ekin = 2.67245542240816 | erot = 4.03405948921518 | epot = -12.334986816614 | etot = -5.6284719049907 +435000 ekin = 2.71543854639996 | erot = 3.93961255970856 | epot = -12.2835230103947 | etot = -5.62847190428618 +436000 ekin = 2.7676099134144 | erot = 3.85063248523209 | epot = -12.2467143025251 | etot = -5.62847190387865 +437000 ekin = 2.82920515671658 | erot = 3.77223859650373 | epot = -12.229915656949 | etot = -5.62847190372866 +438000 ekin = 2.89929820058893 | erot = 3.7070750997503 | epot = -12.2348452041092 | etot = -5.62847190376996 +439000 ekin = 2.9760933415543 | erot = 3.65590372388935 | epot = -12.2604689693862 | etot = -5.62847190394252 +440000 ekin = 3.05720906612876 | erot = 3.6181520078374 | epot = -12.3038329781688 | etot = -5.62847190420265 +441000 ekin = 3.13989672828805 | erot = 3.59232302399544 | epot = -12.3606916568035 | etot = -5.62847190452001 +442000 ekin = 3.22119927518473 | erot = 3.57626892519867 | epot = -12.425940105259 | etot = -5.62847190487565 +443000 ekin = 3.29807867301736 | erot = 3.56737972995847 | epot = -12.493930308225 | etot = -5.62847190524917 +444000 ekin = 3.3675388394357 | erot = 3.56276348927201 | epot = -12.5587742343283 | etot = -5.62847190562061 +445000 ekin = 3.42676046580554 | erot = 3.55942025918735 | epot = -12.6146526309605 | etot = -5.62847190596761 +446000 ekin = 3.47324383646255 | erot = 3.55443462308767 | epot = -12.6561503658212 | etot = -5.62847190627101 +447000 ekin = 3.50497354375501 | erot = 3.54511419619497 | epot = -12.6785596464587 | etot = -5.6284719065087 +448000 ekin = 3.52056213082342 | erot = 3.52974100709899 | epot = -12.678775044445 | etot = -5.62847190652254 +449000 ekin = 3.51939696589681 | erot = 3.50705904510715 | epot = -12.6549279176116 | etot = -5.6284719066076 +450000 ekin = 3.50164536052004 | erot = 3.47565071065649 | epot = -12.6057679777786 | etot = -5.62847190660206 +451000 ekin = 3.46824790705928 | erot = 3.43472151202187 | epot = -12.531441325585 | etot = -5.6284719065038 +452000 ekin = 3.42090312734581 | erot = 3.38414558728953 | epot = -12.4335206209496 | etot = -5.62847190631427 +453000 ekin = 3.36201791826099 | erot = 3.32449206045047 | epot = -12.31498188475 | etot = -5.62847190603854 +454000 ekin = 3.29463316058018 | erot = 3.25701739818687 | epot = -12.1801224644535 | etot = -5.62847190568649 +455000 ekin = 3.22233274896039 | erot = 3.18360703276426 | epot = -12.0344116869964 | etot = -5.62847190527174 +456000 ekin = 3.14914248625823 | erot = 3.10666992197635 | epot = -11.8842843130478 | etot = -5.62847190481318 +457000 ekin = 3.07939737170073 | erot = 3.02894564058048 | epot = -11.736814916623 | etot = -5.62847190434179 +458000 ekin = 3.01756413265085 | erot = 2.95322108562052 | epot = -11.5992571221255 | etot = -5.62847190385414 +459000 ekin = 2.96810632520863 | erot = 2.88249754735619 | epot = -11.479075775972 | etot = -5.62847190340717 +460000 ekin = 2.93513889000246 | erot = 2.8195526752032 | epot = -11.3831634682429 | etot = -5.62847190303722 +461000 ekin = 2.92205746386031 | erot = 2.76669234907353 | epot = -11.3172217157159 | etot = -5.62847190278208 +462000 ekin = 2.93114290148357 | erot = 2.72556812595166 | epot = -11.2851829301103 | etot = -5.62847190267507 +463000 ekin = 2.96319319678696 | erot = 2.69703193760775 | epot = -11.2886970371337 | etot = -5.62847190273899 +464000 ekin = 3.01726238567789 | erot = 2.68105615129522 | epot = -11.3267904399509 | etot = -5.62847190297782 +465000 ekin = 3.0905839893169 | erot = 2.67674994758358 | epot = -11.395805840273 | etot = -5.62847190337253 +466000 ekin = 3.17872270900187 | erot = 2.68248866699541 | epot = -11.4896832798804 | etot = -5.62847190388315 +467000 ekin = 3.27594114496298 | erot = 2.69614045584725 | epot = -11.6005535052675 | etot = -5.62847190445725 +468000 ekin = 3.37571282134157 | erot = 2.71534026239274 | epot = -11.7195249887762 | etot = -5.62847190504193 +469000 ekin = 3.47128178263097 | erot = 2.73774679762323 | epot = -11.8375004858465 | etot = -5.62847190559228 +470000 ekin = 3.55617737699251 | erot = 2.76123628660567 | epot = -11.9458855696746 | etot = -5.62847190607642 +471000 ekin = 3.62463309399585 | erot = 2.78402790003228 | epot = -12.0371329004995 | etot = -5.62847190647142 +472000 ekin = 3.67190559892006 | erot = 2.80477124778249 | epot = -12.1051487534616 | etot = -5.6284719067591 +473000 ekin = 3.69451868440089 | erot = 2.82263116140754 | epot = -12.1456217527309 | etot = -5.62847190692251 +474000 ekin = 3.69045746330095 | erot = 2.83737882568667 | epot = -12.1563081959356 | etot = -5.62847190694794 +475000 ekin = 3.6593211634895 | erot = 2.84946541727286 | epot = -12.1372584875897 | etot = -5.62847190682734 +476000 ekin = 3.60242486136352 | erot = 2.86004016499292 | epot = -12.0909369329187 | etot = -5.62847190656224 +477000 ekin = 3.52282746237348 | erot = 2.87088465736541 | epot = -12.022184025903 | etot = -5.62847190616409 +478000 ekin = 3.42525452627072 | erot = 2.88424967271448 | epot = -11.9379761046535 | etot = -5.62847190566833 +479000 ekin = 3.31588349736032 | erot = 2.90254646897832 | epot = -11.8469018714573 | etot = -5.62847190511867 +480000 ekin = 3.20192949242862 | erot = 2.92801081392743 | epot = -11.7584122109371 | etot = -5.62847190458104 +481000 ekin = 3.09102106837914 | erot = 2.96227510042882 | epot = -11.6817680729442 | etot = -5.62847190413626 +482000 ekin = 2.99039932398843 | erot = 3.00590839371542 | epot = -11.6247796215703 | etot = -5.62847190386642 +483000 ekin = 2.90605693342726 | erot = 3.05799802966767 | epot = -11.5925268669332 | etot = -5.62847190383822 +484000 ekin = 2.84200171523337 | erot = 3.11586840866181 | epot = -11.5863420279766 | etot = -5.62847190408139 +485000 ekin = 2.81072036470602 | erot = 3.03665546459291 | epot = -11.4758477218386 | etot = -5.6284718925397 +486000 ekin = 2.99172671796881 | erot = 2.89028588607158 | epot = -11.5104845147713 | etot = -5.62847191073092 +487000 ekin = 3.04661020882536 | erot = 2.89516257155047 | epot = -11.570244686013 | etot = -5.62847190563722 +488000 ekin = 3.02813445462026 | erot = 2.91755814175518 | epot = -11.5741645019136 | etot = -5.62847190553817 +489000 ekin = 3.02918173190443 | erot = 2.94703274342909 | epot = -11.6046863809385 | etot = -5.62847190560502 +490000 ekin = 3.04920929976752 | erot = 2.9829992143963 | epot = -11.6606804199874 | etot = -5.62847190582359 +491000 ekin = 3.08564623424383 | erot = 3.02458607703026 | epot = -11.7387042173963 | etot = -5.62847190612219 +492000 ekin = 3.13426650217752 | erot = 3.07113014038979 | epot = -11.8338685490083 | etot = -5.62847190644095 +493000 ekin = 3.19024782359286 | erot = 3.12246736377248 | epot = -11.9411870940141 | etot = -5.62847190664877 +494000 ekin = 3.24418110407867 | erot = 3.17757093528454 | epot = -12.0502240478831 | etot = -5.62847200851984 +495000 ekin = 3.12930691891059 | erot = 3.12025770009336 | epot = -11.8780365338362 | etot = -5.62847191483222 +496000 ekin = 3.38154400846385 | erot = 3.12702216682413 | epot = -12.1370381395015 | etot = -5.6284719642135 +497000 ekin = 3.53796334307627 | erot = 3.21345240185485 | epot = -12.3798876661722 | etot = -5.62847192124111 +498000 ekin = 3.54725242247929 | erot = 3.31274815695536 | epot = -12.4884725006935 | etot = -5.62847192125882 +499000 ekin = 3.54686752395102 | erot = 3.42936350672183 | epot = -12.604702952023 | etot = -5.6284719213501 +500000 ekin = 3.53611629145842 | erot = 3.56214471849631 | epot = -12.7267329314715 | etot = -5.62847192151679 +501000 ekin = 3.51474019585048 | erot = 3.70831240063284 | epot = -12.8515245182456 | etot = -5.62847192176227 +502000 ekin = 3.48291543617475 | erot = 3.86351597858863 | epot = -12.9749033367585 | etot = -5.62847192199508 +503000 ekin = 3.44167367984357 | erot = 4.02200657195861 | epot = -13.0921521741542 | etot = -5.62847192235202 +504000 ekin = 3.39166561937802 | erot = 4.17733332042956 | epot = -13.1974708625528 | etot = -5.62847192274522 +505000 ekin = 3.33344269450369 | erot = 4.32266370127691 | epot = -13.2845783189171 | etot = -5.62847192313649 +506000 ekin = 3.26726906278953 | erot = 4.45157764164142 | epot = -13.3473186278349 | etot = -5.62847192340397 +507000 ekin = 3.19388361648963 | erot = 4.55898983229643 | epot = -13.3813453722758 | etot = -5.62847192348974 +508000 ekin = 3.11462724048527 | erot = 4.64207406472335 | epot = -13.3851732285476 | etot = -5.62847192333896 +509000 ekin = 3.03154551889806 | erot = 4.70083202644182 | epot = -13.3608494683002 | etot = -5.62847192296028 +510000 ekin = 2.94513058611301 | erot = 4.73730594222395 | epot = -13.3109084508275 | etot = -5.62847192249055 +511000 ekin = 2.85640718494208 | erot = 4.75516581382858 | epot = -13.2400449206964 | etot = -5.62847192192573 +512000 ekin = 2.76854482524886 | erot = 4.75962991523446 | epot = -13.1566466618523 | etot = -5.62847192136897 +513000 ekin = 2.68465921482974 | erot = 4.75599513194259 | epot = -13.0691262676749 | etot = -5.62847192090256 +514000 ekin = 2.60745568314133 | erot = 4.7487016865945 | epot = -12.9846292903229 | etot = -5.6284719205871 +515000 ekin = 2.53899080264093 | erot = 4.74082869237892 | epot = -12.9082914154295 | etot = -5.62847192040964 +516000 ekin = 2.4805786289685 | erot = 4.73416754061948 | epot = -12.8432180899488 | etot = -5.62847192036078 +517000 ekin = 2.43281299020428 | erot = 4.72933651070645 | epot = -12.7906214213182 | etot = -5.62847192040746 +518000 ekin = 2.39567246200902 | erot = 4.72611868192658 | epot = -12.7502630644448 | etot = -5.62847192050918 +519000 ekin = 2.36868008077583 | erot = 4.72386163456227 | epot = -12.7210136359631 | etot = -5.62847192062505 +520000 ekin = 2.3510906803193 | erot = 4.72186744274965 | epot = -12.7014300437884 | etot = -5.62847192071945 +521000 ekin = 2.34207426124194 | erot = 4.71970227698523 | epot = -12.6902484589981 | etot = -5.62847192077095 +522000 ekin = 2.340858583968 | erot = 4.71735113725796 | epot = -12.6866816420039 | etot = -5.62847192077794 +523000 ekin = 2.34541603965324 | erot = 4.65571671259031 | epot = -12.6296046827302 | etot = -5.62847193048665 +524000 ekin = 2.39460269542338 | erot = 4.54409239666456 | epot = -12.5671670123716 | etot = -5.62847192028367 +525000 ekin = 2.51755565352142 | erot = 4.49060445319741 | epot = -12.6366320324481 | etot = -5.62847192572927 +526000 ekin = 2.63891940341078 | erot = 4.49670026126345 | epot = -12.7640916024644 | etot = -5.62847193779014 +527000 ekin = 2.68130557078061 | erot = 4.50503337375483 | epot = -12.8148108746342 | etot = -5.6284719300988 +528000 ekin = 2.71450795010167 | erot = 4.51098798629419 | epot = -12.8539678665943 | etot = -5.62847193019847 +529000 ekin = 2.74727192393578 | erot = 4.51402301142804 | epot = -12.8897668656323 | etot = -5.62847193026851 +530000 ekin = 2.77952118313533 | erot = 4.51256666252574 | epot = -12.9205597759558 | etot = -5.62847193029471 +531000 ekin = 2.81130699778189 | erot = 4.50555264766606 | epot = -12.9453315757214 | etot = -5.62847193027343 +532000 ekin = 2.84274553226625 | erot = 4.49253106980067 | epot = -12.9637485322803 | etot = -5.62847193021333 +533000 ekin = 2.87393313768489 | erot = 4.47361780233235 | epot = -12.9760228701517 | etot = -5.62847193013447 +534000 ekin = 2.9048693380618 | erot = 4.44928844615846 | epot = -12.9826297142804 | etot = -5.62847193006009 +535000 ekin = 2.93541519863514 | erot = 4.42010482064679 | epot = -12.9839919492879 | etot = -5.62847193000594 +536000 ekin = 2.96529830145678 | erot = 4.38649798395329 | epot = -12.9802682153867 | etot = -5.62847192997666 +537000 ekin = 2.99415467148711 | erot = 4.34867665836371 | epot = -12.9713032598077 | etot = -5.62847192995683 +538000 ekin = 3.02158801646915 | erot = 4.30669342610079 | epot = -12.9567533725263 | etot = -5.62847192995632 +539000 ekin = 3.04722844370983 | erot = 4.26048951905857 | epot = -12.9361898927207 | etot = -5.6284719299523 +540000 ekin = 3.07077963641468 | erot = 4.21000980479945 | epot = -12.9092613711494 | etot = -5.62847192993531 +541000 ekin = 3.09204730614512 | erot = 4.15535061586997 | epot = -12.8758698519159 | etot = -5.62847192990077 +542000 ekin = 3.11094831331516 | erot = 4.09682671840137 | epot = -12.8362469615643 | etot = -5.62847192984778 +543000 ekin = 3.12750284881097 | erot = 4.03499383132543 | epot = -12.7909686099158 | etot = -5.6284719297794 +544000 ekin = 3.14181233916593 | erot = 3.97062692622017 | epot = -12.7409111950905 | etot = -5.62847192970443 +545000 ekin = 3.15402369277102 | erot = 3.90462208418003 | epot = -12.6871177065823 | etot = -5.62847192963125 +546000 ekin = 3.16427777376567 | erot = 3.83809465728464 | epot = -12.6308443606135 | etot = -5.62847192956321 +547000 ekin = 3.17263245314568 | erot = 3.77248542238257 | epot = -12.5735898050643 | etot = -5.62847192953605 +548000 ekin = 3.179051141272 | erot = 3.70842416476057 | epot = -12.5159472355757 | etot = -5.6284719295431 +549000 ekin = 3.18335924851754 | erot = 3.64619443423589 | epot = -12.4580256122966 | etot = -5.62847192954316 +550000 ekin = 3.18506506659047 | erot = 3.58603484428966 | epot = -12.3995718405372 | etot = -5.62847192965712 +551000 ekin = 3.18354118864977 | erot = 3.52751972614617 | epot = -12.3395328445918 | etot = -5.62847192979591 +552000 ekin = 3.17814056098378 | erot = 3.4697331722894 | epot = -12.2763456632104 | etot = -5.62847192993727 +553000 ekin = 3.16816249045812 | erot = 3.41187716293306 | epot = -12.2085115834396 | etot = -5.62847193004847 +554000 ekin = 3.15297464053773 | erot = 3.35363386892402 | epot = -12.1350804395537 | etot = -5.6284719300919 +555000 ekin = 3.13218065539089 | erot = 3.29554931591432 | epot = -12.0562019013385 | etot = -5.62847193003333 +556000 ekin = 3.10581995739448 | erot = 3.23932890454546 | epot = -11.97362079179 | etot = -5.62847192985007 +557000 ekin = 3.0745788389332 | erot = 3.1879540330783 | epot = -11.8910048015461 | etot = -5.62847192953461 +558000 ekin = 3.03998262648526 | erot = 3.1455370733645 | epot = -11.8139916289626 | etot = -5.62847192911286 +559000 ekin = 3.00450378979627 | erot = 3.11693712837836 | epot = -11.7499128467596 | etot = -5.62847192858498 +560000 ekin = 2.97145203616973 | erot = 3.10758181987614 | epot = -11.7075057840726 | etot = -5.62847192802673 +561000 ekin = 2.94451934096015 | erot = 3.12267269756051 | epot = -11.695663966089 | etot = -5.62847192756838 +562000 ekin = 2.92714140951177 | erot = 3.16633554925042 | epot = -11.7219488860146 | etot = -5.62847192725238 +563000 ekin = 2.92206147619018 | erot = 3.24077054357084 | epot = -11.7913039469645 | etot = -5.62847192720349 +564000 ekin = 2.93031627647214 | erot = 3.34563410959066 | epot = -11.904422313567 | etot = -5.62847192750415 +565000 ekin = 2.95068712283333 | erot = 3.47751232966821 | epot = -12.0566713806597 | etot = -5.62847192815818 +566000 ekin = 2.97962685511686 | erot = 3.62985521360919 | epot = -12.2379539978553 | etot = -5.62847192912925 +567000 ekin = 3.01171593565445 | erot = 3.79324477343165 | epot = -12.4334326394058 | etot = -5.62847193031967 +568000 ekin = 3.0405447743718 | erot = 3.95610049179515 | epot = -12.6251171977589 | etot = -5.62847193159194 +569000 ekin = 3.05981811069109 | erot = 4.10576505741751 | epot = -12.7940551008957 | etot = -5.62847193278708 +570000 ekin = 3.06446758287987 | erot = 4.22987220717996 | epot = -12.9228117238052 | etot = -5.62847193374534 +571000 ekin = 3.05159191031777 | erot = 4.31782950115015 | epot = -12.9978933457979 | etot = -5.62847193433 +572000 ekin = 3.02108996830544 | erot = 4.36217384049608 | epot = -13.0117357432537 | etot = -5.62847193445217 +573000 ekin = 2.97589592637986 | erot = 4.35953364453791 | epot = -12.9639015050083 | etot = -5.6284719340905 +574000 ekin = 2.92177260939836 | erot = 4.31098813653063 | epot = -12.8612326792314 | etot = -5.6284719333024 +575000 ekin = 2.86675845138713 | erot = 4.22206447607902 | epot = -12.717294857508 | etot = -5.62847193004183 +576000 ekin = 2.8223869503789 | erot = 4.11002108703159 | epot = -12.5608799669315 | etot = -5.62847192952098 +577000 ekin = 2.79586021282698 | erot = 3.98405314235611 | epot = -12.4083852842739 | etot = -5.62847192909081 +578000 ekin = 2.79062678644879 | erot = 3.84816173900883 | epot = -12.2672604543092 | etot = -5.62847192885153 +579000 ekin = 2.80727876762157 | erot = 3.7063076839788 | epot = -12.1420583804356 | etot = -5.62847192883522 +580000 ekin = 2.84308800282857 | erot = 3.56147502222138 | epot = -12.033034954352 | etot = -5.62847192930204 +581000 ekin = 2.89275945168389 | erot = 3.41677708036392 | epot = -11.9380084614241 | etot = -5.62847192937627 +582000 ekin = 2.94948274098648 | erot = 3.27852635628754 | epot = -11.8564810267198 | etot = -5.62847192944578 +583000 ekin = 3.0060031278149 | erot = 3.15339507864773 | epot = -11.7878701358921 | etot = -5.62847192942947 +584000 ekin = 3.05615870303891 | erot = 3.04800743030686 | epot = -11.7326380626508 | etot = -5.62847192930502 +585000 ekin = 3.09596263910058 | erot = 2.96828908150272 | epot = -11.6927236496984 | etot = -5.62847192909508 +586000 ekin = 3.1240729820111 | erot = 2.91878541586934 | epot = -11.6713303267112 | etot = -5.6284719288308 +587000 ekin = 3.14174614222906 | erot = 2.90225430090919 | epot = -11.6724723716795 | etot = -5.62847192854131 +588000 ekin = 3.15240031624116 | erot = 2.91960613640703 | epot = -11.700478380913 | etot = -5.62847192826478 +589000 ekin = 3.16081808258331 | erot = 2.97006448171823 | epot = -11.7593544923455 | etot = -5.62847192804401 +590000 ekin = 3.17204827386564 | erot = 3.05134069925118 | epot = -11.8518609010364 | etot = -5.62847192791959 +591000 ekin = 3.19150299840181 | erot = 3.16015018730255 | epot = -11.9801251137005 | etot = -5.62847192799616 +592000 ekin = 3.22264872303336 | erot = 3.29204057514201 | epot = -12.1431612264965 | etot = -5.62847192832117 +593000 ekin = 3.26585695463724 | erot = 3.44092346936372 | epot = -12.3352523528637 | etot = -5.62847192886271 +594000 ekin = 3.31918005195198 | erot = 3.59965335600014 | epot = -12.5473053375205 | etot = -5.62847192956837 +595000 ekin = 3.37897127081708 | erot = 3.76045843940704 | epot = -12.7679016405175 | etot = -5.62847193029343 +596000 ekin = 3.43824068576764 | erot = 3.91359738324664 | epot = -12.9803100016429 | etot = -5.6284719326286 +597000 ekin = 3.4874487679544 | erot = 4.04782437859589 | epot = -13.1637450798126 | etot = -5.62847193326233 +598000 ekin = 3.52187002166768 | erot = 4.15698580423951 | epot = -13.3073277595236 | etot = -5.62847193361645 +599000 ekin = 3.53831455068313 | erot = 4.23767846708707 | epot = -13.4044649514583 | etot = -5.6284719336881 +600000 ekin = 3.53510970425615 | erot = 4.28920847102017 | epot = -13.4527901087965 | etot = -5.62847193352019 +601000 ekin = 3.51191041812962 | erot = 4.31320178191252 | epot = -13.4535841332244 | etot = -5.62847193318225 +602000 ekin = 3.46937521141073 | erot = 4.3129515273547 | epot = -13.4107986715144 | etot = -5.62847193274896 +603000 ekin = 3.40882221235898 | erot = 4.29270411923729 | epot = -13.3299982638779 | etot = -5.62847193228164 +604000 ekin = 3.33194570976897 | erot = 4.25705245858959 | epot = -13.2174701001796 | etot = -5.62847193182099 +605000 ekin = 3.24062643782743 | erot = 4.21052248032723 | epot = -13.0796208495416 | etot = -5.62847193138697 +606000 ekin = 3.13683319321467 | erot = 4.15735875790752 | epot = -12.9226638821055 | etot = -5.62847193098336 +607000 ekin = 3.02259481106295 | erot = 4.10146703767137 | epot = -12.752533779339 | etot = -5.62847193060464 +608000 ekin = 2.90001652257939 | erot = 4.04645475151246 | epot = -12.5749432043324 | etot = -5.62847193024057 +609000 ekin = 2.77131728806686 | erot = 3.9957146077566 | epot = -12.3955038257043 | etot = -5.62847192988082 +610000 ekin = 2.63886938889611 | erot = 3.95250622986135 | epot = -12.2198475482764 | etot = -5.62847192951889 +611000 ekin = 2.50524882249988 | erot = 3.92003293773325 | epot = -12.0537536890984 | etot = -5.62847192886525 +612000 ekin = 2.37382087281222 | erot = 3.90218869849447 | epot = -11.9044814998431 | etot = -5.62847192853644 +613000 ekin = 2.24769613362685 | erot = 3.9018678874526 | epot = -11.7780359493068 | etot = -5.62847192822737 +614000 ekin = 2.12975142862109 | erot = 3.92103062110346 | epot = -11.6792539777051 | etot = -5.62847192798058 +615000 ekin = 2.02283676462475 | erot = 3.96080056824183 | epot = -11.6121092606972 | etot = -5.62847192783064 +616000 ekin = 1.92967019041608 | erot = 4.02099162179926 | epot = -11.5791337400261 | etot = -5.6284719278108 +617000 ekin = 1.8527379185552 | erot = 4.09974474400672 | epot = -11.5809545905121 | etot = -5.62847192795013 +618000 ekin = 1.79420296287865 | erot = 4.19322703619206 | epot = -11.6159019273328 | etot = -5.62847192826212 +619000 ekin = 1.75583197419788 | erot = 4.29552606644023 | epot = -11.6798299693697 | etot = -5.62847192873157 +620000 ekin = 1.7389587008847 | erot = 4.39891672372568 | epot = -11.7663473539151 | etot = -5.62847192930469 +621000 ekin = 1.74449834705323 | erot = 4.4946225066521 | epot = -11.8675927835954 | etot = -5.6284719298901 +622000 ekin = 1.77300875716063 | erot = 4.57403518093684 | epot = -11.9755158684793 | etot = -5.6284719303818 +623000 ekin = 1.82476626654578 | erot = 4.63011744400213 | epot = -12.0833556412428 | etot = -5.62847193069493 +624000 ekin = 1.89980556084052 | erot = 4.65854151401777 | epot = -12.1868190056567 | etot = -5.62847193079843 +625000 ekin = 1.99788930994803 | erot = 4.65817060172211 | epot = -12.2845318423909 | etot = -5.62847193072074 +626000 ekin = 2.11841938994316 | erot = 4.63077870097587 | epot = -12.3776700214476 | etot = -5.62847193052855 +627000 ekin = 2.26034340485921 | erot = 4.58024268402232 | epot = -12.4690580191734 | etot = -5.62847193029191 +628000 ekin = 2.42211143967629 | erot = 4.51161612058694 | epot = -12.5621994903281 | etot = -5.62847193006486 +629000 ekin = 2.60047669396776 | erot = 4.43316974513653 | epot = -12.6621183685087 | etot = -5.62847192940437 +630000 ekin = 2.75035748986435 | erot = 4.31003905752691 | epot = -12.6888685130984 | etot = -5.62847196570711 +631000 ekin = 2.81471524126653 | erot = 4.11774535993883 | epot = -12.560932536969 | etot = -5.62847193576361 +632000 ekin = 2.95867552202343 | erot = 4.07926707210706 | epot = -12.6664145270012 | etot = -5.62847193287073 +633000 ekin = 3.21010693580782 | erot = 4.20581326824112 | epot = -13.0443921661263 | etot = -5.62847196207735 +634000 ekin = 3.41641131485967 | erot = 4.25928215932152 | epot = -13.3041654105523 | etot = -5.62847193637112 +635000 ekin = 3.57385274064017 | erot = 4.24018711604243 | epot = -13.4425117938242 | etot = -5.62847193714155 +636000 ekin = 3.71894531184374 | erot = 4.21896102707095 | epot = -13.5663782768924 | etot = -5.62847193797771 +637000 ekin = 3.84555962843745 | erot = 4.19009538997421 | epot = -13.664126957085 | etot = -5.62847193867337 +638000 ekin = 3.94874232724131 | erot = 4.14881281932144 | epot = -13.7260270856049 | etot = -5.62847193904211 +639000 ekin = 4.02564653205978 | erot = 4.09271382126824 | epot = -13.7468322923361 | etot = -5.62847193900805 +640000 ekin = 4.07582551376673 | erot = 4.02260436126851 | epot = -13.7269018136558 | etot = -5.62847193862055 +641000 ekin = 4.10019063777134 | erot = 3.94203419575025 | epot = -13.6706967719888 | etot = -5.62847193846719 +642000 ekin = 4.09923586008661 | erot = 3.85569636519573 | epot = -13.5834041631703 | etot = -5.62847193788798 +643000 ekin = 4.07616079994664 | erot = 3.76850329642401 | epot = -13.4731360337343 | etot = -5.62847193736366 +644000 ekin = 4.03483546321403 | erot = 3.68428538420007 | epot = -13.3475927843633 | etot = -5.6284719369492 +645000 ekin = 3.97939693549996 | erot = 3.60521279253874 | epot = -13.2130816646665 | etot = -5.62847193662782 +646000 ekin = 3.91424157408672 | erot = 3.5319774652156 | epot = -13.0746909756475 | etot = -5.6284719363452 +647000 ekin = 3.84412108368419 | erot = 3.46430751179901 | epot = -12.9369005316694 | etot = -5.62847193618623 +648000 ekin = 3.77442093462977 | erot = 3.40030625102239 | epot = -12.8031991215208 | etot = -5.6284719358686 +649000 ekin = 3.71064844414069 | erot = 3.33902116862802 | epot = -12.6781415483154 | etot = -5.62847193554669 +650000 ekin = 3.65777288971661 | erot = 3.28036981761337 | epot = -12.5666146426042 | etot = -5.6284719352742 +651000 ekin = 3.61962254759293 | erot = 3.22458240433025 | epot = -12.4726768870207 | etot = -5.62847193509757 +652000 ekin = 3.5983886698485 | erot = 3.17201593040843 | epot = -12.3988765352917 | etot = -5.62847193503482 +653000 ekin = 3.59447660059994 | erot = 3.12302902483937 | epot = -12.3459775605093 | etot = -5.62847193506997 +654000 ekin = 3.60674141918748 | erot = 3.07797678365425 | epot = -12.3131901380042 | etot = -5.62847193516246 +655000 ekin = 3.63298841308731 | erot = 3.03728497072474 | epot = -12.2987453190854 | etot = -5.62847193527339 +656000 ekin = 3.67052655523893 | erot = 3.00147990292547 | epot = -12.3004783935545 | etot = -5.62847193539005 +657000 ekin = 3.71734630697157 | erot = 2.97084073545016 | epot = -12.3166589778187 | etot = -5.62847193539701 +658000 ekin = 3.75778663153076 | erot = 2.94872940840489 | epot = -12.3349879987274 | etot = -5.62847195879179 +659000 ekin = 3.70128994146784 | erot = 2.99267200647991 | epot = -12.3224338836791 | etot = -5.62847193573132 +660000 ekin = 3.77980484663485 | erot = 3.0508167858632 | epot = -12.4590935965774 | etot = -5.62847196407936 +661000 ekin = 3.87674047114964 | erot = 3.02043722440496 | epot = -12.5256496409205 | etot = -5.62847194536593 +662000 ekin = 3.96189665296545 | erot = 2.97294510656965 | epot = -12.5633137058439 | etot = -5.62847194630885 +663000 ekin = 4.03233992108651 | erot = 2.90724728968627 | epot = -12.5680591571061 | etot = -5.6284719463333 +664000 ekin = 4.08703350774854 | erot = 2.82371074133269 | epot = -12.5392161948955 | etot = -5.62847194581425 +665000 ekin = 4.13016908270567 | erot = 2.72591755776349 | epot = -12.4845585855259 | etot = -5.62847194505672 +666000 ekin = 4.16485763690331 | erot = 2.62158318077271 | epot = -12.4149127617545 | etot = -5.62847194407844 +667000 ekin = 4.19388444231057 | erot = 2.52048046570678 | epot = -12.3428368513375 | etot = -5.62847194332015 +668000 ekin = 4.21970111362512 | erot = 2.4311756655168 | epot = -12.2793487219105 | etot = -5.6284719427686 +669000 ekin = 4.24419480060344 | erot = 2.35970998766334 | epot = -12.2323767306761 | etot = -5.62847194240935 +670000 ekin = 4.26650932837758 | erot = 2.31009212990318 | epot = -12.2050734005613 | etot = -5.62847194228056 +671000 ekin = 4.28028750577367 | erot = 2.2839406896226 | epot = -12.1927001376243 | etot = -5.62847194222801 +672000 ekin = 4.286049538111 | erot = 2.28087700956881 | epot = -12.1953984898719 | etot = -5.62847194219211 +673000 ekin = 4.28538320977093 | erot = 2.29981058125325 | epot = -12.2136657331723 | etot = -5.62847194214809 +674000 ekin = 4.28032637881323 | erot = 2.33931520005416 | epot = -12.2481135209748 | etot = -5.62847194210737 +675000 ekin = 4.27310613137932 | erot = 2.39770546345542 | epot = -12.2992835369528 | etot = -5.62847194211806 +676000 ekin = 4.26563141837423 | erot = 2.47283047867151 | epot = -12.3669338393238 | etot = -5.62847194227809 +677000 ekin = 4.25873601017197 | erot = 2.56159475147911 | epot = -12.4488027042873 | etot = -5.62847194263624 +678000 ekin = 4.25154383400404 | erot = 2.65951246674531 | epot = -12.5395282439923 | etot = -5.62847194324292 +679000 ekin = 4.24120573455929 | erot = 2.76057514763493 | epot = -12.6302528262372 | etot = -5.628471944043 +680000 ekin = 4.2232005117233 | erot = 2.8577068911792 | epot = -12.7093793477757 | etot = -5.62847194487315 +681000 ekin = 4.19242845444176 | erot = 2.94400272561177 | epot = -12.7649031255562 | etot = -5.62847194550269 +682000 ekin = 4.14477706331028 | erot = 3.01435956402087 | epot = -12.7876085730806 | etot = -5.62847194574946 +683000 ekin = 4.07850194573498 | erot = 3.0666968932365 | epot = -12.7736707845359 | etot = -5.6284719455644 +684000 ekin = 3.98766788576626 | erot = 3.0906277067226 | epot = -12.7067675428786 | etot = -5.62847195038972 +685000 ekin = 3.87609976025144 | erot = 3.0721311887794 | epot = -12.5767028927108 | etot = -5.62847194367995 +686000 ekin = 3.78865422783082 | erot = 3.05379982550292 | epot = -12.4709259956873 | etot = -5.62847194235354 +687000 ekin = 3.72885638113158 | erot = 3.05128310415992 | epot = -12.408611432526 | etot = -5.62847194723451 +688000 ekin = 3.65488085456385 | erot = 3.04382149782401 | epot = -12.3271742987313 | etot = -5.62847194634345 +689000 ekin = 3.57606770138192 | erot = 3.03834252514909 | epot = -12.2428821721681 | etot = -5.62847194563711 +690000 ekin = 3.51634425554767 | erot = 3.04775260803385 | epot = -12.1925688087058 | etot = -5.6284719451243 +691000 ekin = 3.47971445739509 | erot = 3.07622358483667 | epot = -12.1844099871023 | etot = -5.62847194487056 +692000 ekin = 3.46765181254146 | erot = 3.12642449719425 | epot = -12.2225482546729 | etot = -5.62847194493722 +693000 ekin = 3.47854301550202 | erot = 3.19918358098304 | epot = -12.3061985418229 | etot = -5.62847194533786 +694000 ekin = 3.50760869796604 | erot = 3.2934044104258 | epot = -12.4294850544069 | etot = -5.62847194601503 +695000 ekin = 3.54747029158324 | erot = 3.40637947899577 | epot = -12.5823217174297 | etot = -5.6284719468507 +696000 ekin = 3.58927155158232 | erot = 3.53441505478202 | epot = -12.7521585540714 | etot = -5.62847194770705 +697000 ekin = 3.62399868515567 | erot = 3.67347767287419 | epot = -12.9259483064922 | etot = -5.62847194846231 +698000 ekin = 3.64429609748856 | erot = 3.81929275579794 | epot = -13.0920608023944 | etot = -5.62847194910787 +699000 ekin = 3.64411727644142 | erot = 3.96826912274322 | epot = -13.2408583487081 | etot = -5.62847194952344 +700000 ekin = 3.61972386471004 | erot = 4.11779628901722 | epot = -13.3659921034179 | etot = -5.62847194969066 +701000 ekin = 3.57045543126867 | erot = 4.26605645111758 | epot = -13.4649838321254 | etot = -5.62847194973912 +702000 ekin = 3.49917622945371 | erot = 4.41037029489176 | epot = -13.5380184739597 | etot = -5.62847194961422 +703000 ekin = 3.41079978145369 | erot = 4.54773448473206 | epot = -13.5870062155679 | etot = -5.62847194938218 +704000 ekin = 3.31149657249576 | erot = 4.67560464085735 | epot = -13.6155731624397 | etot = -5.62847194908665 +705000 ekin = 3.2080790304337 | erot = 4.79162132887101 | epot = -13.6281723080898 | etot = -5.62847194878512 +706000 ekin = 3.10702043894422 | erot = 4.89365607505418 | epot = -13.629148462546 | etot = -5.62847194854759 +707000 ekin = 3.01353531409874 | erot = 4.97967086421267 | epot = -13.6216781267545 | etot = -5.62847194844312 +708000 ekin = 2.93091332946626 | erot = 5.04739802063624 | epot = -13.6067832986217 | etot = -5.62847194851923 +709000 ekin = 2.86026033876341 | erot = 5.09399325402639 | epot = -13.5827255415665 | etot = -5.62847194877667 +710000 ekin = 2.80069789539212 | erot = 5.11589857306006 | epot = -13.5450684176139 | etot = -5.62847194916176 +711000 ekin = 2.74994326406642 | erot = 5.10911210243646 | epot = -13.4875273160742 | etot = -5.62847194957137 +712000 ekin = 2.70509857027021 | erot = 5.06990681770748 | epot = -13.4034773378593 | etot = -5.62847194988164 +713000 ekin = 2.66343594243819 | erot = 4.99582282608673 | epot = -13.2877307185112 | etot = -5.62847194998628 +714000 ekin = 2.62297982870224 | erot = 4.88658411853972 | epot = -13.1380358970775 | etot = -5.62847194983555 +715000 ekin = 2.58275404764254 | erot = 4.74456650550822 | epot = -12.9557925026026 | etot = -5.6284719494518 +716000 ekin = 2.54267933985284 | erot = 4.57461726508771 | epot = -12.7457685538544 | etot = -5.62847194891384 +717000 ekin = 2.50334692022862 | erot = 4.38348005498769 | epot = -12.5152989232176 | etot = -5.6284719480013 +718000 ekin = 2.46867182055041 | erot = 4.1828061934235 | epot = -12.2799499617185 | etot = -5.62847194774463 +719000 ekin = 2.44027484666831 | erot = 3.97913844322971 | epot = -12.0478852373921 | etot = -5.62847194749405 +720000 ekin = 2.41790751034177 | erot = 3.77617089343529 | epot = -11.8225503510303 | etot = -5.62847194725326 +721000 ekin = 2.40130900325092 | erot = 3.57751641410833 | epot = -11.6072973643847 | etot = -5.62847194702549 +722000 ekin = 2.39001969443857 | erot = 3.38620933378187 | epot = -11.404700975239 | etot = -5.62847194701852 +723000 ekin = 2.38288808218479 | erot = 3.20447847633104 | epot = -11.215838505237 | etot = -5.62847194672118 +724000 ekin = 2.38038137258082 | erot = 3.03585463115629 | epot = -11.0447079501875 | etot = -5.62847194645035 +725000 ekin = 2.38334904384078 | erot = 2.88343528894459 | epot = -10.8952562789953 | etot = -5.62847194620992 +726000 ekin = 2.3927798881752 | erot = 2.74974572539751 | epot = -10.7709975595779 | etot = -5.62847194600517 +727000 ekin = 2.40968215741221 | erot = 2.63676770312337 | epot = -10.6749218063778 | etot = -5.62847194584219 +728000 ekin = 2.42515137987946 | erot = 2.54412147902473 | epot = -10.597744818259 | etot = -5.6284719593548 +729000 ekin = 2.40297855337031 | erot = 2.51475999965194 | epot = -10.5462104924533 | etot = -5.62847193943108 +730000 ekin = 2.46310039286674 | erot = 2.540888382744 | epot = -10.6324607145899 | etot = -5.62847193897912 +731000 ekin = 2.53308642098023 | erot = 2.54954386950276 | epot = -10.711102229553 | etot = -5.62847193907001 +732000 ekin = 2.61398262095739 | erot = 2.5802487460936 | epot = -10.8227033063293 | etot = -5.62847193927826 +733000 ekin = 2.70404858449563 | erot = 2.63167940205859 | epot = -10.9641999262015 | etot = -5.62847193964733 +734000 ekin = 2.80051950070181 | erot = 2.70132929850524 | epot = -11.1303207394307 | etot = -5.62847194022367 +735000 ekin = 2.89941283720295 | erot = 2.78510796773607 | epot = -11.3129927459757 | etot = -5.62847194103669 +736000 ekin = 2.99560133060437 | erot = 2.87741009026776 | epot = -11.5014833619701 | etot = -5.62847194109798 +737000 ekin = 3.08481605483226 | erot = 2.9752448937055 | epot = -11.6885328905221 | etot = -5.62847194198435 +738000 ekin = 3.16217862814496 | erot = 3.07317374879029 | epot = -11.8638243197375 | etot = -5.62847194280226 +739000 ekin = 3.22336037210457 | erot = 3.16493875129292 | epot = -12.0167710667472 | etot = -5.62847194334973 +740000 ekin = 3.26585131612671 | erot = 3.2452213963337 | epot = -12.1395446568933 | etot = -5.62847194443293 +741000 ekin = 3.28375382494221 | erot = 3.29991441181407 | epot = -12.212140181187 | etot = -5.62847194443076 +742000 ekin = 3.27631313134865 | erot = 3.32408611699032 | epot = -12.2288711922813 | etot = -5.62847194394237 +743000 ekin = 3.24737724788096 | erot = 3.32046927259928 | epot = -12.1963184636816 | etot = -5.6284719432014 +744000 ekin = 3.20210603596794 | erot = 3.29401551174191 | epot = -12.1245934901295 | etot = -5.62847194241966 +745000 ekin = 3.14567705880421 | erot = 3.25033566996093 | epot = -12.0244846704798 | etot = -5.62847194171465 +746000 ekin = 3.08279906264057 | erot = 3.19521988680648 | epot = -11.9064908903141 | etot = -5.62847194086707 +747000 ekin = 3.01768881726563 | erot = 3.13473855306841 | epot = -11.7808993107186 | etot = -5.62847194038452 +748000 ekin = 2.95302867419745 | erot = 3.07321432138934 | epot = -11.6547149355341 | etot = -5.62847193994729 +749000 ekin = 2.89104396122167 | erot = 3.01469856693791 | epot = -11.5342144676923 | etot = -5.6284719395327 +750000 ekin = 2.83379417408033 | erot = 2.96315742645669 | epot = -11.4254235396726 | etot = -5.62847193913556 +751000 ekin = 2.78329891260719 | erot = 2.92241777446644 | epot = -11.3341886258388 | etot = -5.62847193876517 +752000 ekin = 2.74156846297845 | erot = 2.89600799316408 | epot = -11.2660483945816 | etot = -5.62847193843909 +753000 ekin = 2.71056677611893 | erot = 2.8869375344884 | epot = -11.2259762487886 | etot = -5.62847193818127 +754000 ekin = 2.69212502636381 | erot = 2.89743125955444 | epot = -11.2180282239416 | etot = -5.62847193802339 +755000 ekin = 2.68776538341817 | erot = 2.92849871098632 | epot = -11.2447360324805 | etot = -5.62847193807603 +756000 ekin = 2.69845743016129 | erot = 2.97938409373429 | epot = -11.3063134621321 | etot = -5.62847193823654 +757000 ekin = 2.72458496399214 | erot = 3.04788425636374 | epot = -11.4009411589946 | etot = -5.62847193863874 +758000 ekin = 2.76540921269775 | erot = 3.12962823295245 | epot = -11.5235093849696 | etot = -5.62847193931939 +759000 ekin = 2.81868342054339 | erot = 3.21794575406346 | epot = -11.6651011148695 | etot = -5.62847194026269 +760000 ekin = 2.88053746471945 | erot = 3.30429272409835 | epot = -11.8133021301665 | etot = -5.62847194134869 +761000 ekin = 2.94600007669967 | erot = 3.37947250557982 | epot = -11.9539445246072 | etot = -5.62847194232772 +762000 ekin = 3.0103728108363 | erot = 3.43568700379387 | epot = -12.0745317575224 | etot = -5.62847194289219 +763000 ekin = 3.07103775537587 | erot = 3.46881600078167 | epot = -12.1683256990032 | etot = -5.62847194284569 +764000 ekin = 3.12866395084712 | erot = 3.47975039697106 | epot = -12.2368862900568 | etot = -5.62847194223863 +765000 ekin = 3.18696433138653 | erot = 3.47390232159169 | epot = -12.2893385943131 | etot = -5.62847194133492 +766000 ekin = 3.25112146468525 | erot = 3.45917589069875 | epot = -12.3387692958358 | etot = -5.62847194045182 +767000 ekin = 3.32577328220466 | erot = 3.44357056015004 | epot = -12.3978157821775 | etot = -5.62847193982283 +768000 ekin = 3.41341833396391 | erot = 3.4334263493615 | epot = -12.4753166228815 | etot = -5.62847193955611 +769000 ekin = 3.51361597959336 | erot = 3.4325883769163 | epot = -12.5746762961707 | etot = -5.62847193966108 +770000 ekin = 3.62296220613534 | erot = 3.44225950920416 | epot = -12.6936936554243 | etot = -5.62847194008485 +771000 ekin = 3.67754209930849 | erot = 3.42051682729324 | epot = -12.726530894413 | etot = -5.62847196781123 +772000 ekin = 3.59351734139873 | erot = 3.35849685484742 | epot = -12.5804861297902 | etot = -5.62847193354401 +773000 ekin = 3.58504863458809 | erot = 3.48413941856385 | epot = -12.697659986425 | etot = -5.62847193327303 +774000 ekin = 3.69556246641496 | erot = 3.75600381486114 | epot = -13.080038250078 | etot = -5.62847196880192 +775000 ekin = 3.75799646991679 | erot = 3.873956410094 | epot = -13.2604248525586 | etot = -5.62847197254785 +776000 ekin = 3.76514931008122 | erot = 3.89275295614278 | epot = -13.2863742389445 | etot = -5.62847197272045 +777000 ekin = 3.74852837933054 | erot = 3.88975944407747 | epot = -13.2667597957584 | etot = -5.62847197235036 +778000 ekin = 3.71300754015998 | erot = 3.86527182207406 | epot = -13.2067513338695 | etot = -5.62847197163544 +779000 ekin = 3.66665793069796 | erot = 3.82295167580669 | epot = -13.1180815770381 | etot = -5.62847197053349 +780000 ekin = 3.61972773138243 | erot = 3.76957330528294 | epot = -13.0177730059552 | etot = -5.62847196928983 +781000 ekin = 3.5827624251825 | erot = 3.71368279717706 | epot = -12.9249171905627 | etot = -5.62847196820313 +782000 ekin = 3.56434384280159 | erot = 3.66344621657883 | epot = -12.8562620268944 | etot = -5.62847196751401 +783000 ekin = 3.56907083370159 | erot = 3.62459601403967 | epot = -12.8221388151988 | etot = -5.62847196745757 +784000 ekin = 3.59655578166301 | erot = 3.59908724292537 | epot = -12.8241149924018 | etot = -5.62847196781346 +785000 ekin = 3.64263842869095 | erot = 3.58559579705149 | epot = -12.856706194237 | etot = -5.62847196849456 +786000 ekin = 3.70061363552459 | erot = 3.58032714317056 | epot = -12.9094127479833 | etot = -5.6284719692882 +787000 ekin = 3.76290289511577 | erot = 3.57827846514429 | epot = -12.9696533303101 | etot = -5.62847197005003 +788000 ekin = 3.82230691224393 | erot = 3.57432079357667 | epot = -13.0250996764978 | etot = -5.62847197067724 +789000 ekin = 3.87288355980582 | erot = 3.5640275053608 | epot = -13.0653830362756 | etot = -5.62847197110898 +790000 ekin = 3.91054381090259 | erot = 3.54422213355097 | epot = -13.0832379157242 | etot = -5.62847197127067 +791000 ekin = 3.93344679963981 | erot = 3.513339825829 | epot = -13.0752585966554 | etot = -5.62847197118663 +792000 ekin = 3.94193166957115 | erot = 3.47142235482322 | epot = -13.041825995302 | etot = -5.62847197090762 +793000 ekin = 3.93805337440561 | erot = 3.41982689850894 | epot = -12.9863522434218 | etot = -5.62847197050723 +794000 ekin = 3.92496167477878 | erot = 3.360819734858 | epot = -12.9142533796931 | etot = -5.62847197005634 +795000 ekin = 3.90631843175017 | erot = 3.29713731842303 | epot = -12.8319277197836 | etot = -5.62847196961038 +796000 ekin = 3.8858792006581 | erot = 3.23158100820237 | epot = -12.7459321780665 | etot = -5.62847196920608 +797000 ekin = 3.86724402797514 | erot = 3.16668037667839 | epot = -12.6623963735179 | etot = -5.62847196886439 +798000 ekin = 3.85371944428472 | erot = 3.10446220748905 | epot = -12.5866536203663 | etot = -5.62847196859256 +799000 ekin = 3.84821326100227 | erot = 3.04637406900957 | epot = -12.5230592984002 | etot = -5.62847196838834 +800000 ekin = 3.85308746091494 | erot = 2.99338091162984 | epot = -12.4749403407895 | etot = -5.62847196824468 +801000 ekin = 3.86994742093311 | erot = 2.94620265096875 | epot = -12.4446220400576 | etot = -5.62847196815571 +802000 ekin = 3.89938743532043 | erot = 2.90559564258017 | epot = -12.4334550460216 | etot = -5.62847196812102 +803000 ekin = 3.94077451962402 | erot = 2.87255363202934 | epot = -12.441800119797 | etot = -5.62847196814361 +804000 ekin = 3.99217445526748 | erot = 2.84833794194511 | epot = -12.468984365439 | etot = -5.62847196822644 +805000 ekin = 4.05048829014821 | erot = 2.83432176495251 | epot = -12.5132820234689 | etot = -5.62847196836816 +806000 ekin = 4.11178329744327 | erot = 2.83170980380164 | epot = -12.5719650698088 | etot = -5.62847196856388 +807000 ekin = 4.17172086389146 | erot = 2.84122318486818 | epot = -12.6414160175669 | etot = -5.62847196880729 +808000 ekin = 4.22595471218244 | erot = 2.86283161315583 | epot = -12.7172582944323 | etot = -5.62847196909407 +809000 ekin = 4.27041103463199 | erot = 2.89559061447317 | epot = -12.7944736185239 | etot = -5.62847196941877 +810000 ekin = 4.30143579161472 | erot = 2.93761851724059 | epot = -12.867526278626 | etot = -5.62847196977065 +811000 ekin = 4.3158591249341 | erot = 2.98622782440343 | epot = -12.9305589194658 | etot = -5.62847197012825 +812000 ekin = 4.31104963132775 | erot = 3.03819974796596 | epot = -12.9777213497531 | etot = -5.62847197045938 +813000 ekin = 4.28501152851198 | erot = 3.09015837137455 | epot = -13.0036418706117 | etot = -5.62847197072517 +814000 ekin = 4.23653530241262 | erot = 3.13897206786273 | epot = -13.0039793411637 | etot = -5.6284719708883 +815000 ekin = 4.16537042744585 | erot = 3.18209773892999 | epot = -12.9759401372993 | etot = -5.62847197092346 +816000 ekin = 4.07236517437489 | erot = 3.21779646457061 | epot = -12.9186336097681 | etot = -5.62847197082257 +817000 ekin = 3.95951977387102 | erot = 3.24518380299012 | epot = -12.833175547459 | etot = -5.62847197059791 +818000 ekin = 3.82991762625571 | erot = 3.26412066899673 | epot = -12.7225102655335 | etot = -5.62847197028107 +819000 ekin = 3.68753356640539 | erot = 3.2749890292221 | epot = -12.5909945655321 | etot = -5.62847196990462 +820000 ekin = 3.53699106710322 | erot = 3.27842149097166 | epot = -12.4438845275865 | etot = -5.62847196951165 +821000 ekin = 3.38323613781718 | erot = 3.27505502165856 | epot = -12.2867631286099 | etot = -5.62847196913417 +822000 ekin = 3.23123737368411 | erot = 3.26537695348515 | epot = -12.1250862959605 | etot = -5.62847196879128 +823000 ekin = 3.08574116225304 | erot = 3.24970236655088 | epot = -11.9639154972909 | etot = -5.62847196848693 +824000 ekin = 2.9510991981331 | erot = 3.22828590254736 | epot = -11.8078570688933 | etot = -5.62847196821286 +825000 ekin = 2.83117167279191 | erot = 3.20152981062071 | epot = -11.6611734513667 | etot = -5.62847196795409 +826000 ekin = 2.72929448938322 | erot = 3.170212329904 | epot = -11.527978786985 | etot = -5.62847196769779 +827000 ekin = 2.64828540333971 | erot = 3.13564460905767 | epot = -11.4124019798381 | etot = -5.62847196744072 +828000 ekin = 2.59045268753837 | erot = 3.09968027827888 | epot = -11.3186049330108 | etot = -5.62847196719354 +829000 ekin = 2.5575674899745 | erot = 3.06454891988821 | epot = -11.2505883768447 | etot = -5.62847196698198 +830000 ekin = 2.55077388401548 | erot = 3.03254604807767 | epot = -11.2117918989325 | etot = -5.6284719668394 +831000 ekin = 2.57043726066164 | erot = 3.00566097392708 | epot = -11.2045702013875 | etot = -5.62847196679876 +832000 ekin = 2.61596871115982 | erot = 2.98524787868899 | epot = -11.2296885567312 | etot = -5.62847196688238 +833000 ekin = 2.68568117843713 | erot = 2.97182255605824 | epot = -11.2859757015904 | etot = -5.62847196709497 +834000 ekin = 2.77673678117253 | erot = 2.96502424236813 | epot = -11.370232990964 | etot = -5.62847196742337 +835000 ekin = 2.885220643029 | erot = 2.96372965115359 | epot = -11.4774222620224 | etot = -5.62847196783982 +836000 ekin = 3.00633984593918 | erot = 2.96626860460898 | epot = -11.6010804188574 | etot = -5.62847196830924 +837000 ekin = 3.13471078930649 | erot = 2.97067133176137 | epot = -11.7338540898654 | etot = -5.62847196879752 +838000 ekin = 3.26467977039692 | erot = 2.97489019017183 | epot = -11.868041929845 | etot = -5.62847196927627 +839000 ekin = 3.39062362172885 | erot = 2.97696578821289 | epot = -11.9960613796666 | etot = -5.62847196972483 +840000 ekin = 3.50719614226998 | erot = 2.9751377340059 | epot = -12.1108058464052 | etot = -5.6284719701293 +841000 ekin = 3.60951430438935 | erot = 2.96792302585542 | epot = -12.2059093007227 | etot = -5.62847197047788 +842000 ekin = 3.69330308375243 | erot = 2.95419217424765 | epot = -12.2759672287577 | etot = -5.62847197075763 +843000 ekin = 3.75502928062943 | erot = 2.93326272933342 | epot = -12.3167639809143 | etot = -5.62847197095144 +844000 ekin = 3.79205095751741 | erot = 2.905010032425 | epot = -12.3255329609822 | etot = -5.62847197103983 +845000 ekin = 3.8027882697654 | erot = 2.86997708288216 | epot = -12.3012373236517 | etot = -5.62847197100412 +846000 ekin = 3.78689078356818 | erot = 2.82944607124618 | epot = -12.2448088256482 | etot = -5.62847197083381 +847000 ekin = 3.7453492374313 | erot = 2.78543387885269 | epot = -12.1592550868164 | etot = -5.62847197053239 +848000 ekin = 3.68048960895024 | erot = 2.74058491120546 | epot = -12.0495464902778 | etot = -5.62847197012212 +849000 ekin = 3.59580402257809 | erot = 2.69795473374334 | epot = -11.9222307259669 | etot = -5.62847196964545 +850000 ekin = 3.49561210988706 | erot = 2.6606982620177 | epot = -11.7847823410607 | etot = -5.62847196915597 +851000 ekin = 3.38460421144088 | erot = 2.63169878902263 | epot = -11.6447749691747 | etot = -5.62847196871119 +852000 ekin = 3.26735834597144 | erot = 2.61319105400609 | epot = -11.5090213683379 | etot = -5.62847196836037 +853000 ekin = 3.14792970794091 | erot = 2.60644045891664 | epot = -11.3828421349899 | etot = -5.62847196813238 +854000 ekin = 3.02961721450397 | erot = 2.61155167654438 | epot = -11.2696408590751 | etot = -5.62847196802677 +855000 ekin = 2.91497870603335 | erot = 2.62749311856603 | epot = -11.1709437926219 | etot = -5.62847196802253 +856000 ekin = 2.80592683601258 | erot = 2.65229723485518 | epot = -11.0866960389482 | etot = -5.62847196808045 +857000 ekin = 2.70394323064281 | erot = 2.68342637105178 | epot = -11.0158415698526 | etot = -5.62847196815805 +858000 ekin = 2.6102808497471 | erot = 2.71820874437837 | epot = -10.9569615623474 | etot = -5.62847196822195 +859000 ekin = 2.52608469636932 | erot = 2.75423459858654 | epot = -10.9087912632103 | etot = -5.62847196825448 +860000 ekin = 2.45241725286413 | erot = 2.78962480120777 | epot = -10.8705140223255 | etot = -5.62847196825358 +861000 ekin = 2.39021948270796 | erot = 2.8231315035024 | epot = -10.8418229544392 | etot = -5.62847196822881 +862000 ekin = 2.34025129495234 | erot = 2.85407946396319 | epot = -10.8228027271118 | etot = -5.62847196819627 +863000 ekin = 2.30304188782341 | erot = 2.88219277654192 | epot = -10.8137066325389 | etot = -5.62847196817353 +864000 ekin = 2.27886006016584 | erot = 2.90737073895635 | epot = -10.8147027672985 | etot = -5.6284719681763 +865000 ekin = 2.26770197186021 | erot = 2.9294767749707 | epot = -10.8256507150445 | etot = -5.62847196821362 +866000 ekin = 2.26929189238761 | erot = 2.94819404266293 | epot = -10.8459579033382 | etot = -5.6284719682877 +867000 ekin = 2.28309242165747 | erot = 2.9629808932943 | epot = -10.8745452833439 | etot = -5.62847196839215 +868000 ekin = 2.30832281649049 | erot = 2.97313399109876 | epot = -10.9099287761031 | etot = -5.62847196851388 +869000 ekin = 2.34398135102351 | erot = 2.97793980541721 | epot = -10.9503931250775 | etot = -5.62847196863683 +870000 ekin = 2.38886744688628 | erot = 2.97686809818554 | epot = -10.9942075138189 | etot = -5.62847196874705 +871000 ekin = 2.44159861726723 | erot = 2.96974175415068 | epot = -11.0398123402555 | etot = -5.62847196883764 +872000 ekin = 2.5006196151775 | erot = 2.95681803681079 | epot = -11.0859096208989 | etot = -5.62847196891058 +873000 ekin = 2.56420808047572 | erot = 2.93874614045633 | epot = -11.131426189908 | etot = -5.62847196897592 +874000 ekin = 2.63049126930056 | erot = 2.91641905767842 | epot = -11.1753822960225 | etot = -5.62847196904347 +875000 ekin = 2.69749664352447 | erot = 2.89079068995882 | epot = -11.2167593025987 | etot = -5.62847196911544 +876000 ekin = 2.7632574078238 | erot = 2.86275138557266 | epot = -11.2544807625772 | etot = -5.62847196918073 +877000 ekin = 2.82597856972948 | erot = 2.83312911621945 | epot = -11.2875796551638 | etot = -5.62847196921485 +878000 ekin = 2.88426505940501 | erot = 2.80282960039437 | epot = -11.3155666289385 | etot = -5.62847196913916 +879000 ekin = 2.93899285403075 | erot = 2.77402557708719 | epot = -11.341490400032 | etot = -5.62847196891407 +880000 ekin = 2.99074429392039 | erot = 2.74904466360361 | epot = -11.3682609264686 | etot = -5.62847196894464 +881000 ekin = 3.03734868878526 | erot = 2.72816458054467 | epot = -11.3939852381131 | etot = -5.62847196878313 +882000 ekin = 3.07935286228137 | erot = 2.71303253487197 | epot = -11.4208573657697 | etot = -5.62847196861634 +883000 ekin = 3.11756796983936 | erot = 2.70517731822857 | epot = -11.4512172565507 | etot = -5.62847196848273 +884000 ekin = 3.15280252747556 | erot = 2.70569769589384 | epot = -11.4869721917774 | etot = -5.62847196840798 +885000 ekin = 3.1857161310425 | erot = 2.71504911530919 | epot = -11.5292372147568 | etot = -5.6284719684051 +886000 ekin = 3.21676773286079 | erot = 2.73290580052215 | epot = -11.5781455018622 | etot = -5.62847196847926 +887000 ekin = 3.24623562321836 | erot = 2.75806669093292 | epot = -11.6327742827852 | etot = -5.62847196863393 +888000 ekin = 3.27425941908945 | erot = 2.78837179663876 | epot = -11.6911031846009 | etot = -5.62847196887267 +889000 ekin = 3.30086478782363 | erot = 2.82064068483657 | epot = -11.7499774418536 | etot = -5.62847196919337 +890000 ekin = 3.32596924764569 | erot = 2.85071439963934 | epot = -11.8051556168602 | etot = -5.62847196957518 +891000 ekin = 3.34941253130769 | erot = 2.87373382370284 | epot = -11.8516183249749 | etot = -5.62847196996437 +892000 ekin = 3.37107523452355 | erot = 2.88476437059098 | epot = -11.8843115753886 | etot = -5.62847197027407 +893000 ekin = 3.39111184994124 | erot = 2.87974242684367 | epot = -11.8993262471909 | etot = -5.62847197040598 +894000 ekin = 3.41023212803652 | erot = 2.8565082945549 | epot = -11.8952123928825 | etot = -5.62847197029109 +895000 ekin = 3.42987730750782 | erot = 2.81553499448249 | epot = -11.8738842719177 | etot = -5.62847196992743 +896000 ekin = 3.45214148852512 | erot = 2.76001213104415 | epot = -11.8406255889559 | etot = -5.6284719693866 +897000 ekin = 3.47941735485478 | erot = 2.69521466357856 | epot = -11.8031039872188 | etot = -5.6284719687855 +898000 ekin = 3.51352961908184 | erot = 2.62737086720505 | epot = -11.7693724676977 | etot = -5.62847198141077 +899000 ekin = 3.48893911266076 | erot = 2.56291214053403 | epot = -11.680323222652 | etot = -5.62847196945724 +900000 ekin = 3.45535689186671 | erot = 2.55015985141027 | epot = -11.6339887056296 | etot = -5.62847196235264 +901000 ekin = 3.50186288044185 | erot = 2.58894159232131 | epot = -11.719276448543 | etot = -5.62847197577986 +902000 ekin = 3.56610213518761 | erot = 2.58196928593651 | epot = -11.7765433936784 | etot = -5.62847197255431 +903000 ekin = 3.62814875800469 | erot = 2.56232070296314 | epot = -11.8189414338963 | etot = -5.62847197292843 +904000 ekin = 3.69112394778049 | erot = 2.55247638362847 | epot = -11.8720723048244 | etot = -5.62847197341544 +905000 ekin = 3.75091280599787 | erot = 2.54985569625826 | epot = -11.9292404761802 | etot = -5.62847197392409 +906000 ekin = 3.80322506898643 | erot = 2.5519127236511 | epot = -11.9836097669886 | etot = -5.62847197435104 +907000 ekin = 3.84434229252392 | erot = 2.55683360398672 | epot = -12.0296478711203 | etot = -5.62847197460963 +908000 ekin = 3.87190064700258 | erot = 2.56394104631182 | epot = -12.0643136679727 | etot = -5.62847197465829 +909000 ekin = 3.88547927917161 | erot = 2.57365301016132 | epot = -12.0876042638463 | etot = -5.62847197451341 +910000 ekin = 3.88680451543638 | erot = 2.58702435581385 | epot = -12.1023008454879 | etot = -5.62847197423765 +911000 ekin = 3.87951720900323 | erot = 2.60508796153765 | epot = -12.1130771444529 | etot = -5.62847197391203 +912000 ekin = 3.86859234285051 | erot = 2.6282770120564 | epot = -12.1253413285184 | etot = -5.62847197361153 +913000 ekin = 3.85955913842215 | erot = 2.6561223476136 | epot = -12.1441534594285 | etot = -5.62847197339272 +914000 ekin = 3.85765974763148 | erot = 2.68725904601826 | epot = -12.1733907663377 | etot = -5.62847197268799 +915000 ekin = 3.86988559311568 | erot = 2.7215549575076 | epot = -12.2199125234873 | etot = -5.62847197286399 +916000 ekin = 3.89721211337583 | erot = 2.75899199497945 | epot = -12.2846760816252 | etot = -5.62847197326989 +917000 ekin = 3.93597306382139 | erot = 2.79756616351325 | epot = -12.3620112010443 | etot = -5.62847197370963 +918000 ekin = 3.98211349575359 | erot = 2.83523643597917 | epot = -12.4458219058878 | etot = -5.62847197415502 +919000 ekin = 4.0310988413113 | erot = 2.86939982884348 | epot = -12.5289706457395 | etot = -5.62847197558473 +920000 ekin = 4.07575006630221 | erot = 2.8920345905181 | epot = -12.5962566327231 | etot = -5.62847197590279 +921000 ekin = 4.11121319932131 | erot = 2.89963705731785 | epot = -12.6393222332815 | etot = -5.6284719766423 +922000 ekin = 4.12946328880359 | erot = 2.89101491261155 | epot = -12.6489501783288 | etot = -5.62847197691366 +923000 ekin = 4.12574551399895 | erot = 2.86656720034022 | epot = -12.6207846912381 | etot = -5.62847197689889 +924000 ekin = 4.09806255499934 | erot = 2.82817436998195 | epot = -12.5547089016171 | etot = -5.62847197663584 +925000 ekin = 4.04683812907195 | erot = 2.77889166113215 | epot = -12.4542017664276 | etot = -5.62847197622352 +926000 ekin = 3.9741598071628 | erot = 2.72240485625824 | epot = -12.3250366391895 | etot = -5.62847197576843 +927000 ekin = 3.88290109531157 | erot = 2.66247239581552 | epot = -12.1738454664594 | etot = -5.62847197533235 +928000 ekin = 3.77619172587496 | erot = 2.60258197321272 | epot = -12.007245674 | etot = -5.62847197491228 +929000 ekin = 3.65741733995828 | erot = 2.54590496396654 | epot = -11.8317942783889 | etot = -5.62847197446407 +930000 ekin = 3.53056331476223 | erot = 2.49545263583675 | epot = -11.6544879245446 | etot = -5.62847197394562 +931000 ekin = 3.40054526036958 | erot = 2.454292850088 | epot = -11.4833100834926 | etot = -5.62847197303497 +932000 ekin = 3.27351307449314 | erot = 2.42812143003077 | epot = -11.3301064771605 | etot = -5.62847197263661 +933000 ekin = 3.15479412952287 | erot = 2.42017428897891 | epot = -11.2034403907363 | etot = -5.6284719722345 +934000 ekin = 3.04934557327986 | erot = 2.43124949901271 | epot = -11.1090670441748 | etot = -5.6284719718822 +935000 ekin = 2.96178382811955 | erot = 2.46165171647534 | epot = -11.0519075162191 | etot = -5.6284719716242 +936000 ekin = 2.89581269435064 | erot = 2.51113391226312 | epot = -11.0354185780997 | etot = -5.62847197148598 +937000 ekin = 2.85385879521477 | erot = 2.5788978601731 | epot = -11.0612286268601 | etot = -5.62847197147222 +938000 ekin = 2.83694342968555 | erot = 2.66364816084931 | epot = -11.1290635621066 | etot = -5.62847197157179 +939000 ekin = 2.8447669618157 | erot = 2.76369076548276 | epot = -11.2369296990579 | etot = -5.6284719717594 +940000 ekin = 2.87595320398489 | erot = 2.87707537672681 | epot = -11.3815005527126 | etot = -5.62847197200085 +941000 ekin = 2.92838858062242 | erot = 3.00178159504245 | epot = -11.5586421479226 | etot = -5.62847197225776 +942000 ekin = 2.99958691393785 | erot = 3.13593595264418 | epot = -11.763994839077 | etot = -5.62847197249495 +943000 ekin = 3.08701485998667 | erot = 3.27802583837004 | epot = -11.9935126710428 | etot = -5.62847197268611 +944000 ekin = 3.18658687127494 | erot = 3.42629435546356 | epot = -12.2413532006333 | etot = -5.62847197389484 +945000 ekin = 3.29120912096008 | erot = 3.57701253266348 | epot = -12.4966936280386 | etot = -5.62847197441502 +946000 ekin = 3.39621217387283 | erot = 3.72637389250492 | epot = -12.7510580413859 | etot = -5.62847197500814 +947000 ekin = 3.49687303106183 | erot = 3.86977321079429 | epot = -12.9951182175547 | etot = -5.62847197569856 +948000 ekin = 3.5882721126636 | erot = 4.00151346862098 | epot = -13.2182575577724 | etot = -5.62847197648783 +949000 ekin = 3.6653664552767 | erot = 4.11475106154221 | epot = -13.4085894941589 | etot = -5.62847197733996 +950000 ekin = 3.72323942060722 | erot = 4.20180191857631 | epot = -13.5535133173567 | etot = -5.62847197817321 +951000 ekin = 3.75754185748942 | erot = 4.25489778354693 | epot = -13.6409116199026 | etot = -5.62847197886623 +952000 ekin = 3.76507381751897 | erot = 4.26734583724678 | epot = -13.6608916340473 | etot = -5.62847197928153 +953000 ekin = 3.74438822476976 | erot = 4.23487585588452 | epot = -13.6077360599562 | etot = -5.62847197930195 +954000 ekin = 3.69625243059747 | erot = 4.15681815457844 | epot = -13.4815425640462 | etot = -5.62847197887032 +955000 ekin = 3.62380420360442 | erot = 4.03673171811831 | epot = -13.2890078997362 | etot = -5.62847197801344 +956000 ekin = 3.52555336959638 | erot = 3.88073805299061 | epot = -13.0347634022312 | etot = -5.62847197964419 +957000 ekin = 3.39894639330823 | erot = 3.70474137854761 | epot = -12.7321597464425 | etot = -5.62847197458665 +958000 ekin = 3.2778287962513 | erot = 3.53760737359561 | epot = -12.4439081428104 | etot = -5.62847197296348 +959000 ekin = 3.17835028752465 | erot = 3.38602207731699 | epot = -12.192844339659 | etot = -5.62847197481739 +960000 ekin = 3.09019088023733 | erot = 3.23509493662461 | epot = -11.9537577933203 | etot = -5.62847197645838 +961000 ekin = 3.00426259422371 | erot = 3.08248133730568 | epot = -11.7152159070792 | etot = -5.62847197554984 +962000 ekin = 2.92693480018163 | erot = 2.94805481000622 | epot = -11.5034615855242 | etot = -5.62847197533634 +963000 ekin = 2.85972055666779 | erot = 2.83488454642881 | epot = -11.3230770781276 | etot = -5.62847197503098 +964000 ekin = 2.80427359464354 | erot = 2.74583973223602 | epot = -11.1785853017319 | etot = -5.62847197485232 +965000 ekin = 2.76170822000418 | erot = 2.6824982618152 | epot = -11.0726784566179 | etot = -5.62847197479852 +966000 ekin = 2.73254763820421 | erot = 2.64503833024941 | epot = -11.0060579433305 | etot = -5.62847197487692 +967000 ekin = 2.71665521986808 | erot = 2.63218922349628 | epot = -10.9773164184569 | etot = -5.62847197509256 +968000 ekin = 2.71315992305503 | erot = 2.64124364138656 | epot = -10.9828755398736 | etot = -5.628471975432 +969000 ekin = 2.72046614449804 | erot = 2.66825860562603 | epot = -11.0171967259813 | etot = -5.62847197585726 +970000 ekin = 2.73639578787687 | erot = 2.70848274022997 | epot = -11.0733505044214 | etot = -5.62847197631454 +971000 ekin = 2.75849382982785 | erot = 2.75695664055477 | epot = -11.1439224470463 | etot = -5.62847197666365 +972000 ekin = 2.78540546107908 | erot = 2.80984083598288 | epot = -11.2237182739984 | etot = -5.62847197693641 +973000 ekin = 2.81581408705481 | erot = 2.8641270459728 | epot = -11.3084131101486 | etot = -5.62847197712097 +974000 ekin = 2.84847994907229 | erot = 2.91762904123098 | epot = -11.3945809675143 | etot = -5.62847197721108 +975000 ekin = 2.88260770588557 | erot = 2.96920774049662 | epot = -11.4802874235912 | etot = -5.628471977209 +976000 ekin = 2.90702474670332 | erot = 3.01964918873866 | epot = -11.5551459370364 | etot = -5.62847200159446 +977000 ekin = 2.82994037756718 | erot = 3.10467594425335 | epot = -11.5630882996782 | etot = -5.62847197785768 +978000 ekin = 2.82908361957399 | erot = 3.22546638560003 | epot = -11.6830220089 | etot = -5.62847200372599 +979000 ekin = 2.83706100119285 | erot = 3.25481873167595 | epot = -11.7203517229612 | etot = -5.62847199009245 +980000 ekin = 2.83601345146519 | erot = 3.27042511685006 | epot = -11.734910558443 | etot = -5.62847199012775 +981000 ekin = 2.8267946753128 | erot = 3.27908746205001 | epot = -11.734354127532 | etot = -5.62847199016915 +982000 ekin = 2.80889457113572 | erot = 3.28090658484328 | epot = -11.7182731461926 | etot = -5.62847199021359 +983000 ekin = 2.78208898690996 | erot = 3.27578647285559 | epot = -11.6863474500053 | etot = -5.62847199023975 +984000 ekin = 2.74660136941676 | erot = 3.26353952517299 | epot = -11.6386128848025 | etot = -5.62847199021277 +985000 ekin = 2.70333214491802 | erot = 3.24411391112877 | epot = -11.5759180461426 | etot = -5.62847199009581 +986000 ekin = 2.65408912818262 | erot = 3.21786526569146 | epot = -11.5004263837359 | etot = -5.62847198986182 +987000 ekin = 2.57871631806181 | erot = 3.17247278925066 | epot = -11.379661101659 | etot = -5.6284719943465 +988000 ekin = 2.53018926628772 | erot = 3.15315340922985 | epot = -11.3118146774823 | etot = -5.62847200196471 +989000 ekin = 2.49566278276619 | erot = 3.12952117455027 | epot = -11.2536559492687 | etot = -5.62847199195226 +990000 ekin = 2.46227182566735 | erot = 3.09741757842189 | epot = -11.1881613954863 | etot = -5.62847199139711 +991000 ekin = 2.44592299301859 | erot = 3.07158095066895 | epot = -11.145975934822 | etot = -5.62847199113442 +992000 ekin = 2.45174281613824 | erot = 3.05611048522941 | epot = -11.136325292302 | etot = -5.62847199093431 +993000 ekin = 2.48099671727936 | erot = 3.05281518215591 | epot = -11.162283890216 | etot = -5.62847199078072 +994000 ekin = 2.53415670276316 | erot = 3.0635915446707 | epot = -11.2262202381289 | etot = -5.62847199069507 +995000 ekin = 2.61088853346932 | erot = 3.09015398642358 | epot = -11.3295145105799 | etot = -5.628471990687 +996000 ekin = 2.71011819731123 | erot = 3.1337829879375 | epot = -11.4723731760072 | etot = -5.62847199075848 +997000 ekin = 2.83015603322162 | erot = 3.1951526780947 | epot = -11.6537807022256 | etot = -5.62847199090924 +998000 ekin = 2.96878571667283 | erot = 3.27423191452594 | epot = -11.8714896223473 | etot = -5.62847199114848 +999000 ekin = 3.12322522699825 | erot = 3.37022004817017 | epot = -12.121917266671 | etot = -5.62847199150257 +1000000 ekin = 3.28990650587599 | erot = 3.48146010802176 | epot = -12.3998386059123 | etot = -5.6284719920145 + 1000000 0.14621807 -0.83009398 0.055104069 -0.56937076 4.8223734e-05 64000 +Loop time of 19.2323 on 4 procs for 1000000 steps with 16 atoms + +Performance: 44924.345 tau/day, 51995.770 timesteps/s +99.6% CPU use with 4 MPI tasks x no OpenMP threads + +MPI task timing breakdown: +Section | min time | avg time | max time |%varavg| %total +--------------------------------------------------------------- +Pair | 9.9775 | 11.825 | 13.857 | 45.0 | 61.49 +Bond | 0.34359 | 0.40765 | 0.52939 | 11.3 | 2.12 +Neigh | 0.009519 | 0.0095805 | 0.00962 | 0.0 | 0.05 +Comm | 2.1953 | 2.2903 | 2.3673 | 5.1 | 11.91 +Output | 0.098605 | 0.10311 | 0.11259 | 1.7 | 0.54 +Modify | 0.73813 | 0.826 | 0.91112 | 9.1 | 4.29 +Other | | 3.771 | | | 19.61 + +Nlocal: 4.00000 ave 4 max 4 min +Histogram: 4 0 0 0 0 0 0 0 0 0 +Nghost: 12.0000 ave 12 max 12 min +Histogram: 4 0 0 0 0 0 0 0 0 0 +Neighs: 49.5000 ave 50 max 48 min +Histogram: 1 0 0 0 0 0 0 0 0 3 + +Total # of neighbors = 198 +Ave neighs/atom = 12.375000 +Ave special neighs/atom = 3.7500000 +Neighbor list builds = 1000 +Dangerous builds = 0 + +write_data last_config.${number}.* nocoeff +write_data last_config.2.* nocoeff +System init for write_data ... +Total wall time: 0:00:19 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/data.duplex4 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/data.duplex4 deleted file mode 100644 index 72872d431a..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/data.duplex4 +++ /dev/null @@ -1,96 +0,0 @@ -# LAMMPS data file -16 atoms -16 ellipsoids -13 bonds - -4 atom types -1 bond types - -# System size --20.000000 20.000000 xlo xhi --20.000000 20.000000 ylo yhi --20.000000 20.000000 zlo zhi - -Masses - -1 3.1575 -2 3.1575 -3 3.1575 -4 3.1575 - -# Atom-ID, type, position, molecule-ID, ellipsoid flag, density -Atoms - -1 1 -6.000000000000001e-01 0.000000000000000e+00 0.000000000000000e+00 1 1 1 -2 2 -4.860249842674776e-01 -3.518234140414736e-01 3.897628551303122e-01 1 1 1 -3 3 -1.874009511073395e-01 -5.699832309147915e-01 7.795257102606244e-01 1 1 1 -4 4 1.824198365552941e-01 -5.715968887521518e-01 1.169288565390937e+00 1 1 1 -5 1 4.829362784135484e-01 -3.560513319622209e-01 1.559051420521249e+00 1 1 1 -6 2 5.999771538385027e-01 -5.235921299024461e-03 1.948814275651561e+00 1 1 1 -7 3 4.890766774371325e-01 3.475687034056071e-01 2.338577130781873e+00 1 1 1 -8 4 1.923677943514057e-01 5.683261666476170e-01 2.728339985912185e+00 1 1 1 -9 1 -1.923677943514057e-01 -5.683261666476170e-01 2.728339985912185e+00 2 1 1 -10 2 -4.890766774371324e-01 -3.475687034056071e-01 2.338577130781873e+00 2 1 1 -11 3 -5.999771538385025e-01 5.235921299024461e-03 1.948814275651561e+00 2 1 1 -12 4 -4.829362784135481e-01 3.560513319622207e-01 1.559051420521249e+00 2 1 1 -13 1 -1.824198365552940e-01 5.715968887521514e-01 1.169288565390936e+00 2 1 1 -14 2 1.874009511073395e-01 5.699832309147912e-01 7.795257102606241e-01 2 1 1 -15 3 4.860249842674773e-01 3.518234140414733e-01 3.897628551303119e-01 2 1 1 -16 4 5.999999999999995e-01 -3.330669073875470e-17 -3.330669073875470e-16 2 1 1 - -# Atom-ID, translational velocity, angular momentum -Velocities - -1 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -3 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -4 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -5 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -6 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -7 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -8 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -9 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -10 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -11 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -12 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -13 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -14 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -15 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -16 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 - -# Atom-ID, shape, quaternion -Ellipsoids - -1 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 1.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 -2 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 9.513258223252946e-01 0.000000000000000e+00 0.000000000000000e+00 3.081869234362515e-01 -3 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 8.100416404457962e-01 0.000000000000000e+00 0.000000000000000e+00 5.863723567357894e-01 -4 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.899012371043606e-01 0.000000000000000e+00 0.000000000000000e+00 8.074754054847398e-01 -5 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 3.123349185122326e-01 0.000000000000000e+00 0.000000000000000e+00 9.499720515246527e-01 -6 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 4.363309284746654e-03 0.000000000000000e+00 0.000000000000000e+00 9.999904807207346e-01 -7 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -3.040330609254902e-01 0.000000000000000e+00 0.000000000000000e+00 9.526614812535865e-01 -8 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 5.828323126827837e-01 0.000000000000000e+00 0.000000000000000e+00 -8.125924533816677e-01 -9 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.125924533816681e-01 5.828323126827832e-01 -0.000000000000000e+00 -10 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.526614812535864e-01 3.040330609254902e-01 0.000000000000000e+00 -11 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.999904807207346e-01 -4.363309284746654e-03 0.000000000000000e+00 -12 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 9.499720515246526e-01 -3.123349185122325e-01 0.000000000000000e+00 -13 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 8.074754054847402e-01 -5.899012371043603e-01 0.000000000000000e+00 -14 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 0.000000000000000e+00 5.863723567357898e-01 -8.100416404457959e-01 0.000000000000000e+00 -15 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 -3.081869234362514e-01 9.513258223252948e-01 0.000000000000000e+00 -16 1.173984503142341e+00 1.173984503142341e+00 1.173984503142341e+00 -0.000000000000000e+00 2.775557561562893e-17 1.000000000000000e+00 -0.000000000000000e+00 - -# Bond topology -Bonds - -1 1 1 2 -2 1 2 3 -3 1 3 4 -4 1 4 5 -5 1 5 6 -6 1 6 7 -7 1 7 8 -8 1 9 10 -9 1 10 11 -10 1 11 12 -11 1 13 14 -12 1 14 15 -13 1 15 16 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.1 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.1 deleted file mode 100644 index 02c9ec0d52..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.1 +++ /dev/null @@ -1,1183 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 4 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex4 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 1 by 1 MPI processor grid - reading atoms ... - 16 atoms - reading velocities ... - 16 velocities - 16 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 13 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - read_data CPU = 0.002 seconds - -set atom * mass 3.1575 - 16 settings made for mass - -group all type 1 4 -16 atoms in group all - -# oxRNA2 bond interactions - FENE backbone -bond_style oxrna2/fene -bond_coeff * 2.0 0.25 0.761070781051 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxRNA2 pair interactions -pair_style hybrid/overlay oxrna2/excv oxrna2/stk oxrna2/hbond oxrna2/xstk oxrna2/coaxstk oxrna2/dh - -pair_coeff * * oxrna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxrna2/stk seqdep ${T} 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 -pair_coeff * * oxrna2/stk seqdep 0.1 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 -pair_coeff * * oxrna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 3 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxrna2/xstk 59.9626 0.5 0.6 0.42 0.58 2.25 0.505 0.58 1.7 1.266 0.68 1.7 1.266 0.68 1.7 0.309 0.68 1.7 0.309 0.68 -pair_coeff * * oxrna2/coaxstk 80 0.5 0.6 0.42 0.58 2.0 2.592 0.65 1.3 0.151 0.8 0.9 0.685 0.95 0.9 0.685 0.95 2.0 -0.65 2.0 -0.65 -pair_coeff * * oxrna2/dh ${T} 0.5 1.02455 -pair_coeff * * oxrna2/dh 0.1 0.5 1.02455 - -# NVE ensemble -#fix 1 all nve/dotc/langevin 0.1 0.1 0.03 457145 angmom 10 -#fix 1 all nve/dot -fix 1 all nve/asphere - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 3.3014979 - ghost atom cutoff = 3.3014979 - binsize = 1.650749, bins = 25 25 25 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxrna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxrna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxrna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxrna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxrna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxrna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 3.3014979169291987 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -13.282537590974 | etot = -13.282537590974 -Per MPI rank memory allocation (min/avg/max) = 8.071 | 8.071 | 8.071 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -0.84341458 0.013255977 -0.8301586 -2.0169485e-05 -1000 ekin = 0.00448503054656468 | erot = 0.00825381229611384 | epot = -13.2952764343122 | etot = -13.2825375914695 -2000 ekin = 0.0179027901180511 | erot = 0.0327684151335467 | epot = -13.3332087967732 | etot = -13.2825375915216 -3000 ekin = 0.0401478317723584 | erot = 0.0728240143066062 | epot = -13.3955094376815 | etot = -13.2825375916026 -4000 ekin = 0.0710654348932282 | erot = 0.127292706283096 | epot = -13.4808957328808 | etot = -13.2825375917044 -5000 ekin = 0.110480309743662 | erot = 0.194739074279834 | epot = -13.5877569758405 | etot = -13.282537591817 -6000 ekin = 0.158231230694432 | erot = 0.273546913858903 | epot = -13.7143157364827 | etot = -13.2825375919294 -7000 ekin = 0.214206450831754 | erot = 0.362058396901232 | epot = -13.8588024397642 | etot = -13.2825375920312 -8000 ekin = 0.278374111850069 | erot = 0.458709556672181 | epot = -14.0196212606361 | etot = -13.2825375921138 -9000 ekin = 0.35080209403022 | erot = 0.562145629088178 | epot = -14.1954853152903 | etot = -13.2825375921719 -10000 ekin = 0.431663021447766 | erot = 0.671302139462136 | epot = -14.385502753114 | etot = -13.2825375922041 -11000 ekin = 0.521222365620265 | erot = 0.78544264622411 | epot = -14.5892026040572 | etot = -13.2825375922128 -12000 ekin = 0.61981039873542 | erot = 0.904150888366026 | epot = -14.8064988793055 | etot = -13.2825375922041 -13000 ekin = 0.72778153179885 | erot = 1.02728222251243 | epot = -15.0376013464974 | etot = -13.2825375921861 -14000 ekin = 0.845466747659446 | erot = 1.154885201864 | epot = -15.2828895416915 | etot = -13.2825375921681 -15000 ekin = 0.973515286429446 | erot = 1.28640002432487 | epot = -15.5424529041413 | etot = -13.2825375933869 -16000 ekin = 1.12323013751098 | erot = 1.40387495398598 | epot = -15.8096426839256 | etot = -13.2825375924286 -17000 ekin = 1.2976927283263 | erot = 1.51347784068661 | epot = -16.0937081607397 | etot = -13.2825375917268 -18000 ekin = 1.48565191084531 | erot = 1.63592970999661 | epot = -16.4041192134347 | etot = -13.2825375925928 -19000 ekin = 1.66750911163348 | erot = 1.77940241938721 | epot = -16.7294491246368 | etot = -13.2825375936161 -20000 ekin = 1.84148924290423 | erot = 1.93695511183687 | epot = -17.0609819484057 | etot = -13.2825375936646 -21000 ekin = 2.02307741366163 | erot = 2.09844265792961 | epot = -17.4040576653939 | etot = -13.2825375938027 -22000 ekin = 2.21183606977224 | erot = 2.26260708947302 | epot = -17.7569807531587 | etot = -13.2825375939134 -23000 ekin = 2.40735468792977 | erot = 2.42817202047308 | epot = -18.1180643024997 | etot = -13.2825375940968 -24000 ekin = 2.60896890448861 | erot = 2.59357882573853 | epot = -18.485085324508 | etot = -13.2825375942809 -25000 ekin = 2.81580135477345 | erot = 2.75706655667055 | epot = -18.855405505957 | etot = -13.282537594513 -26000 ekin = 3.02680083558485 | erot = 2.91667946897257 | epot = -19.2260178993271 | etot = -13.2825375947697 -27000 ekin = 3.24067707260308 | erot = 3.07027299756498 | epot = -19.5934876652175 | etot = -13.2825375950495 -28000 ekin = 3.45601412953572 | erot = 3.21560615188039 | epot = -19.9541578767293 | etot = -13.2825375953132 -29000 ekin = 3.6713683081319 | erot = 3.35037905822946 | epot = -20.304284961999 | etot = -13.2825375956376 -30000 ekin = 3.88476027224393 | erot = 3.47208481891837 | epot = -20.639382687185 | etot = -13.2825375960227 -31000 ekin = 4.09387957878895 | erot = 3.57821385032035 | epot = -20.9546310254509 | etot = -13.2825375963416 -32000 ekin = 4.29662185345806 | erot = 3.66648606531138 | epot = -21.2456455154186 | etot = -13.2825375966492 -33000 ekin = 4.49089153394062 | erot = 3.73482555362569 | epot = -21.5082546845018 | etot = -13.2825375969355 -34000 ekin = 4.67464118182276 | erot = 3.78142516888995 | epot = -21.738603947901 | etot = -13.2825375971883 -35000 ekin = 4.84586411782047 | erot = 3.80480460777895 | epot = -21.9332063229962 | etot = -13.2825375973967 -36000 ekin = 5.00270940487365 | erot = 3.8039453503275 | epot = -22.0891923527593 | etot = -13.2825375975582 -37000 ekin = 5.14355281474259 | erot = 3.7783370953036 | epot = -22.204427507712 | etot = -13.2825375976658 -38000 ekin = 5.26699752588855 | erot = 3.72801268545693 | epot = -22.2775478090594 | etot = -13.2825375977139 -39000 ekin = 5.37191151713863 | erot = 3.65359747923659 | epot = -22.3080465940736 | etot = -13.2825375976984 -40000 ekin = 5.45746010972423 | erot = 3.55633701588595 | epot = -22.2963347232305 | etot = -13.2825375976203 -41000 ekin = 5.52312188621308 | erot = 3.43809872369854 | epot = -22.2437582073842 | etot = -13.2825375974726 -42000 ekin = 5.56872044211992 | erot = 3.30135279333163 | epot = -22.1526108327155 | etot = -13.2825375972639 -43000 ekin = 5.59443660082917 | erot = 3.14910305123731 | epot = -22.0260772490691 | etot = -13.2825375970026 -44000 ekin = 5.60078634437692 | erot = 2.98477133565124 | epot = -21.8680952767294 | etot = -13.2825375967012 -45000 ekin = 5.58859564323333 | erot = 2.81204277265316 | epot = -21.6831760122617 | etot = -13.2825375963752 -46000 ekin = 5.55896198288794 | erot = 2.63469562167501 | epot = -21.4761952006007 | etot = -13.2825375960378 -47000 ekin = 5.51320424221946 | erot = 2.45646420183046 | epot = -21.2522060397483 | etot = -13.2825375956984 -48000 ekin = 5.45280176988517 | erot = 2.28095947573118 | epot = -21.0162988409769 | etot = -13.2825375953605 -49000 ekin = 5.37933239946638 | erot = 2.11161440403257 | epot = -20.7734843985446 | etot = -13.2825375950457 -50000 ekin = 5.29440598595185 | erot = 1.95156309993188 | epot = -20.5285066806346 | etot = -13.2825375947508 -51000 ekin = 5.19960275040233 | erot = 1.8036634398305 | epot = -20.2858037847152 | etot = -13.2825375944824 -52000 ekin = 5.0964231996195 | erot = 1.67046877096987 | epot = -20.0494295648281 | etot = -13.2825375942387 -53000 ekin = 4.9862463955433 | erot = 1.55427111116831 | epot = -19.8230551007329 | etot = -13.2825375940213 -54000 ekin = 4.87030445561499 | erot = 1.45710469956877 | epot = -19.6099467490156 | etot = -13.2825375938318 -55000 ekin = 4.74966978520139 | erot = 1.38074642902068 | epot = -19.4129538078748 | etot = -13.2825375936527 -56000 ekin = 4.62525646670949 | erot = 1.32681969001207 | epot = -19.234613750249 | etot = -13.2825375935274 -57000 ekin = 4.49783496228224 | erot = 1.29648861711347 | epot = -19.0768611728237 | etot = -13.282537593428 -58000 ekin = 4.36805832461578 | erot = 1.29057331365797 | epot = -18.9411692316276 | etot = -13.2825375933539 -59000 ekin = 4.2364904586051 | erot = 1.30961007130951 | epot = -18.8286381232177 | etot = -13.2825375933031 -60000 ekin = 4.10363649615144 | erot = 1.35385055377169 | epot = -18.7400246431963 | etot = -13.2825375932731 -61000 ekin = 3.96997203629753 | erot = 1.42326526715546 | epot = -18.6757748967158 | etot = -13.2825375932628 -62000 ekin = 3.83612285735248 | erot = 1.51750909475431 | epot = -18.63616954536 | etot = -13.2825375932532 -63000 ekin = 3.70275913153266 | erot = 1.63593500305368 | epot = -18.6212317278745 | etot = -13.2825375932882 -64000 ekin = 3.57028395426058 | erot = 1.77765695762491 | epot = -18.6304785052259 | etot = -13.2825375933404 -65000 ekin = 3.43939724701796 | erot = 1.94136642645393 | epot = -18.6633012668467 | etot = -13.2825375933748 -66000 ekin = 3.31090885650418 | erot = 2.12543845180125 | epot = -18.7188849017627 | etot = -13.2825375934573 -67000 ekin = 3.18539537800071 | erot = 2.32812634152943 | epot = -18.7960593130806 | etot = -13.2825375935505 -68000 ekin = 3.0635338653798 | erot = 2.54742667497606 | epot = -18.8934981340101 | etot = -13.2825375936542 -69000 ekin = 2.94609585152078 | erot = 2.78109018587171 | epot = -19.0097236311617 | etot = -13.2825375937692 -70000 ekin = 2.83393040716448 | erot = 3.02662959649683 | epot = -19.1430975975577 | etot = -13.2825375938964 -71000 ekin = 2.72793726696335 | erot = 3.2813399428617 | epot = -19.2918148038566 | etot = -13.2825375940315 -72000 ekin = 2.62902971043607 | erot = 3.54239819983169 | epot = -19.4539655044244 | etot = -13.2825375941566 -73000 ekin = 2.53808722042867 | erot = 3.80701983458538 | epot = -19.6276446493623 | etot = -13.2825375943483 -74000 ekin = 2.455928655269 | erot = 4.07171344127425 | epot = -19.8101796911565 | etot = -13.2825375946133 -75000 ekin = 2.3833072864543 | erot = 4.33220600221137 | epot = -19.9980508835341 | etot = -13.2825375948685 -76000 ekin = 2.32085819246822 | erot = 4.58430888321152 | epot = -20.1877046708087 | etot = -13.2825375951289 -77000 ekin = 2.26905284041982 | erot = 4.82394209159272 | epot = -20.3755325274045 | etot = -13.2825375953919 -78000 ekin = 2.2281821557978 | erot = 5.04720004762901 | epot = -20.5579197990814 | etot = -13.2825375956545 -79000 ekin = 2.19835990746566 | erot = 5.25044819004335 | epot = -20.731345693396 | etot = -13.282537595887 -80000 ekin = 2.17954213158759 | erot = 5.43056087724128 | epot = -20.892640604912 | etot = -13.2825375960832 -81000 ekin = 2.17154912845093 | erot = 5.58515654974166 | epot = -21.0392432744259 | etot = -13.2825375962333 -82000 ekin = 2.17396051633407 | erot = 5.7125507021892 | epot = -21.1690488148909 | etot = -13.2825375963676 -83000 ekin = 2.18608268543525 | erot = 5.81159389139857 | epot = -21.2802141733998 | etot = -13.282537596566 -84000 ekin = 2.2069405579712 | erot = 5.88143457462831 | epot = -21.3709127292228 | etot = -13.2825375966233 -85000 ekin = 2.2355007346892 | erot = 5.92248473361667 | epot = -21.440523064944 | etot = -13.2825375966382 -86000 ekin = 2.27071025957252 | erot = 5.93583657914492 | epot = -21.4890844353356 | etot = -13.2825375966181 -87000 ekin = 2.31151705668581 | erot = 5.92306118835155 | epot = -21.5171158416081 | etot = -13.2825375965708 -88000 ekin = 2.35689880582412 | erot = 5.88606517856673 | epot = -21.525501580893 | etot = -13.2825375965021 -89000 ekin = 2.40589192121148 | erot = 5.82697176767419 | epot = -21.5154012853016 | etot = -13.2825375964159 -90000 ekin = 2.45762089189535 | erot = 5.74803678246179 | epot = -21.4881952706708 | etot = -13.2825375963137 -91000 ekin = 2.51132727735695 | erot = 5.65159908896414 | epot = -21.4454639625169 | etot = -13.2825375961958 -92000 ekin = 2.56639616299259 | erot = 5.54005576567966 | epot = -21.3889895247342 | etot = -13.282537596062 -93000 ekin = 2.62237587147962 | erot = 5.41584923925671 | epot = -21.3207627066499 | etot = -13.2825375959136 -94000 ekin = 2.67898536287491 | erot = 5.28145076624188 | epot = -21.2429737248702 | etot = -13.2825375957534 -95000 ekin = 2.73610698777088 | erot = 5.13933222478715 | epot = -21.1579768081439 | etot = -13.2825375955858 -96000 ekin = 2.79376736409348 | erot = 4.991923519611 | epot = -21.0682284791224 | etot = -13.2825375954179 -97000 ekin = 2.8520975917789 | erot = 4.84155102931962 | epot = -20.9761862163567 | etot = -13.2825375952582 -98000 ekin = 2.91128043087791 | erot = 4.69036811429532 | epot = -20.8841861402883 | etot = -13.2825375951151 -99000 ekin = 2.97148865716348 | erot = 4.54028690688379 | epot = -20.7943131590444 | etot = -13.2825375949971 -100000 ekin = 3.03281936548472 | erot = 4.39291958377954 | epot = -20.7082765441749 | etot = -13.2825375949107 -101000 ekin = 3.09523162855504 | erot = 4.24953761553679 | epot = -20.6273068389522 | etot = -13.2825375948604 -102000 ekin = 3.15849350649721 | erot = 4.11105261279871 | epot = -20.5520837141442 | etot = -13.2825375948483 -103000 ekin = 3.22212928739638 | erot = 3.97803233781106 | epot = -20.4826992200828 | etot = -13.2825375948753 -104000 ekin = 3.28539028419999 | erot = 3.85073569994574 | epot = -20.4186635790808 | etot = -13.2825375949351 -105000 ekin = 3.34731475817757 | erot = 3.72912316717803 | epot = -20.3589755203793 | etot = -13.2825375950237 -106000 ekin = 3.4067279473086 | erot = 3.61292637549551 | epot = -20.3021919179394 | etot = -13.2825375951353 -107000 ekin = 3.46228544964883 | erot = 3.5017039548605 | epot = -20.246526999772 | etot = -13.2825375952626 -108000 ekin = 3.51253156080077 | erot = 3.39489824023761 | epot = -20.1899673964364 | etot = -13.2825375953981 -109000 ekin = 3.55597480315873 | erot = 3.29187299703765 | epot = -20.1303853957321 | etot = -13.2825375955357 -110000 ekin = 3.59118238705146 | erot = 3.19193918351245 | epot = -20.0656591662303 | etot = -13.2825375956664 -111000 ekin = 3.61687343778638 | erot = 3.09439958031605 | epot = -19.9938106138842 | etot = -13.2825375957818 -112000 ekin = 3.63202144077084 | erot = 2.99858073408885 | epot = -19.9131397707328 | etot = -13.2825375958731 -113000 ekin = 3.63595677604976 | erot = 2.9038679642207 | epot = -19.8223623362017 | etot = -13.2825375959313 -114000 ekin = 3.62846110509018 | erot = 2.80974594394126 | epot = -19.7207446449798 | etot = -13.2825375959483 -115000 ekin = 3.60984333606122 | erot = 2.71584476484558 | epot = -19.6082256968244 | etot = -13.2825375959176 -116000 ekin = 3.58098592946299 | erot = 2.62198860618916 | epot = -19.4855121314887 | etot = -13.2825375958366 -117000 ekin = 3.54334240221404 | erot = 2.52827901424375 | epot = -19.3541590121477 | etot = -13.2825375956899 -118000 ekin = 3.49891828359516 | erot = 2.43512420844403 | epot = -19.216580087547 | etot = -13.2825375955078 -119000 ekin = 3.45018316481891 | erot = 2.34313144179019 | epot = -19.0758522018958 | etot = -13.2825375952867 -120000 ekin = 3.39991853306434 | erot = 2.25319419875649 | epot = -18.9356503268596 | etot = -13.2825375950388 -121000 ekin = 3.3510515204902 | erot = 2.16646597387207 | epot = -18.800055089141 | etot = -13.2825375947787 -122000 ekin = 3.30648176977496 | erot = 2.08430580540005 | epot = -18.6733251696956 | etot = -13.2825375945206 -123000 ekin = 3.26892966156092 | erot = 2.00820635396395 | epot = -18.5596736098009 | etot = -13.282537594276 -124000 ekin = 3.24083330103916 | erot = 1.93971532774634 | epot = -18.4630862228367 | etot = -13.2825375940512 -125000 ekin = 3.22476145827508 | erot = 1.88029581293259 | epot = -18.3875948633982 | etot = -13.2825375921906 -126000 ekin = 3.14878052704874 | erot = 1.84062475589788 | epot = -18.2719429098057 | etot = -13.282537626859 -127000 ekin = 2.94943277103419 | erot = 1.886595427589 | epot = -18.1185657735804 | etot = -13.2825375749572 -128000 ekin = 3.16220879321477 | erot = 1.96338946783263 | epot = -18.4081359062158 | etot = -13.2825376451684 -129000 ekin = 3.31015030132664 | erot = 1.94720836362437 | epot = -18.5398963214834 | etot = -13.2825376565324 -130000 ekin = 3.4497203872454 | erot = 1.9263351056887 | epot = -18.6585931496325 | etot = -13.2825376566984 -131000 ekin = 3.58872168957069 | erot = 1.90769906106666 | epot = -18.7789584074301 | etot = -13.2825376567928 -132000 ekin = 3.72319125317242 | erot = 1.89293715413342 | epot = -18.8986660641589 | etot = -13.2825376568531 -133000 ekin = 3.84978251755378 | erot = 1.88373597103185 | epot = -19.0160561454729 | etot = -13.2825376568873 -134000 ekin = 3.96557984951709 | erot = 1.88171908502832 | epot = -19.1298365915084 | etot = -13.282537656963 -135000 ekin = 4.06807957718157 | erot = 1.88790714285761 | epot = -19.2385243770752 | etot = -13.282537657036 -136000 ekin = 4.15531911327293 | erot = 1.90286269173109 | epot = -19.340719462101 | etot = -13.282537657097 -137000 ekin = 4.22592766896957 | erot = 1.92681130724409 | epot = -19.4352766333493 | etot = -13.2825376571357 -138000 ekin = 4.27918313097991 | erot = 1.95973390207695 | epot = -19.5214546902016 | etot = -13.2825376571448 -139000 ekin = 4.31500256681567 | erot = 2.00154238231131 | epot = -19.59908260621 | etot = -13.2825376570831 -140000 ekin = 4.33403278412092 | erot = 2.05223040229202 | epot = -19.6688008434056 | etot = -13.2825376569926 -141000 ekin = 4.33751047770786 | erot = 2.11180924821132 | epot = -19.7318573827854 | etot = -13.2825376568662 -142000 ekin = 4.32708478663564 | erot = 2.18042096416689 | epot = -19.7900434075179 | etot = -13.2825376567154 -143000 ekin = 4.30467959787724 | erot = 2.25833701673724 | epot = -19.8455542711563 | etot = -13.2825376565418 -144000 ekin = 4.27235382259247 | erot = 2.34595165411789 | epot = -19.9008431331009 | etot = -13.2825376563906 -145000 ekin = 4.23214636981244 | erot = 2.44344334214718 | epot = -19.9581273682268 | etot = -13.2825376562672 -146000 ekin = 4.18594231916929 | erot = 2.55071340549331 | epot = -20.0191933808486 | etot = -13.2825376561861 -147000 ekin = 4.13537962661592 | erot = 2.66728850163241 | epot = -20.0852057844046 | etot = -13.2825376561563 -148000 ekin = 4.08179900889712 | erot = 2.79223549069442 | epot = -20.1565721557729 | etot = -13.2825376561813 -149000 ekin = 4.02623498472322 | erot = 2.9241198689985 | epot = -20.232892509982 | etot = -13.2825376562603 -150000 ekin = 3.96943958307703 | erot = 3.06100347347629 | epot = -20.3129807129424 | etot = -13.2825376563891 -151000 ekin = 3.91192645323282 | erot = 3.20047132483819 | epot = -20.3949354346329 | etot = -13.2825376565619 -152000 ekin = 3.85402372610883 | erot = 3.33967877480172 | epot = -20.4762401576828 | etot = -13.2825376567723 -153000 ekin = 3.79592773401783 | erot = 3.47541715770412 | epot = -20.5538825487337 | etot = -13.2825376570117 -154000 ekin = 3.73775530704034 | erot = 3.60420547216072 | epot = -20.6244984364701 | etot = -13.282537657269 -155000 ekin = 3.6795979102985 | erot = 3.7224221778291 | epot = -20.6845577456561 | etot = -13.2825376575285 -156000 ekin = 3.62158147939218 | erot = 3.82649073830497 | epot = -20.7306098754663 | etot = -13.2825376577691 -157000 ekin = 3.5639362554113 | erot = 3.91312084630063 | epot = -20.7595947596784 | etot = -13.2825376579665 -158000 ekin = 3.50707329925225 | erot = 3.9795873650006 | epot = -20.7691983223484 | etot = -13.2825376580955 -159000 ekin = 3.45165682738659 | erot = 4.02400734849606 | epot = -20.7582018340186 | etot = -13.282537658136 -160000 ekin = 3.39865532558911 | erot = 4.04555903021673 | epot = -20.7267520138832 | etot = -13.2825376580774 -161000 ekin = 3.34935406486443 | erot = 4.04458967179415 | epot = -20.6764813945808 | etot = -13.2825376579222 -162000 ekin = 3.30532015421541 | erot = 4.02258247379577 | epot = -20.6104402856967 | etot = -13.2825376576855 -163000 ekin = 3.26831809803593 | erot = 3.9819866935813 | epot = -20.5328424490087 | etot = -13.2825376573915 -164000 ekin = 3.24018500158399 | erot = 3.92594872656713 | epot = -20.4486713852208 | etot = -13.2825376570696 -165000 ekin = 3.22267663501631 | erot = 3.85799639398367 | epot = -20.3632106857524 | etot = -13.2825376567524 -166000 ekin = 3.21735668268678 | erot = 3.78179957337381 | epot = -20.2816939123395 | etot = -13.2825376562789 -167000 ekin = 3.22508554133862 | erot = 3.70216421851936 | epot = -20.2097874159612 | etot = -13.2825376561032 -168000 ekin = 3.24596106315348 | erot = 3.62279974210031 | epot = -20.1512984612673 | etot = -13.2825376560135 -169000 ekin = 3.27955383501624 | erot = 3.54538235194483 | epot = -20.1074738429831 | etot = -13.282537656022 -170000 ekin = 3.32466734771662 | erot = 3.47077759716888 | epot = -20.0779826010138 | etot = -13.2825376561283 -171000 ekin = 3.37937800793516 | erot = 3.39904334979718 | epot = -20.0609590140454 | etot = -13.282537656313 -172000 ekin = 3.44119436380901 | erot = 3.32956363469228 | epot = -20.0532956550473 | etot = -13.282537656546 -173000 ekin = 3.50731985302141 | erot = 3.26128359452907 | epot = -20.0511411043353 | etot = -13.2825376567848 -174000 ekin = 3.57497712060583 | erot = 3.19303082809352 | epot = -20.050545605684 | etot = -13.2825376569846 -175000 ekin = 3.64173116724552 | erot = 3.12386956099455 | epot = -20.0481383853484 | etot = -13.2825376571083 -176000 ekin = 3.70574771913082 | erot = 3.05341479574277 | epot = -20.0417001720058 | etot = -13.2825376571322 -177000 ekin = 3.7659388805688 | erot = 2.98204284338451 | epot = -20.0305193810053 | etot = -13.282537657052 -178000 ekin = 3.82196164475694 | erot = 2.91094638159342 | epot = -20.015445683236 | etot = -13.2825376568857 -179000 ekin = 3.87411507697524 | erot = 2.84204110116973 | epot = -19.9986938347994 | etot = -13.2825376566544 -180000 ekin = 3.92317967933193 | erot = 2.7777395342816 | epot = -19.9834568700068 | etot = -13.2825376563932 -181000 ekin = 3.97015764234382 | erot = 2.72070235461324 | epot = -19.9733976530853 | etot = -13.2825376561282 -182000 ekin = 4.01610171617511 | erot = 2.6734984016926 | epot = -19.9721377738014 | etot = -13.2825376559337 -183000 ekin = 4.06177363427731 | erot = 2.63812245871493 | epot = -19.9824337488135 | etot = -13.2825376558213 -184000 ekin = 4.10756653677024 | erot = 2.61575603465066 | epot = -20.0058602272097 | etot = -13.2825376557888 -185000 ekin = 4.15354652964132 | erot = 2.60670565064911 | epot = -20.042789836128 | etot = -13.2825376558376 -186000 ekin = 4.19945391072101 | erot = 2.61036353554316 | epot = -20.0923551022269 | etot = -13.2825376559628 -187000 ekin = 4.24473107430636 | erot = 2.62524898284916 | epot = -20.1525177133095 | etot = -13.282537656154 -188000 ekin = 4.28856799818784 | erot = 2.6491184592848 | epot = -20.2202241138693 | etot = -13.2825376563966 -189000 ekin = 4.33007364399125 | erot = 2.67919947077837 | epot = -20.291810771393 | etot = -13.2825376566233 -190000 ekin = 4.36845326745518 | erot = 2.71241964780781 | epot = -20.3634105721979 | etot = -13.282537656935 -191000 ekin = 4.40242074847429 | erot = 2.74530093921263 | epot = -20.4302593449101 | etot = -13.2825376572232 -192000 ekin = 4.43037880288296 | erot = 2.7745540103848 | epot = -20.4874704712234 | etot = -13.2825376579557 -193000 ekin = 4.44834510305263 | erot = 2.79692081275968 | epot = -20.5278035740366 | etot = -13.2825376582243 -194000 ekin = 4.45438337861284 | erot = 2.80974801333328 | epot = -20.5466690503491 | etot = -13.282537658403 -195000 ekin = 4.44752201417202 | erot = 2.81136444003046 | epot = -20.5414241126779 | etot = -13.2825376584754 -196000 ekin = 4.42737187905048 | erot = 2.80121240437724 | epot = -20.5111219418607 | etot = -13.282537658433 -197000 ekin = 4.39418615090619 | erot = 2.77991547931436 | epot = -20.4566392884965 | etot = -13.282537658276 -198000 ekin = 4.3488852650834 | erot = 2.74924294053029 | epot = -20.3806658636271 | etot = -13.2825376580134 -199000 ekin = 4.29304006378848 | erot = 2.71196807404358 | epot = -20.2875457954965 | etot = -13.2825376576645 -200000 ekin = 4.22880362118172 | erot = 2.67162662745845 | epot = -20.1829679058976 | etot = -13.2825376572574 -201000 ekin = 4.15878346301308 | erot = 2.6321913339107 | epot = -20.0735124537522 | etot = -13.2825376568284 -202000 ekin = 4.08585235174777 | erot = 2.59768848811556 | epot = -19.9660784962823 | etot = -13.2825376564189 -203000 ekin = 4.01290418154392 | erot = 2.5717916467484 | epot = -19.8672334843641 | etot = -13.2825376560718 -204000 ekin = 3.94257872967226 | erot = 2.55743320243961 | epot = -19.7825495879379 | etot = -13.282537655826 -205000 ekin = 3.87698859849794 | erot = 2.55647506167819 | epot = -19.7160013158883 | etot = -13.2825376557122 -206000 ekin = 3.81748743469197 | erot = 2.56947517652852 | epot = -19.6695002669682 | etot = -13.2825376557477 -207000 ekin = 3.76451595610833 | erot = 2.59557970374943 | epot = -19.6426333157917 | etot = -13.2825376559339 -208000 ekin = 3.71755329412155 | erot = 2.63256413547948 | epot = -19.6326550858542 | etot = -13.2825376562531 -209000 ekin = 3.6751895684106 | erot = 2.67704133017555 | epot = -19.6347685552539 | etot = -13.2825376566678 -210000 ekin = 3.63532366958123 | erot = 2.72484401425475 | epot = -19.6427053409575 | etot = -13.2825376571215 -211000 ekin = 3.59547812025537 | erot = 2.77156531006635 | epot = -19.6495810878665 | etot = -13.2825376575447 -212000 ekin = 3.5532013388674 | erot = 2.8131934632015 | epot = -19.648932459936 | etot = -13.2825376578671 -213000 ekin = 3.5064976129211 | erot = 2.84671880107505 | epot = -19.6357540720302 | etot = -13.282537658034 -214000 ekin = 3.45419694129118 | erot = 2.87055671325296 | epot = -19.6072913125676 | etot = -13.2825376580234 -215000 ekin = 3.3961705526571 | erot = 2.8846579012024 | epot = -19.5633661117116 | etot = -13.2825376578521 -216000 ekin = 3.33333457774708 | erot = 2.89027487492533 | epot = -19.5061471102412 | etot = -13.2825376575688 -217000 ekin = 3.26237078851755 | erot = 2.88652329141154 | epot = -19.4314317899048 | etot = -13.2825377099757 -218000 ekin = 3.06041269207635 | erot = 2.81741383451267 | epot = -19.1603641969459 | etot = -13.2825376703568 -219000 ekin = 2.93316276967062 | erot = 2.8446025024716 | epot = -19.0603029343603 | etot = -13.2825376622181 -220000 ekin = 2.96128614843698 | erot = 2.98904145664669 | epot = -19.2328653086382 | etot = -13.2825377035546 -221000 ekin = 2.90913828063349 | erot = 3.0370109417033 | epot = -19.2286868797594 | etot = -13.2825376574226 -222000 ekin = 2.84227376945866 | erot = 3.05603303801694 | epot = -19.1808444650464 | etot = -13.2825376575708 -223000 ekin = 2.78062900949204 | erot = 3.0623214454287 | epot = -19.1254881126305 | etot = -13.2825376577097 -224000 ekin = 2.72480461600036 | erot = 3.05323876331587 | epot = -19.0605810371255 | etot = -13.2825376578093 -225000 ekin = 2.67532541220325 | erot = 3.02684795807176 | epot = -18.9847110281109 | etot = -13.2825376578359 -226000 ekin = 2.63276163036943 | erot = 2.98227164387593 | epot = -18.8975709320212 | etot = -13.2825376577758 -227000 ekin = 2.59776959648577 | erot = 2.91985728396334 | epot = -18.8001645380875 | etot = -13.2825376576384 -228000 ekin = 2.57104335950892 | erot = 2.84110209326691 | epot = -18.6946831102272 | etot = -13.2825376574514 -229000 ekin = 2.55319781380138 | erot = 2.74837649564534 | epot = -18.5841119666977 | etot = -13.282537657251 -230000 ekin = 2.54463522127686 | erot = 2.64454432367535 | epot = -18.4717172020198 | etot = -13.2825376570676 -231000 ekin = 2.54546021784621 | erot = 2.53260284792485 | epot = -18.3606007226861 | etot = -13.282537656915 -232000 ekin = 2.55549307881088 | erot = 2.41545023211296 | epot = -18.2534809677097 | etot = -13.2825376567859 -233000 ekin = 2.57438548648739 | erot = 2.29583418255703 | epot = -18.1527573257026 | etot = -13.2825376566582 -234000 ekin = 2.60178443029265 | erot = 2.17645519655967 | epot = -18.0607772833614 | etot = -13.2825376565091 -235000 ekin = 2.63745218021159 | erot = 2.06012244390588 | epot = -17.9801122804484 | etot = -13.2825376563309 -236000 ekin = 2.68126373962457 | erot = 1.94983176913329 | epot = -17.913633164896 | etot = -13.2825376561382 -237000 ekin = 2.73306880567091 | erot = 1.84868049785708 | epot = -17.8642869594909 | etot = -13.2825376559629 -238000 ekin = 2.79247907581072 | erot = 1.75962709169619 | epot = -17.8346438233477 | etot = -13.2825376558408 -239000 ekin = 2.8586759443782 | erot = 1.68518476454599 | epot = -17.8263983647219 | etot = -13.2825376557977 -240000 ekin = 2.93031183915977 | erot = 1.62715662270393 | epot = -17.8400061177073 | etot = -13.2825376558436 -241000 ekin = 3.00552986743725 | erot = 1.58648515289343 | epot = -17.8745526763034 | etot = -13.2825376559727 -242000 ekin = 3.0820836546572 | erot = 1.56323726723208 | epot = -17.9278585780555 | etot = -13.2825376561662 -243000 ekin = 3.15752262719342 | erot = 1.5567113441869 | epot = -17.9967716277771 | etot = -13.2825376563968 -244000 ekin = 3.22940955213828 | erot = 1.56564064462198 | epot = -18.0775878533929 | etot = -13.2825376566326 -245000 ekin = 3.29554303953914 | erot = 1.58846457359926 | epot = -18.1665452699782 | etot = -13.2825376568398 -246000 ekin = 3.35415939736843 | erot = 1.62363159705077 | epot = -18.2603286514088 | etot = -13.2825376569896 -247000 ekin = 3.40408574270612 | erot = 1.6698832561101 | epot = -18.3565066558791 | etot = -13.2825376570629 -248000 ekin = 3.44481663263181 | erot = 1.72645823945308 | epot = -18.4538125291412 | etot = -13.2825376570563 -249000 ekin = 3.4764966325555 | erot = 1.79316293261092 | epot = -18.5521972221498 | etot = -13.2825376569834 -250000 ekin = 3.4998119290067 | erot = 1.87028571125164 | epot = -18.6526352971293 | etot = -13.2825376568709 -251000 ekin = 3.51581851748171 | erot = 1.95837689015822 | epot = -18.7567330643924 | etot = -13.2825376567524 -252000 ekin = 3.52575126869464 | erot = 2.05795546201286 | epot = -18.8662443873663 | etot = -13.2825376566588 -253000 ekin = 3.53086049262785 | erot = 2.16922084359604 | epot = -18.9826189928353 | etot = -13.2825376566114 -254000 ekin = 3.53230924463609 | erot = 2.29183768672779 | epot = -19.1066845879831 | etot = -13.2825376566192 -255000 ekin = 3.53114146569382 | erot = 2.42483171779584 | epot = -19.2385108401683 | etot = -13.2825376566786 -256000 ekin = 3.5283101054313 | erot = 2.56659937924946 | epot = -19.3774471414593 | etot = -13.2825376567786 -257000 ekin = 3.52473759358279 | erot = 2.71500399460032 | epot = -19.5222792450876 | etot = -13.2825376569044 -258000 ekin = 3.52137545667859 | erot = 2.86751445186624 | epot = -19.6714275655892 | etot = -13.2825376570444 -259000 ekin = 3.51923070409532 | erot = 3.02134046698889 | epot = -19.8231088282769 | etot = -13.2825376571927 -260000 ekin = 3.51933841084553 | erot = 3.17353025732541 | epot = -19.9754063255224 | etot = -13.2825376573514 -261000 ekin = 3.52267851350856 | erot = 3.32101670247704 | epot = -20.1262328735147 | etot = -13.2825376575291 -262000 ekin = 3.53003333480896 | erot = 3.46062452427896 | epot = -20.273195516825 | etot = -13.2825376577371 -263000 ekin = 3.54180424035152 | erot = 3.58907231404775 | epot = -20.413414212382 | etot = -13.2825376579827 -264000 ekin = 3.55787447685305 | erot = 3.70301127793477 | epot = -20.5434234130524 | etot = -13.2825376582646 -265000 ekin = 3.57751330913344 | erot = 3.7991542896344 | epot = -20.659205257334 | etot = -13.2825376585661 -266000 ekin = 3.59938201293793 | erot = 3.87452595150114 | epot = -20.7564456232931 | etot = -13.2825376588541 -267000 ekin = 3.62167235822875 | erot = 3.92682901662434 | epot = -20.8310390339348 | etot = -13.2825376590817 -268000 ekin = 3.64237343768071 | erot = 3.95486700975834 | epot = -20.8797781066388 | etot = -13.2825376591998 -269000 ekin = 3.65961533754883 | erot = 3.95890941485168 | epot = -20.901062411575 | etot = -13.2825376591745 -270000 ekin = 3.67198713217814 | erot = 3.94085700806684 | epot = -20.8953817992463 | etot = -13.2825376590013 -271000 ekin = 3.67872329079258 | erot = 3.90410726329523 | epot = -20.8653682127982 | etot = -13.2825376587104 -272000 ekin = 3.67969720542176 | erot = 3.85312017496781 | epot = -20.8153550387471 | etot = -13.2825376583575 -273000 ekin = 3.67523785304564 | erot = 3.79279347421287 | epot = -20.7505689852647 | etot = -13.2825376580062 -274000 ekin = 3.66585545030596 | erot = 3.72781503527706 | epot = -20.6762081432927 | etot = -13.2825376577096 -275000 ekin = 3.65198266149159 | erot = 3.66213927987052 | epot = -20.5966595988631 | etot = -13.282537657501 -276000 ekin = 3.633806837076 | erot = 3.598661459447 | epot = -20.5150059539148 | etot = -13.2825376573918 -277000 ekin = 3.61121443635146 | erot = 3.53909052619933 | epot = -20.4328426199275 | etot = -13.2825376573767 -278000 ekin = 3.58382533557885 | erot = 3.48398196201195 | epot = -20.3503449550305 | etot = -13.2825376574397 -279000 ekin = 3.55107927466721 | erot = 3.4328876768366 | epot = -20.2665046090618 | etot = -13.282537657558 -280000 ekin = 3.51234648871563 | erot = 3.38459301004919 | epot = -20.1794771564681 | etot = -13.2825376577033 -281000 ekin = 3.46705217022193 | erot = 3.33742016501543 | epot = -20.0870099930804 | etot = -13.282537657843 -282000 ekin = 3.4148174354963 | erot = 3.28957539031067 | epot = -19.98693048375 | etot = -13.2825376579431 -283000 ekin = 3.3556172386103 | erot = 3.23950140187567 | epot = -19.877656298458 | etot = -13.282537657972 -284000 ekin = 3.28993990743714 | erot = 3.18617834963481 | epot = -19.7586559149802 | etot = -13.2825376579083 -285000 ekin = 3.21891605429293 | erot = 3.12930993710548 | epot = -19.6307636491448 | etot = -13.2825376577464 -286000 ekin = 3.14439051761724 | erot = 3.06934998331701 | epot = -19.4962781582955 | etot = -13.2825376573613 -287000 ekin = 3.06960009495595 | erot = 3.00728050107418 | epot = -19.3594182531578 | etot = -13.2825376571276 -288000 ekin = 2.99759349423582 | erot = 2.94413656453561 | epot = -19.2242677156211 | etot = -13.2825376568497 -289000 ekin = 2.9312259032696 | erot = 2.88109280424398 | epot = -19.0948563640673 | etot = -13.2825376565537 -290000 ekin = 2.87364775959538 | erot = 2.81936189019795 | epot = -18.9755473060557 | etot = -13.2825376562624 -291000 ekin = 2.82808392253236 | erot = 2.76008269212129 | epot = -18.8707042706456 | etot = -13.2825376559919 -292000 ekin = 2.79759576436007 | erot = 2.70430482357457 | epot = -18.7844382436883 | etot = -13.2825376557537 -293000 ekin = 2.78483509079594 | erot = 2.65304729582258 | epot = -18.7204200421757 | etot = -13.2825376555571 -294000 ekin = 2.79179688861819 | erot = 2.6073808528377 | epot = -18.6817153968698 | etot = -13.2825376554139 -295000 ekin = 2.81957934527721 | erot = 2.56847294066555 | epot = -18.6705899412834 | etot = -13.2825376553406 -296000 ekin = 2.8680999060561 | erot = 2.53696733690384 | epot = -18.6876048985713 | etot = -13.2825376556114 -297000 ekin = 2.93560102202648 | erot = 2.51254790532835 | epot = -18.7306865831678 | etot = -13.282537655813 -298000 ekin = 3.01880409347916 | erot = 2.49548083197819 | epot = -18.7968225815706 | etot = -13.2825376561132 -299000 ekin = 3.11317674937778 | erot = 2.48585279572497 | epot = -18.8815672015859 | etot = -13.2825376564832 -300000 ekin = 3.21328607489953 | erot = 2.48363458984354 | epot = -18.9794583216121 | etot = -13.2825376568691 -301000 ekin = 3.31333985043737 | erot = 2.48892965616517 | epot = -19.0848071638044 | etot = -13.2825376572019 -302000 ekin = 3.40783628219689 | erot = 2.50232511253499 | epot = -19.1926990521496 | etot = -13.2825376574178 -303000 ekin = 3.49218145837487 | erot = 2.52518642841966 | epot = -19.2999055442772 | etot = -13.2825376574827 -304000 ekin = 3.56312110363183 | erot = 2.55971045465174 | epot = -19.40536921569 | etot = -13.2825376574064 -305000 ekin = 3.61888774143317 | erot = 2.60863169692503 | epot = -19.5100570955986 | etot = -13.2825376572404 -306000 ekin = 3.65906113322132 | erot = 2.67462381277541 | epot = -19.6162226030555 | etot = -13.2825376570587 -307000 ekin = 3.68422703808102 | erot = 2.75956355882423 | epot = -19.7263282538406 | etot = -13.2825376569354 -308000 ekin = 3.69555713019525 | erot = 2.8638613267912 | epot = -19.8419561139128 | etot = -13.2825376569263 -309000 ekin = 3.69442216794192 | erot = 2.98601798220163 | epot = -19.9629778072027 | etot = -13.2825376570592 -310000 ekin = 3.68211177280713 | erot = 3.12248873496362 | epot = -20.0871381651019 | etot = -13.2825376573311 -311000 ekin = 3.65969154495059 | erot = 3.2678638211702 | epot = -20.2100930238326 | etot = -13.2825376577118 -312000 ekin = 3.62799191203365 | erot = 3.41533011396099 | epot = -20.3258596841441 | etot = -13.2825376581495 -313000 ekin = 3.58770577443554 | erot = 3.55735172711468 | epot = -20.4275951601301 | etot = -13.2825376585799 -314000 ekin = 3.53954680683451 | erot = 3.68647834911027 | epot = -20.5085628148818 | etot = -13.282537658937 -315000 ekin = 3.4844173114834 | erot = 3.79616777476322 | epot = -20.5631227454116 | etot = -13.282537659165 -316000 ekin = 3.42353216211074 | erot = 3.88149414080693 | epot = -20.5875639621475 | etot = -13.2825376592299 -317000 ekin = 3.35845872751502 | erot = 3.93962315500785 | epot = -20.5806195416482 | etot = -13.2825376591254 -318000 ekin = 3.2910554651844 | erot = 3.96997627515888 | epot = -20.5435693992165 | etot = -13.2825376588732 -319000 ekin = 3.223320732024 | erot = 3.97407140328373 | epot = -20.479929793824 | etot = -13.2825376585163 -320000 ekin = 3.15718962490234 | erot = 3.9550982666567 | epot = -20.3948255496666 | etot = -13.2825376581075 -321000 ekin = 3.09432530925327 | erot = 3.91739375694779 | epot = -20.2942567238311 | etot = -13.28253765763 -322000 ekin = 3.03585792728448 | erot = 3.86620572599247 | epot = -20.1846013105892 | etot = -13.2825376573123 -323000 ekin = 2.98241823057113 | erot = 3.80588679425271 | epot = -20.0708426818646 | etot = -13.2825376570408 -324000 ekin = 2.93426965651669 | erot = 3.74025042750917 | epot = -19.9570577408439 | etot = -13.2825376568181 -325000 ekin = 2.89141991680417 | erot = 3.67265058789432 | epot = -19.8466081613358 | etot = -13.2825376566373 -326000 ekin = 2.85377350486309 | erot = 3.60592095018933 | epot = -19.7422321115398 | etot = -13.2825376564874 -327000 ekin = 2.82127903352093 | erot = 3.54238718474863 | epot = -19.6462038746274 | etot = -13.2825376563578 -328000 ekin = 2.7940403019229 | erot = 3.4839107987806 | epot = -19.5604887570628 | etot = -13.2825376563592 -329000 ekin = 2.77197949436762 | erot = 3.43169110626222 | epot = -19.4862082569527 | etot = -13.2825376563229 -330000 ekin = 2.75494613632944 | erot = 3.38614869284798 | epot = -19.4236324854868 | etot = -13.2825376563094 -331000 ekin = 2.74315934445212 | erot = 3.34732307626857 | epot = -19.3730200770426 | etot = -13.2825376563219 -332000 ekin = 2.73688271481215 | erot = 3.3148484337223 | epot = -19.3342688048984 | etot = -13.282537656364 -333000 ekin = 2.73633973950942 | erot = 3.28798960596993 | epot = -19.306867001918 | etot = -13.2825376564386 -334000 ekin = 2.74163678826744 | erot = 3.26568447791269 | epot = -19.2898589227258 | etot = -13.2825376565456 -335000 ekin = 2.75270974558534 | erot = 3.24660647154451 | epot = -19.2818538738101 | etot = -13.2825376566802 -336000 ekin = 2.76930297431775 | erot = 3.22925893950186 | epot = -19.2810995706518 | etot = -13.2825376568322 -337000 ekin = 2.79098432744158 | erot = 3.21211025351894 | epot = -19.2856322379462 | etot = -13.2825376569857 -338000 ekin = 2.81719266282506 | erot = 3.19377253885645 | epot = -19.2935028588025 | etot = -13.282537657121 -339000 ekin = 2.84730801445539 | erot = 3.17321131001621 | epot = -19.3030569816891 | etot = -13.2825376572175 -340000 ekin = 2.88072770851369 | erot = 3.14995757252084 | epot = -19.3132229382919 | etot = -13.2825376572574 -341000 ekin = 2.91693042220102 | erot = 3.12427992089927 | epot = -19.3237480003323 | etot = -13.282537657232 -342000 ekin = 2.95550483676992 | erot = 3.09726362719681 | epot = -19.3353061211116 | etot = -13.2825376571449 -343000 ekin = 2.9961267955816 | erot = 3.07075651726459 | epot = -19.3494209698604 | etot = -13.2825376570142 -344000 ekin = 3.03848111852457 | erot = 3.04717169214071 | epot = -19.3681904675347 | etot = -13.2825376568694 -345000 ekin = 3.08214069495797 | erot = 3.02917600552114 | epot = -19.3938543572237 | etot = -13.2825376567446 -346000 ekin = 3.12643023842184 | erot = 3.019323916367 | epot = -19.4282918114614 | etot = -13.2825376566725 -347000 ekin = 3.17030571950563 | erot = 3.01970377197954 | epot = -19.4725471481646 | etot = -13.2825376566794 -348000 ekin = 3.21227615188227 | erot = 3.03164750475753 | epot = -19.5264613134215 | etot = -13.2825376567817 -349000 ekin = 3.25037907572045 | erot = 3.05552302028484 | epot = -19.5884397529928 | etot = -13.2825376569875 -350000 ekin = 3.28221302801698 | erot = 3.090612077422 | epot = -19.655362762734 | etot = -13.282537657295 -351000 ekin = 3.30503586845675 | erot = 3.13508039752096 | epot = -19.7226539236659 | etot = -13.2825376576882 -352000 ekin = 3.31595350171735 | erot = 3.18605925818043 | epot = -19.7845504180312 | etot = -13.2825376581334 -353000 ekin = 3.31222586318789 | erot = 3.2398547104606 | epot = -19.8346182322276 | etot = -13.2825376585791 -354000 ekin = 3.29169173965575 | erot = 3.29228360641242 | epot = -19.8665130050276 | etot = -13.2825376589594 -355000 ekin = 3.25327251248046 | erot = 3.33911881639371 | epot = -19.8749289880786 | etot = -13.2825376592044 -356000 ekin = 3.19745645460935 | erot = 3.37659336434066 | epot = -19.8565874782071 | etot = -13.2825376592571 -357000 ekin = 3.12661218039488 | erot = 3.40186563883939 | epot = -19.8110154783303 | etot = -13.282537659096 -358000 ekin = 3.04496261886749 | erot = 3.41331336007688 | epot = -19.7408136376952 | etot = -13.2825376587508 -359000 ekin = 2.95811577563389 | erot = 3.41055161315594 | epot = -19.65120504709 | etot = -13.2825376583002 -360000 ekin = 2.87219670777466 | erot = 3.39416675335385 | epot = -19.5489011189775 | etot = -13.282537657849 -361000 ekin = 2.79279437102923 | erot = 3.36527462495985 | epot = -19.4406066534821 | etot = -13.282537657493 -362000 ekin = 2.7240341162549 | erot = 3.32507906116193 | epot = -19.331650834705 | etot = -13.2825376572881 -363000 ekin = 2.6680503223993 | erot = 3.27458936074052 | epot = -19.2251773403761 | etot = -13.2825376572363 -364000 ekin = 2.62498064266483 | erot = 3.21457203232936 | epot = -19.1220903322872 | etot = -13.282537657293 -365000 ekin = 2.59341335852256 | erot = 3.14571210015879 | epot = -19.0216631160705 | etot = -13.2825376573892 -366000 ekin = 2.57108401614146 | erot = 3.06888690043657 | epot = -18.9225085740357 | etot = -13.2825376574577 -367000 ekin = 2.55558493490922 | erot = 2.98543100060401 | epot = -18.8235535929648 | etot = -13.2825376574516 -368000 ekin = 2.54491188940874 | erot = 2.89729436784111 | epot = -18.7247439146015 | etot = -13.2825376573517 -369000 ekin = 2.53777310784828 | erot = 2.80704690677514 | epot = -18.6273576717881 | etot = -13.2825376571646 -370000 ekin = 2.53338825950351 | erot = 2.71819995751228 | epot = -18.5341258738832 | etot = -13.2825376568674 -371000 ekin = 2.53146597101795 | erot = 2.63443214139539 | epot = -18.4484357690378 | etot = -13.2825376566244 -372000 ekin = 2.53305224681573 | erot = 2.55818112001752 | epot = -18.3737710231763 | etot = -13.282537656343 -373000 ekin = 2.53983164211189 | erot = 2.49190590621672 | epot = -18.314275204369 | etot = -13.2825376560404 -374000 ekin = 2.5539361342706 | erot = 2.43803861080169 | epot = -18.2745124008035 | etot = -13.2825376557312 -375000 ekin = 2.57759599288755 | erot = 2.39898190221675 | epot = -18.2591155506456 | etot = -13.2825376555413 -376000 ekin = 2.61177868596779 | erot = 2.3771002007207 | epot = -18.2714165420646 | etot = -13.2825376553761 -377000 ekin = 2.65778740675903 | erot = 2.37359397109588 | epot = -18.313919033141 | etot = -13.2825376552861 -378000 ekin = 2.71669984604403 | erot = 2.38881656768454 | epot = -18.3880540690293 | etot = -13.2825376553007 -379000 ekin = 2.78887075408053 | erot = 2.42222171828729 | epot = -18.493630127821 | etot = -13.2825376554532 -380000 ekin = 2.8735893047097 | erot = 2.47221119730624 | epot = -18.6283381577863 | etot = -13.2825376557704 -381000 ekin = 2.96878304795772 | erot = 2.53604633164126 | epot = -18.7873670358596 | etot = -13.2825376562607 -382000 ekin = 3.07087981816342 | erot = 2.60989110069439 | epot = -18.9633085757602 | etot = -13.2825376569024 -383000 ekin = 3.17493836101257 | erot = 2.68903209116691 | epot = -19.1465081098174 | etot = -13.2825376576379 -384000 ekin = 3.27511217440233 | erot = 2.76828123033647 | epot = -19.3259310631177 | etot = -13.2825376583789 -385000 ekin = 3.36541347868712 | erot = 2.84251901104278 | epot = -19.4904701487519 | etot = -13.282537659022 -386000 ekin = 3.44062041949954 | erot = 2.90728609466352 | epot = -19.6304441736393 | etot = -13.2825376594762 -387000 ekin = 3.49708416826315 | erot = 2.95929717263814 | epot = -19.7389190005894 | etot = -13.2825376596881 -388000 ekin = 3.53320899932111 | erot = 2.99676007578797 | epot = -19.8125067347609 | etot = -13.2825376596518 -389000 ekin = 3.5495047719137 | erot = 3.01944441497906 | epot = -19.8514868462961 | etot = -13.2825376594033 -390000 ekin = 3.54826504042848 | erot = 3.02852374317564 | epot = -19.8593264426069 | etot = -13.2825376590028 -391000 ekin = 3.53302701092198 | erot = 3.02626577204788 | epot = -19.8418304414875 | etot = -13.2825376585177 -392000 ekin = 3.50797457908343 | erot = 3.01564117086773 | epot = -19.8061534079638 | etot = -13.2825376580127 -393000 ekin = 3.47739262395909 | erot = 2.99988985775782 | epot = -19.7598201392632 | etot = -13.2825376575463 -394000 ekin = 3.44522282252996 | erot = 2.98206454116529 | epot = -19.7098250208642 | etot = -13.282537657169 -395000 ekin = 3.41473630917387 | erot = 2.9645789212076 | epot = -19.6618528873007 | etot = -13.2825376569193 -396000 ekin = 3.38832727675903 | erot = 2.94881280953917 | epot = -19.6196777431179 | etot = -13.2825376568196 -397000 ekin = 3.36743033117465 | erot = 2.93484808693188 | epot = -19.5848160749774 | etot = -13.2825376568709 -398000 ekin = 3.35256101408384 | erot = 2.92141113768411 | epot = -19.5565098088173 | etot = -13.2825376570493 -399000 ekin = 3.34346845310144 | erot = 2.90607029857573 | epot = -19.5320764089866 | etot = -13.2825376573094 -400000 ekin = 3.33937255609437 | erot = 2.88568094014063 | epot = -19.5075911538258 | etot = -13.2825376575908 -401000 ekin = 3.33924190395899 | erot = 2.85700017339502 | epot = -19.4787797351863 | etot = -13.2825376578323 -402000 ekin = 3.34205998353892 | erot = 2.81733492843204 | epot = -19.441932569956 | etot = -13.282537657985 -403000 ekin = 3.34703246955511 | erot = 2.76507190137545 | epot = -19.394642028952 | etot = -13.2825376580215 -404000 ekin = 3.35370775612911 | erot = 2.69997817544774 | epot = -19.3362235895154 | etot = -13.2825376579385 -405000 ekin = 3.36200495975409 | erot = 2.62323862901266 | epot = -19.2677812465193 | etot = -13.2825376577526 -406000 ekin = 3.37216882210879 | erot = 2.53727277109617 | epot = -19.1919792506971 | etot = -13.2825376574921 -407000 ekin = 3.38467286642281 | erot = 2.44541531528747 | epot = -19.1126258389005 | etot = -13.2825376571902 -408000 ekin = 3.40009251679172 | erot = 2.35154628927638 | epot = -19.0341764629477 | etot = -13.2825376568796 -409000 ekin = 3.41896361161102 | erot = 2.25973253002432 | epot = -18.9612337982252 | etot = -13.2825376565899 -410000 ekin = 3.44163818667578 | erot = 2.17391337707833 | epot = -18.8980892201011 | etot = -13.282537656347 -411000 ekin = 3.46814489278265 | erot = 2.09764003834874 | epot = -18.8483225873038 | etot = -13.2825376561724 -412000 ekin = 3.49806473021384 | erot = 2.03386747107535 | epot = -18.8144698573718 | etot = -13.2825376560826 -413000 ekin = 3.53043538014641 | erot = 1.98479597299823 | epot = -18.7977690092331 | etot = -13.2825376560885 -414000 ekin = 3.5637005865262 | erot = 1.95176512736844 | epot = -18.7980033700874 | etot = -13.2825376561927 -415000 ekin = 3.59572274043577 | erot = 1.93521132484319 | epot = -18.8134717216665 | etot = -13.2825376563875 -416000 ekin = 3.62387476619239 | erot = 1.93470676736698 | epot = -18.8411191902125 | etot = -13.2825376566531 -417000 ekin = 3.64521944272459 | erot = 1.94909657754553 | epot = -18.8768536772273 | etot = -13.2825376569572 -418000 ekin = 3.65676940727035 | erot = 1.97673635559896 | epot = -18.9160434201279 | etot = -13.2825376572586 -419000 ekin = 3.65580092830618 | erot = 2.01580487492028 | epot = -18.9541434607407 | etot = -13.2825376575142 -420000 ekin = 3.64017400050736 | erot = 2.06463212116818 | epot = -18.9873437793641 | etot = -13.2825376576886 -421000 ekin = 3.60860065288865 | erot = 2.12196023054627 | epot = -19.0130985411983 | etot = -13.2825376577633 -422000 ekin = 3.56080810554219 | erot = 2.18705814556919 | epot = -19.0304039088537 | etot = -13.2825376577423 -423000 ekin = 3.49756602992945 | erot = 2.25964754075635 | epot = -19.0397512283355 | etot = -13.2825376576497 -424000 ekin = 3.42057977942507 | erot = 2.33965549129906 | epot = -19.0427729282473 | etot = -13.2825376575231 -425000 ekin = 3.33228159149811 | erot = 2.42686463918893 | epot = -19.0416838880909 | etot = -13.2825376574039 -426000 ekin = 3.2355690960636 | erot = 2.52056283158548 | epot = -19.0386695849744 | etot = -13.2825376573253 -427000 ekin = 3.13354188401682 | erot = 2.61929302170817 | epot = -19.0353725630316 | etot = -13.2825376573066 -428000 ekin = 3.02927593448342 | erot = 2.72077464105999 | epot = -19.0325882328923 | etot = -13.2825376573489 -429000 ekin = 2.92565831326665 | erot = 2.82201873865516 | epot = -19.03021470936 | etot = -13.2825376574382 -430000 ekin = 2.82528572275416 | erot = 2.9196013800765 | epot = -19.0274247603835 | etot = -13.2825376575529 -431000 ekin = 2.73041359107529 | erot = 3.01000711728887 | epot = -19.0229583660374 | etot = -13.2825376576732 -432000 ekin = 2.64293211741183 | erot = 3.08992822754027 | epot = -19.0153980027419 | etot = -13.2825376577898 -433000 ekin = 2.5643487123274 | erot = 3.15643021828688 | epot = -19.0033165885191 | etot = -13.2825376579049 -434000 ekin = 2.49577139885486 | erot = 3.20696626802801 | epot = -18.9852753249085 | etot = -13.2825376580257 -435000 ekin = 2.43791477049345 | erot = 3.23932321271082 | epot = -18.9597756413533 | etot = -13.282537658149 -436000 ekin = 2.39117206292075 | erot = 3.25164920249633 | epot = -18.9253589236664 | etot = -13.2825376582494 -437000 ekin = 2.35579129858636 | erot = 3.24269240916056 | epot = -18.8810213660233 | etot = -13.2825376582763 -438000 ekin = 2.33215137598552 | erot = 3.2122573583515 | epot = -18.8269463925089 | etot = -13.2825376581719 -439000 ekin = 2.32106357051098 | erot = 3.16171527167181 | epot = -18.7653165000812 | etot = -13.2825376578984 -440000 ekin = 2.32396046468774 | erot = 3.09429994298168 | epot = -18.7007980651355 | etot = -13.282537657466 -441000 ekin = 2.34282585391452 | erot = 3.01497153468354 | epot = -18.640335045538 | etot = -13.2825376569399 -442000 ekin = 2.37979980925604 | erot = 2.92981680804556 | epot = -18.592154273725 | etot = -13.2825376564234 -443000 ekin = 2.43656228551105 | erot = 2.84513622245103 | epot = -18.5642361639989 | etot = -13.2825376560368 -444000 ekin = 2.51342571777136 | erot = 2.7665603961214 | epot = -18.5625237697588 | etot = -13.2825376558661 -445000 ekin = 2.60880718707288 | erot = 2.69827998895654 | epot = -18.5896248319851 | etot = -13.2825376559556 -446000 ekin = 2.71906096767751 | erot = 2.64257205052438 | epot = -18.6441706744987 | etot = -13.2825376562969 -447000 ekin = 2.83874401672896 | erot = 2.59965346897449 | epot = -18.7209351425399 | etot = -13.2825376568365 -448000 ekin = 2.96126772415897 | erot = 2.5678148089411 | epot = -18.8116201905962 | etot = -13.2825376574961 -449000 ekin = 3.07973256248984 | erot = 2.54376856118504 | epot = -18.9060387818655 | etot = -13.2825376581906 -450000 ekin = 3.18773299393897 | erot = 2.52315582293486 | epot = -18.9934264757104 | etot = -13.2825376588365 -451000 ekin = 3.28001368753319 | erot = 2.50120181208189 | epot = -19.063753158964 | etot = -13.2825376593489 -452000 ekin = 3.35296274689406 | erot = 2.47353158346045 | epot = -19.1090319899994 | etot = -13.2825376596449 -453000 ekin = 3.40494017429965 | erot = 2.43707428125779 | epot = -19.1245521152213 | etot = -13.2825376596638 -454000 ekin = 3.43637551402205 | erot = 2.39082250837186 | epot = -19.1097356817972 | etot = -13.2825376594033 -455000 ekin = 3.44952760873151 | erot = 2.33613006950087 | epot = -19.0681953371467 | etot = -13.2825376589143 -456000 ekin = 3.44799144671739 | erot = 2.27640153123032 | epot = -19.0069306362556 | etot = -13.2825376583079 -457000 ekin = 3.43601809741101 | erot = 2.21623652990966 | epot = -18.9347922850214 | etot = -13.2825376577007 -458000 ekin = 3.41788845142157 | erot = 2.1603621628938 | epot = -18.8607882715007 | etot = -13.2825376571853 -459000 ekin = 3.39749151939687 | erot = 2.11268532597155 | epot = -18.7927145021832 | etot = -13.2825376568148 -460000 ekin = 3.37812232252718 | erot = 2.07567909161626 | epot = -18.7363390707458 | etot = -13.2825376566023 -461000 ekin = 3.36231617612891 | erot = 2.05042996966763 | epot = -18.695283802365 | etot = -13.2825376565685 -462000 ekin = 3.3516010060682 | erot = 2.03669678982626 | epot = -18.6708354525534 | etot = -13.2825376566589 -463000 ekin = 3.34749626496938 | erot = 2.03201016323612 | epot = -18.6620440849644 | etot = -13.2825376567589 -464000 ekin = 3.35152548102323 | erot = 2.03372508145255 | epot = -18.6677882192986 | etot = -13.2825376568228 -465000 ekin = 3.36505604034897 | erot = 2.03980035193984 | epot = -18.6873940492544 | etot = -13.2825376569656 -466000 ekin = 3.38750814155411 | erot = 2.04917645651097 | epot = -18.7192222551879 | etot = -13.2825376571228 -467000 ekin = 3.41781846537007 | erot = 2.06078922447704 | epot = -18.7611453471536 | etot = -13.2825376573065 -468000 ekin = 3.45442517050212 | erot = 2.07383123667033 | epot = -18.8107940646966 | etot = -13.2825376575241 -469000 ekin = 3.49517146555834 | erot = 2.08763407955762 | epot = -18.8653432028907 | etot = -13.2825376577748 -470000 ekin = 3.53754304391518 | erot = 2.10145518357448 | epot = -18.9215358855326 | etot = -13.2825376580429 -471000 ekin = 3.57898487463084 | erot = 2.11439735084177 | epot = -18.9759198837659 | etot = -13.2825376582933 -472000 ekin = 3.61725786632598 | erot = 2.12555669055681 | epot = -19.0253522153561 | etot = -13.2825376584733 -473000 ekin = 3.65079380576263 | erot = 2.13440730770723 | epot = -19.0677387719965 | etot = -13.2825376585267 -474000 ekin = 3.67897471803139 | erot = 2.14127953357929 | epot = -19.1027919100348 | etot = -13.2825376584241 -475000 ekin = 3.70221628145293 | erot = 2.14765507905513 | epot = -19.1324090186972 | etot = -13.2825376581891 -476000 ekin = 3.72174790903021 | erot = 2.15602304576331 | epot = -19.1603086126937 | etot = -13.2825376579002 -477000 ekin = 3.73912018616709 | erot = 2.16928365664513 | epot = -19.1909415004644 | etot = -13.2825376576521 -478000 ekin = 3.75565100638758 | erot = 2.1899930971983 | epot = -19.2281817610922 | etot = -13.2825376575063 -479000 ekin = 3.77207488928686 | erot = 2.21984602917254 | epot = -19.2744585759276 | etot = -13.2825376574682 -480000 ekin = 3.78851866246341 | erot = 2.25959918548815 | epot = -19.3306555054526 | etot = -13.282537657501 -481000 ekin = 3.80616995061591 | erot = 2.3098465976453 | epot = -19.3985542055315 | etot = -13.2825376572703 -482000 ekin = 3.82906961959049 | erot = 2.37155747933625 | epot = -19.4831647566213 | etot = -13.2825376576945 -483000 ekin = 3.85390461343261 | erot = 2.44250735313214 | epot = -19.5789496246827 | etot = -13.2825376581179 -484000 ekin = 3.87679301499658 | erot = 2.51997841364319 | epot = -19.67930908719 | etot = -13.2825376585502 -485000 ekin = 3.89418558521177 | erot = 2.6008312618536 | epot = -19.7775545060503 | etot = -13.2825376589849 -486000 ekin = 3.90313775339899 | erot = 2.68139032002724 | epot = -19.8670657328067 | etot = -13.2825376593805 -487000 ekin = 3.90177537850701 | erot = 2.75761792311815 | epot = -19.9419309612886 | etot = -13.2825376596635 -488000 ekin = 3.889862131621 | erot = 2.82561628023752 | epot = -19.9980160716145 | etot = -13.282537659756 -489000 ekin = 3.86922231453781 | erot = 2.88229752819473 | epot = -20.0340575023524 | etot = -13.2825376596199 -490000 ekin = 3.84371636435403 | erot = 2.92590481083913 | epot = -20.0521588344865 | etot = -13.2825376592933 -491000 ekin = 3.81858290487071 | erot = 2.9560720610093 | epot = -20.0571926247727 | etot = -13.2825376588927 -492000 ekin = 3.79923632244415 | erot = 2.97333279544435 | epot = -20.0551067764556 | etot = -13.2825376585671 -493000 ekin = 3.78992062784184 | erot = 2.97831679174276 | epot = -20.0507750780124 | etot = -13.2825376584278 -494000 ekin = 3.79229313456423 | erot = 2.9705277109171 | epot = -20.0453585079524 | etot = -13.282537662471 -495000 ekin = 3.79451442394719 | erot = 2.93410724508575 | epot = -20.011159328423 | etot = -13.28253765939 -496000 ekin = 3.81062488236668 | erot = 2.88141942471639 | epot = -19.9745819636242 | etot = -13.2825376565411 -497000 ekin = 3.85788186105167 | erot = 2.8337274407664 | epot = -19.9741469603156 | etot = -13.2825376584975 -498000 ekin = 3.91884579383985 | erot = 2.78115548049834 | epot = -19.9825389376995 | etot = -13.2825376633613 -499000 ekin = 3.96315793686362 | erot = 2.70246806480193 | epot = -19.9481636596236 | etot = -13.2825376579581 -500000 ekin = 4.00272057627429 | erot = 2.6104605460005 | epot = -19.8957187797396 | etot = -13.2825376574648 -501000 ekin = 4.04216054274959 | erot = 2.51312796102747 | epot = -19.8378261606831 | etot = -13.2825376569061 -502000 ekin = 4.08330148514055 | erot = 2.41632704308052 | epot = -19.7821661846333 | etot = -13.2825376564122 -503000 ekin = 4.12765179374079 | erot = 2.32533692996321 | epot = -19.7355263797777 | etot = -13.2825376560737 -504000 ekin = 4.17571661390362 | erot = 2.24418432884543 | epot = -19.7024385986737 | etot = -13.2825376559247 -505000 ekin = 4.22673456415084 | erot = 2.17536462285507 | epot = -19.6846368429506 | etot = -13.2825376559447 -506000 ekin = 4.27886046446231 | erot = 2.11995169726186 | epot = -19.6813498177051 | etot = -13.2825376559809 -507000 ekin = 4.32989839510322 | erot = 2.07798999627042 | epot = -19.6904260476131 | etot = -13.2825376562394 -508000 ekin = 4.3768369745921 | erot = 2.0484622335072 | epot = -19.7078368645372 | etot = -13.2825376564379 -509000 ekin = 4.41701088937313 | erot = 2.0304046125134 | epot = -19.7299531584259 | etot = -13.2825376565393 -510000 ekin = 4.44869291188757 | erot = 2.0233924534456 | epot = -19.7546230218699 | etot = -13.2825376565367 -511000 ekin = 4.47114700664101 | erot = 2.02761863548855 | epot = -19.7813032985787 | etot = -13.2825376564492 -512000 ekin = 4.48448870189135 | erot = 2.04375687850346 | epot = -19.8107832368134 | etot = -13.2825376564186 -513000 ekin = 4.48914630707508 | erot = 2.07205454687262 | epot = -19.8437385103018 | etot = -13.2825376563541 -514000 ekin = 4.48557666179932 | erot = 2.11236294794912 | epot = -19.880477266066 | etot = -13.2825376563175 -515000 ekin = 4.47432723707008 | erot = 2.16436581139646 | epot = -19.9212307047954 | etot = -13.2825376563288 -516000 ekin = 4.45582679665326 | erot = 2.22719069336678 | epot = -19.9655551464159 | etot = -13.2825376563958 -517000 ekin = 4.43030463229704 | erot = 2.29935278530235 | epot = -20.0121950741138 | etot = -13.2825376565144 -518000 ekin = 4.39778184135852 | erot = 2.37880116113811 | epot = -20.0591206591697 | etot = -13.282537656673 -519000 ekin = 4.35811170485676 | erot = 2.46303435402768 | epot = -20.1036837157425 | etot = -13.2825376568581 -520000 ekin = 4.31103971552051 | erot = 2.54924277018622 | epot = -20.1428201427636 | etot = -13.2825376570569 -521000 ekin = 4.25625922128501 | erot = 2.63444730370309 | epot = -20.173244182248 | etot = -13.2825376572599 -522000 ekin = 4.19345339504261 | erot = 2.71562973710984 | epot = -20.1916207896092 | etot = -13.2825376574568 -523000 ekin = 4.12233106589696 | erot = 2.78987661785769 | epot = -20.1947453413877 | etot = -13.2825376576331 -524000 ekin = 4.04267462478795 | erot = 2.85456825314245 | epot = -20.1797805356988 | etot = -13.2825376577684 -525000 ekin = 3.95441508753717 | erot = 2.90762892529157 | epot = -20.1445816706651 | etot = -13.2825376578364 -526000 ekin = 3.85773415549755 | erot = 2.94781757723194 | epot = -20.0880893905407 | etot = -13.2825376578112 -527000 ekin = 3.75317337789126 | erot = 2.97499774805777 | epot = -20.0107087836244 | etot = -13.2825376576754 -528000 ekin = 3.6417156647281 | erot = 2.99029287548742 | epot = -19.9145462004724 | etot = -13.2825376602569 -529000 ekin = 3.5213345798146 | erot = 2.97329981123624 | epot = -19.7771720480706 | etot = -13.2825376570198 -530000 ekin = 3.40524483354961 | erot = 2.93138498576056 | epot = -19.6191674717665 | etot = -13.2825376524564 -531000 ekin = 3.31329586024631 | erot = 2.90771179337398 | epot = -19.503545306618 | etot = -13.2825376529977 -532000 ekin = 3.23028138423145 | erot = 2.91095227687854 | epot = -19.4237713182462 | etot = -13.2825376571362 -533000 ekin = 3.12254472504979 | erot = 2.92159652025145 | epot = -19.3266789030896 | etot = -13.2825376577884 -534000 ekin = 3.01044793877335 | erot = 2.93913625615111 | epot = -19.2321218524839 | etot = -13.2825376575594 -535000 ekin = 2.90665974197989 | erot = 2.96765394779521 | epot = -19.1568513472187 | etot = -13.2825376574435 -536000 ekin = 2.81267447143307 | erot = 3.00750648802701 | epot = -19.1027186169091 | etot = -13.282537657449 -537000 ekin = 2.72954271624314 | erot = 3.05761918512468 | epot = -19.0696995589408 | etot = -13.282537657573 -538000 ekin = 2.65787075123318 | erot = 3.1155333628036 | epot = -19.0559417718371 | etot = -13.2825376578003 -539000 ekin = 2.59787048049701 | erot = 3.17759265897041 | epot = -19.058000797571 | etot = -13.2825376581036 -540000 ekin = 2.54945648890533 | erot = 3.23927692411588 | epot = -19.0712710714641 | etot = -13.2825376584429 -541000 ekin = 2.51237864339879 | erot = 3.29568121874551 | epot = -19.0905975209143 | etot = -13.28253765877 -542000 ekin = 2.48636877597475 | erot = 3.34210880590418 | epot = -19.1110152409131 | etot = -13.2825376590342 -543000 ekin = 2.47126990556773 | erot = 3.37470651251081 | epot = -19.1285140772705 | etot = -13.282537659192 -544000 ekin = 2.46711428277069 | erot = 3.39103758941789 | epot = -19.1406895314063 | etot = -13.2825376592177 -545000 ekin = 2.47411735000801 | erot = 3.39046709617408 | epot = -19.1471221052938 | etot = -13.2825376591117 -546000 ekin = 2.49256786330982 | erot = 3.37425739407446 | epot = -19.1493629162877 | etot = -13.2825376589034 -547000 ekin = 2.52261985355643 | erot = 3.34533431810425 | epot = -19.1504918303061 | etot = -13.2825376586455 -548000 ekin = 2.56402294022763 | erot = 3.30777050324809 | epot = -19.1543311018765 | etot = -13.2825376584007 -549000 ekin = 2.61585467172408 | erot = 3.26610888708041 | epot = -19.1645012170318 | etot = -13.2825376582273 -550000 ekin = 2.67632806502137 | erot = 3.22468583527721 | epot = -19.1835515584625 | etot = -13.2825376581639 -551000 ekin = 2.74273542047784 | erot = 3.18709627675137 | epot = -19.212369355452 | etot = -13.2825376582228 -552000 ekin = 2.81155537633641 | erot = 3.15588528380799 | epot = -19.2499783185349 | etot = -13.2825376583905 -553000 ekin = 2.87870715456312 | erot = 3.13247774360667 | epot = -19.2937225568045 | etot = -13.2825376586348 -554000 ekin = 2.93989960588913 | erot = 3.11729757853032 | epot = -19.3397348433338 | etot = -13.2825376589144 -555000 ekin = 2.99100571713839 | erot = 3.10999728881187 | epot = -19.3835406651408 | etot = -13.2825376591905 -556000 ekin = 3.02839929469222 | erot = 3.10971957917835 | epot = -19.4206565333019 | etot = -13.2825376594313 -557000 ekin = 3.04921300214531 | erot = 3.11533545055502 | epot = -19.4470861123157 | etot = -13.2825376596154 -558000 ekin = 3.05150347330643 | erot = 3.12563190762761 | epot = -19.4596730406651 | etot = -13.282537659731 -559000 ekin = 3.03432873632176 | erot = 3.13944482423642 | epot = -19.4563112203321 | etot = -13.2825376597739 -560000 ekin = 2.99775269247934 | erot = 3.15574356338642 | epot = -19.4360339156122 | etot = -13.2825376597465 -561000 ekin = 2.942791717946 | erot = 3.17367577834175 | epot = -19.399005155943 | etot = -13.2825376596552 -562000 ekin = 2.87131567491456 | erot = 3.19257954674671 | epot = -19.3464328811715 | etot = -13.2825376595102 -563000 ekin = 2.78591370477175 | erot = 3.21196929020305 | epot = -19.280420654299 | etot = -13.2825376593242 -564000 ekin = 2.68973533676632 | erot = 3.2315030248807 | epot = -19.2037760207577 | etot = -13.2825376591107 -565000 ekin = 2.58631900803934 | erot = 3.25094003295475 | epot = -19.119796699877 | etot = -13.2825376588829 -566000 ekin = 2.47942134876985 | erot = 3.27009788588037 | epot = -19.0320568933032 | etot = -13.282537658653 -567000 ekin = 2.37285930824509 | erot = 3.28881390753205 | epot = -18.9442108742075 | etot = -13.2825376584304 -568000 ekin = 2.27037477203514 | erot = 3.30691420257913 | epot = -18.8598266328372 | etot = -13.2825376582229 -569000 ekin = 2.17552646993524 | erot = 3.32418852070849 | epot = -18.7822526486799 | etot = -13.2825376580362 -570000 ekin = 2.0916071735766 | erot = 3.34036686781736 | epot = -18.7145116992692 | etot = -13.2825376578753 -571000 ekin = 2.02157831416005 | erot = 3.35509336874294 | epot = -18.6592093406479 | etot = -13.2825376577449 -572000 ekin = 1.96800973250246 | erot = 3.36789498999432 | epot = -18.6184423801486 | etot = -13.2825376576519 -573000 ekin = 1.93301131086791 | erot = 3.37814685793653 | epot = -18.5936958264077 | etot = -13.2825376576033 -574000 ekin = 1.91814454491553 | erot = 3.38504063675326 | epot = -18.5857228392773 | etot = -13.2825376576086 -575000 ekin = 1.92430832573438 | erot = 3.38756624559585 | epot = -18.5944122290066 | etot = -13.2825376576764 -576000 ekin = 1.9516044746804 | erot = 3.38452119824724 | epot = -18.6186633307411 | etot = -13.2825376578134 -577000 ekin = 1.99920036892028 | erot = 3.37456184631277 | epot = -18.6562998732547 | etot = -13.2825376580217 -578000 ekin = 2.06522335780326 | erot = 3.3563097483278 | epot = -18.7040707644236 | etot = -13.2825376582925 -579000 ekin = 2.14673519282893 | erot = 3.32851940881583 | epot = -18.7577922602505 | etot = -13.2825376586057 -580000 ekin = 2.23983758245539 | erot = 3.29029959753275 | epot = -18.8126748389157 | etot = -13.2825376589276 -581000 ekin = 2.33993889925887 | erot = 3.2413588198074 | epot = -18.8638353782815 | etot = -13.2825376592153 -582000 ekin = 2.44216781901565 | erot = 3.18222403799831 | epot = -18.9069295164397 | etot = -13.2825376594258 -583000 ekin = 2.54186285338052 | erot = 3.1143690597616 | epot = -18.9387695726707 | etot = -13.2825376595286 -584000 ekin = 2.63514321917816 | erot = 3.04016994422167 | epot = -18.9578508227168 | etot = -13.2825376593169 -585000 ekin = 2.72038124549096 | erot = 2.96231486728252 | epot = -18.9652337720559 | etot = -13.2825376592824 -586000 ekin = 2.7952974207905 | erot = 2.88397447346059 | epot = -18.9618095534243 | etot = -13.2825376591732 -587000 ekin = 2.85803030912891 | erot = 2.80849541231913 | epot = -18.9490633804701 | etot = -13.2825376590221 -588000 ekin = 2.90761924156397 | erot = 2.73897208361712 | epot = -18.9291289840422 | etot = -13.2825376588611 -589000 ekin = 2.94382190769964 | erot = 2.67796026302752 | epot = -18.9043198294429 | etot = -13.2825376587158 -590000 ekin = 2.96693832518019 | erot = 2.6272442019698 | epot = -18.8767201857498 | etot = -13.2825376585998 -591000 ekin = 2.9776673784336 | erot = 2.58778349308244 | epot = -18.8479885300359 | etot = -13.2825376585198 -592000 ekin = 2.97699718658232 | erot = 2.55971358412153 | epot = -18.8192484291808 | etot = -13.2825376584769 -593000 ekin = 2.96611919165071 | erot = 2.54241252024637 | epot = -18.7910693703647 | etot = -13.2825376584677 -594000 ekin = 2.94635665290357 | erot = 2.53461934100801 | epot = -18.7635136523971 | etot = -13.2825376584855 -595000 ekin = 2.91908569710317 | erot = 2.53443482988756 | epot = -18.736058185673 | etot = -13.2825376586822 -596000 ekin = 2.88535047381584 | erot = 2.53857982682822 | epot = -18.706467959406 | etot = -13.2825376587619 -597000 ekin = 2.84590859895571 | erot = 2.54482361731877 | epot = -18.6732698750857 | etot = -13.2825376588112 -598000 ekin = 2.80153060629686 | erot = 2.55163242418938 | epot = -18.6357006893087 | etot = -13.2825376588225 -599000 ekin = 2.75300405718648 | erot = 2.55803363009657 | epot = -18.5935753460797 | etot = -13.2825376587966 -600000 ekin = 2.70110632480755 | erot = 2.56364667647513 | epot = -18.5472906600213 | etot = -13.2825376587386 -601000 ekin = 2.64657369870734 | erot = 2.56865533019019 | epot = -18.4977666875495 | etot = -13.282537658652 -602000 ekin = 2.59009198471546 | erot = 2.5737572619282 | epot = -18.4463869051824 | etot = -13.2825376585387 -603000 ekin = 2.532310533728 | erot = 2.58010020265793 | epot = -18.3949483947879 | etot = -13.282537658402 -604000 ekin = 2.47386381071126 | erot = 2.58919184015783 | epot = -18.3455933091172 | etot = -13.2825376582481 -605000 ekin = 2.41538802269351 | erot = 2.60277705144679 | epot = -18.3007027322262 | etot = -13.2825376580859 -606000 ekin = 2.35753010243637 | erot = 2.62269152368394 | epot = -18.2627592840459 | etot = -13.2825376579255 -607000 ekin = 2.30095094646976 | erot = 2.65066096470521 | epot = -18.2341495689621 | etot = -13.2825376577872 -608000 ekin = 2.24632550980833 | erot = 2.68812711798965 | epot = -18.2169902854651 | etot = -13.2825376576671 -609000 ekin = 2.19433984204655 | erot = 2.73619296832811 | epot = -18.2130704679535 | etot = -13.2825376575789 -610000 ekin = 2.1456873411568 | erot = 2.79546287797992 | epot = -18.2236878766662 | etot = -13.2825376575294 -611000 ekin = 2.10106577311586 | erot = 2.86594569746529 | epot = -18.2495491281048 | etot = -13.2825376575236 -612000 ekin = 2.0611756976334 | erot = 2.94698805374731 | epot = -18.2907014089446 | etot = -13.2825376575639 -613000 ekin = 2.02671979093704 | erot = 3.03724338411882 | epot = -18.3465008327059 | etot = -13.28253765765 -614000 ekin = 1.99840061160153 | erot = 3.13468327208674 | epot = -18.4156215414674 | etot = -13.2825376577792 -615000 ekin = 1.97691265350056 | erot = 3.2366575694735 | epot = -18.496107880919 | etot = -13.282537657945 -616000 ekin = 1.96292427457188 | erot = 3.34000833576675 | epot = -18.5854702684777 | etot = -13.2825376581391 -617000 ekin = 1.95704706954883 | erot = 3.44123904148788 | epot = -18.6808237693867 | etot = -13.28253765835 -618000 ekin = 1.959794260624 | erot = 3.53673433570158 | epot = -18.7790662548898 | etot = -13.2825376585642 -619000 ekin = 1.9715343673676 | erot = 3.62301686059804 | epot = -18.8770888867321 | etot = -13.2825376587665 -620000 ekin = 1.99244950084197 | erot = 3.69701656992999 | epot = -18.972003729714 | etot = -13.2825376589421 -621000 ekin = 2.02250680812395 | erot = 3.75631711882003 | epot = -19.0613615860228 | etot = -13.2825376590788 -622000 ekin = 2.06144629221926 | erot = 3.79933797526636 | epot = -19.1433219266566 | etot = -13.2825376591709 -623000 ekin = 2.10878075941396 | erot = 3.8254151393852 | epot = -19.2167335580189 | etot = -13.2825376592197 -624000 ekin = 2.16379839199852 | erot = 3.83475982185834 | epot = -19.2810958730921 | etot = -13.2825376592353 -625000 ekin = 2.22555932783782 | erot = 3.82830035124808 | epot = -19.3363973383196 | etot = -13.2825376592337 -626000 ekin = 2.29288544261924 | erot = 3.8074411034664 | epot = -19.3828642053187 | etot = -13.2825376592331 -627000 ekin = 2.36435394306741 | erot = 3.77379464740524 | epot = -19.4206862497203 | etot = -13.2825376592476 -628000 ekin = 2.4383143267512 | erot = 3.72895154256394 | epot = -19.4498035285972 | etot = -13.2825376592821 -629000 ekin = 2.51294897945051 | erot = 3.67434156157469 | epot = -19.4698282003552 | etot = -13.28253765933 -630000 ekin = 2.58638771765393 | erot = 3.61121141783299 | epot = -19.4801367948617 | etot = -13.2825376593748 -631000 ekin = 2.65686759984471 | erot = 3.54070434321331 | epot = -19.4801096088491 | etot = -13.2825376657911 -632000 ekin = 2.7229119026317 | erot = 3.46399577716167 | epot = -19.4694453501616 | etot = -13.2825376703683 -633000 ekin = 2.78348672610773 | erot = 3.38241264799394 | epot = -19.4484370443956 | etot = -13.2825376702939 -634000 ekin = 2.83810143013093 | erot = 3.29749507667659 | epot = -19.4181341769767 | etot = -13.2825376701692 -635000 ekin = 2.88683118401642 | erot = 3.21096793801023 | epot = -19.3803367920312 | etot = -13.2825376700046 -636000 ekin = 2.93026618629758 | erot = 3.12465298496329 | epot = -19.3374568410755 | etot = -13.2825376698146 -637000 ekin = 2.96941056884663 | erot = 3.04036924656817 | epot = -19.2923174850264 | etot = -13.2825376696116 -638000 ekin = 3.0055616969203 | erot = 2.95987410217464 | epot = -19.2479734684973 | etot = -13.2825376694023 -639000 ekin = 3.04019340863902 | erot = 2.88486846877173 | epot = -19.2075995465998 | etot = -13.282537669189 -640000 ekin = 3.07485121522857 | erot = 2.81704601028329 | epot = -19.1744348944859 | etot = -13.282537668974 -641000 ekin = 3.11105408027351 | erot = 2.75813097964004 | epot = -19.1517227286789 | etot = -13.2825376687654 -642000 ekin = 3.15019312326614 | erot = 2.70984405485486 | epot = -19.1425748467004 | etot = -13.2825376685794 -643000 ekin = 3.19342381263007 | erot = 2.6737639947772 | epot = -19.1497254758466 | etot = -13.2825376684393 -644000 ekin = 3.24155882074965 | erot = 2.65109893593392 | epot = -19.1751954250542 | etot = -13.2825376683706 -645000 ekin = 3.29497575522052 | erot = 2.64241916696972 | epot = -19.2199325905852 | etot = -13.282537668395 -646000 ekin = 3.35355393406662 | erot = 2.6474169032197 | epot = -19.2835085058124 | etot = -13.2825376685261 -647000 ekin = 3.41664956860753 | erot = 2.66474995394781 | epot = -19.3639371913219 | etot = -13.2825376687666 -648000 ekin = 3.48311410605676 | erot = 2.69200913896285 | epot = -19.4576609141254 | etot = -13.2825376691058 -649000 ekin = 3.55135925694157 | erot = 2.72583530733012 | epot = -19.5597322337903 | etot = -13.2825376695186 -650000 ekin = 3.61947301797256 | erot = 2.76220049491302 | epot = -19.66421118285 | etot = -13.2825376699645 -651000 ekin = 3.68538880274599 | erot = 2.7968481634757 | epot = -19.7647746366125 | etot = -13.2825376703908 -652000 ekin = 3.74709908730764 | erot = 2.82584894414338 | epot = -19.8554857021924 | etot = -13.2825376707414 -653000 ekin = 3.80288488877765 | erot = 2.84617490646512 | epot = -19.9315974662116 | etot = -13.2825376709688 -654000 ekin = 3.85151192348354 | erot = 2.8561531933117 | epot = -19.990202787845 | etot = -13.2825376710498 -655000 ekin = 3.89233743676938 | erot = 2.8556624036667 | epot = -20.0305375114281 | etot = -13.282537670992 -656000 ekin = 3.92529306043646 | erot = 2.84600373605527 | epot = -20.0538344673234 | etot = -13.2825376708317 -657000 ekin = 3.95074924371718 | erot = 2.82948452039907 | epot = -20.0627714347384 | etot = -13.2825376706221 -658000 ekin = 3.96930448524318 | erot = 2.8088410501164 | epot = -20.0606832057771 | etot = -13.2825376704176 -659000 ekin = 3.98156254977942 | erot = 2.78666073058104 | epot = -20.0507609506214 | etot = -13.282537670261 -660000 ekin = 3.98794995383628 | erot = 2.76493225942287 | epot = -20.0354198834365 | etot = -13.2825376701774 -661000 ekin = 3.98860416115366 | erot = 2.74479055428754 | epot = -20.015932385614 | etot = -13.2825376701728 -662000 ekin = 3.9833373621284 | erot = 2.72646306735558 | epot = -19.9923380997221 | etot = -13.2825376702381 -663000 ekin = 3.97166196864596 | erot = 2.70938404532092 | epot = -19.963583684321 | etot = -13.2825376703541 -664000 ekin = 3.95286211460538 | erot = 2.69242500163181 | epot = -19.9278247867315 | etot = -13.2825376704943 -665000 ekin = 3.92609780976883 | erot = 2.67418491171738 | epot = -19.8828203921176 | etot = -13.2825376706314 -666000 ekin = 3.89053574203668 | erot = 2.65328635574204 | epot = -19.8263597685171 | etot = -13.2825376707384 -667000 ekin = 3.8455051846995 | erot = 2.62863029044565 | epot = -19.7566731459372 | etot = -13.2825376707921 -668000 ekin = 3.79067534881142 | erot = 2.59957256262293 | epot = -19.6727855822096 | etot = -13.2825376707752 -669000 ekin = 3.7262419486302 | erot = 2.56600183381255 | epot = -19.5747814531206 | etot = -13.2825376706778 -670000 ekin = 3.65309967706656 | erot = 2.52832169427138 | epot = -19.4639590418358 | etot = -13.2825376704979 -671000 ekin = 3.57296811019995 | erot = 2.48736383191386 | epot = -19.342869612354 | etot = -13.2825376702402 -672000 ekin = 3.48843263532053 | erot = 2.44427271264383 | epot = -19.2152430178819 | etot = -13.2825376699176 -673000 ekin = 3.40286035230263 | erot = 2.40039617767022 | epot = -19.0857941995252 | etot = -13.2825376695524 -674000 ekin = 3.32015657281286 | erot = 2.35719425457146 | epot = -18.9598884965615 | etot = -13.2825376691772 -675000 ekin = 3.24436019808318 | erot = 2.3161584141183 | epot = -18.8430562810336 | etot = -13.2825376688321 -676000 ekin = 3.17913583606218 | erot = 2.27873161512007 | epot = -18.7404051197388 | etot = -13.2825376685566 -677000 ekin = 3.12743284478882 | erot = 2.24616920609518 | epot = -18.656139719201 | etot = -13.282537668317 -678000 ekin = 3.09116321203348 | erot = 2.21938913067101 | epot = -18.5930900109803 | etot = -13.2825376682758 -679000 ekin = 3.06996492216854 | erot = 2.19955802308236 | epot = -18.5520606135364 | etot = -13.2825376682855 -680000 ekin = 3.06282540104525 | erot = 2.1876705770889 | epot = -18.5330336464577 | etot = -13.2825376683235 -681000 ekin = 3.06856941757744 | erot = 2.18446333304044 | epot = -18.5355704189915 | etot = -13.2825376683736 -682000 ekin = 3.08614503867108 | erot = 2.19031007374487 | epot = -18.558992780881 | etot = -13.282537668465 -683000 ekin = 3.11401676516072 | erot = 2.20483123960418 | epot = -18.6013856734434 | etot = -13.2825376686785 -684000 ekin = 3.14994970495273 | erot = 2.22703766522701 | epot = -18.6595250391531 | etot = -13.2825376689733 -685000 ekin = 3.19138817293996 | erot = 2.25525783712498 | epot = -18.7291836793918 | etot = -13.2825376693269 -686000 ekin = 3.23553597362021 | erot = 2.28721755219637 | epot = -18.8052911955215 | etot = -13.2825376697049 -687000 ekin = 3.27958856788279 | erot = 2.32030038563253 | epot = -18.8824266235811 | etot = -13.2825376700658 -688000 ekin = 3.32103493723499 | erot = 2.35186996598162 | epot = -18.9554425735786 | etot = -13.282537670362 -689000 ekin = 3.35799818037969 | erot = 2.37963585731743 | epot = -19.0201717082469 | etot = -13.2825376705498 -690000 ekin = 3.38953188175939 | erot = 2.40199807237719 | epot = -19.0740676247395 | etot = -13.2825376706029 -691000 ekin = 3.4157714469421 | erot = 2.41828305274825 | epot = -19.1165921702108 | etot = -13.2825376705204 -692000 ekin = 3.43789562335505 | erot = 2.42879295704677 | epot = -19.1492262507342 | etot = -13.2825376703324 -693000 ekin = 3.45784949823239 | erot = 2.43469159317282 | epot = -19.1750787614881 | etot = -13.2825376700829 -694000 ekin = 3.47795427967203 | erot = 2.43774070867895 | epot = -19.1982326581721 | etot = -13.2825376698211 -695000 ekin = 3.50053093039304 | erot = 2.4399713160839 | epot = -19.2230399160612 | etot = -13.2825376695842 -696000 ekin = 3.52761050730482 | erot = 2.44340337549077 | epot = -19.2535515521878 | etot = -13.2825376693922 -697000 ekin = 3.56079077323185 | erot = 2.44986396553548 | epot = -19.2931924080162 | etot = -13.2825376692489 -698000 ekin = 3.60121696147781 | erot = 2.46089758485735 | epot = -19.344652215487 | etot = -13.2825376691518 -699000 ekin = 3.64961213279439 | erot = 2.47770733426397 | epot = -19.4098571361632 | etot = -13.2825376691048 -700000 ekin = 3.70626748084738 | erot = 2.50104915956855 | epot = -19.4898543095423 | etot = -13.2825376691264 -701000 ekin = 3.77093513696172 | erot = 2.53103621287676 | epot = -19.5845090190851 | etot = -13.2825376692466 -702000 ekin = 3.84262768940316 | erot = 2.56687733849248 | epot = -19.692042697393 | etot = -13.2825376694974 -703000 ekin = 3.91940034762487 | erot = 2.606641106386 | epot = -19.8085791239058 | etot = -13.2825376698949 -704000 ekin = 3.99823585473084 | erot = 2.64716826818578 | epot = -19.9279417933416 | etot = -13.282537670425 -705000 ekin = 4.07514464413388 | erot = 2.68423896185882 | epot = -20.0419212770262 | etot = -13.2825376710335 -706000 ekin = 4.14554203036204 | erot = 2.71304391275063 | epot = -20.1411236147438 | etot = -13.2825376716311 -707000 ekin = 4.20487575193296 | erot = 2.72892533730943 | epot = -20.2163387613507 | etot = -13.2825376721083 -708000 ekin = 4.24938283126103 | erot = 2.72825870748057 | epot = -20.2601792111048 | etot = -13.2825376723632 -709000 ekin = 4.27678612884219 | erot = 2.70926619646602 | epot = -20.2685899976397 | etot = -13.2825376723315 -710000 ekin = 4.28673081640694 | erot = 2.67252621891708 | epot = -20.2417947073323 | etot = -13.2825376720083 -711000 ekin = 4.28082322621957 | erot = 2.62101051796723 | epot = -20.1843714156378 | etot = -13.282537671451 -712000 ekin = 4.26225868778 | erot = 2.55962600084258 | epot = -20.1044223593835 | etot = -13.2825376707609 -713000 ekin = 4.23515498223018 | erot = 2.4944028055444 | epot = -20.0120954578277 | etot = -13.2825376700531 -714000 ekin = 4.20378550521692 | erot = 2.43156567584085 | epot = -19.917888850485 | etot = -13.2825376694272 -715000 ekin = 4.17190188733734 | erot = 2.37671476691363 | epot = -19.8311543232015 | etot = -13.2825376689505 -716000 ekin = 4.14226649349206 | erot = 2.3342523697806 | epot = -19.7590565319274 | etot = -13.2825376686548 -717000 ekin = 4.11642945244376 | erot = 2.30708700175745 | epot = -19.7060541227433 | etot = -13.2825376685421 -718000 ekin = 4.09471959165695 | erot = 2.29657561670706 | epot = -19.6738328769572 | etot = -13.2825376685932 -719000 ekin = 4.07639008592127 | erot = 2.30263774999632 | epot = -19.6615655046944 | etot = -13.2825376687768 -720000 ekin = 4.05985922916209 | erot = 2.32397934765001 | epot = -19.6663762458682 | etot = -13.2825376690561 -721000 ekin = 4.04299880693399 | erot = 2.35837721353457 | epot = -19.6839136898589 | etot = -13.2825376693903 -722000 ekin = 4.02343688315899 | erot = 2.40299878610026 | epot = -19.7089733390021 | etot = -13.2825376697429 -723000 ekin = 3.99884065343804 | erot = 2.45471133767568 | epot = -19.7360896611936 | etot = -13.2825376700799 -724000 ekin = 3.96717167902019 | erot = 2.51036796126357 | epot = -19.7600773106559 | etot = -13.2825376703722 -725000 ekin = 3.92690441967021 | erot = 2.56705586836307 | epot = -19.776497958628 | etot = -13.2825376705947 -726000 ekin = 3.877296379763 | erot = 2.62227216901836 | epot = -19.7821062194432 | etot = -13.2825376706619 -727000 ekin = 3.81909687723751 | erot = 2.67389404657874 | epot = -19.7755285945101 | etot = -13.2825376706939 -728000 ekin = 3.75316507804808 | erot = 2.7209643611948 | epot = -19.7566671098371 | etot = -13.2825376705942 -729000 ekin = 3.68121241124831 | erot = 2.76353487071471 | epot = -19.7272849523308 | etot = -13.2825376703678 -730000 ekin = 3.6059508327336 | erot = 2.8025565644494 | epot = -19.6910450672226 | etot = -13.2825376700396 -731000 ekin = 3.5308358576752 | erot = 2.83972569859104 | epot = -19.653099225923 | etot = -13.2825376696568 -732000 ekin = 3.45966885133483 | erot = 2.87715368835431 | epot = -19.6193602089727 | etot = -13.2825376692835 -733000 ekin = 3.39612153666129 | erot = 2.91688280104535 | epot = -19.5955420066942 | etot = -13.2825376689875 -734000 ekin = 3.34327992468391 | erot = 2.96033658921789 | epot = -19.586154182727 | etot = -13.2825376688252 -735000 ekin = 3.30330112894221 | erot = 3.00783596110657 | epot = -19.5936747588771 | etot = -13.2825376688283 -736000 ekin = 3.27724072963153 | erot = 3.05831043253391 | epot = -19.6180888311626 | etot = -13.2825376689972 -737000 ekin = 3.26506253896072 | erot = 3.10929392283094 | epot = -19.6568941310923 | etot = -13.2825376693006 -738000 ekin = 3.26580566526431 | erot = 3.15723003734709 | epot = -19.7055733722939 | etot = -13.2825376696825 -739000 ekin = 3.27786090585715 | erot = 3.19803615726732 | epot = -19.7584347331987 | etot = -13.2825376700742 -740000 ekin = 3.29929519802999 | erot = 3.22780296867075 | epot = -19.8096358371115 | etot = -13.2825376704108 -741000 ekin = 3.32815980265726 | erot = 3.24345768500962 | epot = -19.8541551583124 | etot = -13.2825376706455 -742000 ekin = 3.36272243968287 | erot = 3.2432241961257 | epot = -19.8884843065695 | etot = -13.282537670761 -743000 ekin = 3.40154954264288 | erot = 3.2265963503818 | epot = -19.910683563855 | etot = -13.2825376708303 -744000 ekin = 3.4435569016163 | erot = 3.19405338784973 | epot = -19.9201479602027 | etot = -13.2825376707366 -745000 ekin = 3.48810285816643 | erot = 3.1476343280298 | epot = -19.9182748567922 | etot = -13.2825376705959 -746000 ekin = 3.53467364483636 | erot = 3.09004249683477 | epot = -19.9072538121133 | etot = -13.2825376704422 -747000 ekin = 3.58273489719278 | erot = 3.02422947594395 | epot = -19.8895020434337 | etot = -13.282537670297 -748000 ekin = 3.63163431992382 | erot = 2.95313859311453 | epot = -19.8673105832095 | etot = -13.2825376701711 -749000 ekin = 3.68055410772631 | erot = 2.87956450536645 | epot = -19.8426562831615 | etot = -13.2825376700687 -750000 ekin = 3.72850264878195 | erot = 2.80607481970415 | epot = -19.8171151384803 | etot = -13.2825376699942 -751000 ekin = 3.77431992735756 | erot = 2.73492674317463 | epot = -19.7917843404902 | etot = -13.282537669958 -752000 ekin = 3.81667135032455 | erot = 2.66792933662917 | epot = -19.7671383569314 | etot = -13.2825376699777 -753000 ekin = 3.85401538818405 | erot = 2.60623951614805 | epot = -19.7427925744073 | etot = -13.2825376700752 -754000 ekin = 3.88455267934827 | erot = 2.55013273026535 | epot = -19.7172230798809 | etot = -13.2825376702673 -755000 ekin = 3.90620090059213 | erot = 2.49884999016387 | epot = -19.6875885613037 | etot = -13.2825376705477 -756000 ekin = 3.91710462659181 | erot = 2.45069600001941 | epot = -19.6503382971558 | etot = -13.2825376705446 -757000 ekin = 3.9172579202584 | erot = 2.40369183428787 | epot = -19.6034874252701 | etot = -13.2825376707238 -758000 ekin = 3.9062285486505 | erot = 2.35617894285691 | epot = -19.5449451622691 | etot = -13.2825376707616 -759000 ekin = 3.88450313649663 | erot = 2.30751185300537 | epot = -19.4745526600901 | etot = -13.2825376705881 -760000 ekin = 3.85399004377755 | erot = 2.25863561783757 | epot = -19.395163331816 | etot = -13.2825376702009 -761000 ekin = 3.81799666982571 | erot = 2.21208980046811 | epot = -19.3126241399681 | etot = -13.2825376696743 -762000 ekin = 3.78022631319321 | erot = 2.17128933430875 | epot = -19.2340533167241 | etot = -13.2825376692221 -763000 ekin = 3.7366180252016 | erot = 2.13809664147806 | epot = -19.1572523356113 | etot = -13.2825376689316 -764000 ekin = 3.68660767297656 | erot = 2.11458113784664 | epot = -19.0837264795493 | etot = -13.2825376687261 -765000 ekin = 3.63152213040596 | erot = 2.10258243850173 | epot = -19.0166422375194 | etot = -13.2825376686117 -766000 ekin = 3.57217194872735 | erot = 2.1031936475929 | epot = -18.9579032648434 | etot = -13.2825376685232 -767000 ekin = 3.50915043230658 | erot = 2.11696161070578 | epot = -18.9086497115305 | etot = -13.2825376685181 -768000 ekin = 3.44287730030143 | erot = 2.14384189418983 | epot = -18.8692568629862 | etot = -13.282537668495 -769000 ekin = 3.37407811668166 | erot = 2.18352203430368 | epot = -18.8401378194328 | etot = -13.2825376684474 -770000 ekin = 3.30402691102912 | erot = 2.23544699328996 | epot = -18.8220115727027 | etot = -13.2825376683836 -771000 ekin = 3.23454927904009 | erot = 2.29870117920768 | epot = -18.8157881266211 | etot = -13.2825376683733 -772000 ekin = 3.16778213081539 | erot = 2.37165603567085 | epot = -18.8219758348638 | etot = -13.2825376683776 -773000 ekin = 3.10585178825157 | erot = 2.45189360020701 | epot = -18.8402830568753 | etot = -13.2825376684167 -774000 ekin = 3.05132445362867 | erot = 2.53742495789882 | epot = -18.871287079784 | etot = -13.2825376682565 -775000 ekin = 3.00630147843413 | erot = 2.62609752201218 | epot = -18.9149366688656 | etot = -13.2825376684193 -776000 ekin = 2.97144443264239 | erot = 2.71477730985895 | epot = -18.9687594110712 | etot = -13.2825376685698 -777000 ekin = 2.94698171102012 | erot = 2.80100976983049 | epot = -19.0305291495212 | etot = -13.2825376686706 -778000 ekin = 2.93288277550831 | erot = 2.88339388730573 | epot = -19.098814331498 | etot = -13.282537668684 -779000 ekin = 2.92910730289328 | erot = 2.96183002798064 | epot = -19.1734749994681 | etot = -13.2825376685942 -780000 ekin = 2.93579388568063 | erot = 3.03750518021602 | epot = -19.2558367343219 | etot = -13.2825376684252 -781000 ekin = 2.95325630950229 | erot = 3.11251463627355 | epot = -19.3483086140145 | etot = -13.2825376682386 -782000 ekin = 2.98176618547997 | erot = 3.18917136100467 | epot = -19.453475214596 | etot = -13.2825376681113 -783000 ekin = 3.02122758220232 | erot = 3.26921648813326 | epot = -19.5729817384412 | etot = -13.2825376681056 -784000 ekin = 3.07089714795214 | erot = 3.35319620066784 | epot = -19.706631016868 | etot = -13.2825376682481 -785000 ekin = 3.12925653034025 | erot = 3.44018487512673 | epot = -19.8519790739953 | etot = -13.2825376685283 -786000 ekin = 3.19405797125446 | erot = 3.52788200321986 | epot = -20.0044776433832 | etot = -13.2825376689089 -787000 ekin = 3.26249776188221 | erot = 3.61297785906456 | epot = -20.1580132902899 | etot = -13.2825376693431 -788000 ekin = 3.33144967160237 | erot = 3.69161943951618 | epot = -20.3056067809067 | etot = -13.2825376697881 -789000 ekin = 3.3977055617303 | erot = 3.7598253120626 | epot = -20.4400685440047 | etot = -13.2825376702118 -790000 ekin = 3.45820395550971 | erot = 3.81377941396282 | epot = -20.5545210400606 | etot = -13.282537670588 -791000 ekin = 3.51015148124692 | erot = 3.85000835168307 | epot = -20.6426975044819 | etot = -13.2825376715519 -792000 ekin = 3.54776564943404 | erot = 3.86447708281896 | epot = -20.6947804042004 | etot = -13.2825376719474 -793000 ekin = 3.56673386234454 | erot = 3.85375177260368 | epot = -20.7030233071259 | etot = -13.2825376721777 -794000 ekin = 3.56535433495117 | erot = 3.8159958528987 | epot = -20.6638878600464 | etot = -13.2825376721966 -795000 ekin = 3.5433642377304 | erot = 3.75111846557778 | epot = -20.5770203752941 | etot = -13.2825376719859 -796000 ekin = 3.50191265631727 | erot = 3.66102926484438 | epot = -20.4454795927271 | etot = -13.2825376715655 -797000 ekin = 3.44331621140757 | erot = 3.54957138818473 | epot = -20.2754252705807 | etot = -13.2825376709884 -798000 ekin = 3.37066053438385 | erot = 3.42213246910246 | epot = -20.0753306738125 | etot = -13.2825376703262 -799000 ekin = 3.28735656783115 | erot = 3.28504268659738 | epot = -19.854936924078 | etot = -13.2825376696495 -800000 ekin = 3.19676141014365 | erot = 3.14491706729739 | epot = -19.6242161464546 | etot = -13.2825376690136 -801000 ekin = 3.1019338834663 | erot = 3.00807795311394 | epot = -19.3925495050332 | etot = -13.282537668453 -802000 ekin = 3.00553736754957 | erot = 2.88012979878413 | epot = -19.1682048343172 | etot = -13.2825376679835 -803000 ekin = 2.90985246624439 | erot = 2.76569078056438 | epot = -18.9580809144186 | etot = -13.2825376676099 -804000 ekin = 2.81683808713677 | erot = 2.66824302179126 | epot = -18.7676187762615 | etot = -13.2825376673335 -805000 ekin = 2.72818412044707 | erot = 2.59005510941686 | epot = -18.6007768970192 | etot = -13.2825376671552 -806000 ekin = 2.64532439255026 | erot = 2.53214862203847 | epot = -18.4600106816661 | etot = -13.2825376670774 -807000 ekin = 2.56941186666319 | erot = 2.49430692057274 | epot = -18.3462564543342 | etot = -13.2825376670982 -808000 ekin = 2.50128142888609 | erot = 2.47514940737337 | epot = -18.2589685034691 | etot = -13.2825376672096 -809000 ekin = 2.44144236795178 | erot = 2.47230913362798 | epot = -18.1962891689485 | etot = -13.2825376673687 -810000 ekin = 2.3901270834084 | erot = 2.48271406544476 | epot = -18.1553788164593 | etot = -13.2825376676061 -811000 ekin = 2.34728664736262 | erot = 2.50269653308012 | epot = -18.1325208483028 | etot = -13.2825376678601 -812000 ekin = 2.31275384401542 | erot = 2.52846132067668 | epot = -18.1237528327934 | etot = -13.2825376681013 -813000 ekin = 2.28637472346317 | erot = 2.55641958964496 | epot = -18.1253319814163 | etot = -13.2825376683081 -814000 ekin = 2.26809634302172 | erot = 2.58342175985524 | epot = -18.1340557713469 | etot = -13.2825376684699 -815000 ekin = 2.25799398108596 | erot = 2.60689379309751 | epot = -18.14742544277 | etot = -13.2825376685865 -816000 ekin = 2.25623692236831 | erot = 2.62489117861678 | epot = -18.1636657696475 | etot = -13.2825376686624 -817000 ekin = 2.26301448165039 | erot = 2.63611346240567 | epot = -18.1816656127584 | etot = -13.2825376687023 -818000 ekin = 2.27845464057391 | erot = 2.63992517487904 | epot = -18.2009174841599 | etot = -13.282537668707 -819000 ekin = 2.30255118255274 | erot = 2.63638076673618 | epot = -18.2214696180233 | etot = -13.2825376687344 -820000 ekin = 2.33498671690695 | erot = 2.62599567772565 | epot = -18.2435200633228 | etot = -13.2825376686902 -821000 ekin = 2.37528893738016 | erot = 2.61008048018772 | epot = -18.2679070861769 | etot = -13.282537668609 -822000 ekin = 2.42285081016729 | erot = 2.59073415646192 | epot = -18.2961226351262 | etot = -13.282537668497 -823000 ekin = 2.47691845696036 | erot = 2.57068820917611 | epot = -18.3301443345042 | etot = -13.2825376683677 -824000 ekin = 2.53658809763989 | erot = 2.55309938374537 | epot = -18.3722251496239 | etot = -13.2825376682387 -825000 ekin = 2.60079770131159 | erot = 2.54128433493742 | epot = -18.4246197043761 | etot = -13.2825376681271 -826000 ekin = 2.66832973198145 | erot = 2.53844971720025 | epot = -18.4893171172274 | etot = -13.2825376680457 -827000 ekin = 2.73783541426217 | erot = 2.54745860095133 | epot = -18.5678316832164 | etot = -13.2825376680029 -828000 ekin = 2.80787353741911 | erot = 2.57063837231064 | epot = -18.6610495777373 | etot = -13.2825376680075 -829000 ekin = 2.87694004141752 | erot = 2.60959914998359 | epot = -18.7690768594751 | etot = -13.282537668074 -830000 ekin = 2.94346318720061 | erot = 2.66502277157491 | epot = -18.8910236269993 | etot = -13.2825376682238 -831000 ekin = 3.00576095292576 | erot = 2.73641402737172 | epot = -19.024712648777 | etot = -13.2825376684795 -832000 ekin = 3.06199003539877 | erot = 2.82186650180169 | epot = -19.1663942060527 | etot = -13.2825376688522 -833000 ekin = 3.110148995619 | erot = 2.91795032491558 | epot = -19.3106369898627 | etot = -13.2825376693281 -834000 ekin = 3.1482044935896 | erot = 3.01984474732963 | epot = -19.4505869107779 | etot = -13.2825376698586 -835000 ekin = 3.17437957900523 | erot = 3.12179257978299 | epot = -19.5787098291524 | etot = -13.2825376703642 -836000 ekin = 3.18757195243324 | erot = 3.21784689829009 | epot = -19.6879565214765 | etot = -13.2825376707532 -837000 ekin = 3.18777327474487 | erot = 3.30274497123895 | epot = -19.7730559169407 | etot = -13.2825376709568 -838000 ekin = 3.17628521735482 | erot = 3.37264530226156 | epot = -19.8314681905769 | etot = -13.2825376709605 -839000 ekin = 3.15554655753644 | erot = 3.42547713956057 | epot = -19.8635613679131 | etot = -13.2825376708161 -840000 ekin = 3.12853906990003 | erot = 3.46080086775206 | epot = -19.8718776082709 | etot = -13.2825376706188 -841000 ekin = 3.09797460324615 | erot = 3.47929817821818 | epot = -19.8598104519234 | etot = -13.2825376704591 -842000 ekin = 3.06563312580165 | erot = 3.48217550738637 | epot = -19.8303463035648 | etot = -13.2825376703768 -843000 ekin = 3.03218078490834 | erot = 3.47078119393998 | epot = -19.7854996491911 | etot = -13.2825376703427 -844000 ekin = 2.99754824930944 | erot = 3.44659665122456 | epot = -19.7266825708132 | etot = -13.2825376702792 -845000 ekin = 2.96164676060981 | erot = 3.41154768665394 | epot = -19.6557321173685 | etot = -13.2825376701047 -846000 ekin = 2.92503739739786 | erot = 3.36840998775599 | epot = -19.5759850549297 | etot = -13.2825376697759 -847000 ekin = 2.88924342096714 | erot = 3.32104931095848 | epot = -19.4928304012251 | etot = -13.2825376692995 -848000 ekin = 2.8566499721658 | erot = 3.27432583403358 | epot = -19.4135134749444 | etot = -13.2825376687451 -849000 ekin = 2.83005143133688 | erot = 3.23330176451346 | epot = -19.345890864224 | etot = -13.2825376683736 -850000 ekin = 2.8120559738006 | erot = 3.20226229426142 | epot = -19.2968559356534 | etot = -13.2825376675913 -851000 ekin = 2.80444558745355 | erot = 3.18500981062576 | epot = -19.2719930659006 | etot = -13.2825376678213 -852000 ekin = 2.80546277462239 | erot = 3.18034603826089 | epot = -19.2683464810845 | etot = -13.2825376682013 -853000 ekin = 2.812441214848 | erot = 3.18510929964103 | epot = -19.280088183191 | etot = -13.282537668702 -854000 ekin = 2.82227167902831 | erot = 3.19468161890284 | epot = -19.2994909671701 | etot = -13.282537669239 -855000 ekin = 2.83221172622116 | erot = 3.20377851191435 | epot = -19.3185279077701 | etot = -13.2825376696346 -856000 ekin = 2.840300530071 | erot = 3.20718605729409 | epot = -19.3300242573945 | etot = -13.2825376700294 -857000 ekin = 2.84404786962661 | erot = 3.20080956079347 | epot = -19.3273951006411 | etot = -13.282537670221 -858000 ekin = 2.84179014641021 | erot = 3.18249842090011 | epot = -19.3068262375301 | etot = -13.2825376702198 -859000 ekin = 2.83276149965023 | erot = 3.15199731414756 | epot = -19.2672964838693 | etot = -13.2825376700715 -860000 ekin = 2.81700723540486 | erot = 3.11046780830085 | epot = -19.2100127135333 | etot = -13.2825376698276 -861000 ekin = 2.79529073709182 | erot = 3.05989039483855 | epot = -19.1377188014554 | etot = -13.282537669525 -862000 ekin = 2.76903178122151 | erot = 3.00259641980569 | epot = -19.0541658702098 | etot = -13.2825376691826 -863000 ekin = 2.74026019036715 | erot = 2.94102587737081 | epot = -18.963823736545 | etot = -13.2825376688071 -864000 ekin = 2.71154390224074 | erot = 2.87766995664925 | epot = -18.8717515272941 | etot = -13.2825376684041 -865000 ekin = 2.68585679375552 | erot = 2.81509451397853 | epot = -18.7834889757203 | etot = -13.2825376679863 -866000 ekin = 2.66591731933855 | erot = 2.75755671058339 | epot = -18.7060116974738 | etot = -13.2825376675519 -867000 ekin = 2.65369684329544 | erot = 2.7083623798959 | epot = -18.6445968906238 | etot = -13.2825376674325 -868000 ekin = 2.65132555301973 | erot = 2.66699243377824 | epot = -18.6008556541371 | etot = -13.2825376673391 -869000 ekin = 2.66041858384405 | erot = 2.63308802762824 | epot = -18.5760442787927 | etot = -13.2825376673204 -870000 ekin = 2.68169704364212 | erot = 2.60613905014957 | epot = -18.5703737612166 | etot = -13.2825376674249 -871000 ekin = 2.714675381147 | erot = 2.58511614863126 | epot = -18.5823291974597 | etot = -13.2825376676815 -872000 ekin = 2.75720487538646 | erot = 2.56766485203678 | epot = -18.6074073957568 | etot = -13.2825376683336 -873000 ekin = 2.803086198203 | erot = 2.54585820174232 | epot = -18.6314820689118 | etot = -13.2825376689665 -874000 ekin = 2.84699852608312 | erot = 2.51460161594881 | epot = -18.6441378114779 | etot = -13.282537669446 -875000 ekin = 2.88482415058241 | erot = 2.47158418781059 | epot = -18.6389460079955 | etot = -13.2825376696025 -876000 ekin = 2.91408523336093 | erot = 2.41771772911331 | epot = -18.6143406317811 | etot = -13.2825376693068 -877000 ekin = 2.93423099085002 | erot = 2.35825815691149 | epot = -18.5750268164393 | etot = -13.2825376686778 -878000 ekin = 2.9475340562781 | erot = 2.30086645375619 | epot = -18.5309381778309 | etot = -13.2825376677966 -879000 ekin = 2.95817730736049 | erot = 2.25490663308305 | epot = -18.4956216073008 | etot = -13.2825376668573 -880000 ekin = 2.97089825195544 | erot = 2.22983196329486 | epot = -18.4832678815106 | etot = -13.2825376662603 -881000 ekin = 2.98893595228507 | erot = 2.2333347502509 | epot = -18.504808368297 | etot = -13.282537665761 -882000 ekin = 3.01519221963423 | erot = 2.27015029167503 | epot = -18.567880176909 | etot = -13.2825376655997 -883000 ekin = 3.050977470883 | erot = 2.3416684229247 | epot = -18.6751835596182 | etot = -13.2825376658105 -884000 ekin = 3.0943568254625 | erot = 2.4464864171533 | epot = -18.8233809089841 | etot = -13.2825376663683 -885000 ekin = 3.14183207195904 | erot = 2.57965576029431 | epot = -19.0040254994221 | etot = -13.2825376671687 -886000 ekin = 3.18914822789967 | erot = 2.73331108133882 | epot = -19.2049969773566 | etot = -13.2825376681181 -887000 ekin = 3.23157512360419 | erot = 2.89766014760895 | epot = -19.4117729403353 | etot = -13.2825376691222 -888000 ekin = 3.26456551809744 | erot = 3.061776633054 | epot = -19.6088798212464 | etot = -13.282537670095 -889000 ekin = 3.28428902019584 | erot = 3.21442460415165 | epot = -19.7812512953062 | etot = -13.2825376709587 -890000 ekin = 3.2880122327761 | erot = 3.34493087267995 | epot = -19.9154807770949 | etot = -13.2825376716389 -891000 ekin = 3.27434561774921 | erot = 3.44412613410496 | epot = -20.0010094239182 | etot = -13.282537672064 -892000 ekin = 3.24338163760107 | erot = 3.50530517060629 | epot = -20.0312244803861 | etot = -13.2825376721787 -893000 ekin = 3.19671556304815 | erot = 3.52503469849065 | epot = -20.0042879335016 | etot = -13.2825376719628 -894000 ekin = 3.13731299174224 | erot = 3.50356986371644 | epot = -19.9234205269042 | etot = -13.2825376714456 -895000 ekin = 3.06920917356845 | erot = 3.44471943345056 | epot = -19.7964662777175 | etot = -13.2825376706985 -896000 ekin = 2.99708420339467 | erot = 3.35519757225323 | epot = -19.6348194454631 | etot = -13.2825376698152 -897000 ekin = 2.92580051783905 | erot = 3.24367712658266 | epot = -19.4520153133086 | etot = -13.2825376688869 -898000 ekin = 2.85975229197938 | erot = 3.12035510150211 | epot = -19.2626450613858 | etot = -13.2825376679043 -899000 ekin = 2.80277954780206 | erot = 2.99561467370083 | epot = -19.080931888693 | etot = -13.2825376671901 -900000 ekin = 2.75771035422124 | erot = 2.87733650110699 | epot = -18.9175845220101 | etot = -13.2825376666818 -901000 ekin = 2.72580329203606 | erot = 2.77189091312759 | epot = -18.7802318714396 | etot = -13.282537666276 -902000 ekin = 2.70770279133312 | erot = 2.68464861430094 | epot = -18.6748890716256 | etot = -13.2825376659915 -903000 ekin = 2.70344494055935 | erot = 2.61971222757332 | epot = -18.6056948339768 | etot = -13.2825376658441 -904000 ekin = 2.71249184745662 | erot = 2.57966599078369 | epot = -18.5746955043654 | etot = -13.282537666125 -905000 ekin = 2.73259472267538 | erot = 2.56420422221153 | epot = -18.5793366115826 | etot = -13.2825376666957 -906000 ekin = 2.7587438798969 | erot = 2.57016719355457 | epot = -18.6114487407342 | etot = -13.2825376672827 -907000 ekin = 2.78650456171834 | erot = 2.59279042980544 | epot = -18.6618326594225 | etot = -13.2825376678987 -908000 ekin = 2.81181709571449 | erot = 2.62665482043733 | epot = -18.7210095845851 | etot = -13.2825376684333 -909000 ekin = 2.83143463248052 | erot = 2.66677850527315 | epot = -18.7807508065458 | etot = -13.2825376687921 -910000 ekin = 2.84337824047693 | erot = 2.70952965399883 | epot = -18.8354455634031 | etot = -13.2825376689274 -911000 ekin = 2.8471370687053 | erot = 2.75311048607181 | epot = -18.8827852236336 | etot = -13.2825376688565 -912000 ekin = 2.84353295186199 | erot = 2.79744224266107 | epot = -18.9235128631783 | etot = -13.2825376686553 -913000 ekin = 2.83428813317848 | erot = 2.8435092291879 | epot = -18.960335030794 | etot = -13.2825376684276 -914000 ekin = 2.82145638452692 | erot = 2.89244132990744 | epot = -18.9964353826995 | etot = -13.2825376682651 -915000 ekin = 2.80692071975216 | erot = 2.94469332949274 | epot = -19.0341517174625 | etot = -13.2825376682176 -916000 ekin = 2.79210576380763 | erot = 2.99958827392467 | epot = -19.074231706018 | etot = -13.2825376682857 -917000 ekin = 2.77794567113789 | erot = 3.05530679534728 | epot = -19.1157901349159 | etot = -13.2825376684308 -918000 ekin = 2.76505338704383 | erot = 3.10923861037682 | epot = -19.1568296660157 | etot = -13.282537668595 -919000 ekin = 2.75398705152147 | erot = 3.15852296699156 | epot = -19.195047687236 | etot = -13.282537668723 -920000 ekin = 2.7454994548339 | erot = 3.2005917707977 | epot = -19.2286288944091 | etot = -13.2825376687775 -921000 ekin = 2.74117522185331 | erot = 3.23390288539821 | epot = -19.257615776068 | etot = -13.2825376688165 -922000 ekin = 2.74423942349208 | erot = 3.25833644681568 | epot = -19.2851135392148 | etot = -13.282537668907 -923000 ekin = 2.75519506145705 | erot = 3.27241102947033 | epot = -19.3101437598841 | etot = -13.2825376689567 -924000 ekin = 2.7739447954554 | erot = 3.27524658464716 | epot = -19.3317290491124 | etot = -13.2825376690098 -925000 ekin = 2.79984975930912 | erot = 3.26648541912473 | epot = -19.3488728475327 | etot = -13.2825376690988 -926000 ekin = 2.83154188646909 | erot = 3.24600163470344 | epot = -19.3600811904065 | etot = -13.282537669234 -927000 ekin = 2.86690921927924 | erot = 3.21375665515251 | epot = -19.3632035438309 | etot = -13.2825376693992 -928000 ekin = 2.90327996746315 | erot = 3.16982824225361 | epot = -19.355645879275 | etot = -13.2825376695582 -929000 ekin = 2.93775285768297 | erot = 3.11459709937969 | epot = -19.3348876267298 | etot = -13.2825376696671 -930000 ekin = 2.96759841379162 | erot = 3.04898886674992 | epot = -19.2991249502297 | etot = -13.2825376696882 -931000 ekin = 2.99062544127955 | erot = 2.97467062306529 | epot = -19.2478337339459 | etot = -13.2825376696011 -932000 ekin = 3.00543704340314 | erot = 2.89412065066031 | epot = -19.1820953634703 | etot = -13.2825376694069 -933000 ekin = 3.01154336745331 | erot = 2.81054368701041 | epot = -19.1046247235875 | etot = -13.2825376691237 -934000 ekin = 3.00929679360139 | erot = 2.72759799680406 | epot = -19.0194324597362 | etot = -13.2825376693307 -935000 ekin = 2.99746134196625 | erot = 2.6462580748832 | epot = -18.9262570860315 | etot = -13.282537669182 -936000 ekin = 2.97526415103787 | erot = 2.56749092791625 | epot = -18.8252927479484 | etot = -13.2825376689942 -937000 ekin = 2.94352512534142 | erot = 2.49335517907333 | epot = -18.7194179731942 | etot = -13.2825376687795 -938000 ekin = 2.90367826460953 | erot = 2.42575018416443 | epot = -18.6119661173247 | etot = -13.2825376685508 -939000 ekin = 2.85762227332947 | erot = 2.36633148508484 | epot = -18.5064914267463 | etot = -13.282537668332 -940000 ekin = 2.80750328433938 | erot = 2.31642989471101 | epot = -18.4064708471881 | etot = -13.2825376681377 -941000 ekin = 2.75550936315199 | erot = 2.27698712574217 | epot = -18.3150341568762 | etot = -13.282537667982 -942000 ekin = 2.70367879381712 | erot = 2.24846537191208 | epot = -18.2346818336126 | etot = -13.2825376678834 -943000 ekin = 2.65376367606827 | erot = 2.23082283410801 | epot = -18.1671241780099 | etot = -13.2825376678336 -944000 ekin = 2.60720594190486 | erot = 2.22360475791271 | epot = -18.1133483676354 | etot = -13.2825376678178 -945000 ekin = 2.56519856453037 | erot = 2.22610144827738 | epot = -18.0738376806168 | etot = -13.282537667809 -946000 ekin = 2.52882759913744 | erot = 2.23758213189974 | epot = -18.0489473988157 | etot = -13.2825376677785 -947000 ekin = 2.49923315497847 | erot = 2.25754573394355 | epot = -18.0393165566274 | etot = -13.2825376677054 -948000 ekin = 2.47771007490038 | erot = 2.28590689257171 | epot = -18.04615463506 | etot = -13.2825376675879 -949000 ekin = 2.46568539864087 | erot = 2.32304174073513 | epot = -18.0712648068282 | etot = -13.2825376674522 -950000 ekin = 2.46454516557792 | erot = 2.36959060782326 | epot = -18.1166734407329 | etot = -13.2825376673317 -951000 ekin = 2.47533994997988 | erot = 2.42623129981836 | epot = -18.1841089170701 | etot = -13.2825376672718 -952000 ekin = 2.49848236352815 | erot = 2.49338196896345 | epot = -18.2744019998023 | etot = -13.2825376673107 -953000 ekin = 2.53348398193916 | erot = 2.57089243328743 | epot = -18.3869140826966 | etot = -13.28253766747 -954000 ekin = 2.57882587532342 | erot = 2.65786416805845 | epot = -18.519227711132 | etot = -13.2825376677502 -955000 ekin = 2.63199527599012 | erot = 2.75261052013185 | epot = -18.6671434642546 | etot = -13.2825376681326 -956000 ekin = 2.68967924815822 | erot = 2.85274255005244 | epot = -18.8249594667971 | etot = -13.2825376685864 -957000 ekin = 2.74806771946834 | erot = 2.95533472441412 | epot = -18.9859401129583 | etot = -13.2825376690759 -958000 ekin = 2.8031986668001 | erot = 3.05711581061144 | epot = -19.1428521469807 | etot = -13.2825376695691 -959000 ekin = 2.85127801275525 | erot = 3.15464148732907 | epot = -19.2884571701257 | etot = -13.2825376700414 -960000 ekin = 2.88892608818491 | erot = 3.24442918289745 | epot = -19.4158929415587 | etot = -13.2825376704763 -961000 ekin = 2.91333465071856 | erot = 3.32306194469326 | epot = -19.5189342662741 | etot = -13.2825376708623 -962000 ekin = 2.922351418879 | erot = 3.3872858534114 | epot = -19.5921749434782 | etot = -13.2825376711878 -963000 ekin = 2.91452965717995 | erot = 3.43412743872974 | epot = -19.6311947673485 | etot = -13.2825376714389 -964000 ekin = 2.88918087862635 | erot = 3.46104482999767 | epot = -19.632763380221 | etot = -13.282537671597 -965000 ekin = 2.84645277180946 | erot = 3.46610960648151 | epot = -19.5951000499324 | etot = -13.2825376716414 -966000 ekin = 2.78809663571847 | erot = 3.44886971922285 | epot = -19.5195040264054 | etot = -13.2825376714641 -967000 ekin = 2.71967964182096 | erot = 3.41234902495006 | epot = -19.4145663381934 | etot = -13.2825376714224 -968000 ekin = 2.64387658032753 | erot = 3.35650459869427 | epot = -19.2829188502389 | etot = -13.2825376712171 -969000 ekin = 2.5636598359908 | erot = 3.28213071774803 | epot = -19.1283282245599 | etot = -13.282537670821 -970000 ekin = 2.48311062142641 | erot = 3.19174642313887 | epot = -18.9573947148006 | etot = -13.2825376702353 -971000 ekin = 2.40743965733721 | erot = 3.08950974407855 | epot = -18.7794870709146 | etot = -13.2825376694988 -972000 ekin = 2.34264905762229 | erot = 2.98071332522745 | epot = -18.6059000516929 | etot = -13.2825376688431 -973000 ekin = 2.29453827360496 | erot = 2.87084836320828 | epot = -18.4479243047972 | etot = -13.282537667984 -974000 ekin = 2.26986492523629 | erot = 2.76590322630273 | epot = -18.3183058187963 | etot = -13.2825376672573 -975000 ekin = 2.27457634340147 | erot = 2.67096736257246 | epot = -18.2280813727252 | etot = -13.2825376667513 -976000 ekin = 2.31300758345889 | erot = 2.58967385348542 | epot = -18.1852191035746 | etot = -13.2825376666303 -977000 ekin = 2.38775385248975 | erot = 2.52429198072532 | epot = -18.1945835001601 | etot = -13.282537666945 -978000 ekin = 2.49343132116534 | erot = 2.47478959071677 | epot = -18.250758581399 | etot = -13.2825376695168 -979000 ekin = 2.63194261796709 | erot = 2.43666985312452 | epot = -18.3511501394741 | etot = -13.2825376683825 -980000 ekin = 2.80143349398027 | erot = 2.41383709773151 | epot = -18.4978082614141 | etot = -13.2825376697023 -981000 ekin = 2.97613228560276 | erot = 2.40353470196688 | epot = -18.6622046578968 | etot = -13.2825376703271 -982000 ekin = 3.15493786386392 | erot = 2.40097885129711 | epot = -18.8384543865171 | etot = -13.2825376713561 -983000 ekin = 3.32895075407343 | erot = 2.40358703807687 | epot = -19.0150754641488 | etot = -13.2825376719985 -984000 ekin = 3.48942626012081 | erot = 2.40902391909424 | epot = -19.1809878517146 | etot = -13.2825376724995 -985000 ekin = 3.63060554065164 | erot = 2.41512886518655 | epot = -19.3282720786893 | etot = -13.2825376728511 -986000 ekin = 3.74861810546827 | erot = 2.42024356026037 | epot = -19.4513993386244 | etot = -13.2825376728957 -987000 ekin = 3.84212741102323 | erot = 2.42421773192364 | epot = -19.5488828158586 | etot = -13.2825376729117 -988000 ekin = 3.91118765036607 | erot = 2.42704295376118 | epot = -19.6207682769566 | etot = -13.2825376728293 -989000 ekin = 3.95686695907234 | erot = 2.42875435934639 | epot = -19.6681589910888 | etot = -13.28253767267 -990000 ekin = 3.98122336719007 | erot = 2.42964012334027 | epot = -19.6934011629788 | etot = -13.2825376724485 -991000 ekin = 3.98715071444002 | erot = 2.43015135461192 | epot = -19.6998397412253 | etot = -13.2825376721734 -992000 ekin = 3.97827672381777 | erot = 2.43082965983246 | epot = -19.6916440567119 | etot = -13.2825376730616 -993000 ekin = 3.95551199283863 | erot = 2.42901824167109 | epot = -19.667067907421 | etot = -13.2825376729113 -994000 ekin = 3.91976370648951 | erot = 2.42191618451507 | epot = -19.6242175637032 | etot = -13.2825376726986 -995000 ekin = 3.87458078794846 | erot = 2.4093277557877 | epot = -19.5664462161636 | etot = -13.2825376724274 -996000 ekin = 3.82377191573499 | erot = 2.39162261227942 | epot = -19.4979322001273 | etot = -13.2825376721129 -997000 ekin = 3.77108738620107 | erot = 2.36980944943232 | epot = -19.4234345074163 | etot = -13.282537671783 -998000 ekin = 3.71986049080444 | erot = 2.34548651217898 | epot = -19.3478846744548 | etot = -13.2825376714714 -999000 ekin = 3.67268794449355 | erot = 2.32066228967754 | epot = -19.2758879053829 | etot = -13.2825376712118 -1000000 ekin = 3.63122130708104 | erot = 2.29747929874878 | epot = -19.2112382768594 | etot = -13.2825376710296 - 1000000 0.16138761 -1.2609484 0.060246044 -0.97375106 -5.5311015e-05 -Loop time of 27.9244 on 1 procs for 1000000 steps with 16 atoms - -Performance: 30940.635 tau/day, 35810.920 timesteps/s -98.8% CPU use with 1 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 24.096 | 24.096 | 24.096 | 0.0 | 86.29 -Bond | 0.98737 | 0.98737 | 0.98737 | 0.0 | 3.54 -Neigh | 0.000168 | 0.000168 | 0.000168 | 0.0 | 0.00 -Comm | 0.20002 | 0.20002 | 0.20002 | 0.0 | 0.72 -Output | 1e-05 | 1e-05 | 1e-05 | 0.0 | 0.00 -Modify | 2.3385 | 2.3385 | 2.3385 | 0.0 | 8.37 -Other | | 0.3022 | | | 1.08 - -Nlocal: 16.0 ave 16.0 max 16.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Nghost: 0.0 ave 0.0 max 0.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 -Neighs: 77.0 ave 77.0 max 77.0 min -Histogram: 1 0 0 0 0 0 0 0 0 0 - -Total # of neighbors = 77 -Ave neighs/atom = 4.8125 -Ave special neighs/atom = 3.75 -Neighbor list builds = 7 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:27 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.4 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.4 deleted file mode 100644 index aa5a15156a..0000000000 --- a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex4/log.30Jun20.duplex4.g++.4 +++ /dev/null @@ -1,1183 +0,0 @@ -LAMMPS (30 Jun 2020) -variable number equal 4 -variable ofreq equal 1000 -variable efreq equal 1000 -variable T equal 0.1 - -units lj - -dimension 3 - -newton off - -boundary p p p - -atom_style hybrid bond ellipsoid -WARNING: Atom_style hybrid defines both pertype and peratom masses - both must be set, only peratom masses will be used (../atom_vec_hybrid.cpp:156) -atom_modify sort 0 1.0 - -# Pair interactions require lists of neighbours to be calculated -neighbor 1.0 bin -neigh_modify every 1 delay 0 check yes - -read_data data.duplex4 - orthogonal box = (-20 -20 -20) to (20 20 20) - 1 by 2 by 2 MPI processor grid - reading atoms ... - 16 atoms - reading velocities ... - 16 velocities - 16 ellipsoids - scanning bonds ... - 2 = max bonds/atom - reading bonds ... - 13 bonds - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.001 seconds - read_data CPU = 0.004 seconds - -set atom * mass 3.1575 - 16 settings made for mass - -group all type 1 4 -16 atoms in group all - -# oxRNA2 bond interactions - FENE backbone -bond_style oxrna2/fene -bond_coeff * 2.0 0.25 0.761070781051 -special_bonds lj 0 1 1 - 2 = max # of 1-2 neighbors - 2 = max # of 1-3 neighbors - 4 = max # of 1-4 neighbors - 6 = max # of special neighbors - special bonds CPU = 0.000 seconds - -# oxRNA2 pair interactions -pair_style hybrid/overlay oxrna2/excv oxrna2/stk oxrna2/hbond oxrna2/xstk oxrna2/coaxstk oxrna2/dh - -pair_coeff * * oxrna2/excv 2.0 0.7 0.675 2.0 0.515 0.5 2.0 0.33 0.32 -pair_coeff * * oxrna2/stk seqdep ${T} 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 -pair_coeff * * oxrna2/stk seqdep 0.1 1.40206 2.77 6.0 0.43 0.93 0.35 0.78 0.9 0 0.95 0.9 0 0.95 1.3 0 0.8 1.3 0 0.8 2.0 0.65 2.0 0.65 -pair_coeff * * oxrna2/hbond seqdep 0.0 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 1 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 2 3 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff 3 4 oxrna2/hbond seqdep 0.870439 8.0 0.4 0.75 0.34 0.7 1.5 0 0.7 1.5 0 0.7 1.5 0 0.7 0.46 3.141592653589793 0.7 4.0 1.5707963267948966 0.45 4.0 1.5707963267948966 0.45 -pair_coeff * * oxrna2/xstk 59.9626 0.5 0.6 0.42 0.58 2.25 0.505 0.58 1.7 1.266 0.68 1.7 1.266 0.68 1.7 0.309 0.68 1.7 0.309 0.68 -pair_coeff * * oxrna2/coaxstk 80 0.5 0.6 0.42 0.58 2.0 2.592 0.65 1.3 0.151 0.8 0.9 0.685 0.95 0.9 0.685 0.95 2.0 -0.65 2.0 -0.65 -pair_coeff * * oxrna2/dh ${T} 0.5 1.02455 -pair_coeff * * oxrna2/dh 0.1 0.5 1.02455 - -# NVE ensemble -#fix 1 all nve/dotc/langevin 0.1 0.1 0.03 457145 angmom 10 -#fix 1 all nve/dot -fix 1 all nve/asphere - -timestep 1e-5 - -#comm_style tiled -#fix 3 all balance 10000 1.1 rcb -comm_modify cutoff 2.5 - -#compute mol all chunk/atom molecule -#compute mychunk all vcm/chunk mol -#fix 4 all ave/time 10000 1 10000 c_mychunk[1] c_mychunk[2] c_mychunk[3] file vcm.txt mode vector - -#dump pos all xyz ${ofreq} traj.${number}.xyz - -#compute quat all property/atom quatw quati quatj quatk -#dump quat all custom ${ofreq} quat.${number}.txt id c_quat[1] c_quat[2] c_quat[3] c_quat[4] -#dump_modify quat sort id -#dump_modify quat format line "%d %13.6le %13.6le %13.6le %13.6le" - -compute erot all erotate/asphere -compute ekin all ke -compute epot all pe -variable erot equal c_erot -variable ekin equal c_ekin -variable epot equal c_epot -variable etot equal c_erot+c_ekin+c_epot -fix 5 all print ${efreq} "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes -fix 5 all print 1000 "$(step) ekin = ${ekin} | erot = ${erot} | epot = ${epot} | etot = ${etot}" screen yes - -#dump out all custom ${ofreq} out.${number}.txt id x y z vx vy vz fx fy fz tqx tqy tqz -#dump_modify out sort id -#dump_modify out format line "%d %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f %13.9f" - -run 1000000 -Neighbor list info ... - update every 1 steps, delay 0 steps, check yes - max neighbors/atom: 2000, page size: 100000 - master list distance cutoff = 3.3014979 - ghost atom cutoff = 3.3014979 - binsize = 1.650749, bins = 25 25 25 - 6 neighbor lists, perpetual/occasional/extra = 6 0 0 - (1) pair oxrna2/excv, perpetual - attributes: half, newton off - pair build: half/bin/newtoff - stencil: half/bin/3d/newtoff - bin: standard - (2) pair oxrna2/stk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (3) pair oxrna2/hbond, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (4) pair oxrna2/xstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (5) pair oxrna2/coaxstk, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none - (6) pair oxrna2/dh, perpetual, copy from (1) - attributes: half, newton off - pair build: copy - stencil: none - bin: none -WARNING: Communication cutoff adjusted to 3.3014979169291987 (../comm.cpp:690) -0 ekin = 0 | erot = 0 | epot = -13.282537590974 | etot = -13.282537590974 -Per MPI rank memory allocation (min/avg/max) = 8.005 | 8.062 | 8.119 Mbytes -Step Temp E_pair E_mol TotEng Press - 0 0 -0.84341458 0.013255977 -0.8301586 -2.0169485e-05 -1000 ekin = 0.00448503054655829 | erot = 0.00825381229599554 | epot = -13.2952764343121 | etot = -13.2825375914696 -2000 ekin = 0.0179027901180383 | erot = 0.0327684151333158 | epot = -13.333208796773 | etot = -13.2825375915216 -3000 ekin = 0.0401478317723388 | erot = 0.0728240143062734 | epot = -13.3955094376812 | etot = -13.2825375916026 -4000 ekin = 0.0710654348932012 | erot = 0.127292706282676 | epot = -13.4808957328803 | etot = -13.2825375917044 -5000 ekin = 0.110480309743627 | erot = 0.194739074279345 | epot = -13.58775697584 | etot = -13.282537591817 -6000 ekin = 0.158231230694386 | erot = 0.273546913858364 | epot = -13.7143157364821 | etot = -13.2825375919294 -7000 ekin = 0.214206450831694 | erot = 0.362058396900661 | epot = -13.8588024397635 | etot = -13.2825375920312 -8000 ekin = 0.27837411184999 | erot = 0.458709556671591 | epot = -14.0196212606354 | etot = -13.2825375921138 -9000 ekin = 0.350802094030117 | erot = 0.562145629087582 | epot = -14.1954853152897 | etot = -13.282537592172 -10000 ekin = 0.431663021447632 | erot = 0.671302139461542 | epot = -14.3855027531133 | etot = -13.2825375922041 -11000 ekin = 0.521222365620092 | erot = 0.785442646223518 | epot = -14.5892026040564 | etot = -13.2825375922128 -12000 ekin = 0.619810398735201 | erot = 0.90415088836544 | epot = -14.8064988793047 | etot = -13.2825375922041 -13000 ekin = 0.727781531798581 | erot = 1.02728222251184 | epot = -15.0376013464965 | etot = -13.2825375921861 -14000 ekin = 0.845466747659119 | erot = 1.15488520186341 | epot = -15.2828895416906 | etot = -13.2825375921681 -15000 ekin = 0.973515286429056 | erot = 1.28640002432427 | epot = -15.5424529041403 | etot = -13.282537593387 -16000 ekin = 1.12323013751051 | erot = 1.4038749539854 | epot = -15.8096426839246 | etot = -13.2825375924286 -17000 ekin = 1.29769272832575 | erot = 1.51347784068601 | epot = -16.0937081607386 | etot = -13.2825375917268 -18000 ekin = 1.48565191084472 | erot = 1.63592970999597 | epot = -16.4041192134335 | etot = -13.2825375925929 -19000 ekin = 1.66750911163292 | erot = 1.77940241938649 | epot = -16.7294491246356 | etot = -13.2825375936162 -20000 ekin = 1.84148924290367 | erot = 1.93695511183614 | epot = -17.0609819484045 | etot = -13.2825375936647 -21000 ekin = 2.02307741366106 | erot = 2.09844265792887 | epot = -17.4040576653927 | etot = -13.2825375938028 -22000 ekin = 2.21183606977167 | erot = 2.26260708947227 | epot = -17.7569807531574 | etot = -13.2825375939135 -23000 ekin = 2.40735468792923 | erot = 2.42817202047232 | epot = -18.1180643024984 | etot = -13.2825375940969 -24000 ekin = 2.60896890448811 | erot = 2.59357882573777 | epot = -18.4850853245068 | etot = -13.2825375942809 -25000 ekin = 2.815801354773 | erot = 2.75706655666979 | epot = -18.8554055059558 | etot = -13.282537594513 -26000 ekin = 3.02680083558447 | erot = 2.91667946897181 | epot = -19.2260178993261 | etot = -13.2825375947698 -27000 ekin = 3.24067707260278 | erot = 3.07027299756425 | epot = -19.5934876652165 | etot = -13.2825375950495 -28000 ekin = 3.45601412953551 | erot = 3.21560615187967 | epot = -19.9541578767284 | etot = -13.2825375953133 -29000 ekin = 3.67136830813179 | erot = 3.35037905822876 | epot = -20.3042849619982 | etot = -13.2825375956377 -30000 ekin = 3.88476027224393 | erot = 3.47208481891771 | epot = -20.6393826871844 | etot = -13.2825375960227 -31000 ekin = 4.09387957878907 | erot = 3.57821385031972 | epot = -20.9546310254505 | etot = -13.2825375963417 -32000 ekin = 4.2966218534583 | erot = 3.6664860653108 | epot = -21.2456455154184 | etot = -13.2825375966493 -33000 ekin = 4.49089153394099 | erot = 3.73482555362516 | epot = -21.5082546845017 | etot = -13.2825375969356 -34000 ekin = 4.67464118182325 | erot = 3.78142516888949 | epot = -21.7386039479011 | etot = -13.2825375971883 -35000 ekin = 4.84586411782109 | erot = 3.80480460777856 | epot = -21.9332063229965 | etot = -13.2825375973968 -36000 ekin = 5.0027094048744 | erot = 3.80394535032719 | epot = -22.0891923527598 | etot = -13.2825375975582 -37000 ekin = 5.14355281474345 | erot = 3.77833709530338 | epot = -22.2044275077127 | etot = -13.2825375976659 -38000 ekin = 5.26699752588952 | erot = 3.72801268545681 | epot = -22.2775478090603 | etot = -13.282537597714 -39000 ekin = 5.37191151713971 | erot = 3.65359747923658 | epot = -22.3080465940747 | etot = -13.2825375976984 -40000 ekin = 5.45746010972539 | erot = 3.55633701588603 | epot = -22.2963347232318 | etot = -13.2825375976204 -41000 ekin = 5.52312188621432 | erot = 3.43809872369872 | epot = -22.2437582073857 | etot = -13.2825375974727 -42000 ekin = 5.56872044212123 | erot = 3.3013527933319 | epot = -22.1526108327172 | etot = -13.2825375972641 -43000 ekin = 5.59443660083054 | erot = 3.14910305123766 | epot = -22.0260772490709 | etot = -13.2825375970027 -44000 ekin = 5.60078634437832 | erot = 2.98477133565166 | epot = -21.8680952767313 | etot = -13.2825375967014 -45000 ekin = 5.58859564323475 | erot = 2.81204277265363 | epot = -21.6831760122637 | etot = -13.2825375963753 -46000 ekin = 5.55896198288938 | erot = 2.6346956216755 | epot = -21.4761952006028 | etot = -13.2825375960379 -47000 ekin = 5.51320424222089 | erot = 2.45646420183095 | epot = -21.2522060397504 | etot = -13.2825375956985 -48000 ekin = 5.45280176988658 | erot = 2.28095947573165 | epot = -21.0162988409789 | etot = -13.2825375953606 -49000 ekin = 5.37933239946777 | erot = 2.11161440403301 | epot = -20.7734843985466 | etot = -13.2825375950459 -50000 ekin = 5.29440598595322 | erot = 1.95156309993227 | epot = -20.5285066806364 | etot = -13.2825375947509 -51000 ekin = 5.19960275040365 | erot = 1.80366343983081 | epot = -20.2858037847169 | etot = -13.2825375944825 -52000 ekin = 5.09642319962078 | erot = 1.6704687709701 | epot = -20.0494295648296 | etot = -13.2825375942388 -53000 ekin = 4.98624639554453 | erot = 1.55427111116844 | epot = -19.8230551007342 | etot = -13.2825375940213 -54000 ekin = 4.87030445561618 | erot = 1.4571046995688 | epot = -19.6099467490168 | etot = -13.2825375938318 -55000 ekin = 4.74966978520253 | erot = 1.3807464290206 | epot = -19.4129538078759 | etot = -13.2825375936527 -56000 ekin = 4.62525646671059 | erot = 1.32681969001188 | epot = -19.2346137502498 | etot = -13.2825375935274 -57000 ekin = 4.49783496228329 | erot = 1.29648861711317 | epot = -19.0768611728244 | etot = -13.2825375934279 -58000 ekin = 4.3680583246168 | erot = 1.29057331365756 | epot = -18.9411692316282 | etot = -13.2825375933538 -59000 ekin = 4.23649045860609 | erot = 1.30961007130899 | epot = -18.828638123218 | etot = -13.2825375933029 -60000 ekin = 4.10363649615241 | erot = 1.35385055377105 | epot = -18.7400246431965 | etot = -13.2825375932731 -61000 ekin = 3.96997203629848 | erot = 1.42326526715471 | epot = -18.6757748967159 | etot = -13.2825375932627 -62000 ekin = 3.8361228573534 | erot = 1.51750909475347 | epot = -18.63616954536 | etot = -13.2825375932531 -63000 ekin = 3.70275913153356 | erot = 1.63593500305273 | epot = -18.6212317278744 | etot = -13.2825375932881 -64000 ekin = 3.57028395426148 | erot = 1.77765695762388 | epot = -18.6304785052257 | etot = -13.2825375933403 -65000 ekin = 3.43939724701883 | erot = 1.94136642645281 | epot = -18.6633012668463 | etot = -13.2825375933747 -66000 ekin = 3.31090885650503 | erot = 2.12543845180006 | epot = -18.7188849017622 | etot = -13.2825375934572 -67000 ekin = 3.18539537800154 | erot = 2.32812634152817 | epot = -18.7960593130801 | etot = -13.2825375935504 -68000 ekin = 3.0635338653806 | erot = 2.54742667497474 | epot = -18.8934981340094 | etot = -13.2825375936541 -69000 ekin = 2.94609585152155 | erot = 2.78109018587035 | epot = -19.009723631161 | etot = -13.2825375937691 -70000 ekin = 2.83393040716521 | erot = 3.02662959649543 | epot = -19.1430975975569 | etot = -13.2825375938963 -71000 ekin = 2.72793726696403 | erot = 3.28133994286028 | epot = -19.2918148038557 | etot = -13.2825375940314 -72000 ekin = 2.62902971043669 | erot = 3.54239819983024 | epot = -19.4539655044234 | etot = -13.2825375941565 -73000 ekin = 2.53808722042923 | erot = 3.80701983458394 | epot = -19.6276446493613 | etot = -13.2825375943481 -74000 ekin = 2.45592865526949 | erot = 4.07171344127284 | epot = -19.8101796911555 | etot = -13.2825375946132 -75000 ekin = 2.3833072864547 | erot = 4.33220600221002 | epot = -19.9980508835331 | etot = -13.2825375948683 -76000 ekin = 2.32085819246852 | erot = 4.58430888321027 | epot = -20.1877046708076 | etot = -13.2825375951288 -77000 ekin = 2.26905284042002 | erot = 4.82394209159159 | epot = -20.3755325274035 | etot = -13.2825375953919 -78000 ekin = 2.22818215579792 | erot = 5.04720004762804 | epot = -20.5579197990804 | etot = -13.2825375956544 -79000 ekin = 2.19835990746569 | erot = 5.25044819004257 | epot = -20.7313456933952 | etot = -13.2825375958869 -80000 ekin = 2.17954213158754 | erot = 5.43056087724072 | epot = -20.8926406049113 | etot = -13.2825375960831 -81000 ekin = 2.17154912845079 | erot = 5.58515654974133 | epot = -21.0392432744253 | etot = -13.2825375962332 -82000 ekin = 2.17396051633385 | erot = 5.71255070218911 | epot = -21.1690488148905 | etot = -13.2825375963675 -83000 ekin = 2.18608268543497 | erot = 5.8115938913987 | epot = -21.2802141733995 | etot = -13.2825375965659 -84000 ekin = 2.20694055797086 | erot = 5.88143457462865 | epot = -21.3709127292227 | etot = -13.2825375966232 -85000 ekin = 2.2355007346888 | erot = 5.9224847336172 | epot = -21.440523064944 | etot = -13.282537596638 -86000 ekin = 2.27071025957208 | erot = 5.93583657914561 | epot = -21.4890844353357 | etot = -13.282537596618 -87000 ekin = 2.31151705668532 | erot = 5.92306118835237 | epot = -21.5171158416083 | etot = -13.2825375965707 -88000 ekin = 2.35689880582359 | erot = 5.88606517856767 | epot = -21.5255015808933 | etot = -13.282537596502 -89000 ekin = 2.40589192121093 | erot = 5.82697176767523 | epot = -21.515401285302 | etot = -13.2825375964158 -90000 ekin = 2.45762089189478 | erot = 5.74803678246289 | epot = -21.4881952706713 | etot = -13.2825375963137 -91000 ekin = 2.51132727735637 | erot = 5.65159908896529 | epot = -21.4454639625174 | etot = -13.2825375961958 -92000 ekin = 2.56639616299203 | erot = 5.54005576568085 | epot = -21.3889895247349 | etot = -13.282537596062 -93000 ekin = 2.62237587147907 | erot = 5.41584923925793 | epot = -21.3207627066506 | etot = -13.2825375959136 -94000 ekin = 2.6789853628744 | erot = 5.28145076624312 | epot = -21.242973724871 | etot = -13.2825375957535 -95000 ekin = 2.73610698777042 | erot = 5.1393322247884 | epot = -21.1579768081446 | etot = -13.2825375955858 -96000 ekin = 2.79376736409308 | erot = 4.99192351961226 | epot = -21.0682284791232 | etot = -13.2825375954179 -97000 ekin = 2.85209759177855 | erot = 4.84155102932086 | epot = -20.9761862163575 | etot = -13.2825375952581 -98000 ekin = 2.91128043087762 | erot = 4.69036811429654 | epot = -20.8841861402892 | etot = -13.2825375951151 -99000 ekin = 2.97148865716326 | erot = 4.54028690688497 | epot = -20.7943131590452 | etot = -13.282537594997 -100000 ekin = 3.03281936548454 | erot = 4.39291958378067 | epot = -20.7082765441758 | etot = -13.2825375949106 -101000 ekin = 3.09523162855491 | erot = 4.24953761553784 | epot = -20.6273068389531 | etot = -13.2825375948603 -102000 ekin = 3.15849350649712 | erot = 4.11105261279967 | epot = -20.552083714145 | etot = -13.2825375948482 -103000 ekin = 3.22212928739632 | erot = 3.97803233781191 | epot = -20.4826992200835 | etot = -13.2825375948753 -104000 ekin = 3.28539028419995 | erot = 3.85073569994647 | epot = -20.4186635790814 | etot = -13.282537594935 -105000 ekin = 3.34731475817756 | erot = 3.72912316717864 | epot = -20.3589755203797 | etot = -13.2825375950235 -106000 ekin = 3.40672794730861 | erot = 3.61292637549597 | epot = -20.3021919179397 | etot = -13.2825375951351 -107000 ekin = 3.46228544964886 | erot = 3.50170395486082 | epot = -20.2465269997722 | etot = -13.2825375952625 -108000 ekin = 3.51253156080083 | erot = 3.39489824023779 | epot = -20.1899673964366 | etot = -13.282537595398 -109000 ekin = 3.55597480315881 | erot = 3.2918729970377 | epot = -20.1303853957321 | etot = -13.2825375955356 -110000 ekin = 3.59118238705156 | erot = 3.19193918351237 | epot = -20.0656591662303 | etot = -13.2825375956664 -111000 ekin = 3.6168734377865 | erot = 3.09439958031586 | epot = -19.993810613884 | etot = -13.2825375957817 -112000 ekin = 3.63202144077097 | erot = 2.99858073408855 | epot = -19.9131397707325 | etot = -13.282537595873 -113000 ekin = 3.6359567760499 | erot = 2.90386796422028 | epot = -19.8223623362014 | etot = -13.2825375959312 -114000 ekin = 3.62846110509032 | erot = 2.80974594394075 | epot = -19.7207446449794 | etot = -13.2825375959483 -115000 ekin = 3.60984333606135 | erot = 2.71584476484498 | epot = -19.6082256968239 | etot = -13.2825375959176 -116000 ekin = 3.5809859294631 | erot = 2.62198860618847 | epot = -19.4855121314881 | etot = -13.2825375958365 -117000 ekin = 3.54334240221411 | erot = 2.52827901424299 | epot = -19.354159012147 | etot = -13.2825375956899 -118000 ekin = 3.49891828359518 | erot = 2.43512420844321 | epot = -19.2165800875462 | etot = -13.2825375955078 -119000 ekin = 3.45018316481888 | erot = 2.3431314417893 | epot = -19.0758522018948 | etot = -13.2825375952866 -120000 ekin = 3.39991853306425 | erot = 2.25319419875556 | epot = -18.9356503268585 | etot = -13.2825375950387 -121000 ekin = 3.35105152049006 | erot = 2.1664659738711 | epot = -18.8000550891398 | etot = -13.2825375947787 -122000 ekin = 3.30648176977477 | erot = 2.08430580539905 | epot = -18.6733251696944 | etot = -13.2825375945206 -123000 ekin = 3.2689296615607 | erot = 2.00820635396295 | epot = -18.5596736097996 | etot = -13.282537594276 -124000 ekin = 3.24083330103893 | erot = 1.93971532774534 | epot = -18.4630862228354 | etot = -13.2825375940511 -125000 ekin = 3.22476145827485 | erot = 1.8802958129316 | epot = -18.387594863397 | etot = -13.2825375921905 -126000 ekin = 3.14878052704725 | erot = 1.84062475589711 | epot = -18.2719429098034 | etot = -13.282537626859 -127000 ekin = 2.94943277103416 | erot = 1.88659542758862 | epot = -18.11856577358 | etot = -13.2825375749572 -128000 ekin = 3.16220879321558 | erot = 1.96338946783192 | epot = -18.4081359062159 | etot = -13.2825376451684 -129000 ekin = 3.31015030132692 | erot = 1.94720836362345 | epot = -18.5398963214827 | etot = -13.2825376565323 -130000 ekin = 3.44972038724563 | erot = 1.92633510568783 | epot = -18.6585931496318 | etot = -13.2825376566984 -131000 ekin = 3.58872168957087 | erot = 1.90769906106584 | epot = -18.7789584074295 | etot = -13.2825376567928 -132000 ekin = 3.72319125317256 | erot = 1.89293715413269 | epot = -18.8986660641582 | etot = -13.282537656853 -133000 ekin = 3.8497825175539 | erot = 1.88373597103122 | epot = -19.0160561454723 | etot = -13.2825376568872 -134000 ekin = 3.9655798495172 | erot = 1.8817190850278 | epot = -19.1298365915079 | etot = -13.2825376569629 -135000 ekin = 4.06807957718167 | erot = 1.88790714285721 | epot = -19.2385243770747 | etot = -13.2825376570358 -136000 ekin = 4.15531911327304 | erot = 1.90286269173082 | epot = -19.3407194621007 | etot = -13.2825376570969 -137000 ekin = 4.22592766896971 | erot = 1.92681130724396 | epot = -19.4352766333492 | etot = -13.2825376571355 -138000 ekin = 4.27918313098009 | erot = 1.95973390207694 | epot = -19.5214546902017 | etot = -13.2825376571446 -139000 ekin = 4.31500256681588 | erot = 2.00154238231142 | epot = -19.5990826062102 | etot = -13.2825376570829 -140000 ekin = 4.33403278412117 | erot = 2.05223040229225 | epot = -19.6688008434059 | etot = -13.2825376569925 -141000 ekin = 4.33751047770814 | erot = 2.11180924821164 | epot = -19.7318573827859 | etot = -13.2825376568661 -142000 ekin = 4.32708478663596 | erot = 2.18042096416729 | epot = -19.7900434075185 | etot = -13.2825376567153 -143000 ekin = 4.30467959787758 | erot = 2.25833701673771 | epot = -19.845554271157 | etot = -13.2825376565417 -144000 ekin = 4.27235382259283 | erot = 2.3459516541184 | epot = -19.9008431331017 | etot = -13.2825376563904 -145000 ekin = 4.23214636981281 | erot = 2.44344334214771 | epot = -19.9581273682276 | etot = -13.2825376562671 -146000 ekin = 4.18594231916965 | erot = 2.55071340549387 | epot = -20.0191933808494 | etot = -13.2825376561859 -147000 ekin = 4.13537962661628 | erot = 2.66728850163299 | epot = -20.0852057844054 | etot = -13.2825376561562 -148000 ekin = 4.08179900889746 | erot = 2.79223549069502 | epot = -20.1565721557737 | etot = -13.2825376561812 -149000 ekin = 4.02623498472355 | erot = 2.92411986899913 | epot = -20.2328925099828 | etot = -13.2825376562601 -150000 ekin = 3.96943958307735 | erot = 3.06100347347696 | epot = -20.3129807129432 | etot = -13.2825376563889 -151000 ekin = 3.91192645323312 | erot = 3.20047132483891 | epot = -20.3949354346338 | etot = -13.2825376565618 -152000 ekin = 3.85402372610912 | erot = 3.3396787748025 | epot = -20.4762401576838 | etot = -13.2825376567722 -153000 ekin = 3.79592773401811 | erot = 3.47541715770496 | epot = -20.5538825487347 | etot = -13.2825376570116 -154000 ekin = 3.7377553070406 | erot = 3.60420547216162 | epot = -20.6244984364711 | etot = -13.2825376572689 -155000 ekin = 3.67959791029876 | erot = 3.72242217783006 | epot = -20.6845577456572 | etot = -13.2825376575284 -156000 ekin = 3.62158147939242 | erot = 3.82649073830597 | epot = -20.7306098754674 | etot = -13.282537657769 -157000 ekin = 3.56393625541153 | erot = 3.91312084630165 | epot = -20.7595947596795 | etot = -13.2825376579664 -158000 ekin = 3.50707329925246 | erot = 3.97958736500162 | epot = -20.7691983223494 | etot = -13.2825376580953 -159000 ekin = 3.45165682738677 | erot = 4.02400734849703 | epot = -20.7582018340196 | etot = -13.2825376581358 -160000 ekin = 3.39865532558926 | erot = 4.04555903021762 | epot = -20.7267520138841 | etot = -13.2825376580772 -161000 ekin = 3.34935406486454 | erot = 4.04458967179496 | epot = -20.6764813945816 | etot = -13.2825376579221 -162000 ekin = 3.30532015421547 | erot = 4.02258247379647 | epot = -20.6104402856973 | etot = -13.2825376576853 -163000 ekin = 3.26831809803595 | erot = 3.98198669358187 | epot = -20.5328424490092 | etot = -13.2825376573914 -164000 ekin = 3.24018500158393 | erot = 3.92594872656758 | epot = -20.448671385221 | etot = -13.2825376570695 -165000 ekin = 3.22267663501618 | erot = 3.85799639398401 | epot = -20.3632106857525 | etot = -13.2825376567523 -166000 ekin = 3.21735668268655 | erot = 3.78179957337404 | epot = -20.2816939123394 | etot = -13.2825376562788 -167000 ekin = 3.22508554133831 | erot = 3.70216421851945 | epot = -20.2097874159608 | etot = -13.282537656103 -168000 ekin = 3.24596106315309 | erot = 3.62279974210026 | epot = -20.1512984612667 | etot = -13.2825376560133 -169000 ekin = 3.27955383501576 | erot = 3.54538235194467 | epot = -20.1074738429824 | etot = -13.282537656022 -170000 ekin = 3.32466734771607 | erot = 3.47077759716863 | epot = -20.0779826010129 | etot = -13.2825376561282 -171000 ekin = 3.37937800793454 | erot = 3.39904334979686 | epot = -20.0609590140444 | etot = -13.282537656313 -172000 ekin = 3.44119436380834 | erot = 3.32956363469193 | epot = -20.0532956550461 | etot = -13.2825376565459 -173000 ekin = 3.5073198530207 | erot = 3.2612835945287 | epot = -20.051141104334 | etot = -13.2825376567846 -174000 ekin = 3.57497712060509 | erot = 3.19303082809317 | epot = -20.0505456056827 | etot = -13.2825376569845 -175000 ekin = 3.64173116724473 | erot = 3.12386956099425 | epot = -20.0481383853471 | etot = -13.2825376571082 -176000 ekin = 3.70574771912998 | erot = 3.05341479574251 | epot = -20.0417001720045 | etot = -13.282537657132 -177000 ekin = 3.76593888056791 | erot = 2.98204284338433 | epot = -20.0305193810041 | etot = -13.2825376570519 -178000 ekin = 3.82196164475597 | erot = 2.91094638159331 | epot = -20.0154456832348 | etot = -13.2825376568855 -179000 ekin = 3.87411507697419 | erot = 2.8420411011697 | epot = -19.9986938347981 | etot = -13.2825376566543 -180000 ekin = 3.92317967933079 | erot = 2.77773953428165 | epot = -19.9834568700055 | etot = -13.2825376563931 -181000 ekin = 3.97015764234259 | erot = 2.72070235461336 | epot = -19.973397653084 | etot = -13.2825376561281 -182000 ekin = 4.01610171617377 | erot = 2.67349840169278 | epot = -19.9721377738001 | etot = -13.2825376559335 -183000 ekin = 4.06177363427588 | erot = 2.63812245871518 | epot = -19.9824337488122 | etot = -13.2825376558212 -184000 ekin = 4.10756653676875 | erot = 2.61575603465098 | epot = -20.0058602272084 | etot = -13.2825376557887 -185000 ekin = 4.1535465296398 | erot = 2.60670565064949 | epot = -20.0427898361268 | etot = -13.2825376558375 -186000 ekin = 4.19945391071947 | erot = 2.61036353554361 | epot = -20.0923551022258 | etot = -13.2825376559627 -187000 ekin = 4.24473107430486 | erot = 2.62524898284968 | epot = -20.1525177133085 | etot = -13.282537656154 -188000 ekin = 4.28856799818638 | erot = 2.64911845928539 | epot = -20.2202241138684 | etot = -13.2825376563966 -189000 ekin = 4.33007364398987 | erot = 2.67919947077904 | epot = -20.2918107713923 | etot = -13.2825376566233 -190000 ekin = 4.36845326745392 | erot = 2.71241964780855 | epot = -20.3634105721975 | etot = -13.282537656935 -191000 ekin = 4.40242074847318 | erot = 2.74530093921345 | epot = -20.4302593449098 | etot = -13.2825376572232 -192000 ekin = 4.43037880288196 | erot = 2.77455401038569 | epot = -20.4874704712234 | etot = -13.2825376579557 -193000 ekin = 4.4483451030517 | erot = 2.79692081276062 | epot = -20.5278035740367 | etot = -13.2825376582243 -194000 ekin = 4.45438337861199 | erot = 2.80974801333428 | epot = -20.5466690503493 | etot = -13.282537658403 -195000 ekin = 4.44752201417129 | erot = 2.81136444003151 | epot = -20.5414241126783 | etot = -13.2825376584755 -196000 ekin = 4.4273718790499 | erot = 2.80121240437835 | epot = -20.5111219418613 | etot = -13.2825376584331 -197000 ekin = 4.39418615090579 | erot = 2.77991547931552 | epot = -20.4566392884973 | etot = -13.282537658276 -198000 ekin = 4.3488852650832 | erot = 2.74924294053151 | epot = -20.3806658636282 | etot = -13.2825376580135 -199000 ekin = 4.2930400637885 | erot = 2.71196807404484 | epot = -20.2875457954979 | etot = -13.2825376576645 -200000 ekin = 4.228803621182 | erot = 2.67162662745973 | epot = -20.1829679058993 | etot = -13.2825376572575 -201000 ekin = 4.1587834630136 | erot = 2.63219133391197 | epot = -20.0735124537541 | etot = -13.2825376568285 -202000 ekin = 4.08585235174851 | erot = 2.59768848811678 | epot = -19.9660784962843 | etot = -13.282537656419 -203000 ekin = 4.01290418154487 | erot = 2.57179164674953 | epot = -19.8672334843662 | etot = -13.2825376560718 -204000 ekin = 3.94257872967339 | erot = 2.55743320244059 | epot = -19.7825495879401 | etot = -13.2825376558261 -205000 ekin = 3.8769885984992 | erot = 2.55647506167898 | epot = -19.7160013158905 | etot = -13.2825376557123 -206000 ekin = 3.81748743469334 | erot = 2.56947517652909 | epot = -19.6695002669703 | etot = -13.2825376557479 -207000 ekin = 3.76451595610977 | erot = 2.59557970374973 | epot = -19.6426333157935 | etot = -13.282537655934 -208000 ekin = 3.71755329412301 | erot = 2.63256413547951 | epot = -19.6326550858557 | etot = -13.2825376562532 -209000 ekin = 3.67518956841205 | erot = 2.6770413301753 | epot = -19.6347685552552 | etot = -13.2825376566678 -210000 ekin = 3.63532366958265 | erot = 2.72484401425423 | epot = -19.6427053409585 | etot = -13.2825376571216 -211000 ekin = 3.59547812025674 | erot = 2.7715653100656 | epot = -19.6495810878672 | etot = -13.2825376575449 -212000 ekin = 3.55320133886872 | erot = 2.81319346320055 | epot = -19.6489324599365 | etot = -13.2825376578672 -213000 ekin = 3.50649761292236 | erot = 2.84671880107394 | epot = -19.6357540720304 | etot = -13.2825376580341 -214000 ekin = 3.45419694129236 | erot = 2.87055671325175 | epot = -19.6072913125676 | etot = -13.2825376580235 -215000 ekin = 3.3961705526582 | erot = 2.88465790120113 | epot = -19.5633661117115 | etot = -13.2825376578522 -216000 ekin = 3.33333457774809 | erot = 2.89027487492404 | epot = -19.506147110241 | etot = -13.2825376575688 -217000 ekin = 3.26237078851854 | erot = 2.88652329141029 | epot = -19.4314317899046 | etot = -13.2825377099757 -218000 ekin = 3.0604126920775 | erot = 2.81741383451156 | epot = -19.1603641969459 | etot = -13.2825376703569 -219000 ekin = 2.93316276967125 | erot = 2.84460250247024 | epot = -19.0603029343598 | etot = -13.2825376622183 -220000 ekin = 2.96128614843719 | erot = 2.9890414566452 | epot = -19.2328653086372 | etot = -13.2825377035548 -221000 ekin = 2.90913828063365 | erot = 3.0370109417019 | epot = -19.2286868797585 | etot = -13.2825376574229 -222000 ekin = 2.8422737694587 | erot = 3.05603303801555 | epot = -19.1808444650453 | etot = -13.2825376575711 -223000 ekin = 2.78062900949199 | erot = 3.06232144542732 | epot = -19.1254881126293 | etot = -13.28253765771 -224000 ekin = 2.72480461600021 | erot = 3.05323876331451 | epot = -19.0605810371243 | etot = -13.2825376578096 -225000 ekin = 2.67532541220304 | erot = 3.02684795807043 | epot = -18.9847110281097 | etot = -13.2825376578362 -226000 ekin = 2.63276163036917 | erot = 2.98227164387466 | epot = -18.8975709320199 | etot = -13.2825376577761 -227000 ekin = 2.59776959648546 | erot = 2.91985728396212 | epot = -18.8001645380861 | etot = -13.2825376576386 -228000 ekin = 2.57104335950858 | erot = 2.84110209326577 | epot = -18.694683110226 | etot = -13.2825376574516 -229000 ekin = 2.55319781380102 | erot = 2.74837649564429 | epot = -18.5841119666965 | etot = -13.2825376572512 -230000 ekin = 2.54463522127649 | erot = 2.64454432367442 | epot = -18.4717172020187 | etot = -13.2825376570678 -231000 ekin = 2.54546021784584 | erot = 2.53260284792404 | epot = -18.3606007226851 | etot = -13.2825376569152 -232000 ekin = 2.55549307881052 | erot = 2.41545023211231 | epot = -18.2534809677089 | etot = -13.2825376567861 -233000 ekin = 2.57438548648707 | erot = 2.29583418255659 | epot = -18.1527573257021 | etot = -13.2825376566584 -234000 ekin = 2.60178443029238 | erot = 2.17645519655946 | epot = -18.0607772833611 | etot = -13.2825376565093 -235000 ekin = 2.63745218021138 | erot = 2.06012244390592 | epot = -17.9801122804485 | etot = -13.2825376563312 -236000 ekin = 2.68126373962444 | erot = 1.94983176913362 | epot = -17.9136331648965 | etot = -13.2825376561384 -237000 ekin = 2.73306880567087 | erot = 1.84868049785769 | epot = -17.8642869594917 | etot = -13.2825376559632 -238000 ekin = 2.79247907581076 | erot = 1.75962709169706 | epot = -17.8346438233489 | etot = -13.2825376558411 -239000 ekin = 2.85867594437833 | erot = 1.68518476454709 | epot = -17.8263983647234 | etot = -13.282537655798 -240000 ekin = 2.93031183915998 | erot = 1.62715662270522 | epot = -17.840006117709 | etot = -13.2825376558438 -241000 ekin = 3.00552986743756 | erot = 1.58648515289486 | epot = -17.8745526763053 | etot = -13.2825376559729 -242000 ekin = 3.0820836546576 | erot = 1.5632372672336 | epot = -17.9278585780576 | etot = -13.2825376561664 -243000 ekin = 3.15752262719394 | erot = 1.55671134418848 | epot = -17.9967716277795 | etot = -13.282537656397 -244000 ekin = 3.22940955213892 | erot = 1.56564064462356 | epot = -18.0775878533954 | etot = -13.2825376566329 -245000 ekin = 3.29554303953992 | erot = 1.58846457360084 | epot = -18.1665452699808 | etot = -13.28253765684 -246000 ekin = 3.35415939736937 | erot = 1.6236315970523 | epot = -18.2603286514115 | etot = -13.2825376569898 -247000 ekin = 3.40408574270723 | erot = 1.66988325611156 | epot = -18.3565066558819 | etot = -13.2825376570631 -248000 ekin = 3.4448166326331 | erot = 1.72645823945448 | epot = -18.4538125291441 | etot = -13.2825376570566 -249000 ekin = 3.47649663255696 | erot = 1.79316293261223 | epot = -18.5521972221528 | etot = -13.2825376569836 -250000 ekin = 3.49981192900835 | erot = 1.87028571125288 | epot = -18.6526352971325 | etot = -13.2825376568713 -251000 ekin = 3.51581851748353 | erot = 1.95837689015936 | epot = -18.7567330643956 | etot = -13.2825376567528 -252000 ekin = 3.52575126869662 | erot = 2.05795546201388 | epot = -18.8662443873696 | etot = -13.2825376566591 -253000 ekin = 3.53086049262996 | erot = 2.16922084359695 | epot = -18.9826189928386 | etot = -13.2825376566117 -254000 ekin = 3.5323092446383 | erot = 2.29183768672856 | epot = -19.1066845879863 | etot = -13.2825376566194 -255000 ekin = 3.53114146569609 | erot = 2.42483171779644 | epot = -19.2385108401714 | etot = -13.2825376566788 -256000 ekin = 3.5283101054336 | erot = 2.56659937924988 | epot = -19.3774471414622 | etot = -13.2825376567787 -257000 ekin = 3.52473759358505 | erot = 2.71500399460053 | epot = -19.5222792450903 | etot = -13.2825376569047 -258000 ekin = 3.52137545668075 | erot = 2.86751445186622 | epot = -19.6714275655916 | etot = -13.2825376570446 -259000 ekin = 3.51923070409731 | erot = 3.02134046698861 | epot = -19.8231088282789 | etot = -13.282537657193 -260000 ekin = 3.51933841084731 | erot = 3.17353025732487 | epot = -19.9754063255239 | etot = -13.2825376573517 -261000 ekin = 3.52267851351005 | erot = 3.32101670247621 | epot = -20.1262328735157 | etot = -13.2825376575294 -262000 ekin = 3.53003333481016 | erot = 3.46062452427784 | epot = -20.2731955168254 | etot = -13.2825376577374 -263000 ekin = 3.54180424035237 | erot = 3.58907231404639 | epot = -20.4134142123818 | etot = -13.282537657983 -264000 ekin = 3.55787447685355 | erot = 3.7030112779332 | epot = -20.5434234130516 | etot = -13.2825376582649 -265000 ekin = 3.57751330913366 | erot = 3.7991542896327 | epot = -20.6592052573327 | etot = -13.2825376585664 -266000 ekin = 3.59938201293792 | erot = 3.87452595149942 | epot = -20.7564456232916 | etot = -13.2825376588543 -267000 ekin = 3.62167235822857 | erot = 3.92682901662269 | epot = -20.8310390339333 | etot = -13.282537659082 -268000 ekin = 3.64237343768047 | erot = 3.95486700975685 | epot = -20.8797781066375 | etot = -13.2825376592002 -269000 ekin = 3.6596153375486 | erot = 3.95890941485044 | epot = -20.901062411574 | etot = -13.2825376591749 -270000 ekin = 3.67198713217804 | erot = 3.9408570080659 | epot = -20.8953817992456 | etot = -13.2825376590016 -271000 ekin = 3.67872329079266 | erot = 3.9041072632946 | epot = -20.865368212798 | etot = -13.2825376587107 -272000 ekin = 3.67969720542205 | erot = 3.85312017496749 | epot = -20.8153550387474 | etot = -13.2825376583578 -273000 ekin = 3.67523785304609 | erot = 3.79279347421283 | epot = -20.7505689852654 | etot = -13.2825376580065 -274000 ekin = 3.66585545030655 | erot = 3.72781503527724 | epot = -20.6762081432937 | etot = -13.28253765771 -275000 ekin = 3.65198266149228 | erot = 3.66213927987085 | epot = -20.5966595988644 | etot = -13.2825376575013 -276000 ekin = 3.63380683707674 | erot = 3.59866145944742 | epot = -20.5150059539162 | etot = -13.282537657392 -277000 ekin = 3.61121443635218 | erot = 3.53909052619982 | epot = -20.4328426199289 | etot = -13.2825376573769 -278000 ekin = 3.58382533557949 | erot = 3.48398196201246 | epot = -20.3503449550318 | etot = -13.2825376574399 -279000 ekin = 3.55107927466775 | erot = 3.43288767683711 | epot = -20.266504609063 | etot = -13.2825376575582 -280000 ekin = 3.512346488716 | erot = 3.38459301004971 | epot = -20.1794771564691 | etot = -13.2825376577034 -281000 ekin = 3.46705217022212 | erot = 3.33742016501593 | epot = -20.0870099930813 | etot = -13.2825376578432 -282000 ekin = 3.4148174354963 | erot = 3.28957539031116 | epot = -19.9869304837506 | etot = -13.2825376579432 -283000 ekin = 3.35561723861012 | erot = 3.23950140187618 | epot = -19.8776562984585 | etot = -13.2825376579722 -284000 ekin = 3.28993990743678 | erot = 3.18617834963535 | epot = -19.7586559149806 | etot = -13.2825376579084 -285000 ekin = 3.21891605429242 | erot = 3.12930993710604 | epot = -19.630763649145 | etot = -13.2825376577465 -286000 ekin = 3.14439051761661 | erot = 3.06934998331757 | epot = -19.4962781582957 | etot = -13.2825376573615 -287000 ekin = 3.06960009495524 | erot = 3.00728050107473 | epot = -19.3594182531579 | etot = -13.2825376571279 -288000 ekin = 2.99759349423509 | erot = 2.9441365645361 | epot = -19.2242677156211 | etot = -13.2825376568499 -289000 ekin = 2.93122590326888 | erot = 2.88109280424439 | epot = -19.0948563640672 | etot = -13.2825376565539 -290000 ekin = 2.87364775959469 | erot = 2.81936189019821 | epot = -18.9755473060555 | etot = -13.2825376562626 -291000 ekin = 2.82808392253171 | erot = 2.76008269212137 | epot = -18.8707042706452 | etot = -13.2825376559921 -292000 ekin = 2.79759576435947 | erot = 2.70430482357441 | epot = -18.7844382436877 | etot = -13.2825376557538 -293000 ekin = 2.78483509079536 | erot = 2.65304729582213 | epot = -18.7204200421748 | etot = -13.2825376555573 -294000 ekin = 2.79179688861761 | erot = 2.60738085283692 | epot = -18.6817153968686 | etot = -13.282537655414 -295000 ekin = 2.8195793452766 | erot = 2.56847294066441 | epot = -18.6705899412817 | etot = -13.2825376553407 -296000 ekin = 2.86809990605543 | erot = 2.53696733690238 | epot = -18.6876048985693 | etot = -13.2825376556115 -297000 ekin = 2.93560102202575 | erot = 2.51254790532664 | epot = -18.7306865831654 | etot = -13.2825376558131 -298000 ekin = 3.01880409347839 | erot = 2.49548083197626 | epot = -18.7968225815679 | etot = -13.2825376561133 -299000 ekin = 3.11317674937697 | erot = 2.4858527957229 | epot = -18.8815672015831 | etot = -13.2825376564832 -300000 ekin = 3.21328607489871 | erot = 2.4836345898414 | epot = -18.9794583216092 | etot = -13.2825376568691 -301000 ekin = 3.31333985043658 | erot = 2.48892965616305 | epot = -19.0848071638015 | etot = -13.2825376572019 -302000 ekin = 3.40783628219617 | erot = 2.50232511253297 | epot = -19.192699052147 | etot = -13.2825376574178 -303000 ekin = 3.49218145837423 | erot = 2.52518642841781 | epot = -19.2999055442748 | etot = -13.2825376574828 -304000 ekin = 3.56312110363128 | erot = 2.55971045465009 | epot = -19.4053692156879 | etot = -13.2825376574065 -305000 ekin = 3.6188877414327 | erot = 2.6086316969236 | epot = -19.5100570955968 | etot = -13.2825376572405 -306000 ekin = 3.65906113322095 | erot = 2.67462381277421 | epot = -19.616222603054 | etot = -13.2825376570589 -307000 ekin = 3.68422703808074 | erot = 2.75956355882326 | epot = -19.7263282538395 | etot = -13.2825376569355 -308000 ekin = 3.69555713019506 | erot = 2.86386132679045 | epot = -19.841956113912 | etot = -13.2825376569265 -309000 ekin = 3.6944221679418 | erot = 2.98601798220111 | epot = -19.9629778072023 | etot = -13.2825376570594 -310000 ekin = 3.68211177280709 | erot = 3.12248873496333 | epot = -20.0871381651018 | etot = -13.2825376573313 -311000 ekin = 3.65969154495063 | erot = 3.26786382117018 | epot = -20.2100930238327 | etot = -13.2825376577119 -312000 ekin = 3.62799191203377 | erot = 3.41533011396127 | epot = -20.3258596841446 | etot = -13.2825376581496 -313000 ekin = 3.5877057744357 | erot = 3.5573517271153 | epot = -20.4275951601311 | etot = -13.2825376585801 -314000 ekin = 3.53954680683471 | erot = 3.68647834911128 | epot = -20.5085628148833 | etot = -13.2825376589373 -315000 ekin = 3.48441731148361 | erot = 3.79616777476463 | epot = -20.5631227454135 | etot = -13.2825376591653 -316000 ekin = 3.42353216211093 | erot = 3.88149414080879 | epot = -20.5875639621498 | etot = -13.2825376592301 -317000 ekin = 3.35845872751516 | erot = 3.93962315501014 | epot = -20.5806195416508 | etot = -13.2825376591255 -318000 ekin = 3.29105546518444 | erot = 3.96997627516161 | epot = -20.5435693992194 | etot = -13.2825376588734 -319000 ekin = 3.22332073202391 | erot = 3.97407140328684 | epot = -20.4799297938271 | etot = -13.2825376585164 -320000 ekin = 3.15718962490207 | erot = 3.95509826666012 | epot = -20.3948255496699 | etot = -13.2825376581077 -321000 ekin = 3.09432530925279 | erot = 3.91739375695147 | epot = -20.2942567238344 | etot = -13.2825376576302 -322000 ekin = 3.03585792728377 | erot = 3.86620572599634 | epot = -20.1846013105925 | etot = -13.2825376573124 -323000 ekin = 2.98241823057018 | erot = 3.80588679425669 | epot = -20.0708426818679 | etot = -13.282537657041 -324000 ekin = 2.93426965651548 | erot = 3.74025042751319 | epot = -19.9570577408469 | etot = -13.2825376568183 -325000 ekin = 2.89141991680272 | erot = 3.6726505878983 | epot = -19.8466081613385 | etot = -13.2825376566375 -326000 ekin = 2.85377350486142 | erot = 3.60592095019319 | epot = -19.7422321115423 | etot = -13.2825376564876 -327000 ekin = 2.82127903351907 | erot = 3.54238718475229 | epot = -19.6462038746294 | etot = -13.2825376563581 -328000 ekin = 2.79404030192089 | erot = 3.483910798784 | epot = -19.5604887570644 | etot = -13.2825376563595 -329000 ekin = 2.77197949436551 | erot = 3.43169110626534 | epot = -19.486208256954 | etot = -13.2825376563232 -330000 ekin = 2.75494613632729 | erot = 3.38614869285078 | epot = -19.4236324854878 | etot = -13.2825376563097 -331000 ekin = 2.74315934444998 | erot = 3.34732307627103 | epot = -19.3730200770432 | etot = -13.2825376563222 -332000 ekin = 2.73688271481008 | erot = 3.31484843372441 | epot = -19.3342688048987 | etot = -13.2825376563643 -333000 ekin = 2.73633973950745 | erot = 3.28798960597169 | epot = -19.3068670019181 | etot = -13.282537656439 -334000 ekin = 2.74163678826561 | erot = 3.26568447791409 | epot = -19.2898589227256 | etot = -13.2825376565459 -335000 ekin = 2.75270974558365 | erot = 3.24660647154557 | epot = -19.2818538738098 | etot = -13.2825376566806 -336000 ekin = 2.76930297431622 | erot = 3.22925893950259 | epot = -19.2810995706514 | etot = -13.2825376568326 -337000 ekin = 2.79098432744022 | erot = 3.21211025351937 | epot = -19.2856322379457 | etot = -13.2825376569861 -338000 ekin = 2.81719266282387 | erot = 3.19377253885662 | epot = -19.2935028588019 | etot = -13.2825376571214 -339000 ekin = 2.84730801445438 | erot = 3.17321131001618 | epot = -19.3030569816885 | etot = -13.2825376572179 -340000 ekin = 2.88072770851284 | erot = 3.14995757252068 | epot = -19.3132229382912 | etot = -13.2825376572577 -341000 ekin = 2.91693042220033 | erot = 3.12427992089905 | epot = -19.3237480003317 | etot = -13.2825376572323 -342000 ekin = 2.95550483676937 | erot = 3.09726362719658 | epot = -19.3353061211112 | etot = -13.2825376571453 -343000 ekin = 2.99612679558118 | erot = 3.07075651726445 | epot = -19.3494209698602 | etot = -13.2825376570146 -344000 ekin = 3.03848111852428 | erot = 3.0471716921407 | epot = -19.3681904675347 | etot = -13.2825376568698 -345000 ekin = 3.08214069495779 | erot = 3.02917600552132 | epot = -19.393854357224 | etot = -13.2825376567449 -346000 ekin = 3.12643023842175 | erot = 3.01932391636737 | epot = -19.428291811462 | etot = -13.2825376566729 -347000 ekin = 3.1703057195056 | erot = 3.01970377198013 | epot = -19.4725471481654 | etot = -13.2825376566797 -348000 ekin = 3.21227615188226 | erot = 3.03164750475832 | epot = -19.5264613134225 | etot = -13.282537656782 -349000 ekin = 3.25037907572041 | erot = 3.05552302028579 | epot = -19.588439752994 | etot = -13.2825376569878 -350000 ekin = 3.28221302801688 | erot = 3.09061207742305 | epot = -19.6553627627352 | etot = -13.2825376572953 -351000 ekin = 3.30503586845653 | erot = 3.13508039752205 | epot = -19.722653923667 | etot = -13.2825376576884 -352000 ekin = 3.31595350171697 | erot = 3.1860592581815 | epot = -19.7845504180322 | etot = -13.2825376581337 -353000 ekin = 3.31222586318731 | erot = 3.23985471046157 | epot = -19.8346182322283 | etot = -13.2825376585794 -354000 ekin = 3.29169173965498 | erot = 3.29228360641323 | epot = -19.8665130050279 | etot = -13.2825376589597 -355000 ekin = 3.25327251247953 | erot = 3.33911881639432 | epot = -19.8749289880785 | etot = -13.2825376592046 -356000 ekin = 3.19745645460831 | erot = 3.37659336434106 | epot = -19.8565874782066 | etot = -13.2825376592572 -357000 ekin = 3.12661218039379 | erot = 3.40186563883957 | epot = -19.8110154783295 | etot = -13.2825376590961 -358000 ekin = 3.04496261886646 | erot = 3.41331336007688 | epot = -19.7408136376943 | etot = -13.2825376587509 -359000 ekin = 2.95811577563298 | erot = 3.41055161315579 | epot = -19.651205047089 | etot = -13.2825376583003 -360000 ekin = 2.87219670777394 | erot = 3.39416675335358 | epot = -19.5489011189766 | etot = -13.2825376578491 -361000 ekin = 2.79279437102874 | erot = 3.36527462495952 | epot = -19.4406066534814 | etot = -13.2825376574932 -362000 ekin = 2.72403411625464 | erot = 3.32507906116156 | epot = -19.3316508347044 | etot = -13.2825376572882 -363000 ekin = 2.66805032239925 | erot = 3.27458936074012 | epot = -19.2251773403758 | etot = -13.2825376572364 -364000 ekin = 2.62498064266495 | erot = 3.21457203232894 | epot = -19.1220903322869 | etot = -13.2825376572931 -365000 ekin = 2.5934133585228 | erot = 3.14571210015836 | epot = -19.0216631160704 | etot = -13.2825376573892 -366000 ekin = 2.5710840161418 | erot = 3.06888690043612 | epot = -18.9225085740357 | etot = -13.2825376574577 -367000 ekin = 2.55558493490964 | erot = 2.98543100060352 | epot = -18.8235535929648 | etot = -13.2825376574517 -368000 ekin = 2.54491188940922 | erot = 2.89729436784059 | epot = -18.7247439146015 | etot = -13.2825376573517 -369000 ekin = 2.53777310784879 | erot = 2.80704690677456 | epot = -18.6273576717881 | etot = -13.2825376571647 -370000 ekin = 2.53338825950404 | erot = 2.71819995751166 | epot = -18.5341258738832 | etot = -13.2825376568675 -371000 ekin = 2.53146597101848 | erot = 2.63443214139472 | epot = -18.4484357690377 | etot = -13.2825376566245 -372000 ekin = 2.53305224681624 | erot = 2.55818112001678 | epot = -18.3737710231761 | etot = -13.2825376563431 -373000 ekin = 2.53983164211236 | erot = 2.49190590621591 | epot = -18.3142752043687 | etot = -13.2825376560405 -374000 ekin = 2.55393613427103 | erot = 2.43803861080081 | epot = -18.2745124008031 | etot = -13.2825376557312 -375000 ekin = 2.57759599288795 | erot = 2.39898190221581 | epot = -18.2591155506451 | etot = -13.2825376555413 -376000 ekin = 2.61177868596817 | erot = 2.37710020071972 | epot = -18.2714165420641 | etot = -13.2825376553762 -377000 ekin = 2.6577874067594 | erot = 2.3735939710949 | epot = -18.3139190331406 | etot = -13.2825376552863 -378000 ekin = 2.71669984604439 | erot = 2.38881656768362 | epot = -18.388054069029 | etot = -13.2825376553009 -379000 ekin = 2.78887075408087 | erot = 2.42222171828648 | epot = -18.4936301278208 | etot = -13.2825376554534 -380000 ekin = 2.87358930471002 | erot = 2.47221119730558 | epot = -18.6283381577863 | etot = -13.2825376557707 -381000 ekin = 2.96878304795802 | erot = 2.53604633164079 | epot = -18.7873670358597 | etot = -13.2825376562609 -382000 ekin = 3.07087981816367 | erot = 2.60989110069411 | epot = -18.9633085757604 | etot = -13.2825376569026 -383000 ekin = 3.17493836101278 | erot = 2.68903209116685 | epot = -19.1465081098178 | etot = -13.2825376576382 -384000 ekin = 3.2751121744025 | erot = 2.76828123033664 | epot = -19.3259310631183 | etot = -13.2825376583791 -385000 ekin = 3.36541347868724 | erot = 2.84251901104316 | epot = -19.4904701487526 | etot = -13.2825376590222 -386000 ekin = 3.44062041949959 | erot = 2.90728609466406 | epot = -19.63044417364 | etot = -13.2825376594764 -387000 ekin = 3.49708416826313 | erot = 2.95929717263878 | epot = -19.7389190005902 | etot = -13.2825376596883 -388000 ekin = 3.533208999321 | erot = 2.99676007578866 | epot = -19.8125067347616 | etot = -13.2825376596519 -389000 ekin = 3.54950477191345 | erot = 3.01944441497972 | epot = -19.8514868462967 | etot = -13.2825376594035 -390000 ekin = 3.54826504042807 | erot = 3.0285237431762 | epot = -19.8593264426073 | etot = -13.282537659003 -391000 ekin = 3.53302701092141 | erot = 3.02626577204824 | epot = -19.8418304414874 | etot = -13.2825376585178 -392000 ekin = 3.50797457908268 | erot = 3.01564117086781 | epot = -19.8061534079633 | etot = -13.2825376580128 -393000 ekin = 3.47739262395814 | erot = 2.99988985775754 | epot = -19.7598201392621 | etot = -13.2825376575465 -394000 ekin = 3.44522282252884 | erot = 2.98206454116459 | epot = -19.7098250208625 | etot = -13.2825376571691 -395000 ekin = 3.41473630917259 | erot = 2.96457892120641 | epot = -19.6618528872984 | etot = -13.2825376569194 -396000 ekin = 3.38832727675762 | erot = 2.94881280953746 | epot = -19.6196777431148 | etot = -13.2825376568197 -397000 ekin = 3.36743033117316 | erot = 2.93484808692962 | epot = -19.5848160749737 | etot = -13.2825376568709 -398000 ekin = 3.35256101408232 | erot = 2.92141113768133 | epot = -19.5565098088131 | etot = -13.2825376570494 -399000 ekin = 3.34346845309996 | erot = 2.90607029857247 | epot = -19.5320764089819 | etot = -13.2825376573095 -400000 ekin = 3.33937255609299 | erot = 2.885680940137 | epot = -19.5075911538209 | etot = -13.2825376575909 -401000 ekin = 3.33924190395778 | erot = 2.85700017339113 | epot = -19.4787797351814 | etot = -13.2825376578325 -402000 ekin = 3.34205998353793 | erot = 2.81733492842804 | epot = -19.4419325699511 | etot = -13.2825376579852 -403000 ekin = 3.34703246955441 | erot = 2.76507190137147 | epot = -19.3946420289475 | etot = -13.2825376580217 -404000 ekin = 3.35370775612875 | erot = 2.69997817544394 | epot = -19.3362235895114 | etot = -13.2825376579387 -405000 ekin = 3.36200495975411 | erot = 2.62323862900913 | epot = -19.267781246516 | etot = -13.2825376577527 -406000 ekin = 3.37216882210917 | erot = 2.53727277109297 | epot = -19.1919792506945 | etot = -13.2825376574923 -407000 ekin = 3.38467286642355 | erot = 2.44541531528468 | epot = -19.1126258388987 | etot = -13.2825376571904 -408000 ekin = 3.40009251679279 | erot = 2.351546289274 | epot = -19.0341764629466 | etot = -13.2825376568798 -409000 ekin = 3.41896361161237 | erot = 2.25973253002234 | epot = -18.9612337982248 | etot = -13.2825376565901 -410000 ekin = 3.44163818667736 | erot = 2.17391337707674 | epot = -18.8980892201012 | etot = -13.2825376563471 -411000 ekin = 3.46814489278439 | erot = 2.0976400383475 | epot = -18.8483225873044 | etot = -13.2825376561725 -412000 ekin = 3.49806473021567 | erot = 2.03386747107442 | epot = -18.8144698573729 | etot = -13.2825376560828 -413000 ekin = 3.53043538014826 | erot = 1.98479597299758 | epot = -18.7977690092345 | etot = -13.2825376560887 -414000 ekin = 3.56370058652801 | erot = 1.95176512736805 | epot = -18.7980033700889 | etot = -13.2825376561928 -415000 ekin = 3.59572274043747 | erot = 1.93521132484302 | epot = -18.8134717216681 | etot = -13.2825376563876 -416000 ekin = 3.62387476619394 | erot = 1.93470676736702 | epot = -18.8411191902142 | etot = -13.2825376566532 -417000 ekin = 3.64521944272596 | erot = 1.94909657754577 | epot = -18.876853677229 | etot = -13.2825376569573 -418000 ekin = 3.65676940727155 | erot = 1.97673635559937 | epot = -18.9160434201296 | etot = -13.2825376572587 -419000 ekin = 3.65580092830723 | erot = 2.01580487492087 | epot = -18.9541434607423 | etot = -13.2825376575142 -420000 ekin = 3.64017400050826 | erot = 2.06463212116893 | epot = -18.9873437793658 | etot = -13.2825376576886 -421000 ekin = 3.60860065288942 | erot = 2.12196023054716 | epot = -19.0130985412 | etot = -13.2825376577634 -422000 ekin = 3.56080810554285 | erot = 2.18705814557018 | epot = -19.0304039088553 | etot = -13.2825376577423 -423000 ekin = 3.49756602993001 | erot = 2.2596475407574 | epot = -19.039751228337 | etot = -13.2825376576496 -424000 ekin = 3.42057977942553 | erot = 2.33965549130008 | epot = -19.0427729282486 | etot = -13.282537657523 -425000 ekin = 3.33228159149848 | erot = 2.42686463918984 | epot = -19.041683888092 | etot = -13.2825376574037 -426000 ekin = 3.23556909606388 | erot = 2.52056283158619 | epot = -19.0386695849753 | etot = -13.2825376573252 -427000 ekin = 3.13354188401699 | erot = 2.61929302170861 | epot = -19.0353725630321 | etot = -13.2825376573065 -428000 ekin = 3.0292759344835 | erot = 2.72077464106008 | epot = -19.0325882328924 | etot = -13.2825376573488 -429000 ekin = 2.92565831326667 | erot = 2.82201873865485 | epot = -19.0302147093596 | etot = -13.2825376574381 -430000 ekin = 2.82528572275417 | erot = 2.91960138007576 | epot = -19.0274247603827 | etot = -13.2825376575528 -431000 ekin = 2.73041359107532 | erot = 3.01000711728769 | epot = -19.022958366036 | etot = -13.282537657673 -432000 ekin = 2.64293211741192 | erot = 3.08992822753868 | epot = -19.0153980027402 | etot = -13.2825376577896 -433000 ekin = 2.5643487123276 | erot = 3.15643021828492 | epot = -19.0033165885172 | etot = -13.2825376579047 -434000 ekin = 2.49577139885518 | erot = 3.20696626802576 | epot = -18.9852753249064 | etot = -13.2825376580255 -435000 ekin = 2.43791477049391 | erot = 3.23932321270836 | epot = -18.9597756413512 | etot = -13.2825376581489 -436000 ekin = 2.39117206292133 | erot = 3.25164920249376 | epot = -18.9253589236643 | etot = -13.2825376582492 -437000 ekin = 2.35579129858705 | erot = 3.242692409158 | epot = -18.8810213660213 | etot = -13.2825376582762 -438000 ekin = 2.33215137598627 | erot = 3.2122573583491 | epot = -18.826946392507 | etot = -13.2825376581716 -439000 ekin = 2.32106357051175 | erot = 3.16171527166972 | epot = -18.7653165000796 | etot = -13.2825376578981 -440000 ekin = 2.32396046468846 | erot = 3.09429994298005 | epot = -18.7007980651343 | etot = -13.2825376574658 -441000 ekin = 2.34282585391516 | erot = 3.01497153468249 | epot = -18.6403350455373 | etot = -13.2825376569397 -442000 ekin = 2.37979980925652 | erot = 2.92981680804517 | epot = -18.5921542737248 | etot = -13.2825376564231 -443000 ekin = 2.4365622855113 | erot = 2.84513622245133 | epot = -18.5642361639992 | etot = -13.2825376560366 -444000 ekin = 2.51342571777129 | erot = 2.76656039612237 | epot = -18.5625237697596 | etot = -13.2825376558659 -445000 ekin = 2.60880718707236 | erot = 2.6982799889581 | epot = -18.5896248319859 | etot = -13.2825376559555 -446000 ekin = 2.71906096767643 | erot = 2.64257205052642 | epot = -18.6441706744995 | etot = -13.2825376562967 -447000 ekin = 2.83874401672722 | erot = 2.59965346897689 | epot = -18.7209351425404 | etot = -13.2825376568363 -448000 ekin = 2.9612677241565 | erot = 2.56781480894371 | epot = -18.8116201905961 | etot = -13.2825376574959 -449000 ekin = 3.07973256248662 | erot = 2.54376856118776 | epot = -18.9060387818648 | etot = -13.2825376581905 -450000 ekin = 3.18773299393503 | erot = 2.52315582293758 | epot = -18.9934264757091 | etot = -13.2825376588364 -451000 ekin = 3.28001368752861 | erot = 2.50120181208454 | epot = -19.063753158962 | etot = -13.2825376593488 -452000 ekin = 3.35296274688896 | erot = 2.47353158346301 | epot = -19.1090319899968 | etot = -13.2825376596448 -453000 ekin = 3.40494017429419 | erot = 2.43707428126018 | epot = -19.1245521152182 | etot = -13.2825376596639 -454000 ekin = 3.4363755140164 | erot = 2.39082250837405 | epot = -19.1097356817938 | etot = -13.2825376594033 -455000 ekin = 3.44952760872581 | erot = 2.33613006950283 | epot = -19.068195337143 | etot = -13.2825376589143 -456000 ekin = 3.44799144671178 | erot = 2.27640153123202 | epot = -19.0069306362517 | etot = -13.2825376583079 -457000 ekin = 3.43601809740561 | erot = 2.21623652991106 | epot = -18.9347922850174 | etot = -13.2825376577007 -458000 ekin = 3.41788845141646 | erot = 2.16036216289489 | epot = -18.8607882714966 | etot = -13.2825376571853 -459000 ekin = 3.3974915193921 | erot = 2.1126853259723 | epot = -18.7927145021792 | etot = -13.2825376568148 -460000 ekin = 3.37812232252278 | erot = 2.07567909161665 | epot = -18.7363390707418 | etot = -13.2825376566024 -461000 ekin = 3.36231617612483 | erot = 2.05042996966781 | epot = -18.6952838023611 | etot = -13.2825376565685 -462000 ekin = 3.3516010060643 | erot = 2.03669678982629 | epot = -18.6708354525495 | etot = -13.2825376566589 -463000 ekin = 3.34749626496556 | erot = 2.03201016323594 | epot = -18.6620440849604 | etot = -13.2825376567589 -464000 ekin = 3.35152548101934 | erot = 2.0337250814521 | epot = -18.6677882192943 | etot = -13.2825376568228 -465000 ekin = 3.36505604034505 | erot = 2.03980035193901 | epot = -18.6873940492497 | etot = -13.2825376569656 -466000 ekin = 3.38750814155039 | erot = 2.04917645650973 | epot = -18.719222255183 | etot = -13.2825376571229 -467000 ekin = 3.4178184653666 | erot = 2.06078922447546 | epot = -18.7611453471486 | etot = -13.2825376573065 -468000 ekin = 3.45442517049901 | erot = 2.07383123666845 | epot = -18.8107940646916 | etot = -13.2825376575242 -469000 ekin = 3.49517146555562 | erot = 2.08763407955549 | epot = -18.865343202886 | etot = -13.2825376577749 -470000 ekin = 3.5375430439129 | erot = 2.10145518357207 | epot = -18.9215358855281 | etot = -13.2825376580432 -471000 ekin = 3.578984874629 | erot = 2.11439735083904 | epot = -18.9759198837616 | etot = -13.2825376582935 -472000 ekin = 3.61725786632456 | erot = 2.12555669055365 | epot = -19.0253522153517 | etot = -13.2825376584735 -473000 ekin = 3.65079380576158 | erot = 2.13440730770354 | epot = -19.067738771992 | etot = -13.2825376585269 -474000 ekin = 3.67897471803071 | erot = 2.14127953357501 | epot = -19.1027919100301 | etot = -13.2825376584244 -475000 ekin = 3.70221628145261 | erot = 2.14765507905023 | epot = -19.1324090186923 | etot = -13.2825376581894 -476000 ekin = 3.72174790903032 | erot = 2.15602304575789 | epot = -19.1603086126886 | etot = -13.2825376579004 -477000 ekin = 3.73912018616774 | erot = 2.16928365663934 | epot = -19.1909415004594 | etot = -13.2825376576523 -478000 ekin = 3.7556510063889 | erot = 2.18999309719236 | epot = -19.2281817610876 | etot = -13.2825376575064 -479000 ekin = 3.77207488928898 | erot = 2.21984602916671 | epot = -19.2744585759238 | etot = -13.2825376574681 -480000 ekin = 3.78851866246641 | erot = 2.25959918548264 | epot = -19.33065550545 | etot = -13.2825376575009 -481000 ekin = 3.80616995061892 | erot = 2.30984659763992 | epot = -19.3985542055291 | etot = -13.2825376572702 -482000 ekin = 3.82906961959312 | erot = 2.37155747933105 | epot = -19.4831647566187 | etot = -13.2825376576945 -483000 ekin = 3.85390461343509 | erot = 2.44250735312729 | epot = -19.5789496246803 | etot = -13.2825376581179 -484000 ekin = 3.87679301499903 | erot = 2.51997841363885 | epot = -19.6793090871881 | etot = -13.2825376585502 -485000 ekin = 3.8941855852142 | erot = 2.60083126184978 | epot = -19.7775545060489 | etot = -13.2825376589849 -486000 ekin = 3.9031377534013 | erot = 2.6813903200239 | epot = -19.8670657328057 | etot = -13.2825376593805 -487000 ekin = 3.90177537850899 | erot = 2.75761792311516 | epot = -19.9419309612876 | etot = -13.2825376596634 -488000 ekin = 3.88986213162243 | erot = 2.82561628023474 | epot = -19.9980160716132 | etot = -13.282537659756 -489000 ekin = 3.86922231453849 | erot = 2.88229752819206 | epot = -20.0340575023505 | etot = -13.2825376596199 -490000 ekin = 3.84371636435388 | erot = 2.92590481083659 | epot = -20.0521588344839 | etot = -13.2825376592934 -491000 ekin = 3.8185829048698 | erot = 2.95607206100703 | epot = -20.0571926247696 | etot = -13.2825376588928 -492000 ekin = 3.79923632244268 | erot = 2.97333279544265 | epot = -20.0551067764526 | etot = -13.2825376585672 -493000 ekin = 3.78992062784017 | erot = 2.97831679174203 | epot = -20.0507750780101 | etot = -13.2825376584279 -494000 ekin = 3.7922931345625 | erot = 2.97052771091745 | epot = -20.0453585079511 | etot = -13.2825376624711 -495000 ekin = 3.79451442394532 | erot = 2.9341072450869 | epot = -20.0111593284224 | etot = -13.2825376593901 -496000 ekin = 3.8106248823664 | erot = 2.88141942472008 | epot = -19.9745819636276 | etot = -13.2825376565411 -497000 ekin = 3.85788186105348 | erot = 2.83372744077321 | epot = -19.9741469603241 | etot = -13.2825376584974 -498000 ekin = 3.9188457938421 | erot = 2.78115548050691 | epot = -19.9825389377102 | etot = -13.2825376633612 -499000 ekin = 3.96315793686508 | erot = 2.7024680648114 | epot = -19.9481636596344 | etot = -13.2825376579579 -500000 ekin = 4.0027205762755 | erot = 2.61046054601125 | epot = -19.8957187797513 | etot = -13.2825376574646 -501000 ekin = 4.04216054275046 | erot = 2.51312796103934 | epot = -19.8378261606956 | etot = -13.2825376569058 -502000 ekin = 4.08330148514098 | erot = 2.4163270430933 | epot = -19.7821661846463 | etot = -13.282537656412 -503000 ekin = 4.12765179374065 | erot = 2.32533692997657 | epot = -19.7355263797907 | etot = -13.2825376560735 -504000 ekin = 4.17571661390275 | erot = 2.24418432885896 | epot = -19.7024385986861 | etot = -13.2825376559244 -505000 ekin = 4.22673456414904 | erot = 2.17536462286828 | epot = -19.6846368429618 | etot = -13.2825376559445 -506000 ekin = 4.27886046445946 | erot = 2.11995169727426 | epot = -19.6813498177143 | etot = -13.2825376559806 -507000 ekin = 4.32989839509928 | erot = 2.07798999628154 | epot = -19.69042604762 | etot = -13.2825376562392 -508000 ekin = 4.37683697458704 | erot = 2.04846223351658 | epot = -19.7078368645412 | etot = -13.2825376564376 -509000 ekin = 4.41701088936698 | erot = 2.03040461252071 | epot = -19.7299531584268 | etot = -13.2825376565391 -510000 ekin = 4.44869291188054 | erot = 2.0233924534507 | epot = -19.7546230218677 | etot = -13.2825376565364 -511000 ekin = 4.47114700663339 | erot = 2.02761863549144 | epot = -19.7813032985736 | etot = -13.2825376564488 -512000 ekin = 4.4844887018835 | erot = 2.0437568785043 | epot = -19.8107832368059 | etot = -13.2825376564181 -513000 ekin = 4.48914630706749 | erot = 2.07205454687191 | epot = -19.843738510293 | etot = -13.2825376563536 -514000 ekin = 4.48557666179243 | erot = 2.11236294794722 | epot = -19.8804772660566 | etot = -13.282537656317 -515000 ekin = 4.47432723706423 | erot = 2.1643658113937 | epot = -19.9212307047863 | etot = -13.2825376563284 -516000 ekin = 4.45582679664873 | erot = 2.22719069336347 | epot = -19.9655551464075 | etot = -13.2825376563953 -517000 ekin = 4.43030463229401 | erot = 2.29935278529871 | epot = -20.0121950741066 | etot = -13.2825376565139 -518000 ekin = 4.39778184135702 | erot = 2.37880116113426 | epot = -20.0591206591638 | etot = -13.2825376566725 -519000 ekin = 4.35811170485674 | erot = 2.46303435402364 | epot = -20.1036837157379 | etot = -13.2825376568575 -520000 ekin = 4.31103971552179 | erot = 2.54924277018193 | epot = -20.14282014276 | etot = -13.2825376570563 -521000 ekin = 4.25625922128732 | erot = 2.63444730369841 | epot = -20.1732441822451 | etot = -13.2825376572594 -522000 ekin = 4.19345339504562 | erot = 2.71562973710461 | epot = -20.1916207896065 | etot = -13.2825376574562 -523000 ekin = 4.12233106590031 | erot = 2.78987661785175 | epot = -20.1947453413846 | etot = -13.2825376576325 -524000 ekin = 4.04267462479128 | erot = 2.85456825313573 | epot = -20.1797805356948 | etot = -13.2825376577678 -525000 ekin = 3.95441508754014 | erot = 2.9076289252841 | epot = -20.14458167066 | etot = -13.2825376578358 -526000 ekin = 3.85773415549987 | erot = 2.94781757722392 | epot = -20.0880893905345 | etot = -13.2825376578107 -527000 ekin = 3.75317337789272 | erot = 2.97499774804953 | epot = -20.0107087836172 | etot = -13.282537657675 -528000 ekin = 3.64171566472863 | erot = 2.99029287547963 | epot = -19.9145462004646 | etot = -13.2825376602563 -529000 ekin = 3.52133457981484 | erot = 2.97329981123796 | epot = -19.777172048072 | etot = -13.2825376570192 -530000 ekin = 3.40524483354409 | erot = 2.93138498576302 | epot = -19.619167471763 | etot = -13.2825376524559 -531000 ekin = 3.31329586023445 | erot = 2.90771179337181 | epot = -19.5035453066036 | etot = -13.2825376529973 -532000 ekin = 3.23028138422137 | erot = 2.91095227687559 | epot = -19.4237713182328 | etot = -13.2825376571358 -533000 ekin = 3.12254472504549 | erot = 2.92159652025206 | epot = -19.3266789030856 | etot = -13.282537657788 -534000 ekin = 3.01044793876856 | erot = 2.93913625615421 | epot = -19.2321218524818 | etot = -13.282537657559 -535000 ekin = 2.90665974197478 | erot = 2.96765394780088 | epot = -19.1568513472188 | etot = -13.2825376574432 -536000 ekin = 2.81267447142782 | erot = 3.00750648803519 | epot = -19.1027186169117 | etot = -13.2825376574487 -537000 ekin = 2.72954271623794 | erot = 3.05761918513524 | epot = -19.0696995589458 | etot = -13.2825376575726 -538000 ekin = 2.65787075122818 | erot = 3.11553336281627 | epot = -19.0559417718444 | etot = -13.2825376577999 -539000 ekin = 2.59787048049233 | erot = 3.17759265898484 | epot = -19.0580007975803 | etot = -13.2825376581031 -540000 ekin = 2.54945648890107 | erot = 3.23927692413161 | epot = -19.0712710714752 | etot = -13.2825376584425 -541000 ekin = 2.512378643395 | erot = 3.29568121876202 | epot = -19.0905975209266 | etot = -13.2825376587696 -542000 ekin = 2.48636877597141 | erot = 3.34210880592089 | epot = -19.1110152409261 | etot = -13.2825376590338 -543000 ekin = 2.4712699055648 | erot = 3.3747065125272 | epot = -19.1285140772836 | etot = -13.2825376591916 -544000 ekin = 2.46711428276816 | erot = 3.3910375894335 | epot = -19.1406895314189 | etot = -13.2825376592173 -545000 ekin = 2.4741173500058 | erot = 3.39046709618852 | epot = -19.1471221053056 | etot = -13.2825376591113 -546000 ekin = 2.49256786330789 | erot = 3.37425739408745 | epot = -19.1493629162983 | etot = -13.282537658903 -547000 ekin = 2.52261985355472 | erot = 3.34533431811562 | epot = -19.1504918303153 | etot = -13.282537658645 -548000 ekin = 2.5640229402261 | erot = 3.30777050325775 | epot = -19.1543311018841 | etot = -13.2825376584002 -549000 ekin = 2.61585467172264 | erot = 3.26610888708834 | epot = -19.1645012170377 | etot = -13.2825376582267 -550000 ekin = 2.67632806501996 | erot = 3.22468583528343 | epot = -19.1835515584667 | etot = -13.2825376581633 -551000 ekin = 2.74273542047637 | erot = 3.18709627675594 | epot = -19.2123693554546 | etot = -13.2825376582223 -552000 ekin = 2.81155537633479 | erot = 3.155885283811 | epot = -19.2499783185357 | etot = -13.2825376583899 -553000 ekin = 2.87870715456128 | erot = 3.13247774360817 | epot = -19.2937225568035 | etot = -13.2825376586341 -554000 ekin = 2.93989960588701 | erot = 3.11729757853042 | epot = -19.3397348433313 | etot = -13.2825376589139 -555000 ekin = 2.99100571713598 | erot = 3.10999728881064 | epot = -19.3835406651366 | etot = -13.2825376591899 -556000 ekin = 3.02839929468956 | erot = 3.10971957917588 | epot = -19.4206565332962 | etot = -13.2825376594307 -557000 ekin = 3.04921300214246 | erot = 3.11533545055142 | epot = -19.4470861123087 | etot = -13.2825376596148 -558000 ekin = 3.05150347330348 | erot = 3.12563190762297 | epot = -19.4596730406569 | etot = -13.2825376597304 -559000 ekin = 3.03432873631885 | erot = 3.13944482423083 | epot = -19.456311220323 | etot = -13.2825376597733 -560000 ekin = 2.9977526924766 | erot = 3.15574356337998 | epot = -19.4360339156024 | etot = -13.2825376597459 -561000 ekin = 2.9427917179436 | erot = 3.17367577833455 | epot = -19.3990051559327 | etot = -13.2825376596546 -562000 ekin = 2.87131567491266 | erot = 3.19257954673888 | epot = -19.3464328811612 | etot = -13.2825376595096 -563000 ekin = 2.78591370477051 | erot = 3.2119692901947 | epot = -19.2804206542887 | etot = -13.2825376593235 -564000 ekin = 2.6897353367659 | erot = 3.23150302487196 | epot = -19.2037760207478 | etot = -13.28253765911 -565000 ekin = 2.58631900803989 | erot = 3.25094003294576 | epot = -19.1197966998677 | etot = -13.282537658882 -566000 ekin = 2.47942134877151 | erot = 3.27009788587128 | epot = -19.0320568932949 | etot = -13.2825376586521 -567000 ekin = 2.37285930824791 | erot = 3.28881390752303 | epot = -18.9442108742005 | etot = -13.2825376584296 -568000 ekin = 2.2703747720392 | erot = 3.30691420257032 | epot = -18.8598266328315 | etot = -13.282537658222 -569000 ekin = 2.17552646994053 | erot = 3.32418852070003 | epot = -18.7822526486758 | etot = -13.2825376580353 -570000 ekin = 2.09160717358308 | erot = 3.34036686780938 | epot = -18.7145116992668 | etot = -13.2825376578743 -571000 ekin = 2.02157831416758 | erot = 3.35509336873546 | epot = -18.659209340647 | etot = -13.282537657744 -572000 ekin = 1.96800973251089 | erot = 3.36789498998737 | epot = -18.6184423801492 | etot = -13.2825376576509 -573000 ekin = 1.93301131087701 | erot = 3.37814685793009 | epot = -18.5936958264095 | etot = -13.2825376576024 -574000 ekin = 1.91814454492506 | erot = 3.38504063674726 | epot = -18.5857228392799 | etot = -13.2825376576076 -575000 ekin = 1.92430832574408 | erot = 3.38756624559013 | epot = -18.5944122290096 | etot = -13.2825376576754 -576000 ekin = 1.95160447468999 | erot = 3.38452119824164 | epot = -18.6186633307441 | etot = -13.2825376578125 -577000 ekin = 1.99920036892949 | erot = 3.37456184630709 | epot = -18.6562998732574 | etot = -13.2825376580208 -578000 ekin = 2.06522335781187 | erot = 3.35630974832182 | epot = -18.7040707644253 | etot = -13.2825376582916 -579000 ekin = 2.14673519283674 | erot = 3.32851940880933 | epot = -18.7577922602508 | etot = -13.2825376586048 -580000 ekin = 2.23983758246226 | erot = 3.29029959752555 | epot = -18.8126748389145 | etot = -13.2825376589267 -581000 ekin = 2.33993889926474 | erot = 3.2413588197994 | epot = -18.8638353782784 | etot = -13.2825376592143 -582000 ekin = 2.44216781902051 | erot = 3.18222403798945 | epot = -18.9069295164348 | etot = -13.2825376594248 -583000 ekin = 2.54186285338444 | erot = 3.11436905975195 | epot = -18.938769572664 | etot = -13.2825376595277 -584000 ekin = 2.63514321918155 | erot = 3.04016994421133 | epot = -18.9578508227089 | etot = -13.282537659316 -585000 ekin = 2.72038124549456 | erot = 2.96231486727155 | epot = -18.9652337720477 | etot = -13.2825376592816 -586000 ekin = 2.79529742079441 | erot = 2.88397447344912 | epot = -18.9618095534158 | etot = -13.2825376591723 -587000 ekin = 2.85803030913321 | erot = 2.80849541230731 | epot = -18.9490633804616 | etot = -13.2825376590211 -588000 ekin = 2.90761924156872 | erot = 2.73897208360503 | epot = -18.9291289840339 | etot = -13.2825376588602 -589000 ekin = 2.94382190770487 | erot = 2.67796026301525 | epot = -18.9043198294349 | etot = -13.2825376587148 -590000 ekin = 2.96693832518588 | erot = 2.62724420195739 | epot = -18.8767201857421 | etot = -13.2825376585988 -591000 ekin = 2.97766737843971 | erot = 2.58778349306991 | epot = -18.8479885300284 | etot = -13.2825376585188 -592000 ekin = 2.97699718658878 | erot = 2.55971358410891 | epot = -18.8192484291735 | etot = -13.2825376584758 -593000 ekin = 2.96611919165746 | erot = 2.54241252023367 | epot = -18.7910693703577 | etot = -13.2825376584665 -594000 ekin = 2.94635665291053 | erot = 2.53461934099529 | epot = -18.7635136523902 | etot = -13.2825376584844 -595000 ekin = 2.9190856971103 | erot = 2.53443482987529 | epot = -18.7360581856667 | etot = -13.2825376586811 -596000 ekin = 2.8853504738233 | erot = 2.53857982681691 | epot = -18.706467959401 | etot = -13.2825376587608 -597000 ekin = 2.84590859896362 | erot = 2.54482361730832 | epot = -18.6732698750819 | etot = -13.28253765881 -598000 ekin = 2.80153060630531 | erot = 2.55163242417959 | epot = -18.6357006893061 | etot = -13.2825376588212 -599000 ekin = 2.75300405719548 | erot = 2.55803363008721 | epot = -18.5935753460782 | etot = -13.2825376587955 -600000 ekin = 2.70110632481711 | erot = 2.56364667646595 | epot = -18.5472906600206 | etot = -13.2825376587375 -601000 ekin = 2.64657369871742 | erot = 2.56865533018097 | epot = -18.4977666875493 | etot = -13.2825376586509 -602000 ekin = 2.59009198472601 | erot = 2.57375726191876 | epot = -18.4463869051824 | etot = -13.2825376585376 -603000 ekin = 2.53231053373895 | erot = 2.58010020264817 | epot = -18.394948394788 | etot = -13.2825376584008 -604000 ekin = 2.47386381072251 | erot = 2.58919184014772 | epot = -18.3455933091172 | etot = -13.282537658247 -605000 ekin = 2.41538802270495 | erot = 2.60277705143637 | epot = -18.300702732226 | etot = -13.2825376580847 -606000 ekin = 2.35753010244784 | erot = 2.62269152367331 | epot = -18.2627592840455 | etot = -13.2825376579243 -607000 ekin = 2.30095094648108 | erot = 2.65066096469453 | epot = -18.2341495689615 | etot = -13.2825376577859 -608000 ekin = 2.24632550981926 | erot = 2.68812711797909 | epot = -18.2169902854641 | etot = -13.2825376576658 -609000 ekin = 2.19433984205684 | erot = 2.73619296831783 | epot = -18.2130704679521 | etot = -13.2825376575774 -610000 ekin = 2.14568734116616 | erot = 2.7954628779701 | epot = -18.2236878766643 | etot = -13.2825376575281 -611000 ekin = 2.10106577312396 | erot = 2.8659456974561 | epot = -18.2495491281024 | etot = -13.2825376575223 -612000 ekin = 2.06117569763992 | erot = 2.9469880537389 | epot = -18.2907014089413 | etot = -13.2825376575624 -613000 ekin = 2.02671979094169 | erot = 3.03724338411132 | epot = -18.3465008327016 | etot = -13.2825376576486 -614000 ekin = 1.99840061160405 | erot = 3.13468327208026 | epot = -18.415621541462 | etot = -13.2825376577777 -615000 ekin = 1.97691265350076 | erot = 3.23665756946818 | epot = -18.4961078809123 | etot = -13.2825376579434 -616000 ekin = 1.96292427456966 | erot = 3.34000833576273 | epot = -18.58547026847 | etot = -13.2825376581376 -617000 ekin = 1.95704706954419 | erot = 3.4412390414853 | epot = -18.680823769378 | etot = -13.2825376583485 -618000 ekin = 1.95979426061707 | erot = 3.53673433570056 | epot = -18.7790662548804 | etot = -13.2825376585628 -619000 ekin = 1.97153436735861 | erot = 3.62301686059867 | epot = -18.8770888867224 | etot = -13.2825376587651 -620000 ekin = 1.99244950083126 | erot = 3.69701656993236 | epot = -18.9720037297043 | etot = -13.2825376589407 -621000 ekin = 2.02250680811196 | erot = 3.75631711882421 | epot = -19.0613615860136 | etot = -13.2825376590775 -622000 ekin = 2.06144629220648 | erot = 3.7993379752723 | epot = -19.1433219266483 | etot = -13.2825376591695 -623000 ekin = 2.10878075940092 | erot = 3.82541513939284 | epot = -19.216733558012 | etot = -13.2825376592183 -624000 ekin = 2.16379839198576 | erot = 3.83475982186747 | epot = -19.2810958730871 | etot = -13.2825376592339 -625000 ekin = 2.22555932782583 | erot = 3.82830035125848 | epot = -19.3363973383166 | etot = -13.2825376592323 -626000 ekin = 2.29288544260848 | erot = 3.80744110347782 | epot = -19.3828642053181 | etot = -13.2825376592318 -627000 ekin = 2.36435394305829 | erot = 3.77379464741738 | epot = -19.4206862497219 | etot = -13.2825376592462 -628000 ekin = 2.43831432674405 | erot = 3.72895154257647 | epot = -19.4498035286011 | etot = -13.2825376592806 -629000 ekin = 2.5129489794456 | erot = 3.67434156158729 | epot = -19.4698282003614 | etot = -13.2825376593285 -630000 ekin = 2.58638771765141 | erot = 3.61121141784532 | epot = -19.4801367948702 | etot = -13.2825376593735 -631000 ekin = 2.65686759984465 | erot = 3.54070434322503 | epot = -19.4801096088593 | etot = -13.2825376657897 -632000 ekin = 2.72291190263409 | erot = 3.46399577717246 | epot = -19.4694453501734 | etot = -13.2825376703668 -633000 ekin = 2.78348672611247 | erot = 3.38241264800352 | epot = -19.4484370444086 | etot = -13.2825376702926 -634000 ekin = 2.83810143013786 | erot = 3.29749507668476 | epot = -19.4181341769904 | etot = -13.2825376701678 -635000 ekin = 2.88683118402529 | erot = 3.21096793801688 | epot = -19.3803367920453 | etot = -13.2825376700031 -636000 ekin = 2.93026618630813 | erot = 3.12465298496839 | epot = -19.3374568410897 | etot = -13.2825376698132 -637000 ekin = 2.96941056885858 | erot = 3.0403692465718 | epot = -19.2923174850405 | etot = -13.2825376696101 -638000 ekin = 3.00556169693335 | erot = 2.95987410217697 | epot = -19.2479734685112 | etot = -13.2825376694009 -639000 ekin = 3.04019340865286 | erot = 2.88486846877298 | epot = -19.2075995466134 | etot = -13.2825376691875 -640000 ekin = 3.07485121524287 | erot = 2.81704601028373 | epot = -19.1744348944991 | etot = -13.2825376689725 -641000 ekin = 3.11105408028794 | erot = 2.75813097963992 | epot = -19.1517227286916 | etot = -13.2825376687637 -642000 ekin = 3.15019312328036 | erot = 2.7098440548544 | epot = -19.1425748467125 | etot = -13.2825376685778 -643000 ekin = 3.19342381264373 | erot = 2.67376399477657 | epot = -19.149725475858 | etot = -13.2825376684377 -644000 ekin = 3.2415588207624 | erot = 2.65109893593325 | epot = -19.1751954250647 | etot = -13.282537668369 -645000 ekin = 3.29497575523204 | erot = 2.64241916696914 | epot = -19.2199325905945 | etot = -13.2825376683933 -646000 ekin = 3.35355393407658 | erot = 2.64741690321924 | epot = -19.2835085058203 | etot = -13.2825376685245 -647000 ekin = 3.41664956861565 | erot = 2.66474995394752 | epot = -19.3639371913281 | etot = -13.2825376687649 -648000 ekin = 3.4831141060628 | erot = 2.69200913896267 | epot = -19.4576609141298 | etot = -13.2825376691043 -649000 ekin = 3.55135925694529 | erot = 2.72583530732997 | epot = -19.5597322337925 | etot = -13.2825376695172 -650000 ekin = 3.61947301797377 | erot = 2.76220049491276 | epot = -19.6642111828496 | etot = -13.2825376699631 -651000 ekin = 3.68538880274457 | erot = 2.79684816347516 | epot = -19.764774636609 | etot = -13.2825376703893 -652000 ekin = 3.74709908730354 | erot = 2.82584894414238 | epot = -19.8554857021858 | etot = -13.2825376707399 -653000 ekin = 3.80288488877091 | erot = 2.84617490646358 | epot = -19.9315974662018 | etot = -13.2825376709673 -654000 ekin = 3.85151192347428 | erot = 2.85615319330961 | epot = -19.9902027878321 | etot = -13.2825376710482 -655000 ekin = 3.89233743675784 | erot = 2.85566240366418 | epot = -20.0305375114124 | etot = -13.2825376709904 -656000 ekin = 3.92529306042297 | erot = 2.84600373605249 | epot = -20.0538344673054 | etot = -13.2825376708299 -657000 ekin = 3.9507492437021 | erot = 2.82948452039627 | epot = -20.0627714347188 | etot = -13.2825376706204 -658000 ekin = 3.96930448522689 | erot = 2.80884105011381 | epot = -20.0606832057567 | etot = -13.282537670416 -659000 ekin = 3.98156254976232 | erot = 2.78666073057887 | epot = -20.0507609506005 | etot = -13.2825376702593 -660000 ekin = 3.98794995381879 | erot = 2.76493225942124 | epot = -20.0354198834157 | etot = -13.2825376701757 -661000 ekin = 3.98860416113611 | erot = 2.74479055428647 | epot = -20.0159323855936 | etot = -13.282537670171 -662000 ekin = 3.98333736211109 | erot = 2.72646306735502 | epot = -19.9923380997025 | etot = -13.2825376702364 -663000 ekin = 3.9716619686291 | erot = 2.70938404532074 | epot = -19.9635836843021 | etot = -13.2825376703522 -664000 ekin = 3.95286211458908 | erot = 2.69242500163181 | epot = -19.9278247867134 | etot = -13.2825376704925 -665000 ekin = 3.92609780975317 | erot = 2.67418491171735 | epot = -19.8828203921001 | etot = -13.2825376706295 -666000 ekin = 3.89053574202168 | erot = 2.65328635574181 | epot = -19.8263597684999 | etot = -13.2825376707365 -667000 ekin = 3.84550518468516 | erot = 2.62863029044506 | epot = -19.7566731459204 | etot = -13.2825376707901 -668000 ekin = 3.79067534879777 | erot = 2.59957256262197 | epot = -19.6727855821932 | etot = -13.2825376707734 -669000 ekin = 3.72624194861737 | erot = 2.56600183381133 | epot = -19.5747814531047 | etot = -13.282537670676 -670000 ekin = 3.65309967705475 | erot = 2.52832169427011 | epot = -19.4639590418208 | etot = -13.282537670496 -671000 ekin = 3.57296811018949 | erot = 2.48736383191286 | epot = -19.3428696123407 | etot = -13.2825376702383 -672000 ekin = 3.48843263531181 | erot = 2.44427271264344 | epot = -19.2152430178709 | etot = -13.2825376699157 -673000 ekin = 3.40286035229605 | erot = 2.40039617767075 | epot = -19.0857941995173 | etot = -13.2825376695505 -674000 ekin = 3.32015657280881 | erot = 2.35719425457316 | epot = -18.9598884965573 | etot = -13.2825376691753 -675000 ekin = 3.24436019808196 | erot = 2.31615841412129 | epot = -18.8430562810334 | etot = -13.2825376688302 -676000 ekin = 3.17913583606399 | erot = 2.27873161512438 | epot = -18.740405119743 | etot = -13.2825376685547 -677000 ekin = 3.12743284479367 | erot = 2.24616920610074 | epot = -18.6561397192095 | etot = -13.2825376683151 -678000 ekin = 3.09116321204123 | erot = 2.21938913067767 | epot = -18.5930900109928 | etot = -13.2825376682739 -679000 ekin = 3.06996492217903 | erot = 2.19955802308988 | epot = -18.5520606135526 | etot = -13.2825376682837 -680000 ekin = 3.06282540105824 | erot = 2.18767057709701 | epot = -18.5330336464769 | etot = -13.2825376683217 -681000 ekin = 3.06856941759266 | erot = 2.18446333304883 | epot = -18.5355704190133 | etot = -13.2825376683718 -682000 ekin = 3.08614503868821 | erot = 2.19031007375325 | epot = -18.5589927809047 | etot = -13.2825376684632 -683000 ekin = 3.11401676517912 | erot = 2.20483123961229 | epot = -18.6013856734681 | etot = -13.2825376686767 -684000 ekin = 3.1499497049718 | erot = 2.22703766523478 | epot = -18.6595250391781 | etot = -13.2825376689715 -685000 ekin = 3.1913881729591 | erot = 2.25525783713242 | epot = -18.7291836794166 | etot = -13.2825376693251 -686000 ekin = 3.2355359736388 | erot = 2.28721755220356 | epot = -18.8052911955454 | etot = -13.282537669703 -687000 ekin = 3.27958856790023 | erot = 2.32030038563959 | epot = -18.8824266236037 | etot = -13.2825376700639 -688000 ekin = 3.32103493725068 | erot = 2.35186996598866 | epot = -18.9554425735995 | etot = -13.2825376703601 -689000 ekin = 3.35799818039315 | erot = 2.37963585732459 | epot = -19.0201717082656 | etot = -13.2825376705479 -690000 ekin = 3.38953188177024 | erot = 2.40199807238457 | epot = -19.0740676247556 | etot = -13.2825376706008 -691000 ekin = 3.41577144695012 | erot = 2.41828305275593 | epot = -19.1165921702244 | etot = -13.2825376705183 -692000 ekin = 3.43789562336026 | erot = 2.42879295705483 | epot = -19.1492262507455 | etot = -13.2825376703304 -693000 ekin = 3.45784949823494 | erot = 2.43469159318125 | epot = -19.1750787614971 | etot = -13.2825376700809 -694000 ekin = 3.47795427967228 | erot = 2.43774070868771 | epot = -19.1982326581791 | etot = -13.2825376698191 -695000 ekin = 3.50053093039143 | erot = 2.43997131609287 | epot = -19.2230399160667 | etot = -13.2825376695824 -696000 ekin = 3.52761050730188 | erot = 2.44340337549972 | epot = -19.253551552192 | etot = -13.2825376693904 -697000 ekin = 3.56079077322806 | erot = 2.44986396554409 | epot = -19.2931924080192 | etot = -13.2825376692471 -698000 ekin = 3.60121696147359 | erot = 2.46089758486526 | epot = -19.3446522154888 | etot = -13.28253766915 -699000 ekin = 3.6496121327901 | erot = 2.47770733427071 | epot = -19.4098571361639 | etot = -13.2825376691031 -700000 ekin = 3.70626748084333 | erot = 2.50104915957359 | epot = -19.4898543095415 | etot = -13.2825376691246 -701000 ekin = 3.77093513695816 | erot = 2.53103621287959 | epot = -19.5845090190825 | etot = -13.2825376692448 -702000 ekin = 3.84262768940034 | erot = 2.56687733849262 | epot = -19.6920426973887 | etot = -13.2825376694958 -703000 ekin = 3.91940034762304 | erot = 2.60664110638312 | epot = -19.8085791238994 | etot = -13.2825376698933 -704000 ekin = 3.9982358547303 | erot = 2.64716826817973 | epot = -19.9279417933333 | etot = -13.2825376704233 -705000 ekin = 4.07514464413495 | erot = 2.68423896184971 | epot = -20.0419212770165 | etot = -13.2825376710318 -706000 ekin = 4.14554203036507 | erot = 2.71304391273882 | epot = -20.1411236147333 | etot = -13.2825376716295 -707000 ekin = 4.20487575193823 | erot = 2.7289253372954 | epot = -20.2163387613403 | etot = -13.2825376721067 -708000 ekin = 4.24938283126873 | erot = 2.72825870746495 | epot = -20.2601792110953 | etot = -13.2825376723616 -709000 ekin = 4.27678612885237 | erot = 2.70926619644947 | epot = -20.2685899976319 | etot = -13.2825376723301 -710000 ekin = 4.28673081641948 | erot = 2.67252621890016 | epot = -20.2417947073265 | etot = -13.2825376720069 -711000 ekin = 4.28082322623417 | erot = 2.6210105179504 | epot = -20.1843714156341 | etot = -13.2825376714495 -712000 ekin = 4.26225868779622 | erot = 2.55962600082617 | epot = -20.104422359382 | etot = -13.2825376707596 -713000 ekin = 4.23515498224752 | erot = 2.49440280552867 | epot = -20.0120954578281 | etot = -13.2825376700519 -714000 ekin = 4.20378550523481 | erot = 2.43156567582597 | epot = -19.9178888504867 | etot = -13.282537669426 -715000 ekin = 4.17190188735528 | erot = 2.37671476689976 | epot = -19.8311543232044 | etot = -13.2825376689494 -716000 ekin = 4.14226649350958 | erot = 2.33425236976786 | epot = -19.7590565319311 | etot = -13.2825376686537 -717000 ekin = 4.11642945246045 | erot = 2.30708700174596 | epot = -19.7060541227473 | etot = -13.2825376685409 -718000 ekin = 4.09471959167245 | erot = 2.29657561669689 | epot = -19.6738328769614 | etot = -13.282537668592 -719000 ekin = 4.07639008593528 | erot = 2.30263774998752 | epot = -19.6615655046985 | etot = -13.2825376687757 -720000 ekin = 4.05985922917437 | erot = 2.32397934764256 | epot = -19.666376245872 | etot = -13.2825376690551 -721000 ekin = 4.04299880694437 | erot = 2.35837721352838 | epot = -19.6839136898621 | etot = -13.2825376693893 -722000 ekin = 4.02343688316733 | erot = 2.40299878609526 | epot = -19.7089733390043 | etot = -13.2825376697417 -723000 ekin = 3.99884065344427 | erot = 2.45471133767174 | epot = -19.7360896611947 | etot = -13.2825376700787 -724000 ekin = 3.96717167902435 | erot = 2.51036796126059 | epot = -19.7600773106559 | etot = -13.282537670371 -725000 ekin = 3.92690441967245 | erot = 2.56705586836098 | epot = -19.7764979586269 | etot = -13.2825376705935 -726000 ekin = 3.87729637976355 | erot = 2.62227216901714 | epot = -19.7821062194414 | etot = -13.2825376706607 -727000 ekin = 3.8190968772367 | erot = 2.6738940465784 | epot = -19.7755285945079 | etot = -13.2825376706928 -728000 ekin = 3.75316507804633 | erot = 2.72096436119536 | epot = -19.7566671098349 | etot = -13.2825376705932 -729000 ekin = 3.68121241124607 | erot = 2.76353487071615 | epot = -19.7272849523289 | etot = -13.2825376703667 -730000 ekin = 3.60595083273131 | erot = 2.80255656445165 | epot = -19.6910450672214 | etot = -13.2825376700385 -731000 ekin = 3.53083585767324 | erot = 2.83972569859397 | epot = -19.653099225923 | etot = -13.2825376696558 -732000 ekin = 3.45966885133349 | erot = 2.87715368835778 | epot = -19.6193602089738 | etot = -13.2825376692825 -733000 ekin = 3.39612153666075 | erot = 2.91688280104916 | epot = -19.5955420066965 | etot = -13.2825376689866 -734000 ekin = 3.34327992468431 | erot = 2.96033658922183 | epot = -19.5861541827305 | etot = -13.2825376688244 -735000 ekin = 3.3033011289436 | erot = 3.00783596111042 | epot = -19.5936747588816 | etot = -13.2825376688276 -736000 ekin = 3.27724072963395 | erot = 3.05831043253752 | epot = -19.6180888311677 | etot = -13.2825376689963 -737000 ekin = 3.26506253896415 | erot = 3.10929392283416 | epot = -19.656894131098 | etot = -13.2825376692997 -738000 ekin = 3.26580566526871 | erot = 3.15723003734976 | epot = -19.7055733723001 | etot = -13.2825376696816 -739000 ekin = 3.27786090586245 | erot = 3.19803615726929 | epot = -19.7584347332053 | etot = -13.2825376700736 -740000 ekin = 3.29929519803613 | erot = 3.22780296867189 | epot = -19.8096358371181 | etot = -13.2825376704101 -741000 ekin = 3.3281598026641 | erot = 3.2434576850098 | epot = -19.8541551583189 | etot = -13.282537670645 -742000 ekin = 3.36272243969023 | erot = 3.24322419612484 | epot = -19.8884843065754 | etot = -13.2825376707603 -743000 ekin = 3.40154954265053 | erot = 3.22659635037975 | epot = -19.91068356386 | etot = -13.2825376708298 -744000 ekin = 3.44355690162401 | erot = 3.19405338784643 | epot = -19.9201479602064 | etot = -13.282537670736 -745000 ekin = 3.48810285817397 | erot = 3.14763432802534 | epot = -19.9182748567946 | etot = -13.2825376705953 -746000 ekin = 3.53467364484348 | erot = 3.09004249682931 | epot = -19.9072538121143 | etot = -13.2825376704415 -747000 ekin = 3.58273489719928 | erot = 3.02422947593768 | epot = -19.8895020434333 | etot = -13.2825376702963 -748000 ekin = 3.63163431992952 | erot = 2.95313859310771 | epot = -19.8673105832079 | etot = -13.2825376701706 -749000 ekin = 3.68055410773111 | erot = 2.87956450535935 | epot = -19.8426562831586 | etot = -13.2825376700682 -750000 ekin = 3.7285026487858 | erot = 2.80607481969708 | epot = -19.8171151384766 | etot = -13.2825376699938 -751000 ekin = 3.77431992736046 | erot = 2.73492674316789 | epot = -19.7917843404859 | etot = -13.2825376699576 -752000 ekin = 3.81667135032658 | erot = 2.66792933662307 | epot = -19.7671383569269 | etot = -13.2825376699773 -753000 ekin = 3.85401538818531 | erot = 2.6062395161429 | epot = -19.7427925744031 | etot = -13.2825376700749 -754000 ekin = 3.88455267934887 | erot = 2.5501327302614 | epot = -19.7172230798774 | etot = -13.2825376702671 -755000 ekin = 3.90620090059213 | erot = 2.49884999016135 | epot = -19.6875885613011 | etot = -13.2825376705476 -756000 ekin = 3.91710462659123 | erot = 2.4506960000184 | epot = -19.6503382971539 | etot = -13.2825376705443 -757000 ekin = 3.91725792025721 | erot = 2.40369183428835 | epot = -19.6034874252691 | etot = -13.2825376707236 -758000 ekin = 3.90622854864869 | erot = 2.35617894285865 | epot = -19.5449451622686 | etot = -13.2825376707613 -759000 ekin = 3.88450313649421 | erot = 2.307511853008 | epot = -19.47455266009 | etot = -13.2825376705877 -760000 ekin = 3.85399004377457 | erot = 2.25863561784068 | epot = -19.3951633318159 | etot = -13.2825376702006 -761000 ekin = 3.81799666982234 | erot = 2.2120898004713 | epot = -19.3126241399677 | etot = -13.2825376696741 -762000 ekin = 3.78022631318949 | erot = 2.17128933431168 | epot = -19.2340533167231 | etot = -13.2825376692219 -763000 ekin = 3.73661802519724 | erot = 2.13809664148039 | epot = -19.157252335609 | etot = -13.2825376689313 -764000 ekin = 3.68660767297181 | erot = 2.11458113784821 | epot = -19.0837264795458 | etot = -13.2825376687258 -765000 ekin = 3.63152213040114 | erot = 2.10258243850245 | epot = -19.016642237515 | etot = -13.2825376686114 -766000 ekin = 3.57217194872271 | erot = 2.10319364759271 | epot = -18.9579032648383 | etot = -13.2825376685229 -767000 ekin = 3.50915043230235 | erot = 2.11696161070464 | epot = -18.9086497115248 | etot = -13.2825376685178 -768000 ekin = 3.44287730029771 | erot = 2.14384189418764 | epot = -18.8692568629801 | etot = -13.2825376684947 -769000 ekin = 3.3740781166784 | erot = 2.18352203430037 | epot = -18.8401378194259 | etot = -13.2825376684472 -770000 ekin = 3.3040269110262 | erot = 2.2354469932855 | epot = -18.8220115726952 | etot = -13.2825376683835 -771000 ekin = 3.23454927903731 | erot = 2.29870117920211 | epot = -18.8157881266126 | etot = -13.2825376683732 -772000 ekin = 3.16778213081256 | erot = 2.37165603566442 | epot = -18.8219758348544 | etot = -13.2825376683774 -773000 ekin = 3.10585178824851 | erot = 2.45189360020004 | epot = -18.840283056865 | etot = -13.2825376684165 -774000 ekin = 3.05132445362518 | erot = 2.53742495789156 | epot = -18.8712870797731 | etot = -13.2825376682564 -775000 ekin = 3.00630147843012 | erot = 2.62609752200496 | epot = -18.9149366688542 | etot = -13.2825376684191 -776000 ekin = 2.97144443263784 | erot = 2.71477730985204 | epot = -18.9687594110596 | etot = -13.2825376685697 -777000 ekin = 2.94698171101505 | erot = 2.80100976982407 | epot = -19.0305291495095 | etot = -13.2825376686704 -778000 ekin = 2.93288277550281 | erot = 2.8833938872999 | epot = -19.0988143314864 | etot = -13.2825376686837 -779000 ekin = 2.9291073028875 | erot = 2.9618300279754 | epot = -19.1734749994569 | etot = -13.282537668594 -780000 ekin = 2.93579388567472 | erot = 3.03750518021137 | epot = -19.2558367343112 | etot = -13.2825376684251 -781000 ekin = 2.95325630949646 | erot = 3.11251463626943 | epot = -19.3483086140044 | etot = -13.2825376682385 -782000 ekin = 2.98176618547441 | erot = 3.189171361001 | epot = -19.4534752145867 | etot = -13.2825376681113 -783000 ekin = 3.02122758219725 | erot = 3.26921648812991 | epot = -19.5729817384327 | etot = -13.2825376681056 -784000 ekin = 3.07089714794778 | erot = 3.35319620066463 | epot = -19.7066310168605 | etot = -13.2825376682481 -785000 ekin = 3.12925653033684 | erot = 3.44018487512351 | epot = -19.8519790739888 | etot = -13.2825376685285 -786000 ekin = 3.19405797125228 | erot = 3.52788200321648 | epot = -20.0044776433779 | etot = -13.2825376689092 -787000 ekin = 3.26249776188156 | erot = 3.61297785906092 | epot = -20.1580132902857 | etot = -13.2825376693433 -788000 ekin = 3.33144967160353 | erot = 3.69161943951225 | epot = -20.305606780904 | etot = -13.2825376697883 -789000 ekin = 3.39770556173349 | erot = 3.75982531205833 | epot = -20.4400685440038 | etot = -13.282537670212 -790000 ekin = 3.45820395551511 | erot = 3.81377941395818 | epot = -20.5545210400615 | etot = -13.2825376705882 -791000 ekin = 3.51015148125463 | erot = 3.85000835167799 | epot = -20.6426975044847 | etot = -13.2825376715521 -792000 ekin = 3.5477656494443 | erot = 3.86447708281342 | epot = -20.6947804042054 | etot = -13.2825376719477 -793000 ekin = 3.56673386235719 | erot = 3.85375177259752 | epot = -20.7030233071327 | etot = -13.282537672178 -794000 ekin = 3.56535433496591 | erot = 3.81599585289175 | epot = -20.6638878600545 | etot = -13.2825376721968 -795000 ekin = 3.54336423774681 | erot = 3.75111846556983 | epot = -20.5770203753028 | etot = -13.2825376719862 -796000 ekin = 3.50191265633486 | erot = 3.66102926483526 | epot = -20.445479592736 | etot = -13.2825376715658 -797000 ekin = 3.44331621142581 | erot = 3.54957138817431 | epot = -20.275425270589 | etot = -13.2825376709889 -798000 ekin = 3.37066053440221 | erot = 3.42213246909072 | epot = -20.0753306738195 | etot = -13.2825376703266 -799000 ekin = 3.28735656784917 | erot = 3.28504268658437 | epot = -19.8549369240833 | etot = -13.2825376696498 -800000 ekin = 3.1967614101609 | erot = 3.14491706728329 | epot = -19.6242161464581 | etot = -13.2825376690139 -801000 ekin = 3.10193388348241 | erot = 3.008077953099 | epot = -19.3925495050348 | etot = -13.2825376684534 -802000 ekin = 3.00553736756426 | erot = 2.88012979876869 | epot = -19.1682048343169 | etot = -13.2825376679839 -803000 ekin = 2.90985246625746 | erot = 2.76569078054883 | epot = -18.9580809144165 | etot = -13.2825376676103 -804000 ekin = 2.81683808714811 | erot = 2.66824302177604 | epot = -18.767618776258 | etot = -13.2825376673338 -805000 ekin = 2.72818412045662 | erot = 2.59005510940243 | epot = -18.6007768970147 | etot = -13.2825376671557 -806000 ekin = 2.64532439255801 | erot = 2.53214862202529 | epot = -18.460010681661 | etot = -13.2825376670777 -807000 ekin = 2.56941186666917 | erot = 2.49430692056124 | epot = -18.3462564543289 | etot = -13.2825376670985 -808000 ekin = 2.50128142889036 | erot = 2.4751494073639 | epot = -18.2589685034643 | etot = -13.2825376672101 -809000 ekin = 2.44144236795443 | erot = 2.47230913362086 | epot = -18.1962891689445 | etot = -13.2825376673692 -810000 ekin = 2.39012708340952 | erot = 2.48271406544018 | epot = -18.1553788164563 | etot = -13.2825376676066 -811000 ekin = 2.34728664736234 | erot = 2.50269653307823 | epot = -18.1325208483013 | etot = -13.2825376678607 -812000 ekin = 2.31275384401392 | erot = 2.5284613206776 | epot = -18.1237528327934 | etot = -13.2825376681019 -813000 ekin = 2.28637472346062 | erot = 2.55641958964873 | epot = -18.1253319814181 | etot = -13.2825376683087 -814000 ekin = 2.2680963430183 | erot = 2.58342175986192 | epot = -18.1340557713507 | etot = -13.2825376684705 -815000 ekin = 2.25799398108187 | erot = 2.60689379310711 | epot = -18.147425442776 | etot = -13.282537668587 -816000 ekin = 2.25623692236378 | erot = 2.6248911786293 | epot = -18.1636657696559 | etot = -13.2825376686629 -817000 ekin = 2.26301448164562 | erot = 2.63611346242108 | epot = -18.1816656127696 | etot = -13.2825376687029 -818000 ekin = 2.27845464056916 | erot = 2.63992517489727 | epot = -18.200917484174 | etot = -13.2825376687075 -819000 ekin = 2.30255118254824 | erot = 2.63638076675709 | epot = -18.2214696180403 | etot = -13.2825376687349 -820000 ekin = 2.33498671690288 | erot = 2.62599567774902 | epot = -18.2435200633427 | etot = -13.2825376686908 -821000 ekin = 2.37528893737676 | erot = 2.61008048021327 | epot = -18.2679070861996 | etot = -13.2825376686096 -822000 ekin = 2.42285081016476 | erot = 2.59073415648932 | epot = -18.2961226351515 | etot = -13.2825376684974 -823000 ekin = 2.47691845695884 | erot = 2.57068820920496 | epot = -18.330144334532 | etot = -13.2825376683682 -824000 ekin = 2.53658809763949 | erot = 2.55309938377513 | epot = -18.3722251496539 | etot = -13.2825376682393 -825000 ekin = 2.60079770131234 | erot = 2.54128433496743 | epot = -18.4246197044077 | etot = -13.2825376681279 -826000 ekin = 2.6683297319833 | erot = 2.53844971722971 | epot = -18.4893171172594 | etot = -13.2825376680464 -827000 ekin = 2.73783541426496 | erot = 2.54745860097927 | epot = -18.5678316832478 | etot = -13.2825376680036 -828000 ekin = 2.8078735374226 | erot = 2.570638372336 | epot = -18.6610495777666 | etot = -13.282537668008 -829000 ekin = 2.87694004142142 | erot = 2.6095991500053 | epot = -18.7690768595013 | etot = -13.2825376680745 -830000 ekin = 2.94346318720465 | erot = 2.66502277159192 | epot = -18.8910236270209 | etot = -13.2825376682243 -831000 ekin = 3.00576095292962 | erot = 2.73641402738311 | epot = -19.0247126487928 | etot = -13.28253766848 -832000 ekin = 3.0619900354022 | erot = 2.82186650180673 | epot = -19.1663942060617 | etot = -13.2825376688528 -833000 ekin = 3.11014899562178 | erot = 2.9179503249138 | epot = -19.3106369898642 | etot = -13.2825376693286 -834000 ekin = 3.14820449359153 | erot = 3.01984474732083 | epot = -19.4505869107716 | etot = -13.2825376698592 -835000 ekin = 3.17437957900616 | erot = 3.12179257976731 | epot = -19.5787098291384 | etot = -13.2825376703649 -836000 ekin = 3.18757195243303 | erot = 3.217846898268 | epot = -19.687956521455 | etot = -13.282537670754 -837000 ekin = 3.18777327474339 | erot = 3.30274497121124 | epot = -19.7730559169123 | etot = -13.2825376709577 -838000 ekin = 3.17628521735201 | erot = 3.37264530222933 | epot = -19.8314681905428 | etot = -13.2825376709614 -839000 ekin = 3.15554655753232 | erot = 3.42547713952516 | epot = -19.8635613678745 | etot = -13.282537670817 -840000 ekin = 3.12853906989481 | erot = 3.46080086771501 | epot = -19.8718776082294 | etot = -13.2825376706196 -841000 ekin = 3.09797460324027 | erot = 3.47929817818113 | epot = -19.8598104518813 | etot = -13.2825376704599 -842000 ekin = 3.06563312579573 | erot = 3.48217550735097 | epot = -19.8303463035245 | etot = -13.2825376703778 -843000 ekin = 3.0321807849032 | erot = 3.47078119390777 | epot = -19.7854996491548 | etot = -13.2825376703438 -844000 ekin = 2.99754824930587 | erot = 3.44659665119674 | epot = -19.7266825707828 | etot = -13.2825376702802 -845000 ekin = 2.96164676060849 | erot = 3.41154768663129 | epot = -19.6557321173456 | etot = -13.2825376701058 -846000 ekin = 2.92503739739917 | erot = 3.3684099877387 | epot = -19.5759850549147 | etot = -13.2825376697769 -847000 ekin = 2.88924342097115 | erot = 3.32104931094625 | epot = -19.4928304012178 | etot = -13.2825376693004 -848000 ekin = 2.85664997217234 | erot = 3.2743258340256 | epot = -19.413513474944 | etot = -13.282537668746 -849000 ekin = 2.83005143134554 | erot = 3.23330176450845 | epot = -19.3458908642286 | etot = -13.2825376683746 -850000 ekin = 2.81205597381057 | erot = 3.20226229425748 | epot = -19.2968559356605 | etot = -13.2825376675925 -851000 ekin = 2.80444558746427 | erot = 3.18500981062148 | epot = -19.2719930659083 | etot = -13.2825376678225 -852000 ekin = 2.80546277463363 | erot = 3.18034603825546 | epot = -19.2683464810916 | etot = -13.2825376682025 -853000 ekin = 2.81244121485968 | erot = 3.18510929963401 | epot = -19.280088183197 | etot = -13.2825376687033 -854000 ekin = 2.82227167904044 | erot = 3.19468161889413 | epot = -19.2994909671748 | etot = -13.2825376692403 -855000 ekin = 2.83221172623428 | erot = 3.20377851190415 | epot = -19.3185279077744 | etot = -13.282537669636 -856000 ekin = 2.84030053008536 | erot = 3.20718605728263 | epot = -19.3300242573987 | etot = -13.2825376700307 -857000 ekin = 2.84404786964225 | erot = 3.20080956078108 | epot = -19.3273951006455 | etot = -13.2825376702222 -858000 ekin = 2.84179014642712 | erot = 3.18249842088716 | epot = -19.3068262375353 | etot = -13.282537670221 -859000 ekin = 2.8327614996683 | erot = 3.15199731413447 | epot = -19.2672964838756 | etot = -13.2825376700728 -860000 ekin = 2.8170072354239 | erot = 3.110467808288 | epot = -19.2100127135406 | etot = -13.2825376698287 -861000 ekin = 2.79529073711156 | erot = 3.0598903948263 | epot = -19.1377188014641 | etot = -13.2825376695262 -862000 ekin = 2.76903178124154 | erot = 3.00259641979431 | epot = -19.0541658702196 | etot = -13.2825376691838 -863000 ekin = 2.740260190387 | erot = 2.94102587736042 | epot = -18.9638237365556 | etot = -13.2825376688082 -864000 ekin = 2.71154390225988 | erot = 2.8776699566398 | epot = -18.8717515273048 | etot = -13.2825376684052 -865000 ekin = 2.68585679377337 | erot = 2.81509451396977 | epot = -18.7834889757305 | etot = -13.2825376679873 -866000 ekin = 2.66591731935461 | erot = 2.75755671057519 | epot = -18.7060116974828 | etot = -13.282537667553 -867000 ekin = 2.65369684330944 | erot = 2.70836237988842 | epot = -18.6445968906315 | etot = -13.2825376674336 -868000 ekin = 2.65132555303167 | erot = 2.66699243377126 | epot = -18.6008556541432 | etot = -13.2825376673403 -869000 ekin = 2.6604185838541 | erot = 2.63308802762149 | epot = -18.5760442787973 | etot = -13.2825376673217 -870000 ekin = 2.68169704365066 | erot = 2.60613905014281 | epot = -18.5703737612197 | etot = -13.2825376674262 -871000 ekin = 2.71467538115452 | erot = 2.58511614862431 | epot = -18.5823291974616 | etot = -13.2825376676827 -872000 ekin = 2.75720487539373 | erot = 2.56766485202981 | epot = -18.6074073957583 | etot = -13.2825376683347 -873000 ekin = 2.80308619821104 | erot = 2.54585820173567 | epot = -18.6314820689143 | etot = -13.2825376689676 -874000 ekin = 2.84699852609265 | erot = 2.51460161594248 | epot = -18.6441378114824 | etot = -13.2825376694472 -875000 ekin = 2.88482415059394 | erot = 2.47158418780442 | epot = -18.638946008002 | etot = -13.2825376696036 -876000 ekin = 2.91408523337446 | erot = 2.4177177291072 | epot = -18.6143406317896 | etot = -13.2825376693079 -877000 ekin = 2.93423099086519 | erot = 2.35825815690521 | epot = -18.5750268164492 | etot = -13.2825376686788 -878000 ekin = 2.94753405629445 | erot = 2.3008664537491 | epot = -18.5309381778413 | etot = -13.2825376677977 -879000 ekin = 2.95817730737743 | erot = 2.25490663307461 | epot = -18.4956216073104 | etot = -13.2825376668584 -880000 ekin = 2.97089825197214 | erot = 2.22983196328469 | epot = -18.4832678815182 | etot = -13.2825376662614 -881000 ekin = 2.98893595230079 | erot = 2.2333347502388 | epot = -18.5048083683019 | etot = -13.2825376657623 -882000 ekin = 3.01519221964841 | erot = 2.27015029166098 | epot = -18.5678801769104 | etot = -13.282537665601 -883000 ekin = 3.05097747089527 | erot = 2.3416684229089 | epot = -18.6751835596161 | etot = -13.2825376658119 -884000 ekin = 3.09435682547256 | erot = 2.4464864171362 | epot = -18.8233809089785 | etot = -13.2825376663698 -885000 ekin = 3.14183207196681 | erot = 2.57965576027657 | epot = -19.0040254994135 | etot = -13.2825376671702 -886000 ekin = 3.1891482279053 | erot = 2.73331108132125 | epot = -19.2049969773462 | etot = -13.2825376681197 -887000 ekin = 3.23157512360801 | erot = 2.89766014759257 | epot = -19.4117729403243 | etot = -13.2825376691237 -888000 ekin = 3.2645655180999 | erot = 3.06177663304004 | epot = -19.6088798212365 | etot = -13.2825376700966 -889000 ekin = 3.28428902019744 | erot = 3.21442460414138 | epot = -19.7812512952993 | etot = -13.2825376709605 -890000 ekin = 3.28801223277735 | erot = 3.34493087267462 | epot = -19.9154807770927 | etot = -13.2825376716407 -891000 ekin = 3.27434561775047 | erot = 3.44412613410549 | epot = -20.0010094239219 | etot = -13.2825376720659 -892000 ekin = 3.24338163760246 | erot = 3.5053051706131 | epot = -20.031224480396 | etot = -13.2825376721805 -893000 ekin = 3.19671556304953 | erot = 3.52503469850342 | epot = -20.0042879335176 | etot = -13.2825376719647 -894000 ekin = 3.13731299174319 | erot = 3.50356986373413 | epot = -19.9234205269247 | etot = -13.2825376714474 -895000 ekin = 3.06920917356835 | erot = 3.44471943347162 | epot = -19.7964662777404 | etot = -13.2825376707004 -896000 ekin = 2.99708420339286 | erot = 3.35519757227584 | epot = -19.6348194454858 | etot = -13.2825376698171 -897000 ekin = 2.92580051783491 | erot = 3.24367712660513 | epot = -19.4520153133288 | etot = -13.2825376688887 -898000 ekin = 2.85975229197251 | erot = 3.12035510152301 | epot = -19.2626450614017 | etot = -13.2825376679062 -899000 ekin = 2.80277954779219 | erot = 2.9956146737193 | epot = -19.0809318887035 | etot = -13.282537667192 -900000 ekin = 2.75771035420834 | erot = 2.87733650112268 | epot = -18.9175845220148 | etot = -13.2825376666838 -901000 ekin = 2.72580329202024 | erot = 2.77189091314049 | epot = -18.7802318714387 | etot = -13.282537666278 -902000 ekin = 2.70770279131466 | erot = 2.6846486143113 | epot = -18.6748890716194 | etot = -13.2825376659935 -903000 ekin = 2.7034449405386 | erot = 2.61971222758158 | epot = -18.6056948339661 | etot = -13.282537665846 -904000 ekin = 2.712491847434 | erot = 2.57966599079039 | epot = -18.5746955043512 | etot = -13.2825376661268 -905000 ekin = 2.73259472265153 | erot = 2.56420422221706 | epot = -18.5793366115661 | etot = -13.2825376666975 -906000 ekin = 2.75874387987261 | erot = 2.57016719355954 | epot = -18.6114487407167 | etot = -13.2825376672845 -907000 ekin = 2.78650456169418 | erot = 2.5927904298105 | epot = -18.6618326594052 | etot = -13.2825376679006 -908000 ekin = 2.81181709569093 | erot = 2.62665482044298 | epot = -18.7210095845691 | etot = -13.2825376684352 -909000 ekin = 2.83143463245786 | erot = 2.66677850527972 | epot = -18.7807508065316 | etot = -13.282537668794 -910000 ekin = 2.84337824045527 | erot = 2.70952965400631 | epot = -18.8354455633909 | etot = -13.2825376689293 -911000 ekin = 2.84713706868452 | erot = 2.75311048607999 | epot = -18.882785223623 | etot = -13.2825376688585 -912000 ekin = 2.8435329518418 | erot = 2.79744224266951 | epot = -18.9235128631685 | etot = -13.2825376686572 -913000 ekin = 2.83428813315847 | erot = 2.84350922919611 | epot = -18.9603350307843 | etot = -13.2825376684297 -914000 ekin = 2.82145638450671 | erot = 2.89244132991502 | epot = -18.996435382689 | etot = -13.2825376682672 -915000 ekin = 2.80692071973142 | erot = 2.94469332949939 | epot = -19.0341517174505 | etot = -13.2825376682197 -916000 ekin = 2.79210576378607 | erot = 2.99958827393019 | epot = -19.074231706004 | etot = -13.2825376682877 -917000 ekin = 2.77794567111531 | erot = 3.05530679535158 | epot = -19.1157901348997 | etot = -13.2825376684328 -918000 ekin = 2.76505338702007 | erot = 3.1092386103798 | epot = -19.156829665997 | etot = -13.2825376685971 -919000 ekin = 2.75398705149648 | erot = 3.15852296699312 | epot = -19.1950476872148 | etot = -13.2825376687252 -920000 ekin = 2.74549945480772 | erot = 3.2005917707978 | epot = -19.2286288943852 | etot = -13.2825376687797 -921000 ekin = 2.74117522182622 | erot = 3.23390288539695 | epot = -19.2576157760415 | etot = -13.2825376688183 -922000 ekin = 2.74423942346447 | erot = 3.25833644681322 | epot = -19.2851135391865 | etot = -13.2825376689088 -923000 ekin = 2.75519506142942 | erot = 3.27241102946701 | epot = -19.310143759855 | etot = -13.2825376689586 -924000 ekin = 2.77394479542841 | erot = 3.27524658464355 | epot = -19.3317290490837 | etot = -13.2825376690117 -925000 ekin = 2.79984975928351 | erot = 3.26648541912167 | epot = -19.3488728475058 | etot = -13.2825376691007 -926000 ekin = 2.83154188644563 | erot = 3.24600163470182 | epot = -19.3600811903832 | etot = -13.2825376692358 -927000 ekin = 2.86690921925873 | erot = 3.21375665515305 | epot = -19.3632035438127 | etot = -13.2825376694009 -928000 ekin = 2.90327996744615 | erot = 3.1698282422568 | epot = -19.3556458792629 | etot = -13.28253766956 -929000 ekin = 2.9377528576698 | erot = 3.11459709938568 | epot = -19.3348876267244 | etot = -13.2825376696689 -930000 ekin = 2.96759841378242 | erot = 3.04898886675846 | epot = -19.2991249502308 | etot = -13.28253766969 -931000 ekin = 2.99062544127426 | erot = 2.97467062307573 | epot = -19.2478337339529 | etot = -13.2825376696029 -932000 ekin = 3.00543704340162 | erot = 2.89412065067177 | epot = -19.182095363482 | etot = -13.2825376694086 -933000 ekin = 3.01154336745542 | erot = 2.81054368702195 | epot = -19.1046247236028 | etot = -13.2825376691254 -934000 ekin = 3.009296793607 | erot = 2.72759799681476 | epot = -19.0194324597542 | etot = -13.2825376693324 -935000 ekin = 2.997461341975 | erot = 2.64625807489206 | epot = -18.9262570860507 | etot = -13.2825376691836 -936000 ekin = 2.97526415104969 | erot = 2.56749092792282 | epot = -18.8252927479684 | etot = -13.2825376689959 -937000 ekin = 2.94352512535629 | erot = 2.49335517907744 | epot = -18.7194179732148 | etot = -13.2825376687811 -938000 ekin = 2.90367826462751 | erot = 2.42575018416626 | epot = -18.611966117346 | etot = -13.2825376685523 -939000 ekin = 2.85762227335056 | erot = 2.36633148508481 | epot = -18.5064914267688 | etot = -13.2825376683334 -940000 ekin = 2.80750328436355 | erot = 2.31642989470971 | epot = -18.4064708472124 | etot = -13.2825376681392 -941000 ekin = 2.75550936317914 | erot = 2.27698712574035 | epot = -18.315034156903 | etot = -13.2825376679835 -942000 ekin = 2.70367879384707 | erot = 2.24846537191054 | epot = -18.2346818336424 | etot = -13.2825376678848 -943000 ekin = 2.65376367610072 | erot = 2.23082283410755 | epot = -18.1671241780433 | etot = -13.282537667835 -944000 ekin = 2.60720594193945 | erot = 2.22360475791407 | epot = -18.1133483676727 | etot = -13.2825376678192 -945000 ekin = 2.56519856456668 | erot = 2.2261014482812 | epot = -18.0738376806584 | etot = -13.2825376678105 -946000 ekin = 2.52882759917491 | erot = 2.23758213190646 | epot = -18.0489473988614 | etot = -13.28253766778 -947000 ekin = 2.49923315501652 | erot = 2.25754573395336 | epot = -18.0393165566767 | etot = -13.2825376677068 -948000 ekin = 2.47771007493837 | erot = 2.28590689258452 | epot = -18.0461546351121 | etot = -13.2825376675892 -949000 ekin = 2.46568539867815 | erot = 2.32304174075055 | epot = -18.0712648068822 | etot = -13.2825376674535 -950000 ekin = 2.46454516561394 | erot = 2.36959060784074 | epot = -18.1166734407876 | etot = -13.2825376673329 -951000 ekin = 2.47533995001422 | erot = 2.42623129983711 | epot = -18.1841089171244 | etot = -13.2825376672731 -952000 ekin = 2.49848236356054 | erot = 2.49338196898259 | epot = -18.2744019998551 | etot = -13.282537667312 -953000 ekin = 2.53348398196953 | erot = 2.57089243330607 | epot = -18.3869140827469 | etot = -13.2825376674713 -954000 ekin = 2.57882587535192 | erot = 2.65786416807577 | epot = -18.5192277111793 | etot = -13.2825376677516 -955000 ekin = 2.63199527601701 | erot = 2.75261052014717 | epot = -18.6671434642983 | etot = -13.2825376681341 -956000 ekin = 2.68967924818385 | erot = 2.85274255006523 | epot = -18.824959466837 | etot = -13.2825376685879 -957000 ekin = 2.74806771949303 | erot = 2.95533472442408 | epot = -18.9859401129945 | etot = -13.2825376690774 -958000 ekin = 2.80319866682411 | erot = 3.05711581061847 | epot = -19.1428521470133 | etot = -13.2825376695707 -959000 ekin = 2.85127801277871 | erot = 3.15464148733328 | epot = -19.2884571701549 | etot = -13.2825376700429 -960000 ekin = 2.88892608820776 | erot = 3.24442918289906 | epot = -19.4158929415847 | etot = -13.2825376704779 -961000 ekin = 2.91333465074054 | erot = 3.32306194469256 | epot = -19.5189342662969 | etot = -13.2825376708638 -962000 ekin = 2.92235141889966 | erot = 3.38728585340868 | epot = -19.5921749434977 | etot = -13.2825376711894 -963000 ekin = 2.91452965719862 | erot = 3.43412743872512 | epot = -19.631194767364 | etot = -13.2825376714403 -964000 ekin = 2.88918087864217 | erot = 3.46104482999107 | epot = -19.6327633802318 | etot = -13.2825376715986 -965000 ekin = 2.84645277182146 | erot = 3.46610960647262 | epot = -19.595100049937 | etot = -13.282537671643 -966000 ekin = 2.78809663572529 | erot = 3.4488697192109 | epot = -19.5195040264019 | etot = -13.2825376714657 -967000 ekin = 2.71967964182158 | erot = 3.41234902493455 | epot = -19.4145663381801 | etot = -13.2825376714239 -968000 ekin = 2.64387658032148 | erot = 3.35650459867512 | epot = -19.2829188502152 | etot = -13.2825376712186 -969000 ekin = 2.56365983597794 | erot = 3.2821307177253 | epot = -19.1283282245258 | etot = -13.2825376708226 -970000 ekin = 2.48311062140704 | erot = 3.19174642311281 | epot = -18.9573947147568 | etot = -13.282537670237 -971000 ekin = 2.4074396573122 | erot = 3.08950974404967 | epot = -18.7794870708623 | etot = -13.2825376695004 -972000 ekin = 2.34264905759316 | erot = 2.98071332519642 | epot = -18.6059000516343 | etot = -13.2825376688447 -973000 ekin = 2.29453827357382 | erot = 2.87084836317583 | epot = -18.4479243047352 | etot = -13.2825376679856 -974000 ekin = 2.26986492520578 | erot = 2.76590322626965 | epot = -18.3183058187343 | etot = -13.2825376672589 -975000 ekin = 2.27457634337442 | erot = 2.67096736253948 | epot = -18.2280813726668 | etot = -13.2825376667529 -976000 ekin = 2.31300758343906 | erot = 2.58967385345333 | epot = -18.1852191035243 | etot = -13.2825376666319 -977000 ekin = 2.38775385247815 | erot = 2.52429198069488 | epot = -18.1945835001196 | etot = -13.2825376669466 -978000 ekin = 2.4934313211563 | erot = 2.47478959068606 | epot = -18.2507585813607 | etot = -13.2825376695183 -979000 ekin = 2.63194261798452 | erot = 2.43666985309478 | epot = -18.3511501394633 | etot = -13.282537668384 -980000 ekin = 2.80143349399528 | erot = 2.41383709770836 | epot = -18.4978082614077 | etot = -13.282537669704 -981000 ekin = 2.97613228562078 | erot = 2.40353470194656 | epot = -18.6622046578964 | etot = -13.2825376703291 -982000 ekin = 3.15493786388404 | erot = 2.40097885128001 | epot = -18.8384543865222 | etot = -13.2825376713581 -983000 ekin = 3.32895075409049 | erot = 2.40358703806397 | epot = -19.0150754641548 | etot = -13.2825376720003 -984000 ekin = 3.48942626013249 | erot = 2.40902391908617 | epot = -19.18098785172 | etot = -13.2825376725014 -985000 ekin = 3.6306055406564 | erot = 2.41512886518398 | epot = -19.3282720786933 | etot = -13.2825376728529 -986000 ekin = 3.74861810546546 | erot = 2.42024356026412 | epot = -19.4513993386271 | etot = -13.2825376728975 -987000 ekin = 3.84212741101313 | erot = 2.42421773193476 | epot = -19.5488828158614 | etot = -13.2825376729136 -988000 ekin = 3.9111876503493 | erot = 2.42704295378038 | epot = -19.6207682769609 | etot = -13.2825376728312 -989000 ekin = 3.95686695904995 | erot = 2.42875435937409 | epot = -19.668158991096 | etot = -13.282537672672 -990000 ekin = 3.98122336716337 | erot = 2.42964012337661 | epot = -19.6934011629903 | etot = -13.2825376724504 -991000 ekin = 3.98715071441045 | erot = 2.43015135465657 | epot = -19.6998397412425 | etot = -13.2825376721755 -992000 ekin = 3.97827672378661 | erot = 2.43082965988458 | epot = -19.6916440567348 | etot = -13.2825376730636 -993000 ekin = 3.95551199280445 | erot = 2.42901824172678 | epot = -19.6670679074445 | etot = -13.2825376729133 -994000 ekin = 3.91976370645273 | erot = 2.42191618457207 | epot = -19.6242175637255 | etot = -13.2825376727007 -995000 ekin = 3.87458078790943 | erot = 2.40932775584377 | epot = -19.5664462161828 | etot = -13.2825376724296 -996000 ekin = 3.82377191569406 | erot = 2.39162261233252 | epot = -19.4979322001416 | etot = -13.282537672115 -997000 ekin = 3.77108738615857 | erot = 2.36980944948075 | epot = -19.4234345074243 | etot = -13.282537671785 -998000 ekin = 3.71986049076073 | erot = 2.34548651222161 | epot = -19.3478846744559 | etot = -13.2825376714735 -999000 ekin = 3.6726879444491 | erot = 2.32066228971374 | epot = -19.2758879053768 | etot = -13.282537671214 -1000000 ekin = 3.63122130703635 | erot = 2.29747929877849 | epot = -19.2112382768466 | etot = -13.2825376710318 - 1000000 0.16138761 -1.2609484 0.060246044 -0.97375106 -5.5311015e-05 -Loop time of 26.5666 on 4 procs for 1000000 steps with 16 atoms - -Performance: 32522.039 tau/day, 37641.249 timesteps/s -99.5% CPU use with 4 MPI tasks x no OpenMP threads - -MPI task timing breakdown: -Section | min time | avg time | max time |%varavg| %total ---------------------------------------------------------------- -Pair | 3.3902 | 10.546 | 19.399 | 188.7 | 39.70 -Bond | 0.18541 | 0.40208 | 0.71402 | 31.3 | 1.51 -Neigh | 0.000147 | 0.000155 | 0.000163 | 0.0 | 0.00 -Comm | 2.6792 | 2.8295 | 2.994 | 7.2 | 10.65 -Output | 3.1e-05 | 3.425e-05 | 3.6e-05 | 0.0 | 0.00 -Modify | 0.37735 | 0.81798 | 1.4614 | 45.1 | 3.08 -Other | | 11.97 | | | 45.06 - -Nlocal: 4.0 ave 8.0 max 1.0 min -Histogram: 1 1 0 0 0 1 0 0 0 1 -Nghost: 10.5 ave 12.0 max 8.0 min -Histogram: 1 0 0 0 0 0 0 2 0 1 -Neighs: 31.75 ave 55.0 max 9.0 min -Histogram: 1 1 0 0 0 0 0 0 1 1 - -Total # of neighbors = 127 -Ave neighs/atom = 7.9375 -Ave special neighs/atom = 3.75 -Neighbor list builds = 7 -Dangerous builds = 0 - -#write_restart config.${number}.* -Total wall time: 0:00:26 diff --git a/src/.gitignore b/src/.gitignore index c562f89e61..022785c00e 100644 --- a/src/.gitignore +++ b/src/.gitignore @@ -70,8 +70,8 @@ /meam*.h /meam*.cpp -/pair_meam.cpp -/pair_meam.h +/pair_meamc.cpp +/pair_meamc.h /compute_mliap.cpp /compute_mliap.h @@ -314,6 +314,8 @@ /atom_vec_granular.h /atom_vec_molecular.cpp /atom_vec_molecular.h +/atom_vec_oxdna.cpp +/atom_vec_oxdna.h /atom_vec_peri.cpp /atom_vec_peri.h /atom_vec_template.cpp @@ -386,8 +388,6 @@ /compute_erotate_rigid.h /compute_event_displace.cpp /compute_event_displace.h -/compute_fabric.cpp -/compute_fabric.h /compute_fep.cpp /compute_fep.h /compute_force_tally.cpp @@ -1431,10 +1431,6 @@ /pair_thole.h /pair_buck_mdf.cpp /pair_buck_mdf.h -/pair_dpd.cpp -/pair_dpd.h -/pair_dpd_tstat.cpp -/pair_dpd_tstat.h /pair_dpd_ext.cpp /pair_dpd_ext.h /pair_dpd_ext_tstat.cpp diff --git a/src/CG-DNA/Install.sh b/src/CG-DNA/Install.sh index 9ef10d3f62..bf74a85aef 100755 --- a/src/CG-DNA/Install.sh +++ b/src/CG-DNA/Install.sh @@ -28,6 +28,8 @@ action () { # list of files with dependcies +action atom_vec_oxdna.cpp atom_vec.h +action atom_vec_oxdna.h atom_vec.h action bond_oxdna_fene.cpp bond_fene.h action bond_oxdna2_fene.cpp bond_fene.h action bond_oxrna2_fene.cpp bond_fene.h diff --git a/src/CG-DNA/atom_vec_oxdna.cpp b/src/CG-DNA/atom_vec_oxdna.cpp new file mode 100644 index 0000000000..dc50656906 --- /dev/null +++ b/src/CG-DNA/atom_vec_oxdna.cpp @@ -0,0 +1,103 @@ +// clang-format off +/* ---------------------------------------------------------------------- + LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator + https://www.lammps.org/, Sandia National Laboratories + Steve Plimpton, sjplimp@sandia.gov + + Copyright (2003) Sandia Corporation. Under the terms of Contract + DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains + certain rights in this software. This software is distributed under + the GNU General Public License. + + See the README file in the top-level LAMMPS directory. +------------------------------------------------------------------------- */ + +#include "atom_vec_oxdna.h" +#include "atom.h" +#include "comm.h" + +using namespace LAMMPS_NS; + +/* ---------------------------------------------------------------------- */ +AtomVecOxdna::AtomVecOxdna(LAMMPS *lmp) : AtomVec(lmp) +{ + molecular = Atom::MOLECULAR; + bonds_allow = 1; + mass_type = PER_TYPE; + + atom->molecule_flag = 1; + + // strings with peratom variables to include in each AtomVec method + // strings cannot contain fields in corresponding AtomVec default strings + // order of fields in a string does not matter + // except: fields_data_atom & fields_data_vel must match data file + + fields_grow = (char *) "id5p"; + fields_copy = (char *) "id5p"; + fields_comm = (char *) ""; + fields_comm_vel = (char *) ""; + fields_reverse = (char *) ""; + fields_border = (char *) "id5p"; + fields_border_vel = (char *) ""; + fields_exchange = (char *) "id5p"; + fields_restart = (char *) "id5p"; + fields_create = (char *) ""; + fields_data_atom = (char *) "id type x"; + fields_data_vel = (char *) "id v"; + + setup_fields(); + +} + +/* ---------------------------------------------------------------------- */ +AtomVecOxdna::~AtomVecOxdna() +{ + +} + +/* ---------------------------------------------------------------------- + set local copies of all grow ptrs used by this class, except defaults + needed in replicate when 2 atom classes exist and it calls pack_restart() +------------------------------------------------------------------------- */ + +void AtomVecOxdna::grow_pointers() +{ + id5p = atom->id5p; + +} + +/* ---------------------------------------------------------------------- + process bond information as per data file + store 5' partner to inform 3'->5' bond directionality +------------------------------------------------------------------------- */ + +void AtomVecOxdna::data_bonds_post(int n, char *buf, tagint id_offset) +{ + + int m,tmp,itype,rv; + tagint atom1,atom2; + char *next; + + tagint *id5p = atom->id5p; + + if (comm->me == 0) utils::logmesg(lmp,"Setting oxDNA 3'->5' bond directionality ...\n"); + + for (int i = 0; i < n; i++) { + + next = strchr(buf,'\n'); + *next = '\0'; + rv = sscanf(buf,"%d %d " TAGINT_FORMAT " " TAGINT_FORMAT, + &tmp,&itype,&atom1,&atom2); + + if (id_offset) { + atom1 += id_offset; + atom2 += id_offset; + } + + if ((m = atom->map(atom1)) >= 0) { + id5p[m] = atom2; + } + + buf = next + 1; + } +} diff --git a/src/CG-DNA/atom_vec_oxdna.h b/src/CG-DNA/atom_vec_oxdna.h new file mode 100644 index 0000000000..b8af0305f7 --- /dev/null +++ b/src/CG-DNA/atom_vec_oxdna.h @@ -0,0 +1,48 @@ +/* -*- c++ -*- ---------------------------------------------------------- + LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator + https://www.lammps.org/, Sandia National Laboratories + Steve Plimpton, sjplimp@sandia.gov + + Copyright (2003) Sandia Corporation. Under the terms of Contract + DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains + certain rights in this software. This software is distributed under + the GNU General Public License. + + See the README file in the top-level LAMMPS directory. +------------------------------------------------------------------------- */ + +#ifdef ATOM_CLASS +// clang-format off +AtomStyle(oxdna,AtomVecOxdna); +// clang-format on +#else + +#ifndef LMP_ATOM_VEC_OXDNA_H +#define LMP_ATOM_VEC_OXDNA_H + +#include "atom.h" +#include "atom_vec.h" + +namespace LAMMPS_NS { + +class AtomVecOxdna : public AtomVec { + public: + AtomVecOxdna(class LAMMPS *); + ~AtomVecOxdna(); + + void grow_pointers(); + virtual void data_bonds_post(int, char *, tagint); + + private: + tagint *id5p; + +}; + +} // namespace LAMMPS_NS + +#endif +#endif + +/* ERROR/WARNING messages: + +*/ diff --git a/src/CG-DNA/pair_oxdna_stk.cpp b/src/CG-DNA/pair_oxdna_stk.cpp index 25521fd1e0..10fa0781f1 100644 --- a/src/CG-DNA/pair_oxdna_stk.cpp +++ b/src/CG-DNA/pair_oxdna_stk.cpp @@ -29,6 +29,7 @@ #include "error.h" #include "atom_vec_ellipsoid.h" +#include "atom_vec_oxdna.h" #include "math_extra.h" using namespace LAMMPS_NS; @@ -42,26 +43,26 @@ PairOxdnaStk::PairOxdnaStk(LAMMPS *lmp) : Pair(lmp) writedata = 1; // sequence-specific stacking strength - // A:0 C:1 G:2 T:3, 5'- [i][j] -3' + // A:0 C:1 G:2 T:3, 3'- [i][j] -5' eta_st[0][0] = 1.11960; - eta_st[0][1] = 1.00852; - eta_st[0][2] = 0.96950; - eta_st[0][3] = 0.99632; + eta_st[1][0] = 1.00852; + eta_st[2][0] = 0.96950; + eta_st[3][0] = 0.99632; - eta_st[1][0] = 1.01889; + eta_st[0][1] = 1.01889; eta_st[1][1] = 0.97804; - eta_st[1][2] = 1.02681; - eta_st[1][3] = 0.96950; + eta_st[2][1] = 1.02681; + eta_st[3][1] = 0.96950; - eta_st[2][0] = 0.98169; - eta_st[2][1] = 1.05913; + eta_st[0][2] = 0.98169; + eta_st[1][2] = 1.05913; eta_st[2][2] = 0.97804; - eta_st[2][3] = 1.00852; + eta_st[3][2] = 1.00852; - eta_st[3][0] = 0.94694; - eta_st[3][1] = 0.98169; - eta_st[3][2] = 1.01889; + eta_st[0][3] = 0.94694; + eta_st[1][3] = 0.98169; + eta_st[2][3] = 1.01889; eta_st[3][3] = 0.96383; } @@ -244,11 +245,13 @@ void PairOxdnaStk::compute(int eflag, int vflag) int **bondlist = neighbor->bondlist; int nbondlist = neighbor->nbondlist; + tagint *id5p = atom->id5p; + AtomVecEllipsoid *avec = (AtomVecEllipsoid *) atom->style_match("ellipsoid"); AtomVecEllipsoid::Bonus *bonus = avec->bonus; int *ellipsoid = atom->ellipsoid; - int a,b,in,atype,btype; + int a,b,btemp,in,atype,btype; double f1,f4t4,f4t5,f4t6,f5c1,f5c2; double df1,df4t4,df4t5,df4t6,df5c1,df5c2; @@ -261,8 +264,19 @@ void PairOxdnaStk::compute(int eflag, int vflag) for (in = 0; in < nbondlist; in++) { - a = bondlist[in][1]; - b = bondlist[in][0]; + a = bondlist[in][0]; + b = bondlist[in][1]; + + // directionality test: a -> b is 3' -> 5' + if(atom->tag[b] != id5p[a]) { + + btemp = b; + b = a; + a = btemp; + + } + + // a now in 3' direction, b in 5' direction qa=bonus[ellipsoid[a]].quat; MathExtra::q_to_exyz(qa,ax,ay,az); @@ -279,30 +293,11 @@ void PairOxdnaStk::compute(int eflag, int vflag) rb_cst[1] = d_cst*bx[1]; rb_cst[2] = d_cst*bx[2]; - // vector stacking site b to a - delr_st[0] = x[a][0] + ra_cst[0] - x[b][0] - rb_cst[0]; - delr_st[1] = x[a][1] + ra_cst[1] - x[b][1] - rb_cst[1]; - delr_st[2] = x[a][2] + ra_cst[2] - x[b][2] - rb_cst[2]; + // vector stacking site a to b + delr_st[0] = x[b][0] + rb_cst[0] - x[a][0] - ra_cst[0]; + delr_st[1] = x[b][1] + rb_cst[1] - x[a][1] - ra_cst[1]; + delr_st[2] = x[b][2] + rb_cst[2] - x[a][2] - ra_cst[2]; - // test for directionality of vector b to a - tptofp = MFOxdna::is_3pto5p(delr_st,bz); - - // if b to a is 5' to 3' we need to swap roles of a and b - if (tptofp == -1) { - - std::swap(a,b); - std::swap(ax,bx); - std::swap(ay,by); - std::swap(az,bz); - std::swap(ra_cst,rb_cst); - - delr_st[0] *= -1; - delr_st[1] *= -1; - delr_st[2] *= -1; - - } - - // a now in 5' direction, b in 3' direction atype = type[a]; btype = type[b]; @@ -325,9 +320,9 @@ void PairOxdnaStk::compute(int eflag, int vflag) rb_cs[2] = d_cs*bx[2]; // vector backbone site b to a - delr_ss[0] = (x[a][0] + ra_cs[0] - x[b][0] - rb_cs[0]); - delr_ss[1] = (x[a][1] + ra_cs[1] - x[b][1] - rb_cs[1]); - delr_ss[2] = (x[a][2] + ra_cs[2] - x[b][2] - rb_cs[2]); + delr_ss[0] = (x[b][0] + rb_cs[0] - x[a][0] - ra_cs[0]); + delr_ss[1] = (x[b][1] + rb_cs[1] - x[a][1] - ra_cs[1]); + delr_ss[2] = (x[b][2] + rb_cs[2] - x[a][2] - ra_cs[2]); rsq_ss = delr_ss[0]*delr_ss[0] + delr_ss[1]*delr_ss[1] + delr_ss[2]*delr_ss[2]; r_ss = sqrt(rsq_ss); @@ -345,7 +340,7 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (f1) { // theta4 angle and correction - cost4 = MathExtra::dot3(az,bz); + cost4 = MathExtra::dot3(bz,az); if (cost4 > 1.0) cost4 = 1.0; if (cost4 < -1.0) cost4 = -1.0; theta4 = acos(cost4); @@ -357,7 +352,7 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (f4t4) { // theta5 angle and correction - cost5p = MathExtra::dot3(delr_st_norm,az); + cost5p = MathExtra::dot3(delr_st_norm,bz); if (cost5p > 1.0) cost5p = 1.0; if (cost5p < -1.0) cost5p = -1.0; theta5p = acos(cost5p); @@ -368,16 +363,16 @@ void PairOxdnaStk::compute(int eflag, int vflag) // early rejection criterium if (f4t5) { - cost6p = MathExtra::dot3(delr_st_norm,bz); + cost6p = MathExtra::dot3(delr_st_norm,az); if (cost6p > 1.0) cost6p = 1.0; if (cost6p < -1.0) cost6p = -1.0; theta6p = acos(cost6p); - cosphi1 = MathExtra::dot3(delr_ss_norm,ay); + cosphi1 = MathExtra::dot3(delr_ss_norm,by); if (cosphi1 > 1.0) cosphi1 = 1.0; if (cosphi1 < -1.0) cosphi1 = -1.0; - cosphi2 = MathExtra::dot3(delr_ss_norm,by); + cosphi2 = MathExtra::dot3(delr_ss_norm,ay); if (cosphi2 > 1.0) cosphi2 = 1.0; if (cosphi2 < -1.0) cosphi2 = -1.0; @@ -385,11 +380,10 @@ void PairOxdnaStk::compute(int eflag, int vflag) b_st6[atype][btype], dtheta_st6_c[atype][btype]); f5c1 = F5(-cosphi1, a_st1[atype][btype], -cosphi_st1_ast[atype][btype], b_st1[atype][btype], - cosphi_st1_c[atype][btype]); + -cosphi_st1_c[atype][btype]); f5c2 = F5(-cosphi2, a_st2[atype][btype], -cosphi_st2_ast[atype][btype], b_st2[atype][btype], - cosphi_st2_c[atype][btype]); - + -cosphi_st2_c[atype][btype]); evdwl = f1 * f4t4 * f4t5 * f4t6 * f5c1 * f5c2; @@ -410,10 +404,10 @@ void PairOxdnaStk::compute(int eflag, int vflag) b_st6[atype][btype], dtheta_st6_c[atype][btype])/sin(theta6p); df5c1 = DF5(-cosphi1, a_st1[atype][btype], -cosphi_st1_ast[atype][btype], b_st1[atype][btype], - cosphi_st1_c[atype][btype]); + -cosphi_st1_c[atype][btype]); df5c2 = DF5(-cosphi2, a_st2[atype][btype], -cosphi_st2_ast[atype][btype], b_st2[atype][btype], - cosphi_st2_c[atype][btype]); + -cosphi_st2_c[atype][btype]); // force, torque and virial contribution for forces between stacking sites @@ -446,9 +440,9 @@ void PairOxdnaStk::compute(int eflag, int vflag) finc = -f1 * f4t4 * df4t5 * f4t6 * f5c1 * f5c2 * rinv_st; fpair += finc; - delf[0] += (delr_st_norm[0]*cost5p - az[0]) * finc; - delf[1] += (delr_st_norm[1]*cost5p - az[1]) * finc; - delf[2] += (delr_st_norm[2]*cost5p - az[2]) * finc; + delf[0] += (delr_st_norm[0]*cost5p - bz[0]) * finc; + delf[1] += (delr_st_norm[1]*cost5p - bz[1]) * finc; + delf[2] += (delr_st_norm[2]*cost5p - bz[2]) * finc; } @@ -458,28 +452,27 @@ void PairOxdnaStk::compute(int eflag, int vflag) finc = -f1 * f4t4 * f4t5 * df4t6 * f5c1 * f5c2 * rinv_st; fpair += finc; - delf[0] += (delr_st_norm[0]*cost6p - bz[0]) * finc; - delf[1] += (delr_st_norm[1]*cost6p - bz[1]) * finc; - delf[2] += (delr_st_norm[2]*cost6p - bz[2]) * finc; + delf[0] += (delr_st_norm[0]*cost6p - az[0]) * finc; + delf[1] += (delr_st_norm[1]*cost6p - az[1]) * finc; + delf[2] += (delr_st_norm[2]*cost6p - az[2]) * finc; } // increment forces and torques - if (newton_bond || a < nlocal) { - f[a][0] += delf[0]; - f[a][1] += delf[1]; - f[a][2] += delf[2]; + f[a][0] -= delf[0]; + f[a][1] -= delf[1]; + f[a][2] -= delf[2]; MathExtra::cross3(ra_cst,delf,delta); } if (newton_bond || b < nlocal) { - f[b][0] -= delf[0]; - f[b][1] -= delf[1]; - f[b][2] -= delf[2]; + f[b][0] += delf[0]; + f[b][1] += delf[1]; + f[b][2] += delf[2]; MathExtra::cross3(rb_cst,delf,deltb); @@ -487,16 +480,16 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (newton_bond || a < nlocal) { - torque[a][0] += delta[0]; - torque[a][1] += delta[1]; - torque[a][2] += delta[2]; + torque[a][0] -= delta[0]; + torque[a][1] -= delta[1]; + torque[a][2] -= delta[2]; } if (newton_bond || b < nlocal) { - torque[b][0] -= deltb[0]; - torque[b][1] -= deltb[1]; - torque[b][2] -= deltb[2]; + torque[b][0] += deltb[0]; + torque[b][1] += deltb[1]; + torque[b][2] += deltb[2]; } @@ -505,7 +498,7 @@ void PairOxdnaStk::compute(int eflag, int vflag) // (see G. Ciccotti and J.P. Ryckaert, Comp. Phys. Rep. 4, 345-392 (1986)) if (evflag) ev_tally_xyz(a,b,nlocal,newton_bond,evdwl, - delf[0],delf[1],delf[2],x[a][0]-x[b][0],x[a][1]-x[b][1],x[a][2]-x[b][2]); + delf[0],delf[1],delf[2],x[b][0]-x[a][0],x[b][1]-x[a][1],x[b][2]-x[a][2]); // force, torque and virial contribution for forces between backbone sites @@ -529,9 +522,9 @@ void PairOxdnaStk::compute(int eflag, int vflag) finc = -f1 * f4t4 * f4t5 * f4t6 * df5c1 * f5c2 * rinv_ss; fpair += finc; - delf[0] += (delr_ss_norm[0]*cosphi1 - ay[0]) * finc; - delf[1] += (delr_ss_norm[1]*cosphi1 - ay[1]) * finc; - delf[2] += (delr_ss_norm[2]*cosphi1 - ay[2]) * finc; + delf[0] += (delr_ss_norm[0]*cosphi1 - by[0]) * finc; + delf[1] += (delr_ss_norm[1]*cosphi1 - by[1]) * finc; + delf[2] += (delr_ss_norm[2]*cosphi1 - by[2]) * finc; } @@ -541,28 +534,27 @@ void PairOxdnaStk::compute(int eflag, int vflag) finc = -f1 * f4t4 * f4t5 * f4t6 * f5c1 * df5c2 * rinv_ss; fpair += finc; - delf[0] += (delr_ss_norm[0]*cosphi2 - by[0]) * finc; - delf[1] += (delr_ss_norm[1]*cosphi2 - by[1]) * finc; - delf[2] += (delr_ss_norm[2]*cosphi2 - by[2]) * finc; + delf[0] += (delr_ss_norm[0]*cosphi2 - ay[0]) * finc; + delf[1] += (delr_ss_norm[1]*cosphi2 - ay[1]) * finc; + delf[2] += (delr_ss_norm[2]*cosphi2 - ay[2]) * finc; } // increment forces and torques - if (newton_bond || a < nlocal) { - f[a][0] += delf[0]; - f[a][1] += delf[1]; - f[a][2] += delf[2]; + f[a][0] -= delf[0]; + f[a][1] -= delf[1]; + f[a][2] -= delf[2]; MathExtra::cross3(ra_cs,delf,delta); } if (newton_bond || b < nlocal) { - f[b][0] -= delf[0]; - f[b][1] -= delf[1]; - f[b][2] -= delf[2]; + f[b][0] += delf[0]; + f[b][1] += delf[1]; + f[b][2] += delf[2]; MathExtra::cross3(rb_cs,delf,deltb); @@ -570,22 +562,22 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (newton_bond || a < nlocal) { - torque[a][0] += delta[0]; - torque[a][1] += delta[1]; - torque[a][2] += delta[2]; + torque[a][0] -= delta[0]; + torque[a][1] -= delta[1]; + torque[a][2] -= delta[2]; } if (newton_bond || b < nlocal) { - torque[b][0] -= deltb[0]; - torque[b][1] -= deltb[1]; - torque[b][2] -= deltb[2]; + torque[b][0] += deltb[0]; + torque[b][1] += deltb[1]; + torque[b][2] += deltb[2]; } // increment virial only if (evflag) ev_tally_xyz(a,b,nlocal,newton_bond,0.0, - delf[0],delf[1],delf[2],x[a][0]-x[b][0],x[a][1]-x[b][1],x[a][2]-x[b][2]); + delf[0],delf[1],delf[2],x[b][0]-x[a][0],x[b][1]-x[a][1],x[b][2]-x[a][2]); // pure torques not expressible as r x f @@ -600,7 +592,7 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (theta4) { tpair = -f1 * df4t4 * f4t5 * f4t6 * f5c1 * f5c2; - MathExtra::cross3(bz,az,t4dir); + MathExtra::cross3(az,bz,t4dir); delta[0] += t4dir[0]*tpair; delta[1] += t4dir[1]*tpair; @@ -616,11 +608,11 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (theta5p) { tpair = -f1 * f4t4 * df4t5 * f4t6 * f5c1 * f5c2; - MathExtra::cross3(delr_st_norm,az,t5pdir); + MathExtra::cross3(delr_st_norm,bz,t5pdir); - delta[0] += t5pdir[0] * tpair; - delta[1] += t5pdir[1] * tpair; - delta[2] += t5pdir[2] * tpair; + deltb[0] += t5pdir[0] * tpair; + deltb[1] += t5pdir[1] * tpair; + deltb[2] += t5pdir[2] * tpair; } @@ -628,11 +620,11 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (theta6p) { tpair = -f1 * f4t4 * f4t5 * df4t6 * f5c1 * f5c2; - MathExtra::cross3(delr_st_norm,bz,t6pdir); + MathExtra::cross3(delr_st_norm,az,t6pdir); - deltb[0] -= t6pdir[0] * tpair; - deltb[1] -= t6pdir[1] * tpair; - deltb[2] -= t6pdir[2] * tpair; + delta[0] -= t6pdir[0] * tpair; + delta[1] -= t6pdir[1] * tpair; + delta[2] -= t6pdir[2] * tpair; } @@ -640,11 +632,11 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (cosphi1) { tpair = -f1 * f4t4 * f4t5 * f4t6 * df5c1 * f5c2; - MathExtra::cross3(delr_ss_norm,ay,cosphi1dir); + MathExtra::cross3(delr_ss_norm,by,cosphi1dir); - delta[0] += cosphi1dir[0] * tpair; - delta[1] += cosphi1dir[1] * tpair; - delta[2] += cosphi1dir[2] * tpair; + deltb[0] += cosphi1dir[0] * tpair; + deltb[1] += cosphi1dir[1] * tpair; + deltb[2] += cosphi1dir[2] * tpair; } @@ -652,27 +644,27 @@ void PairOxdnaStk::compute(int eflag, int vflag) if (cosphi2) { tpair = -f1 * f4t4 * f4t5 * f4t6 * f5c1 * df5c2; - MathExtra::cross3(delr_ss_norm,by,cosphi2dir); + MathExtra::cross3(delr_ss_norm,ay,cosphi2dir); - deltb[0] -= cosphi2dir[0] * tpair; - deltb[1] -= cosphi2dir[1] * tpair; - deltb[2] -= cosphi2dir[2] * tpair; + delta[0] -= cosphi2dir[0] * tpair; + delta[1] -= cosphi2dir[1] * tpair; + delta[2] -= cosphi2dir[2] * tpair; } // increment torques if (newton_bond || a < nlocal) { - torque[a][0] += delta[0]; - torque[a][1] += delta[1]; - torque[a][2] += delta[2]; + torque[a][0] -= delta[0]; + torque[a][1] -= delta[1]; + torque[a][2] -= delta[2]; } if (newton_bond || b < nlocal) { - torque[b][0] -= deltb[0]; - torque[b][1] -= deltb[1]; - torque[b][2] -= deltb[2]; + torque[b][0] += deltb[0]; + torque[b][1] += deltb[1]; + torque[b][2] += deltb[2]; } @@ -935,6 +927,17 @@ void PairOxdnaStk::coeff(int narg, char **arg) } +/* ---------------------------------------------------------------------- + atom_style hybrid bond ellipsoid oxdna required +------------------------------------------------------------------------- */ + +void PairOxdnaStk::init_style() +{ + if (!atom->style_match("oxdna")) { + error->all(FLERR,"Must use 'atom_style hybrid bond ellipsoid oxdna' with pair style oxdna/stk, oxdna2/stk or oxrna2/stk"); + } +} + /* ---------------------------------------------------------------------- neighbor callback to inform pair style of neighbor list to use regular ------------------------------------------------------------------------- */ diff --git a/src/CG-DNA/pair_oxdna_stk.h b/src/CG-DNA/pair_oxdna_stk.h index 3d6c22d909..8695f8fd36 100644 --- a/src/CG-DNA/pair_oxdna_stk.h +++ b/src/CG-DNA/pair_oxdna_stk.h @@ -32,6 +32,7 @@ class PairOxdnaStk : public Pair { virtual void compute(int, int); void settings(int, char **); void coeff(int, char **); + void init_style(); void init_list(int, class NeighList *); double init_one(int, int); void write_restart(FILE *); diff --git a/src/CG-DNA/pair_oxrna2_stk.cpp b/src/CG-DNA/pair_oxrna2_stk.cpp index 8353a22463..627f302699 100644 --- a/src/CG-DNA/pair_oxrna2_stk.cpp +++ b/src/CG-DNA/pair_oxrna2_stk.cpp @@ -19,6 +19,7 @@ #include "atom.h" #include "atom_vec_ellipsoid.h" +#include "atom_vec_oxdna.h" #include "comm.h" #include "error.h" #include "force.h" @@ -44,26 +45,26 @@ PairOxrna2Stk::PairOxrna2Stk(LAMMPS *lmp) : Pair(lmp) writedata = 1; // sequence-specific stacking strength - // A:0 C:1 G:2 U:3, 5'- [i][j] -3' + // A:0 C:1 G:2 U:3, 3'- [i][j] -5' eta_st[0][0] = 0.93851; - eta_st[0][1] = 1.12901; - eta_st[0][2] = 1.15626; - eta_st[0][3] = 0.88850; + eta_st[1][0] = 1.12901; + eta_st[2][0] = 1.15626; + eta_st[3][0] = 0.88850; - eta_st[1][0] = 0.86331; + eta_st[0][1] = 0.86331; eta_st[1][1] = 1.05060; - eta_st[1][2] = 0.90982; - eta_st[1][3] = 0.83252; + eta_st[2][1] = 0.90982; + eta_st[3][1] = 0.83252; - eta_st[2][0] = 0.99407; - eta_st[2][1] = 1.14333; + eta_st[0][2] = 0.99407; + eta_st[1][2] = 1.14333; eta_st[2][2] = 1.06573; - eta_st[2][3] = 0.91705; + eta_st[3][2] = 0.91705; - eta_st[3][0] = 0.98804; - eta_st[3][1] = 1.04949; - eta_st[3][2] = 1.12063; + eta_st[0][3] = 0.98804; + eta_st[1][3] = 1.04949; + eta_st[2][3] = 1.12063; eta_st[3][3] = 0.83818; } @@ -261,11 +262,13 @@ void PairOxrna2Stk::compute(int eflag, int vflag) int **bondlist = neighbor->bondlist; int nbondlist = neighbor->nbondlist; + tagint *id5p = atom->id5p; + AtomVecEllipsoid *avec = (AtomVecEllipsoid *) atom->style_match("ellipsoid"); AtomVecEllipsoid::Bonus *bonus = avec->bonus; int *ellipsoid = atom->ellipsoid; - int a,b,in,atype,btype; + int a,b,btemp,in,atype,btype; double f1,f4t5,f4t6,f4t9,f4t10,f5c1,f5c2; double df1,df4t5,df4t6,df4t9,df4t10,df5c1,df5c2; @@ -278,62 +281,43 @@ void PairOxrna2Stk::compute(int eflag, int vflag) for (in = 0; in < nbondlist; in++) { - a = bondlist[in][1]; - b = bondlist[in][0]; + a = bondlist[in][0]; + b = bondlist[in][1]; + + // directionality test: a -> b is 3' -> 5' + if(atom->tag[b] != id5p[a]) { + + btemp = b; + b = a; + a = btemp; + + } + + // a now in 3' direction, b in 5' direction qa=bonus[ellipsoid[a]].quat; MathExtra::q_to_exyz(qa,ax,ay,az); qb=bonus[ellipsoid[b]].quat; MathExtra::q_to_exyz(qb,bx,by,bz); - // vector COM a - 3'-stacking site a - ra_cst[0] = d_cst_x_3p*ax[0] + d_cst_y_3p*ay[0]; - ra_cst[1] = d_cst_x_3p*ax[1] + d_cst_y_3p*ay[1]; - ra_cst[2] = d_cst_x_3p*ax[2] + d_cst_y_3p*ay[2]; + // vector COM a - 5'-stacking site a + ra_cst[0] = d_cst_x_5p*ax[0] + d_cst_y_5p*ay[0]; + ra_cst[1] = d_cst_x_5p*ax[1] + d_cst_y_5p*ay[1]; + ra_cst[2] = d_cst_x_5p*ax[2] + d_cst_y_5p*ay[2]; - // vector COM b - 5'-stacking site b - rb_cst[0] = d_cst_x_5p*bx[0] + d_cst_y_5p*by[0]; - rb_cst[1] = d_cst_x_5p*bx[1] + d_cst_y_5p*by[1]; - rb_cst[2] = d_cst_x_5p*bx[2] + d_cst_y_5p*by[2]; + // vector COM b - 3'-stacking site b + rb_cst[0] = d_cst_x_3p*bx[0] + d_cst_y_3p*by[0]; + rb_cst[1] = d_cst_x_3p*bx[1] + d_cst_y_3p*by[1]; + rb_cst[2] = d_cst_x_3p*bx[2] + d_cst_y_3p*by[2]; - // vector 5'-stacking site b to 3'-stacking site a - delr_st[0] = x[a][0] + ra_cst[0] - x[b][0] - rb_cst[0]; - delr_st[1] = x[a][1] + ra_cst[1] - x[b][1] - rb_cst[1]; - delr_st[2] = x[a][2] + ra_cst[2] - x[b][2] - rb_cst[2]; + // vector 5'-stacking site a to 3'-stacking site b + delr_st[0] = x[b][0] + rb_cst[0] - x[a][0] - ra_cst[0]; + delr_st[1] = x[b][1] + rb_cst[1] - x[a][1] - ra_cst[1]; + delr_st[2] = x[b][2] + rb_cst[2] - x[a][2] - ra_cst[2]; - // test for directionality of vector b to a - tptofp = MFOxdna::is_3pto5p(delr_st,bz); - - // if b to a is 5' to 3' we need to swap roles of a and b - if (tptofp == -1) { - - std::swap(a,b); - std::swap(ax,bx); - std::swap(ay,by); - std::swap(az,bz); - - } - - // a now in 5' direction, b in 3' direction atype = type[a]; btype = type[b]; - // calculate again - // vector COM a - 3'-stacking site a - ra_cst[0] = d_cst_x_3p*ax[0] + d_cst_y_3p*ay[0]; - ra_cst[1] = d_cst_x_3p*ax[1] + d_cst_y_3p*ay[1]; - ra_cst[2] = d_cst_x_3p*ax[2] + d_cst_y_3p*ay[2]; - - // vector COM b - 5'-stacking site b - rb_cst[0] = d_cst_x_5p*bx[0] + d_cst_y_5p*by[0]; - rb_cst[1] = d_cst_x_5p*bx[1] + d_cst_y_5p*by[1]; - rb_cst[2] = d_cst_x_5p*bx[2] + d_cst_y_5p*by[2]; - - // vector 5'-stacking site b to 3'-stacking site a - delr_st[0] = x[a][0] + ra_cst[0] - x[b][0] - rb_cst[0]; - delr_st[1] = x[a][1] + ra_cst[1] - x[b][1] - rb_cst[1]; - delr_st[2] = x[a][2] + ra_cst[2] - x[b][2] - rb_cst[2]; - rsq_st = delr_st[0]*delr_st[0] + delr_st[1]*delr_st[1] + delr_st[2]*delr_st[2]; r_st = sqrt(rsq_st); rinv_st = 1.0/r_st; @@ -352,10 +336,10 @@ void PairOxrna2Stk::compute(int eflag, int vflag) rb_cs[1] = d_cs_x*bx[1] + d_cs_z*bz[1]; rb_cs[2] = d_cs_x*bx[2] + d_cs_z*bz[2]; - // vector backbone site b to a - delr_ss[0] = (x[a][0] + ra_cs[0] - x[b][0] - rb_cs[0]); - delr_ss[1] = (x[a][1] + ra_cs[1] - x[b][1] - rb_cs[1]); - delr_ss[2] = (x[a][2] + ra_cs[2] - x[b][2] - rb_cs[2]); + // vector backbone site a to b + delr_ss[0] = (x[b][0] + rb_cs[0] - x[a][0] - ra_cs[0]); + delr_ss[1] = (x[b][1] + rb_cs[1] - x[a][1] - ra_cs[1]); + delr_ss[2] = (x[b][2] + rb_cs[2] - x[a][2] - ra_cs[2]); rsq_ss = delr_ss[0]*delr_ss[0] + delr_ss[1]*delr_ss[1] + delr_ss[2]*delr_ss[2]; r_ss = sqrt(rsq_ss); @@ -373,7 +357,7 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (f1) { // theta5 angle and correction - cost5p = MathExtra::dot3(delr_st_norm,az); + cost5p = MathExtra::dot3(delr_st_norm,bz); if (cost5p > 1.0) cost5p = 1.0; if (cost5p < -1.0) cost5p = -1.0; theta5p = acos(cost5p); @@ -384,18 +368,18 @@ void PairOxrna2Stk::compute(int eflag, int vflag) // early rejection criterium if (f4t5) { - cost6p = MathExtra::dot3(delr_st_norm,bz); + cost6p = MathExtra::dot3(delr_st_norm,az); if (cost6p > 1.0) cost6p = 1.0; if (cost6p < -1.0) cost6p = -1.0; theta6p = acos(cost6p); - aux3p[0] = d3p_x * ax[0] + d3p_y * ay[0] + d3p_z * az[0]; - aux3p[1] = d3p_x * ax[1] + d3p_y * ay[1] + d3p_z * az[1]; - aux3p[2] = d3p_x * ax[2] + d3p_y * ay[2] + d3p_z * az[2]; + aux5p[0] = d5p_x * ax[0] + d5p_y * ay[0] + d5p_z * az[0]; + aux5p[1] = d5p_x * ax[1] + d5p_y * ay[1] + d5p_z * az[1]; + aux5p[2] = d5p_x * ax[2] + d5p_y * ay[2] + d5p_z * az[2]; - aux5p[0] = d5p_x * bx[0] + d5p_y * by[0] + d5p_z * bz[0]; - aux5p[1] = d5p_x * bx[1] + d5p_y * by[1] + d5p_z * bz[1]; - aux5p[2] = d5p_x * bx[2] + d5p_y * by[2] + d5p_z * bz[2]; + aux3p[0] = d3p_x * bx[0] + d3p_y * by[0] + d3p_z * bz[0]; + aux3p[1] = d3p_x * bx[1] + d3p_y * by[1] + d3p_z * bz[1]; + aux3p[2] = d3p_x * bx[2] + d3p_y * by[2] + d3p_z * bz[2]; cost9 = MathExtra::dot3(delr_ss_norm,aux3p); if (cost9 > 1.0) cost9 = 1.0; @@ -407,11 +391,11 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (cost10 < -1.0) cost10 = -1.0; theta10 = acos(cost10); - cosphi1 = MathExtra::dot3(delr_ss_norm,ay); + cosphi1 = MathExtra::dot3(delr_ss_norm,by); if (cosphi1 > 1.0) cosphi1 = 1.0; if (cosphi1 < -1.0) cosphi1 = -1.0; - cosphi2 = MathExtra::dot3(delr_ss_norm,by); + cosphi2 = MathExtra::dot3(delr_ss_norm,ay); if (cosphi2 > 1.0) cosphi2 = 1.0; if (cosphi2 < -1.0) cosphi2 = -1.0; @@ -425,10 +409,10 @@ void PairOxrna2Stk::compute(int eflag, int vflag) b_st10[atype][btype], dtheta_st10_c[atype][btype]); f5c1 = F5(-cosphi1, a_st1[atype][btype], -cosphi_st1_ast[atype][btype], b_st1[atype][btype], - cosphi_st1_c[atype][btype]); + -cosphi_st1_c[atype][btype]); f5c2 = F5(-cosphi2, a_st2[atype][btype], -cosphi_st2_ast[atype][btype], b_st2[atype][btype], - cosphi_st2_c[atype][btype]); + -cosphi_st2_c[atype][btype]); evdwl = f1 * f4t5 * f4t6 * f4t9 * f4t10 * f5c1 * f5c2; @@ -453,10 +437,10 @@ void PairOxrna2Stk::compute(int eflag, int vflag) b_st10[atype][btype], dtheta_st10_c[atype][btype])/sin(theta10); df5c1 = DF5(-cosphi1, a_st1[atype][btype], -cosphi_st1_ast[atype][btype], b_st1[atype][btype], - cosphi_st1_c[atype][btype]); + -cosphi_st1_c[atype][btype]); df5c2 = DF5(-cosphi2, a_st2[atype][btype], -cosphi_st2_ast[atype][btype], b_st2[atype][btype], - cosphi_st2_c[atype][btype]); + -cosphi_st2_c[atype][btype]); // force, torque and virial contribution for forces between stacking sites @@ -489,9 +473,9 @@ void PairOxrna2Stk::compute(int eflag, int vflag) finc = -f1 * df4t5 * f4t6 * f4t9 * f4t10 * f5c1 * f5c2 * rinv_st; fpair += finc; - delf[0] += (delr_st_norm[0]*cost5p - az[0]) * finc; - delf[1] += (delr_st_norm[1]*cost5p - az[1]) * finc; - delf[2] += (delr_st_norm[2]*cost5p - az[2]) * finc; + delf[0] += (delr_st_norm[0]*cost5p - bz[0]) * finc; + delf[1] += (delr_st_norm[1]*cost5p - bz[1]) * finc; + delf[2] += (delr_st_norm[2]*cost5p - bz[2]) * finc; } @@ -501,28 +485,27 @@ void PairOxrna2Stk::compute(int eflag, int vflag) finc = -f1 * f4t5 * df4t6 * f4t9 * f4t10 * f5c1 * f5c2 * rinv_st; fpair += finc; - delf[0] += (delr_st_norm[0]*cost6p - bz[0]) * finc; - delf[1] += (delr_st_norm[1]*cost6p - bz[1]) * finc; - delf[2] += (delr_st_norm[2]*cost6p - bz[2]) * finc; + delf[0] += (delr_st_norm[0]*cost6p - az[0]) * finc; + delf[1] += (delr_st_norm[1]*cost6p - az[1]) * finc; + delf[2] += (delr_st_norm[2]*cost6p - az[2]) * finc; } // increment forces and torques - if (newton_bond || a < nlocal) { - f[a][0] += delf[0]; - f[a][1] += delf[1]; - f[a][2] += delf[2]; + f[a][0] -= delf[0]; + f[a][1] -= delf[1]; + f[a][2] -= delf[2]; MathExtra::cross3(ra_cst,delf,delta); } if (newton_bond || b < nlocal) { - f[b][0] -= delf[0]; - f[b][1] -= delf[1]; - f[b][2] -= delf[2]; + f[b][0] += delf[0]; + f[b][1] += delf[1]; + f[b][2] += delf[2]; MathExtra::cross3(rb_cst,delf,deltb); @@ -530,16 +513,16 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (newton_bond || a < nlocal) { - torque[a][0] += delta[0]; - torque[a][1] += delta[1]; - torque[a][2] += delta[2]; + torque[a][0] -= delta[0]; + torque[a][1] -= delta[1]; + torque[a][2] -= delta[2]; } if (newton_bond || b < nlocal) { - torque[b][0] -= deltb[0]; - torque[b][1] -= deltb[1]; - torque[b][2] -= deltb[2]; + torque[b][0] += deltb[0]; + torque[b][1] += deltb[1]; + torque[b][2] += deltb[2]; } @@ -547,8 +530,8 @@ void PairOxrna2Stk::compute(int eflag, int vflag) // NOTE: The virial is calculated on the 'molecular' basis. // (see G. Ciccotti and J.P. Ryckaert, Comp. Phys. Rep. 4, 345-392 (1986)) - if (evflag) ev_tally_xyz(a,b,nlocal,newton_bond,evdwl, - delf[0],delf[1],delf[2],x[a][0]-x[b][0],x[a][1]-x[b][1],x[a][2]-x[b][2]); + if (evflag) ev_tally_xyz(b,a,nlocal,newton_bond,evdwl, + delf[0],delf[1],delf[2],x[b][0]-x[a][0],x[b][1]-x[a][1],x[b][2]-x[a][2]); // force, torque and virial contribution for forces between backbone sites @@ -596,9 +579,9 @@ void PairOxrna2Stk::compute(int eflag, int vflag) finc = -f1 * f4t5 * f4t6 * f4t9 * f4t10 * df5c1 * f5c2 * rinv_ss; fpair += finc; - delf[0] += (delr_ss_norm[0]*cosphi1 - ay[0]) * finc; - delf[1] += (delr_ss_norm[1]*cosphi1 - ay[1]) * finc; - delf[2] += (delr_ss_norm[2]*cosphi1 - ay[2]) * finc; + delf[0] += (delr_ss_norm[0]*cosphi1 - by[0]) * finc; + delf[1] += (delr_ss_norm[1]*cosphi1 - by[1]) * finc; + delf[2] += (delr_ss_norm[2]*cosphi1 - by[2]) * finc; } @@ -608,28 +591,27 @@ void PairOxrna2Stk::compute(int eflag, int vflag) finc = -f1 * f4t5 * f4t6 * f4t9 * f4t10 * f5c1 * df5c2 * rinv_ss; fpair += finc; - delf[0] += (delr_ss_norm[0]*cosphi2 - by[0]) * finc; - delf[1] += (delr_ss_norm[1]*cosphi2 - by[1]) * finc; - delf[2] += (delr_ss_norm[2]*cosphi2 - by[2]) * finc; + delf[0] += (delr_ss_norm[0]*cosphi2 - ay[0]) * finc; + delf[1] += (delr_ss_norm[1]*cosphi2 - ay[1]) * finc; + delf[2] += (delr_ss_norm[2]*cosphi2 - ay[2]) * finc; } // increment forces and torques - if (newton_bond || a < nlocal) { - f[a][0] += delf[0]; - f[a][1] += delf[1]; - f[a][2] += delf[2]; + f[a][0] -= delf[0]; + f[a][1] -= delf[1]; + f[a][2] -= delf[2]; MathExtra::cross3(ra_cs,delf,delta); } if (newton_bond || b < nlocal) { - f[b][0] -= delf[0]; - f[b][1] -= delf[1]; - f[b][2] -= delf[2]; + f[b][0] += delf[0]; + f[b][1] += delf[1]; + f[b][2] += delf[2]; MathExtra::cross3(rb_cs,delf,deltb); @@ -637,22 +619,22 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (newton_bond || a < nlocal) { - torque[a][0] += delta[0]; - torque[a][1] += delta[1]; - torque[a][2] += delta[2]; + torque[a][0] -= delta[0]; + torque[a][1] -= delta[1]; + torque[a][2] -= delta[2]; } if (newton_bond || b < nlocal) { - torque[b][0] -= deltb[0]; - torque[b][1] -= deltb[1]; - torque[b][2] -= deltb[2]; + torque[b][0] += deltb[0]; + torque[b][1] += deltb[1]; + torque[b][2] += deltb[2]; } // increment virial only - if (evflag) ev_tally_xyz(a,b,nlocal,newton_bond,0.0, - delf[0],delf[1],delf[2],x[a][0]-x[b][0],x[a][1]-x[b][1],x[a][2]-x[b][2]); + if (evflag) ev_tally_xyz(b,a,nlocal,newton_bond,0.0, + delf[0],delf[1],delf[2],x[b][0]-x[a][0],x[b][1]-x[a][1],x[b][2]-x[a][2]); // pure torques not expressible as r x f @@ -667,11 +649,11 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (theta5p) { tpair = -f1 * df4t5 * f4t6 * f4t9 * f4t10 * f5c1 * f5c2; - MathExtra::cross3(delr_st_norm,az,t5pdir); + MathExtra::cross3(delr_st_norm,bz,t5pdir); - delta[0] += t5pdir[0] * tpair; - delta[1] += t5pdir[1] * tpair; - delta[2] += t5pdir[2] * tpair; + deltb[0] += t5pdir[0] * tpair; + deltb[1] += t5pdir[1] * tpair; + deltb[2] += t5pdir[2] * tpair; } @@ -679,11 +661,11 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (theta6p) { tpair = -f1 * f4t5 * df4t6 * f4t9 * f4t10 * f5c1 * f5c2; - MathExtra::cross3(delr_st_norm,bz,t6pdir); + MathExtra::cross3(delr_st_norm,az,t6pdir); - deltb[0] -= t6pdir[0] * tpair; - deltb[1] -= t6pdir[1] * tpair; - deltb[2] -= t6pdir[2] * tpair; + delta[0] -= t6pdir[0] * tpair; + delta[1] -= t6pdir[1] * tpair; + delta[2] -= t6pdir[2] * tpair; } @@ -693,9 +675,9 @@ void PairOxrna2Stk::compute(int eflag, int vflag) tpair = -f1 * f4t5 * f4t6 * df4t9 * f4t10 * f5c1 * f5c2; MathExtra::cross3(delr_ss_norm,aux3p,t9dir); - delta[0] += t9dir[0] * tpair; - delta[1] += t9dir[1] * tpair; - delta[2] += t9dir[2] * tpair; + deltb[0] += t9dir[0] * tpair; + deltb[1] += t9dir[1] * tpair; + deltb[2] += t9dir[2] * tpair; } @@ -705,9 +687,9 @@ void PairOxrna2Stk::compute(int eflag, int vflag) tpair = -f1 * f4t5 * f4t6 * f4t9 * df4t10 * f5c1 * f5c2; MathExtra::cross3(delr_ss_norm,aux5p,t10dir); - deltb[0] -= t10dir[0] * tpair; - deltb[1] -= t10dir[1] * tpair; - deltb[2] -= t10dir[2] * tpair; + delta[0] -= t10dir[0] * tpair; + delta[1] -= t10dir[1] * tpair; + delta[2] -= t10dir[2] * tpair; } @@ -715,11 +697,11 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (cosphi1) { tpair = -f1 * f4t5 * f4t6 * f4t9 * f4t10 * df5c1 * f5c2; - MathExtra::cross3(delr_ss_norm,ay,cosphi1dir); + MathExtra::cross3(delr_ss_norm,by,cosphi1dir); - delta[0] += cosphi1dir[0] * tpair; - delta[1] += cosphi1dir[1] * tpair; - delta[2] += cosphi1dir[2] * tpair; + deltb[0] += cosphi1dir[0] * tpair; + deltb[1] += cosphi1dir[1] * tpair; + deltb[2] += cosphi1dir[2] * tpair; } @@ -727,27 +709,27 @@ void PairOxrna2Stk::compute(int eflag, int vflag) if (cosphi2) { tpair = -f1 * f4t5 * f4t6 * f4t9 * f4t10 * f5c1 * df5c2; - MathExtra::cross3(delr_ss_norm,by,cosphi2dir); + MathExtra::cross3(delr_ss_norm,ay,cosphi2dir); - deltb[0] -= cosphi2dir[0] * tpair; - deltb[1] -= cosphi2dir[1] * tpair; - deltb[2] -= cosphi2dir[2] * tpair; + delta[0] -= cosphi2dir[0] * tpair; + delta[1] -= cosphi2dir[1] * tpair; + delta[2] -= cosphi2dir[2] * tpair; } // increment torques if (newton_bond || a < nlocal) { - torque[a][0] += delta[0]; - torque[a][1] += delta[1]; - torque[a][2] += delta[2]; + torque[a][0] -= delta[0]; + torque[a][1] -= delta[1]; + torque[a][2] -= delta[2]; } if (newton_bond || b < nlocal) { - torque[b][0] -= deltb[0]; - torque[b][1] -= deltb[1]; - torque[b][2] -= deltb[2]; + torque[b][0] += deltb[0]; + torque[b][1] += deltb[1]; + torque[b][2] += deltb[2]; } @@ -1027,6 +1009,17 @@ void PairOxrna2Stk::coeff(int narg, char **arg) } +/* ---------------------------------------------------------------------- + atom_style hybrid bond ellipsoid oxdna required +------------------------------------------------------------------------- */ + +void PairOxrna2Stk::init_style() +{ + if (!atom->style_match("oxdna")) { + error->all(FLERR,"Must use 'atom_style hybrid bond ellipsoid oxdna' with pair style oxdna/stk, oxdna2/stk or oxrna2/stk"); + } +} + /* ---------------------------------------------------------------------- neighbor callback to inform pair style of neighbor list to use regular ------------------------------------------------------------------------- */ diff --git a/src/CG-DNA/pair_oxrna2_stk.h b/src/CG-DNA/pair_oxrna2_stk.h index 7648dd207d..23650c98b5 100644 --- a/src/CG-DNA/pair_oxrna2_stk.h +++ b/src/CG-DNA/pair_oxrna2_stk.h @@ -31,6 +31,7 @@ class PairOxrna2Stk : public Pair { virtual void compute(int, int); void settings(int, char **); void coeff(int, char **); + void init_style(); void init_list(int, class NeighList *); double init_one(int, int); void write_restart(FILE *); diff --git a/src/atom.cpp b/src/atom.cpp index 6c93161dfd..f32489f148 100644 --- a/src/atom.cpp +++ b/src/atom.cpp @@ -161,7 +161,7 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp) sp = fm = fm_long = nullptr; - // EFF and AWPMD packages + // USER-EFF and USER-AWPMD packages spin = nullptr; eradius = ervel = erforce = nullptr; @@ -169,23 +169,27 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp) cs = csforce = vforce = nullptr; etag = nullptr; - // DPD-REACT package + // USER-CGDNA package + + id5p = nullptr; + + // USER-DPD package uCond = uMech = uChem = uCG = uCGnew = nullptr; duChem = dpdTheta = nullptr; - // MESO package + // USER-MESO package cc = cc_flux = nullptr; edpd_temp = edpd_flux = edpd_cv = nullptr; - // MESONT package + // USER-MESONT package length = nullptr; buckling = nullptr; bond_nt = nullptr; - // MACHDYN package + // USER-SMD package contact_radius = nullptr; smd_data_9 = nullptr; @@ -194,12 +198,12 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp) eff_plastic_strain_rate = nullptr; damage = nullptr; - // SPH package + // USER-SPH package rho = drho = esph = desph = cv = nullptr; vest = nullptr; - // DIELECTRIC package + // USER-DIELECTRIC package area = ed = em = epsilon = curvature = q_unscaled = nullptr; @@ -457,14 +461,14 @@ void Atom::peratom_create() add_peratom("fm",&fm,DOUBLE,3,1); add_peratom("fm_long",&fm_long,DOUBLE,3,1); - // EFF package + // USER-EFF package add_peratom("spin",&spin,INT,0); add_peratom("eradius",&eradius,DOUBLE,0); add_peratom("ervel",&ervel,DOUBLE,0); add_peratom("erforce",&erforce,DOUBLE,0,1); // set per-thread flag - // AWPMD package + // USER-AWPMD package add_peratom("cs",&cs,DOUBLE,2); add_peratom("csforce",&csforce,DOUBLE,2); @@ -472,7 +476,11 @@ void Atom::peratom_create() add_peratom("ervelforce",&ervelforce,DOUBLE,0); add_peratom("etag",&etag,INT,0); - // DPD-REACT package + // USER-CGDNA package + + add_peratom("id5p",&id5p,tagintsize,0); + + // USER-DPD package add_peratom("dpdTheta",&dpdTheta,DOUBLE,0); add_peratom("uCond",&uCond,DOUBLE,0); @@ -482,7 +490,7 @@ void Atom::peratom_create() add_peratom("uCGnew",&uCGnew,DOUBLE,0); add_peratom("duChem",&duChem,DOUBLE,0); - // MESO package + // USER-MESO package add_peratom("edpd_cv",&edpd_cv,DOUBLE,0); add_peratom("edpd_temp",&edpd_temp,DOUBLE,0); @@ -491,13 +499,13 @@ void Atom::peratom_create() add_peratom("cc",&cc,DOUBLE,1); add_peratom("cc_flux",&cc_flux,DOUBLE,1,1); // set per-thread flag - // MESONT package + // USER-MESONT package add_peratom("length",&length,DOUBLE,0); add_peratom("buckling",&buckling,INT,0); add_peratom("bond_nt",&bond_nt,tagintsize,2); - // SPH package + // USER-SPH package add_peratom("rho",&rho,DOUBLE,0); add_peratom("drho",&drho,DOUBLE,0,1); // set per-thread flag @@ -506,7 +514,7 @@ void Atom::peratom_create() add_peratom("vest",&vest,DOUBLE,3); add_peratom("cv",&cv,DOUBLE,0); - // MACHDYN package + // USER-SMD package add_peratom("contact_radius",&contact_radius,DOUBLE,0); add_peratom("smd_data_9",&smd_data_9,DOUBLE,1); @@ -515,7 +523,7 @@ void Atom::peratom_create() add_peratom("eff_plastic_strain_rate",&eff_plastic_strain_rate,DOUBLE,0); add_peratom("damage",&damage,DOUBLE,0); - // DIELECTRIC package + // USER-DIELECTRIC package add_peratom("area",&area,DOUBLE,0); add_peratom("ed",&ed,DOUBLE,0); @@ -1292,6 +1300,7 @@ void Atom::data_bonds(int n, char *buf, int *count, tagint id_offset, } } } + buf = next + 1; } } @@ -2646,7 +2655,7 @@ void *Atom::extract(const char *name) if (strcmp(name,"cv") == 0) return (void *) cv; if (strcmp(name,"vest") == 0) return (void *) vest; - // MESONT package + // USER-MESONT package if (strcmp(name,"length") == 0) return (void *) length; if (strcmp(name,"buckling") == 0) return (void *) buckling; if (strcmp(name,"bond_nt") == 0) return (void *) bond_nt; @@ -2663,7 +2672,7 @@ void *Atom::extract(const char *name) if (strcmp(name,"dpdTheta") == 0) return (void *) dpdTheta; if (strcmp(name,"edpd_temp") == 0) return (void *) edpd_temp; - // DIELECTRIC + // USER-DIELECTRIC if (strcmp(name,"area") == 0) return (void *) area; if (strcmp(name,"ed") == 0) return (void *) ed; if (strcmp(name,"em") == 0) return (void *) em; @@ -2739,7 +2748,7 @@ int Atom::extract_datatype(const char *name) if (strcmp(name,"cv") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"vest") == 0) return LAMMPS_DOUBLE_2D; - // MESONT package + // USER-MESONT package if (strcmp(name,"length") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"buckling") == 0) return LAMMPS_INT; if (strcmp(name,"bond_nt") == 0) return LAMMPS_TAGINT_2D; @@ -2754,7 +2763,7 @@ int Atom::extract_datatype(const char *name) if (strcmp(name,"dpdTheta") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"edpd_temp") == 0) return LAMMPS_DOUBLE; - // DIELECTRIC + // USER-DIELECTRIC if (strcmp(name,"area") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"ed") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"em") == 0) return LAMMPS_DOUBLE; diff --git a/src/atom.h b/src/atom.h index c881490b8e..115c9601ce 100644 --- a/src/atom.h +++ b/src/atom.h @@ -114,7 +114,7 @@ class Atom : protected Pointers { double **sp, **fm, **fm_long; - // EFF and AWPMD packages + // USER_EFF and USER-AWPMD packages int *spin; double *eradius, *ervel, *erforce; @@ -122,14 +122,18 @@ class Atom : protected Pointers { double **cs, **csforce, **vforce; int *etag; - // DPD-REACT package + // USER-CGDNA package + + tagint *id5p; + + // USER-DPD package double *uCond, *uMech, *uChem, *uCGnew, *uCG; double *duChem; double *dpdTheta; int nspecies_dpd; - // MESO package + // USER-MESO package double **cc, **cc_flux; // cc = chemical concentration double *edpd_temp, *edpd_flux; // temperature and heat flux @@ -137,13 +141,13 @@ class Atom : protected Pointers { double *edpd_cv; // heat capacity int cc_species; - // MESONT package + // USER-MESONT package double *length; int *buckling; tagint **bond_nt; - // MACHDYN package + // USER-SMD package double *contact_radius; double **smd_data_9; @@ -152,12 +156,12 @@ class Atom : protected Pointers { double *eff_plastic_strain_rate; double *damage; - // SPH package + // USER-SPH package double *rho, *drho, *esph, *desph, *cv; double **vest; - // DIELECTRIC package + // USER-DIELECTRIC package double *area,*ed,*em,*epsilon,*curvature,*q_unscaled; @@ -187,7 +191,7 @@ class Atom : protected Pointers { int sp_flag; - // MACHDYN package + // USER-SMD package int x0_flag; int smd_flag, damage_flag; diff --git a/src/atom_vec.h b/src/atom_vec.h index a65fd17dcd..ff811c39bc 100644 --- a/src/atom_vec.h +++ b/src/atom_vec.h @@ -129,6 +129,8 @@ class AtomVec : protected Pointers { virtual void data_atom_bonus(int, char **) {} virtual void data_body(int, int, int, int *, double *) {} + virtual void data_bonds_post(int, char *, tagint) {} + virtual void pack_data(double **); virtual void write_data(FILE *, int, double **); virtual void pack_data_pre(int) {} diff --git a/src/read_data.cpp b/src/read_data.cpp index 12ad6c3b8c..af200d3af6 100644 --- a/src/read_data.cpp +++ b/src/read_data.cpp @@ -71,6 +71,7 @@ ReadData::ReadData(LAMMPS *lmp) : Command(lmp) keyword = new char[MAXLINE]; style = new char[MAXLINE]; buffer = new char[CHUNK*MAXLINE]; + buffer_post = new char[CHUNK*MAXLINE]; ncoeffarg = maxcoeffarg = 0; coeffarg = nullptr; fp = nullptr; @@ -86,6 +87,11 @@ ReadData::ReadData(LAMMPS *lmp) : Command(lmp) avec_tri = (AtomVecTri *) atom->style_match("tri"); nbodies = 0; avec_body = (AtomVecBody *) atom->style_match("body"); + + if (atom->style_match("oxdna")) + avec = (AtomVec *) atom->style_match("oxdna"); + else + avec = atom->avec; } /* ---------------------------------------------------------------------- */ @@ -96,6 +102,7 @@ ReadData::~ReadData() delete [] keyword; delete [] style; delete [] buffer; + delete [] buffer_post; memory->sfree(coeffarg); for (int i = 0; i < nfix; i++) { @@ -1333,7 +1340,9 @@ void ReadData::bonds(int firstpass) nchunk = MIN(nbonds-nread,CHUNK); eof = utils::read_lines_from_file(fp,nchunk,MAXLINE,buffer,me,world); if (eof) error->all(FLERR,"Unexpected end of data file"); + strcpy(buffer_post,buffer); atom->data_bonds(nchunk,buffer,count,id_offset,boffset); + if (!firstpass) avec->data_bonds_post(nchunk,buffer_post,id_offset); nread += nchunk; } diff --git a/src/read_data.h b/src/read_data.h index 482c45e6e6..1f240a18bc 100644 --- a/src/read_data.h +++ b/src/read_data.h @@ -32,7 +32,7 @@ class ReadData : public Command { private: int me, compressed; - char *line, *keyword, *buffer, *style; + char *line, *keyword, *buffer, *buffer_post, *style; FILE *fp; char **coeffarg; int ncoeffarg, maxcoeffarg; @@ -54,6 +54,7 @@ class ReadData : public Command { class AtomVecTri *avec_tri; bigint nbodies; class AtomVecBody *avec_body; + class AtomVec *avec; // box info From 65e2d8fd5e869fb8fb6280fd5d22799577e13956 Mon Sep 17 00:00:00 2001 From: Oliver Henrich Date: Mon, 5 Jul 2021 17:29:11 +0100 Subject: [PATCH 02/14] Added data_bonds_post2() method for testing purposes --- src/CG-DNA/atom_vec_oxdna.cpp | 12 ++++++++++++ src/CG-DNA/atom_vec_oxdna.h | 1 + src/atom.cpp | 1 + src/atom_vec.h | 1 + src/atom_vec_hybrid.cpp | 11 +++++++++++ src/atom_vec_hybrid.h | 3 +++ 6 files changed, 29 insertions(+) diff --git a/src/CG-DNA/atom_vec_oxdna.cpp b/src/CG-DNA/atom_vec_oxdna.cpp index dc50656906..0a1fd0684e 100644 --- a/src/CG-DNA/atom_vec_oxdna.cpp +++ b/src/CG-DNA/atom_vec_oxdna.cpp @@ -101,3 +101,15 @@ void AtomVecOxdna::data_bonds_post(int n, char *buf, tagint id_offset) buf = next + 1; } } + +/* ---------------------------------------------------------------------- + process bond information as per data file + store 5' partner to inform 3'->5' bond directionality +------------------------------------------------------------------------- */ + +void AtomVecOxdna::data_bonds_post2(int m, int num_bond, tagint atom1, tagint atom2, tagint id_offset) +{ + +printf("CALLED FROM ATOM_VEC_OXDNA\n"); + +} diff --git a/src/CG-DNA/atom_vec_oxdna.h b/src/CG-DNA/atom_vec_oxdna.h index b8af0305f7..e4485a3152 100644 --- a/src/CG-DNA/atom_vec_oxdna.h +++ b/src/CG-DNA/atom_vec_oxdna.h @@ -32,6 +32,7 @@ class AtomVecOxdna : public AtomVec { void grow_pointers(); virtual void data_bonds_post(int, char *, tagint); + virtual void data_bonds_post2(int, int, tagint, tagint, tagint); private: tagint *id5p; diff --git a/src/atom.cpp b/src/atom.cpp index f32489f148..fbc930dca1 100644 --- a/src/atom.cpp +++ b/src/atom.cpp @@ -1288,6 +1288,7 @@ void Atom::data_bonds(int n, char *buf, int *count, tagint id_offset, bond_type[m][num_bond[m]] = itype; bond_atom[m][num_bond[m]] = atom2; num_bond[m]++; + avec->data_bonds_post2(m, num_bond[m], atom1, atom2, id_offset); } } if (newton_bond == 0) { diff --git a/src/atom_vec.h b/src/atom_vec.h index ff811c39bc..d65f1f3345 100644 --- a/src/atom_vec.h +++ b/src/atom_vec.h @@ -130,6 +130,7 @@ class AtomVec : protected Pointers { virtual void data_body(int, int, int, int *, double *) {} virtual void data_bonds_post(int, char *, tagint) {} + virtual void data_bonds_post2(int, int , tagint, tagint, tagint) {} virtual void pack_data(double **); virtual void write_data(FILE *, int, double **); diff --git a/src/atom_vec_hybrid.cpp b/src/atom_vec_hybrid.cpp index 4327420cee..6df260801c 100644 --- a/src/atom_vec_hybrid.cpp +++ b/src/atom_vec_hybrid.cpp @@ -438,6 +438,17 @@ void AtomVecHybrid::data_atom_post(int ilocal) styles[k]->data_atom_post(ilocal); } +/* ---------------------------------------------------------------------- + modify what AtomVec::data_bonds() just unpacked + or initialize other bond quantities +------------------------------------------------------------------------- */ +void AtomVecHybrid::data_bonds_post2(int m, int num_bond, tagint atom1, tagint atom2, tagint id_offset) +{ + +printf("CALLED FROM ATOM_VEC_HYBRID\n"); + +} + /* ---------------------------------------------------------------------- modify values for AtomVec::pack_data() to pack ------------------------------------------------------------------------- */ diff --git a/src/atom_vec_hybrid.h b/src/atom_vec_hybrid.h index 3c804a462c..317dc86338 100644 --- a/src/atom_vec_hybrid.h +++ b/src/atom_vec_hybrid.h @@ -55,6 +55,9 @@ class AtomVecHybrid : public AtomVec { void unpack_restart_init(int); void create_atom_post(int); void data_atom_post(int); + + virtual void data_bonds_post2(int, int, tagint, tagint, tagint); + void pack_data_pre(int); void pack_data_post(int); From d190ef09c2b0f1c873ef7b50545f042409de8384 Mon Sep 17 00:00:00 2001 From: Oliver Henrich Date: Wed, 7 Jul 2021 09:58:53 +0100 Subject: [PATCH 03/14] Initialised id5p atom quantity --- src/CG-DNA/atom_vec_oxdna.cpp | 9 +++++++++ src/CG-DNA/atom_vec_oxdna.h | 2 +- 2 files changed, 10 insertions(+), 1 deletion(-) diff --git a/src/CG-DNA/atom_vec_oxdna.cpp b/src/CG-DNA/atom_vec_oxdna.cpp index 0a1fd0684e..150e9e6d1d 100644 --- a/src/CG-DNA/atom_vec_oxdna.cpp +++ b/src/CG-DNA/atom_vec_oxdna.cpp @@ -63,7 +63,16 @@ AtomVecOxdna::~AtomVecOxdna() void AtomVecOxdna::grow_pointers() { id5p = atom->id5p; +} +/* ---------------------------------------------------------------------- + initialize atom quantity +------------------------------------------------------------------------- */ + +void AtomVecOxdna::data_atom_post(int ilocal) +{ + tagint *id5p = atom->id5p; + id5p[ilocal] = -1; } /* ---------------------------------------------------------------------- diff --git a/src/CG-DNA/atom_vec_oxdna.h b/src/CG-DNA/atom_vec_oxdna.h index e4485a3152..bb8f9a457d 100644 --- a/src/CG-DNA/atom_vec_oxdna.h +++ b/src/CG-DNA/atom_vec_oxdna.h @@ -20,7 +20,6 @@ AtomStyle(oxdna,AtomVecOxdna); #ifndef LMP_ATOM_VEC_OXDNA_H #define LMP_ATOM_VEC_OXDNA_H -#include "atom.h" #include "atom_vec.h" namespace LAMMPS_NS { @@ -33,6 +32,7 @@ class AtomVecOxdna : public AtomVec { void grow_pointers(); virtual void data_bonds_post(int, char *, tagint); virtual void data_bonds_post2(int, int, tagint, tagint, tagint); + void data_atom_post(int); private: tagint *id5p; From 38b156a08a24e8a2146ec04336e91b06790da84e Mon Sep 17 00:00:00 2001 From: Aidan Thompson Date: Wed, 14 Jul 2021 11:07:10 -0600 Subject: [PATCH 04/14] Resolved bogus merge conflict and added change to last molecule deletion --- src/MC/fix_gcmc.cpp | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/src/MC/fix_gcmc.cpp b/src/MC/fix_gcmc.cpp index 6598890ea4..fc1b1c03db 100644 --- a/src/MC/fix_gcmc.cpp +++ b/src/MC/fix_gcmc.cpp @@ -1230,7 +1230,7 @@ void FixGCMC::attempt_molecule_deletion() // work-around to avoid n=0 problem with fix rigid/nvt/small - if (ngas == natoms_per_molecule) return; + if (rigidflag && ngas == natoms_per_molecule) return; tagint deletion_molecule = pick_random_gas_molecule(); if (deletion_molecule == -1) return; @@ -1900,7 +1900,7 @@ void FixGCMC::attempt_molecule_deletion_full() // work-around to avoid n=0 problem with fix rigid/nvt/small - if (ngas == natoms_per_molecule) return; + if (rigidflag && ngas == natoms_per_molecule) return; tagint deletion_molecule = pick_random_gas_molecule(); if (deletion_molecule == -1) return; From fb73382c9471648e19a9780c33197c7d27b8fb22 Mon Sep 17 00:00:00 2001 From: Aidan Thompson Date: Wed, 14 Jul 2021 11:13:54 -0600 Subject: [PATCH 05/14] Documented restriction on molecular count >= 1 for fix rigid --- doc/src/fix_gcmc.rst | 5 +++++ 1 file changed, 5 insertions(+) diff --git a/doc/src/fix_gcmc.rst b/doc/src/fix_gcmc.rst index 894e4ec4b1..c65dace601 100644 --- a/doc/src/fix_gcmc.rst +++ b/doc/src/fix_gcmc.rst @@ -451,6 +451,11 @@ When using fix gcmc in combination with fix shake or fix rigid, only GCMC exchange moves are supported, so the argument *M* must be zero. +When using fix gcmc in combination with fix rigid, deletion +of the last remaining molecule is not allowed for technical reasons, +and so the molecule count will never drop below 1, regardless of the +specified chemical potential. + Note that very lengthy simulations involving insertions/deletions of billions of gas molecules may run out of atom or molecule IDs and trigger an error, so it is better to run multiple shorter-duration From 22957453180977a6c20f1d68158b01071325d68e Mon Sep 17 00:00:00 2001 From: Stan Gerald Moore Date: Wed, 14 Jul 2021 11:21:12 -0600 Subject: [PATCH 06/14] Revert to original SNAP code for Kokkos CPU --- src/KOKKOS/pair_snap_kokkos_impl.h | 12 ++++++++++++ 1 file changed, 12 insertions(+) diff --git a/src/KOKKOS/pair_snap_kokkos_impl.h b/src/KOKKOS/pair_snap_kokkos_impl.h index 34dffacca8..296d9cc83f 100644 --- a/src/KOKKOS/pair_snap_kokkos_impl.h +++ b/src/KOKKOS/pair_snap_kokkos_impl.h @@ -86,6 +86,11 @@ PairSNAPKokkos::~PairSNAPKokkos() template void PairSNAPKokkos::init_style() { + if (host_flag) { + PairSNAP::init_style(); + return; + } + if (force->newton_pair == 0) error->all(FLERR,"Pair style SNAP requires newton pair on"); @@ -133,6 +138,13 @@ struct FindMaxNumNeighs { template void PairSNAPKokkos::compute(int eflag_in, int vflag_in) { + if (host_flag) { + atomKK->sync(Host,X_MASK|TYPE_MASK); + PairSNAP::compute(eflag_in,vflag_in); + atomKK->modified(Host,F_MASK); + return; + } + eflag = eflag_in; vflag = vflag_in; From 54cf985280b18b535cff8633528d4a9db2100a99 Mon Sep 17 00:00:00 2001 From: Stan Gerald Moore Date: Wed, 14 Jul 2021 20:54:50 -0600 Subject: [PATCH 07/14] Add message so no unexpected behavior --- src/KOKKOS/pair_snap_kokkos_impl.h | 8 +++++++- 1 file changed, 7 insertions(+), 1 deletion(-) diff --git a/src/KOKKOS/pair_snap_kokkos_impl.h b/src/KOKKOS/pair_snap_kokkos_impl.h index 296d9cc83f..30a4082711 100644 --- a/src/KOKKOS/pair_snap_kokkos_impl.h +++ b/src/KOKKOS/pair_snap_kokkos_impl.h @@ -30,6 +30,7 @@ #include "neighbor_kokkos.h" #include "kokkos.h" #include "sna.h" +#include "comm.h" #define MAXLINE 1024 #define MAXWORD 3 @@ -87,7 +88,12 @@ template void PairSNAPKokkos::init_style() { if (host_flag) { - PairSNAP::init_style(); + if (lmp->kokkos->nthreads > 1) + if (comm->me == 0) + utils::logmesg(lmp,"Pair style snap/kk currently only runs on a single " + "CPU thread, even if more threads are requested\n"); + + PairSNAP::init_style(); return; } From 0f0059269d0666ce6a7f7d16b53f4660111fd5ba Mon Sep 17 00:00:00 2001 From: Oliver Henrich Date: Thu, 15 Jul 2021 13:36:40 +0100 Subject: [PATCH 08/14] Modified data_bonds_post() and calling structure --- .../oxDNA/duplex1/log.27May21.duplex1.g++.1 | 1 - .../oxDNA/duplex1/log.27May21.duplex1.g++.4 | 1 - .../oxDNA/duplex2/log.27May21.duplex2.g++.1 | 1 - .../oxDNA/duplex2/log.27May21.duplex2.g++.4 | 1 - .../oxDNA2/duplex1/log.27May21.duplex1.g++.1 | 1 - .../oxDNA2/duplex1/log.27May21.duplex1.g++.4 | 1 - .../oxDNA2/duplex2/log.27May21.duplex2.g++.1 | 1 - .../oxDNA2/duplex2/log.27May21.duplex2.g++.4 | 1 - .../oxDNA2/duplex3/log.27May21.duplex3.g++.1 | 1 - .../oxDNA2/duplex3/log.27May21.duplex3.g++.4 | 1 - .../unique_bp/log.27May21.duplex4.4type.g++1 | 1 - .../unique_bp/log.27May21.duplex4.4type.g++4 | 1 - .../unique_bp/log.27May21.duplex4.8type.g++1 | 1 - .../unique_bp/log.27May21.duplex4.8type.g++4 | 1 - .../oxRNA2/duplex2/log.27May21.duplex2.g++.1 | 1 - .../oxRNA2/duplex2/log.27May21.duplex2.g++.4 | 1 - src/CG-DNA/atom_vec_oxdna.cpp | 46 ++++--------------- src/CG-DNA/atom_vec_oxdna.h | 3 +- src/atom.cpp | 3 +- src/atom_vec.h | 3 +- src/atom_vec_hybrid.cpp | 8 ++-- src/atom_vec_hybrid.h | 2 +- src/read_data.cpp | 1 - 23 files changed, 18 insertions(+), 64 deletions(-) diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 index 6433d417de..7d5af6aec3 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.1 @@ -32,7 +32,6 @@ Reading data file ... 2 = max bonds/atom 10 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 8 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 index cf52039af3..da1a98817b 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex1/log.27May21.duplex1.g++.4 @@ -32,7 +32,6 @@ Reading data file ... 2 = max bonds/atom 10 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 8 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 index f69905aa0c..f9b5a909eb 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.1 @@ -32,7 +32,6 @@ Reading data file ... 2 = max bonds/atom 16 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 13 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 index 7ded7eec79..8744f7b4cd 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 +++ b/examples/PACKAGES/cgdna/examples/oxDNA/duplex2/log.27May21.duplex2.g++.4 @@ -32,7 +32,6 @@ Reading data file ... 2 = max bonds/atom 16 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 13 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 index 0c27e603c8..40a6f32d18 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.1 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 10 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 8 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 index e787299257..0ab77a2d50 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex1/log.27May21.duplex1.g++.4 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 10 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 8 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 index 6379401f02..6ad31311d6 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.1 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 16 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 13 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 index 5db1bd47b3..0cd4417b42 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex2/log.27May21.duplex2.g++.4 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 16 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 13 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 index ac55cbd994..965502247e 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.1 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 10 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 8 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 index 735559c643..6d5e7669bb 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/duplex3/log.27May21.duplex3.g++.4 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 10 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 8 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 index 0193d361af..080db1e84f 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++1 @@ -36,7 +36,6 @@ Reading data file ... 2 = max bonds/atom 26 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 24 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 index eda197670d..e04e7ab623 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.4type.g++4 @@ -36,7 +36,6 @@ Reading data file ... 2 = max bonds/atom 26 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 24 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 index e6c11be477..64807e1037 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++1 @@ -36,7 +36,6 @@ Reading data file ... 2 = max bonds/atom 26 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 24 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 index d16e7b4935..2a7b689c6c 100644 --- a/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 +++ b/examples/PACKAGES/cgdna/examples/oxDNA2/unique_bp/log.27May21.duplex4.8type.g++4 @@ -36,7 +36,6 @@ Reading data file ... 2 = max bonds/atom 26 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 24 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 index a3fe688104..9e047a580d 100644 --- a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 +++ b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.1 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 16 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 13 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 index bbca5e3594..94b722f1da 100644 --- a/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 +++ b/examples/PACKAGES/cgdna/examples/oxRNA2/duplex2/log.27May21.duplex2.g++.4 @@ -33,7 +33,6 @@ Reading data file ... 2 = max bonds/atom 16 ellipsoids reading bonds ... -Setting oxDNA 3'->5' bond directionality ... 13 bonds Finding 1-2 1-3 1-4 neighbors ... special bond factors lj: 0 0 0 diff --git a/src/CG-DNA/atom_vec_oxdna.cpp b/src/CG-DNA/atom_vec_oxdna.cpp index 150e9e6d1d..240a38709b 100644 --- a/src/CG-DNA/atom_vec_oxdna.cpp +++ b/src/CG-DNA/atom_vec_oxdna.cpp @@ -66,7 +66,7 @@ void AtomVecOxdna::grow_pointers() } /* ---------------------------------------------------------------------- - initialize atom quantity + initialize atom quantity 5' partner ------------------------------------------------------------------------- */ void AtomVecOxdna::data_atom_post(int ilocal) @@ -80,45 +80,17 @@ void AtomVecOxdna::data_atom_post(int ilocal) store 5' partner to inform 3'->5' bond directionality ------------------------------------------------------------------------- */ -void AtomVecOxdna::data_bonds_post(int n, char *buf, tagint id_offset) +void AtomVecOxdna::data_bonds_post(int m, int num_bond, tagint atom1, + tagint atom2, tagint id_offset) { - - int m,tmp,itype,rv; - tagint atom1,atom2; - char *next; - tagint *id5p = atom->id5p; - if (comm->me == 0) utils::logmesg(lmp,"Setting oxDNA 3'->5' bond directionality ...\n"); + if (id_offset) { + atom1 += id_offset; + atom2 += id_offset; + } - for (int i = 0; i < n; i++) { - - next = strchr(buf,'\n'); - *next = '\0'; - rv = sscanf(buf,"%d %d " TAGINT_FORMAT " " TAGINT_FORMAT, - &tmp,&itype,&atom1,&atom2); - - if (id_offset) { - atom1 += id_offset; - atom2 += id_offset; - } - - if ((m = atom->map(atom1)) >= 0) { - id5p[m] = atom2; - } - - buf = next + 1; + if ((m = atom->map(atom1)) >= 0) { + id5p[m] = atom2; } } - -/* ---------------------------------------------------------------------- - process bond information as per data file - store 5' partner to inform 3'->5' bond directionality -------------------------------------------------------------------------- */ - -void AtomVecOxdna::data_bonds_post2(int m, int num_bond, tagint atom1, tagint atom2, tagint id_offset) -{ - -printf("CALLED FROM ATOM_VEC_OXDNA\n"); - -} diff --git a/src/CG-DNA/atom_vec_oxdna.h b/src/CG-DNA/atom_vec_oxdna.h index bb8f9a457d..e3297a0482 100644 --- a/src/CG-DNA/atom_vec_oxdna.h +++ b/src/CG-DNA/atom_vec_oxdna.h @@ -30,8 +30,7 @@ class AtomVecOxdna : public AtomVec { ~AtomVecOxdna(); void grow_pointers(); - virtual void data_bonds_post(int, char *, tagint); - virtual void data_bonds_post2(int, int, tagint, tagint, tagint); + virtual void data_bonds_post(int, int, tagint, tagint, tagint); void data_atom_post(int); private: diff --git a/src/atom.cpp b/src/atom.cpp index fbc930dca1..323f88719a 100644 --- a/src/atom.cpp +++ b/src/atom.cpp @@ -1288,7 +1288,7 @@ void Atom::data_bonds(int n, char *buf, int *count, tagint id_offset, bond_type[m][num_bond[m]] = itype; bond_atom[m][num_bond[m]] = atom2; num_bond[m]++; - avec->data_bonds_post2(m, num_bond[m], atom1, atom2, id_offset); + avec->data_bonds_post(m, num_bond[m], atom1, atom2, id_offset); } } if (newton_bond == 0) { @@ -1298,6 +1298,7 @@ void Atom::data_bonds(int n, char *buf, int *count, tagint id_offset, bond_type[m][num_bond[m]] = itype; bond_atom[m][num_bond[m]] = atom1; num_bond[m]++; + avec->data_bonds_post(m, num_bond[m], atom1, atom2, id_offset); } } } diff --git a/src/atom_vec.h b/src/atom_vec.h index d65f1f3345..ad3b4c6626 100644 --- a/src/atom_vec.h +++ b/src/atom_vec.h @@ -129,8 +129,7 @@ class AtomVec : protected Pointers { virtual void data_atom_bonus(int, char **) {} virtual void data_body(int, int, int, int *, double *) {} - virtual void data_bonds_post(int, char *, tagint) {} - virtual void data_bonds_post2(int, int , tagint, tagint, tagint) {} + virtual void data_bonds_post(int, int , tagint, tagint, tagint) {} virtual void pack_data(double **); virtual void write_data(FILE *, int, double **); diff --git a/src/atom_vec_hybrid.cpp b/src/atom_vec_hybrid.cpp index 6df260801c..aa19f14bc8 100644 --- a/src/atom_vec_hybrid.cpp +++ b/src/atom_vec_hybrid.cpp @@ -442,11 +442,11 @@ void AtomVecHybrid::data_atom_post(int ilocal) modify what AtomVec::data_bonds() just unpacked or initialize other bond quantities ------------------------------------------------------------------------- */ -void AtomVecHybrid::data_bonds_post2(int m, int num_bond, tagint atom1, tagint atom2, tagint id_offset) +void AtomVecHybrid::data_bonds_post(int m, int num_bond, tagint atom1, + tagint atom2, tagint id_offset) { - -printf("CALLED FROM ATOM_VEC_HYBRID\n"); - + for (int k = 0; k < nstyles; k++) + styles[k]->data_bonds_post(m, num_bond, atom1, atom2, id_offset); } /* ---------------------------------------------------------------------- diff --git a/src/atom_vec_hybrid.h b/src/atom_vec_hybrid.h index 317dc86338..e596754fb3 100644 --- a/src/atom_vec_hybrid.h +++ b/src/atom_vec_hybrid.h @@ -56,7 +56,7 @@ class AtomVecHybrid : public AtomVec { void create_atom_post(int); void data_atom_post(int); - virtual void data_bonds_post2(int, int, tagint, tagint, tagint); + virtual void data_bonds_post(int, int, tagint, tagint, tagint); void pack_data_pre(int); void pack_data_post(int); diff --git a/src/read_data.cpp b/src/read_data.cpp index af200d3af6..183ef30648 100644 --- a/src/read_data.cpp +++ b/src/read_data.cpp @@ -1342,7 +1342,6 @@ void ReadData::bonds(int firstpass) if (eof) error->all(FLERR,"Unexpected end of data file"); strcpy(buffer_post,buffer); atom->data_bonds(nchunk,buffer,count,id_offset,boffset); - if (!firstpass) avec->data_bonds_post(nchunk,buffer_post,id_offset); nread += nchunk; } From e6181d14d711858c26141fdcd9416da54a2e6a89 Mon Sep 17 00:00:00 2001 From: Oliver Henrich Date: Thu, 15 Jul 2021 13:53:15 +0100 Subject: [PATCH 09/14] Use latest versions in master branch --- src/atom.cpp | 43 +++++++++++++++++++++---------------------- src/atom.h | 18 +++++++++--------- src/read_data.cpp | 8 -------- src/read_data.h | 3 +-- 4 files changed, 31 insertions(+), 41 deletions(-) diff --git a/src/atom.cpp b/src/atom.cpp index 323f88719a..6063398f40 100644 --- a/src/atom.cpp +++ b/src/atom.cpp @@ -161,7 +161,7 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp) sp = fm = fm_long = nullptr; - // USER-EFF and USER-AWPMD packages + // EFF and AWPMD packages spin = nullptr; eradius = ervel = erforce = nullptr; @@ -169,27 +169,27 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp) cs = csforce = vforce = nullptr; etag = nullptr; - // USER-CGDNA package + // CG-DNA package id5p = nullptr; - // USER-DPD package + // DPD-REACT package uCond = uMech = uChem = uCG = uCGnew = nullptr; duChem = dpdTheta = nullptr; - // USER-MESO package + // MESO package cc = cc_flux = nullptr; edpd_temp = edpd_flux = edpd_cv = nullptr; - // USER-MESONT package + // MESONT package length = nullptr; buckling = nullptr; bond_nt = nullptr; - // USER-SMD package + // MACHDYN package contact_radius = nullptr; smd_data_9 = nullptr; @@ -198,12 +198,12 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp) eff_plastic_strain_rate = nullptr; damage = nullptr; - // USER-SPH package + // SPH package rho = drho = esph = desph = cv = nullptr; vest = nullptr; - // USER-DIELECTRIC package + // DIELECTRIC package area = ed = em = epsilon = curvature = q_unscaled = nullptr; @@ -461,14 +461,14 @@ void Atom::peratom_create() add_peratom("fm",&fm,DOUBLE,3,1); add_peratom("fm_long",&fm_long,DOUBLE,3,1); - // USER-EFF package + // EFF package add_peratom("spin",&spin,INT,0); add_peratom("eradius",&eradius,DOUBLE,0); add_peratom("ervel",&ervel,DOUBLE,0); add_peratom("erforce",&erforce,DOUBLE,0,1); // set per-thread flag - // USER-AWPMD package + // AWPMD package add_peratom("cs",&cs,DOUBLE,2); add_peratom("csforce",&csforce,DOUBLE,2); @@ -476,11 +476,11 @@ void Atom::peratom_create() add_peratom("ervelforce",&ervelforce,DOUBLE,0); add_peratom("etag",&etag,INT,0); - // USER-CGDNA package + // CG-DNA package add_peratom("id5p",&id5p,tagintsize,0); - // USER-DPD package + // DPD-REACT package add_peratom("dpdTheta",&dpdTheta,DOUBLE,0); add_peratom("uCond",&uCond,DOUBLE,0); @@ -490,7 +490,7 @@ void Atom::peratom_create() add_peratom("uCGnew",&uCGnew,DOUBLE,0); add_peratom("duChem",&duChem,DOUBLE,0); - // USER-MESO package + // MESO package add_peratom("edpd_cv",&edpd_cv,DOUBLE,0); add_peratom("edpd_temp",&edpd_temp,DOUBLE,0); @@ -499,13 +499,13 @@ void Atom::peratom_create() add_peratom("cc",&cc,DOUBLE,1); add_peratom("cc_flux",&cc_flux,DOUBLE,1,1); // set per-thread flag - // USER-MESONT package + // MESONT package add_peratom("length",&length,DOUBLE,0); add_peratom("buckling",&buckling,INT,0); add_peratom("bond_nt",&bond_nt,tagintsize,2); - // USER-SPH package + // SPH package add_peratom("rho",&rho,DOUBLE,0); add_peratom("drho",&drho,DOUBLE,0,1); // set per-thread flag @@ -514,7 +514,7 @@ void Atom::peratom_create() add_peratom("vest",&vest,DOUBLE,3); add_peratom("cv",&cv,DOUBLE,0); - // USER-SMD package + // MACHDYN package add_peratom("contact_radius",&contact_radius,DOUBLE,0); add_peratom("smd_data_9",&smd_data_9,DOUBLE,1); @@ -523,7 +523,7 @@ void Atom::peratom_create() add_peratom("eff_plastic_strain_rate",&eff_plastic_strain_rate,DOUBLE,0); add_peratom("damage",&damage,DOUBLE,0); - // USER-DIELECTRIC package + // DIELECTRIC package add_peratom("area",&area,DOUBLE,0); add_peratom("ed",&ed,DOUBLE,0); @@ -1302,7 +1302,6 @@ void Atom::data_bonds(int n, char *buf, int *count, tagint id_offset, } } } - buf = next + 1; } } @@ -2657,7 +2656,7 @@ void *Atom::extract(const char *name) if (strcmp(name,"cv") == 0) return (void *) cv; if (strcmp(name,"vest") == 0) return (void *) vest; - // USER-MESONT package + // MESONT package if (strcmp(name,"length") == 0) return (void *) length; if (strcmp(name,"buckling") == 0) return (void *) buckling; if (strcmp(name,"bond_nt") == 0) return (void *) bond_nt; @@ -2674,7 +2673,7 @@ void *Atom::extract(const char *name) if (strcmp(name,"dpdTheta") == 0) return (void *) dpdTheta; if (strcmp(name,"edpd_temp") == 0) return (void *) edpd_temp; - // USER-DIELECTRIC + // DIELECTRIC if (strcmp(name,"area") == 0) return (void *) area; if (strcmp(name,"ed") == 0) return (void *) ed; if (strcmp(name,"em") == 0) return (void *) em; @@ -2750,7 +2749,7 @@ int Atom::extract_datatype(const char *name) if (strcmp(name,"cv") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"vest") == 0) return LAMMPS_DOUBLE_2D; - // USER-MESONT package + // MESONT package if (strcmp(name,"length") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"buckling") == 0) return LAMMPS_INT; if (strcmp(name,"bond_nt") == 0) return LAMMPS_TAGINT_2D; @@ -2765,7 +2764,7 @@ int Atom::extract_datatype(const char *name) if (strcmp(name,"dpdTheta") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"edpd_temp") == 0) return LAMMPS_DOUBLE; - // USER-DIELECTRIC + // DIELECTRIC if (strcmp(name,"area") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"ed") == 0) return LAMMPS_DOUBLE; if (strcmp(name,"em") == 0) return LAMMPS_DOUBLE; diff --git a/src/atom.h b/src/atom.h index 22165fa053..daf2f04f8a 100644 --- a/src/atom.h +++ b/src/atom.h @@ -114,7 +114,7 @@ class Atom : protected Pointers { double **sp, **fm, **fm_long; - // USER_EFF and USER-AWPMD packages + // EFF and AWPMD packages int *spin; double *eradius, *ervel, *erforce; @@ -122,18 +122,18 @@ class Atom : protected Pointers { double **cs, **csforce, **vforce; int *etag; - // USER-CGDNA package + // CG-DNA package tagint *id5p; - // USER-DPD package + // DPD-REACT package double *uCond, *uMech, *uChem, *uCGnew, *uCG; double *duChem; double *dpdTheta; int nspecies_dpd; - // USER-MESO package + // MESO package double **cc, **cc_flux; // cc = chemical concentration double *edpd_temp, *edpd_flux; // temperature and heat flux @@ -141,13 +141,13 @@ class Atom : protected Pointers { double *edpd_cv; // heat capacity int cc_species; - // USER-MESONT package + // MESONT package double *length; int *buckling; tagint **bond_nt; - // USER-SMD package + // MACHDYN package double *contact_radius; double **smd_data_9; @@ -156,12 +156,12 @@ class Atom : protected Pointers { double *eff_plastic_strain_rate; double *damage; - // USER-SPH package + // SPH package double *rho, *drho, *esph, *desph, *cv; double **vest; - // USER-DIELECTRIC package + // DIELECTRIC package double *area,*ed,*em,*epsilon,*curvature,*q_unscaled; @@ -191,7 +191,7 @@ class Atom : protected Pointers { int sp_flag; - // USER-SMD package + // MACHDYN package int x0_flag; int smd_flag, damage_flag; diff --git a/src/read_data.cpp b/src/read_data.cpp index 183ef30648..12ad6c3b8c 100644 --- a/src/read_data.cpp +++ b/src/read_data.cpp @@ -71,7 +71,6 @@ ReadData::ReadData(LAMMPS *lmp) : Command(lmp) keyword = new char[MAXLINE]; style = new char[MAXLINE]; buffer = new char[CHUNK*MAXLINE]; - buffer_post = new char[CHUNK*MAXLINE]; ncoeffarg = maxcoeffarg = 0; coeffarg = nullptr; fp = nullptr; @@ -87,11 +86,6 @@ ReadData::ReadData(LAMMPS *lmp) : Command(lmp) avec_tri = (AtomVecTri *) atom->style_match("tri"); nbodies = 0; avec_body = (AtomVecBody *) atom->style_match("body"); - - if (atom->style_match("oxdna")) - avec = (AtomVec *) atom->style_match("oxdna"); - else - avec = atom->avec; } /* ---------------------------------------------------------------------- */ @@ -102,7 +96,6 @@ ReadData::~ReadData() delete [] keyword; delete [] style; delete [] buffer; - delete [] buffer_post; memory->sfree(coeffarg); for (int i = 0; i < nfix; i++) { @@ -1340,7 +1333,6 @@ void ReadData::bonds(int firstpass) nchunk = MIN(nbonds-nread,CHUNK); eof = utils::read_lines_from_file(fp,nchunk,MAXLINE,buffer,me,world); if (eof) error->all(FLERR,"Unexpected end of data file"); - strcpy(buffer_post,buffer); atom->data_bonds(nchunk,buffer,count,id_offset,boffset); nread += nchunk; } diff --git a/src/read_data.h b/src/read_data.h index 1f240a18bc..482c45e6e6 100644 --- a/src/read_data.h +++ b/src/read_data.h @@ -32,7 +32,7 @@ class ReadData : public Command { private: int me, compressed; - char *line, *keyword, *buffer, *buffer_post, *style; + char *line, *keyword, *buffer, *style; FILE *fp; char **coeffarg; int ncoeffarg, maxcoeffarg; @@ -54,7 +54,6 @@ class ReadData : public Command { class AtomVecTri *avec_tri; bigint nbodies; class AtomVecBody *avec_body; - class AtomVec *avec; // box info From a7619b8daec465d1a6ab367e1a137ee6f64cf5c9 Mon Sep 17 00:00:00 2001 From: Oliver Henrich Date: Thu, 15 Jul 2021 17:32:19 +0100 Subject: [PATCH 10/14] Removed virtual keyword, defined internal variable --- src/CG-DNA/atom_vec_oxdna.cpp | 5 +++-- src/CG-DNA/atom_vec_oxdna.h | 2 +- src/atom_vec_hybrid.h | 2 +- 3 files changed, 5 insertions(+), 4 deletions(-) diff --git a/src/CG-DNA/atom_vec_oxdna.cpp b/src/CG-DNA/atom_vec_oxdna.cpp index 240a38709b..ed37fd0877 100644 --- a/src/CG-DNA/atom_vec_oxdna.cpp +++ b/src/CG-DNA/atom_vec_oxdna.cpp @@ -83,6 +83,7 @@ void AtomVecOxdna::data_atom_post(int ilocal) void AtomVecOxdna::data_bonds_post(int m, int num_bond, tagint atom1, tagint atom2, tagint id_offset) { + int n; tagint *id5p = atom->id5p; if (id_offset) { @@ -90,7 +91,7 @@ void AtomVecOxdna::data_bonds_post(int m, int num_bond, tagint atom1, atom2 += id_offset; } - if ((m = atom->map(atom1)) >= 0) { - id5p[m] = atom2; + if ((n = atom->map(atom1)) >= 0) { + id5p[n] = atom2; } } diff --git a/src/CG-DNA/atom_vec_oxdna.h b/src/CG-DNA/atom_vec_oxdna.h index e3297a0482..eb167e6859 100644 --- a/src/CG-DNA/atom_vec_oxdna.h +++ b/src/CG-DNA/atom_vec_oxdna.h @@ -30,8 +30,8 @@ class AtomVecOxdna : public AtomVec { ~AtomVecOxdna(); void grow_pointers(); - virtual void data_bonds_post(int, int, tagint, tagint, tagint); void data_atom_post(int); + void data_bonds_post(int, int, tagint, tagint, tagint); private: tagint *id5p; diff --git a/src/atom_vec_hybrid.h b/src/atom_vec_hybrid.h index e596754fb3..949ae37319 100644 --- a/src/atom_vec_hybrid.h +++ b/src/atom_vec_hybrid.h @@ -56,7 +56,7 @@ class AtomVecHybrid : public AtomVec { void create_atom_post(int); void data_atom_post(int); - virtual void data_bonds_post(int, int, tagint, tagint, tagint); + void data_bonds_post(int, int, tagint, tagint, tagint); void pack_data_pre(int); void pack_data_post(int); From d024dc0e098cb2f0c641fde3f73ea4ced722cec5 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Thu, 15 Jul 2021 15:12:04 -0400 Subject: [PATCH 11/14] whitespace fixes --- src/CG-DNA/atom_vec_oxdna.cpp | 2 +- src/CG-DNA/pair_oxrna2_stk.cpp | 2 +- src/atom_vec_hybrid.cpp | 2 +- 3 files changed, 3 insertions(+), 3 deletions(-) diff --git a/src/CG-DNA/atom_vec_oxdna.cpp b/src/CG-DNA/atom_vec_oxdna.cpp index ed37fd0877..5990fa5dfc 100644 --- a/src/CG-DNA/atom_vec_oxdna.cpp +++ b/src/CG-DNA/atom_vec_oxdna.cpp @@ -77,7 +77,7 @@ void AtomVecOxdna::data_atom_post(int ilocal) /* ---------------------------------------------------------------------- process bond information as per data file - store 5' partner to inform 3'->5' bond directionality + store 5' partner to inform 3'->5' bond directionality ------------------------------------------------------------------------- */ void AtomVecOxdna::data_bonds_post(int m, int num_bond, tagint atom1, diff --git a/src/CG-DNA/pair_oxrna2_stk.cpp b/src/CG-DNA/pair_oxrna2_stk.cpp index 627f302699..b6b68662d5 100644 --- a/src/CG-DNA/pair_oxrna2_stk.cpp +++ b/src/CG-DNA/pair_oxrna2_stk.cpp @@ -1014,7 +1014,7 @@ void PairOxrna2Stk::coeff(int narg, char **arg) ------------------------------------------------------------------------- */ void PairOxrna2Stk::init_style() -{ +{ if (!atom->style_match("oxdna")) { error->all(FLERR,"Must use 'atom_style hybrid bond ellipsoid oxdna' with pair style oxdna/stk, oxdna2/stk or oxrna2/stk"); } diff --git a/src/atom_vec_hybrid.cpp b/src/atom_vec_hybrid.cpp index aa19f14bc8..0bffde2129 100644 --- a/src/atom_vec_hybrid.cpp +++ b/src/atom_vec_hybrid.cpp @@ -444,7 +444,7 @@ void AtomVecHybrid::data_atom_post(int ilocal) ------------------------------------------------------------------------- */ void AtomVecHybrid::data_bonds_post(int m, int num_bond, tagint atom1, tagint atom2, tagint id_offset) -{ +{ for (int k = 0; k < nstyles; k++) styles[k]->data_bonds_post(m, num_bond, atom1, atom2, id_offset); } From d97ea4ebf6d32ae8269dc3e2e689f1ba43037266 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Thu, 15 Jul 2021 15:42:50 -0400 Subject: [PATCH 12/14] make dependency of CG-DNA on ASPHERE and MOLECULE a hard dependency --- cmake/CMakeLists.txt | 2 ++ doc/src/Packages_details.rst | 5 +++++ src/CG-DNA/Install.sh | 19 +++++++++++++++++-- 3 files changed, 24 insertions(+), 2 deletions(-) diff --git a/cmake/CMakeLists.txt b/cmake/CMakeLists.txt index 371f836a36..a5861ab885 100644 --- a/cmake/CMakeLists.txt +++ b/cmake/CMakeLists.txt @@ -305,6 +305,8 @@ pkg_depends(LATBOLTZ MPI) pkg_depends(PHONON KSPACE) pkg_depends(SCAFACOS MPI) pkg_depends(DIELECTRIC KSPACE) +pkg_depends(CG-DNA MOLECULE) +pkg_depends(CG-DNA ASPHERE) # detect if we may enable OpenMP support by default set(BUILD_OMP_DEFAULT OFF) diff --git a/doc/src/Packages_details.rst b/doc/src/Packages_details.rst index cf70be0d4b..5a4327dad6 100644 --- a/doc/src/Packages_details.rst +++ b/doc/src/Packages_details.rst @@ -311,6 +311,11 @@ rigid-body integrators with improved stability. **Author:** Oliver Henrich (University of Strathclyde, Glasgow). +**Install:** + +The CG-DNA package requires that also the `MOLECULE `_ and +`ASPHERE `_ packages are installed. + **Supporting info:** * src/CG-DNA: filenames -> commands diff --git a/src/CG-DNA/Install.sh b/src/CG-DNA/Install.sh index bf74a85aef..3c65fac787 100755 --- a/src/CG-DNA/Install.sh +++ b/src/CG-DNA/Install.sh @@ -26,10 +26,25 @@ action () { fi } +# the CG-DNA package cannot be used without +# the MOLECULE and ASPHERE packages installed. + +if (test $1 = 1) then + if (test ! -e ../bond_harmonic.cpp) then + echo "Must install MOLECULE package with CG-DNA" + exit 1 + fi + if (test ! -e ../fix_nve_asphere.cpp) then + echo "Must install ASPHERE package with CG-DNA" + exit 1 + fi +fi + + # list of files with dependcies -action atom_vec_oxdna.cpp atom_vec.h -action atom_vec_oxdna.h atom_vec.h +action atom_vec_oxdna.cpp +action atom_vec_oxdna.h action bond_oxdna_fene.cpp bond_fene.h action bond_oxdna2_fene.cpp bond_fene.h action bond_oxrna2_fene.cpp bond_fene.h From dc70f97ad48742c7891cc1375c7ffb454815be58 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Thu, 15 Jul 2021 15:44:35 -0400 Subject: [PATCH 13/14] restore changes from upstream that were undone by incorrectly resolving merge conflicts --- doc/src/atom_style.rst | 27 ++++++++++++--------- doc/src/bond_oxdna.rst | 8 +++--- doc/src/pair_oxdna.rst | 8 +++--- doc/src/pair_oxdna2.rst | 8 +++--- doc/src/pair_oxrna2.rst | 8 +++--- doc/utils/sphinx-config/false_positives.txt | 11 ++++++--- src/.gitignore | 12 ++++++--- 7 files changed, 48 insertions(+), 34 deletions(-) diff --git a/doc/src/atom_style.rst b/doc/src/atom_style.rst index 4689895007..4d880077d1 100644 --- a/doc/src/atom_style.rst +++ b/doc/src/atom_style.rst @@ -199,10 +199,10 @@ The *oxdna* style is for coarse-grained nucleotides and stores the 3'-to-5' polarity of the nucleotide strand, which is set through the bond topology in the data file. The first (second) atom in a bond definition is understood to point towards the 3'-end (5'-end) -of the strand. Note that this style is part of the USER-CGDNA package. +of the strand. Note that this style is part of the CG-DNA package. The *dpd* style is for dissipative particle dynamics (DPD) particles. -Note that it is part of the USER-DPD package, and is not for use with +Note that it is part of the DPD-REACT package, and is not for use with the :doc:`pair_style dpd or dpd/stat ` commands, which can simply use atom_style atomic. Atom_style dpd extends DPD particle properties with internal temperature (dpdTheta), internal conductive @@ -327,14 +327,16 @@ styles take the same arguments and should produce the same results, except for round-off and precision issues. Note that other acceleration packages in LAMMPS, specifically the GPU, -USER-INTEL, USER-OMP, and OPT packages do not use accelerated atom +INTEL, OPENMP, and OPT packages do not use accelerated atom styles. The accelerated styles are part of the KOKKOS package. They are only -enabled if LAMMPS was built with those packages. See the :doc:`Build package ` doc page for more info. +enabled if LAMMPS was built with those packages. See the :doc:`Build +package ` doc page for more info. You can specify the accelerated styles explicitly in your input script -by including their suffix, or you can use the :doc:`-suffix command-line switch ` when you invoke LAMMPS, or you can use the +by including their suffix, or you can use the :doc:`-suffix command-line +switch ` when you invoke LAMMPS, or you can use the :doc:`suffix ` command in your input script. See the :doc:`Speed packages ` doc page for more @@ -347,7 +349,8 @@ This command cannot be used after the simulation box is defined by a :doc:`read_data ` or :doc:`create_box ` command. Many of the styles listed above are only enabled if LAMMPS was built -with a specific package, as listed below. See the :doc:`Build package ` doc page for more info. +with a specific package, as listed below. See the :doc:`Build package +` doc page for more info. The *angle*\ , *bond*\ , *full*\ , *molecular*\ , and *template* styles are part of the MOLECULE package. @@ -360,14 +363,14 @@ The *dipole* style is part of the DIPOLE package. The *peri* style is part of the PERI package for Peridynamics. -The *oxdna* style is part of the USER-CGDNA package for coarse-grained simulation of DNA and RNA. +The *oxdna* style is part of the CG-DNA package for coarse-grained simulation of DNA and RNA. -The *electron* style is part of the USER-EFF package for :doc:`electronic force fields `. +The *electron* style is part of the EFF package for :doc:`electronic force fields `. -The *dpd* style is part of the USER-DPD package for dissipative +The *dpd* style is part of the DPD-REACT package for dissipative particle dynamics (DPD). -The *edpd*\ , *mdpd*\ , and *tdpd* styles are part of the USER-MESODPD package +The *edpd*\ , *mdpd*\ , and *tdpd* styles are part of the DPD-MESO package for energy-conserving dissipative particle dynamics (eDPD), many-body dissipative particle dynamics (mDPD), and transport dissipative particle dynamics (tDPD), respectively. @@ -375,11 +378,11 @@ dynamics (tDPD), respectively. The *sph* style is part of the SPH package for smoothed particle hydrodynamics (SPH). See `this PDF guide `_ to using SPH in LAMMPS. -The *mesont* style is part of the USER-MESONT package. +The *mesont* style is part of the MESONT package. The *spin* style is part of the SPIN package. -The *wavepacket* style is part of the USER-AWPMD package for the +The *wavepacket* style is part of the AWPMD package for the :doc:`antisymmetrized wave packet MD method `. Related commands diff --git a/doc/src/bond_oxdna.rst b/doc/src/bond_oxdna.rst index 4f87393aec..80153d52b9 100644 --- a/doc/src/bond_oxdna.rst +++ b/doc/src/bond_oxdna.rst @@ -86,16 +86,16 @@ commands: Example input and data files for DNA and RNA duplexes can be found in -examples/USER/cgdna/examples/oxDNA/ , /oxDNA2/ and /oxRNA2/. A simple python +examples/PACKAGES/cgdna/examples/oxDNA/ , /oxDNA2/ and /oxRNA2/. A simple python setup tool which creates single straight or helical DNA strands, DNA/RNA duplexes or arrays of DNA/RNA duplexes can be found in -examples/USER/cgdna/util/. +examples/PACKAGES/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxDNA/oxRNA publications. These are :ref:`(Ouldridge) ` and :ref:`(Ouldridge-DPhil) ` for oxDNA, @@ -110,7 +110,7 @@ Restrictions """""""""""" This bond style can only be used if LAMMPS was built with the -USER-CGDNA package and the MOLECULE and ASPHERE package. See the +CG-DNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands diff --git a/doc/src/pair_oxdna.rst b/doc/src/pair_oxdna.rst index 26479bccc6..38fb19a8b0 100644 --- a/doc/src/pair_oxdna.rst +++ b/doc/src/pair_oxdna.rst @@ -99,15 +99,15 @@ for a detailed description of the oxDNA force field. the bond topology in the data file. The first (second) atom in a bond definition is understood to point towards the 3'-end (5'-end) of the strand. -Example input and data files for DNA duplexes can be found in examples/USER/cgdna/examples/oxDNA/ and /oxDNA2/. +Example input and data files for DNA duplexes can be found in examples/PACKAGES/cgdna/examples/oxDNA/ and /oxDNA2/. A simple python setup tool which creates single straight or helical DNA strands, -DNA duplexes or arrays of DNA duplexes can be found in examples/USER/cgdna/util/. +DNA duplexes or arrays of DNA duplexes can be found in examples/PACKAGES/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxDNA publications :ref:`(Ouldridge) `, :ref:`(Ouldridge-DPhil) ` @@ -119,7 +119,7 @@ Restrictions """""""""""" These pair styles can only be used if LAMMPS was built with the -USER-CGDNA package and the MOLECULE and ASPHERE package. See the +CG-DNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands diff --git a/doc/src/pair_oxdna2.rst b/doc/src/pair_oxdna2.rst index 7f5a2642eb..3dce3c2d1b 100644 --- a/doc/src/pair_oxdna2.rst +++ b/doc/src/pair_oxdna2.rst @@ -108,15 +108,15 @@ and :ref:`(Ouldridge) ` for a detailed description of the oxDNA2 fo the bond topology in the data file. The first (second) atom in a bond definition is understood to point towards the 3'-end (5'-end) of the strand. -Example input and data files for DNA duplexes can be found in examples/USER/cgdna/examples/oxDNA/ and /oxDNA2/. +Example input and data files for DNA duplexes can be found in examples/PACKAGES/cgdna/examples/oxDNA/ and /oxDNA2/. A simple python setup tool which creates single straight or helical DNA strands, -DNA duplexes or arrays of DNA duplexes can be found in examples/USER/cgdna/util/. +DNA duplexes or arrays of DNA duplexes can be found in examples/PACKAGES/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxDNA2 publications :ref:`(Snodin) ` and :ref:`(Sulc) `. @@ -126,7 +126,7 @@ Restrictions """""""""""" These pair styles can only be used if LAMMPS was built with the -USER-CGDNA package and the MOLECULE and ASPHERE package. See the +CG-DNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands diff --git a/doc/src/pair_oxrna2.rst b/doc/src/pair_oxrna2.rst index 81c5562489..63a5c9308b 100644 --- a/doc/src/pair_oxrna2.rst +++ b/doc/src/pair_oxrna2.rst @@ -109,15 +109,15 @@ and :ref:`(Ouldridge) ` for a detailed description of the oxRNA2 fo the bond topology in the data file. The first (second) atom in a bond definition is understood to point towards the 3'-end (5'-end) of the strand. -Example input and data files for DNA duplexes can be found in examples/USER/cgdna/examples/oxDNA/ and /oxDNA2/. +Example input and data files for DNA duplexes can be found in examples/PACKAGES/cgdna/examples/oxDNA/ and /oxDNA2/. A simple python setup tool which creates single straight or helical DNA strands, -DNA duplexes or arrays of DNA duplexes can be found in examples/USER/cgdna/util/. +DNA duplexes or arrays of DNA duplexes can be found in examples/PACKAGES/cgdna/util/. Please cite :ref:`(Henrich) ` in any publication that uses this implementation. The article contains general information on the model, its implementation and performance as well as the structure of the data and input file. The preprint version of the article can be found -`here `_. +`here `_. Please cite also the relevant oxRNA2 publications :ref:`(Sulc1) ` and :ref:`(Sulc2) `. @@ -127,7 +127,7 @@ Restrictions """""""""""" These pair styles can only be used if LAMMPS was built with the -USER-CGDNA package and the MOLECULE and ASPHERE package. See the +CG-DNA package and the MOLECULE and ASPHERE package. See the :doc:`Build package ` doc page for more info. Related commands diff --git a/doc/utils/sphinx-config/false_positives.txt b/doc/utils/sphinx-config/false_positives.txt index 906ac54a42..846e08f501 100644 --- a/doc/utils/sphinx-config/false_positives.txt +++ b/doc/utils/sphinx-config/false_positives.txt @@ -1325,6 +1325,7 @@ hyperradius hyperspherical hysteretic hz +IAP Ibanez iatom ibar @@ -1647,6 +1648,8 @@ larentzos Larentzos Laroche lars +LATBOLTZ +latboltz latencies Latour latourr @@ -1797,6 +1800,8 @@ Lysogorskiy Lyulin lz Maaravi +MACHDYN +machdyn Mackay Mackrodt Macromolecules @@ -1891,8 +1896,7 @@ mdi mdpd mDPD meam -meamc -MEAMC +MEAM meamf meanDist mech @@ -2737,7 +2741,7 @@ README realtime reamin reax -REAXC +REAXFF ReaxFF rebo recursing @@ -2859,6 +2863,7 @@ Rossky rosybrown rotationally Rotenberg +Rothenburg Rovigatti royalblue rozero diff --git a/src/.gitignore b/src/.gitignore index 022785c00e..53d4f63276 100644 --- a/src/.gitignore +++ b/src/.gitignore @@ -52,7 +52,7 @@ /*_dielectric.cpp /*_dielectric.h /compute_efield_atom.cpp -/compute_efield_atom.j +/compute_efield_atom.h /superpose3d.h @@ -70,8 +70,8 @@ /meam*.h /meam*.cpp -/pair_meamc.cpp -/pair_meamc.h +/pair_meam.cpp +/pair_meam.h /compute_mliap.cpp /compute_mliap.h @@ -388,6 +388,8 @@ /compute_erotate_rigid.h /compute_event_displace.cpp /compute_event_displace.h +/compute_fabric.cpp +/compute_fabric.h /compute_fep.cpp /compute_fep.h /compute_force_tally.cpp @@ -1431,6 +1433,10 @@ /pair_thole.h /pair_buck_mdf.cpp /pair_buck_mdf.h +/pair_dpd.cpp +/pair_dpd.h +/pair_dpd_tstat.cpp +/pair_dpd_tstat.h /pair_dpd_ext.cpp /pair_dpd_ext.h /pair_dpd_ext_tstat.cpp From 637eef51b97a650177f020391690bb1c965ec79b Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Thu, 15 Jul 2021 15:45:01 -0400 Subject: [PATCH 14/14] reformat --- src/CG-DNA/atom_vec_oxdna.cpp | 16 +++++---------- src/CG-DNA/atom_vec_oxdna.h | 1 - src/CG-DNA/pair_oxdna2_excv.cpp | 34 +++++++++----------------------- src/CG-DNA/pair_oxdna2_excv.h | 5 +++-- src/CG-DNA/pair_oxdna_stk.cpp | 22 ++++++++++----------- src/CG-DNA/pair_oxrna2_dh.cpp | 28 ++++++-------------------- src/CG-DNA/pair_oxrna2_dh.h | 4 ++-- src/CG-DNA/pair_oxrna2_excv.cpp | 14 ------------- src/CG-DNA/pair_oxrna2_excv.h | 4 ++-- src/CG-DNA/pair_oxrna2_hbond.cpp | 9 --------- src/CG-DNA/pair_oxrna2_hbond.h | 2 +- 11 files changed, 39 insertions(+), 100 deletions(-) diff --git a/src/CG-DNA/atom_vec_oxdna.cpp b/src/CG-DNA/atom_vec_oxdna.cpp index 5990fa5dfc..65787a0d98 100644 --- a/src/CG-DNA/atom_vec_oxdna.cpp +++ b/src/CG-DNA/atom_vec_oxdna.cpp @@ -1,4 +1,3 @@ -// clang-format off /* ---------------------------------------------------------------------- LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator https://www.lammps.org/, Sandia National Laboratories @@ -13,6 +12,7 @@ ------------------------------------------------------------------------- */ #include "atom_vec_oxdna.h" + #include "atom.h" #include "comm.h" @@ -46,14 +46,10 @@ AtomVecOxdna::AtomVecOxdna(LAMMPS *lmp) : AtomVec(lmp) fields_data_vel = (char *) "id v"; setup_fields(); - } /* ---------------------------------------------------------------------- */ -AtomVecOxdna::~AtomVecOxdna() -{ - -} +AtomVecOxdna::~AtomVecOxdna() {} /* ---------------------------------------------------------------------- set local copies of all grow ptrs used by this class, except defaults @@ -80,8 +76,8 @@ void AtomVecOxdna::data_atom_post(int ilocal) store 5' partner to inform 3'->5' bond directionality ------------------------------------------------------------------------- */ -void AtomVecOxdna::data_bonds_post(int m, int num_bond, tagint atom1, - tagint atom2, tagint id_offset) +void AtomVecOxdna::data_bonds_post(int m, int num_bond, tagint atom1, tagint atom2, + tagint id_offset) { int n; tagint *id5p = atom->id5p; @@ -91,7 +87,5 @@ void AtomVecOxdna::data_bonds_post(int m, int num_bond, tagint atom1, atom2 += id_offset; } - if ((n = atom->map(atom1)) >= 0) { - id5p[n] = atom2; - } + if ((n = atom->map(atom1)) >= 0) { id5p[n] = atom2; } } diff --git a/src/CG-DNA/atom_vec_oxdna.h b/src/CG-DNA/atom_vec_oxdna.h index eb167e6859..f05f6d2013 100644 --- a/src/CG-DNA/atom_vec_oxdna.h +++ b/src/CG-DNA/atom_vec_oxdna.h @@ -35,7 +35,6 @@ class AtomVecOxdna : public AtomVec { private: tagint *id5p; - }; } // namespace LAMMPS_NS diff --git a/src/CG-DNA/pair_oxdna2_excv.cpp b/src/CG-DNA/pair_oxdna2_excv.cpp index 2197fceb76..cde2af65da 100644 --- a/src/CG-DNA/pair_oxdna2_excv.cpp +++ b/src/CG-DNA/pair_oxdna2_excv.cpp @@ -1,4 +1,3 @@ -// clang-format off /* ---------------------------------------------------------------------- LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator https://www.lammps.org/, Sandia National Laboratories @@ -19,34 +18,19 @@ using namespace LAMMPS_NS; -/* ---------------------------------------------------------------------- */ - -PairOxdna2Excv::PairOxdna2Excv(LAMMPS *lmp) : PairOxdnaExcv(lmp) -{ - -} - -/* ---------------------------------------------------------------------- */ - -PairOxdna2Excv::~PairOxdna2Excv() -{ - -} - /* ---------------------------------------------------------------------- compute vector COM-excluded volume interaction sites in oxDNA2 ------------------------------------------------------------------------- */ -void PairOxdna2Excv::compute_interaction_sites(double e1[3], double e2[3], - double /*e3*/[3], double rs[3], double rb[3]) +void PairOxdna2Excv::compute_interaction_sites(double e1[3], double e2[3], double /*e3*/[3], + double rs[3], double rb[3]) { - double d_cs_x=-0.34, d_cs_y=+0.3408, d_cb=+0.4; + double d_cs_x = -0.34, d_cs_y = +0.3408, d_cb = +0.4; - rs[0] = d_cs_x*e1[0] + d_cs_y*e2[0]; - rs[1] = d_cs_x*e1[1] + d_cs_y*e2[1]; - rs[2] = d_cs_x*e1[2] + d_cs_y*e2[2]; - - rb[0] = d_cb*e1[0]; - rb[1] = d_cb*e1[1]; - rb[2] = d_cb*e1[2]; + rs[0] = d_cs_x * e1[0] + d_cs_y * e2[0]; + rs[1] = d_cs_x * e1[1] + d_cs_y * e2[1]; + rs[2] = d_cs_x * e1[2] + d_cs_y * e2[2]; + rb[0] = d_cb * e1[0]; + rb[1] = d_cb * e1[1]; + rb[2] = d_cb * e1[2]; } diff --git a/src/CG-DNA/pair_oxdna2_excv.h b/src/CG-DNA/pair_oxdna2_excv.h index e5fc3a3a26..bc016534f0 100644 --- a/src/CG-DNA/pair_oxdna2_excv.h +++ b/src/CG-DNA/pair_oxdna2_excv.h @@ -26,8 +26,9 @@ namespace LAMMPS_NS { class PairOxdna2Excv : public PairOxdnaExcv { public: - PairOxdna2Excv(class LAMMPS *); - virtual ~PairOxdna2Excv(); + PairOxdna2Excv(class LAMMPS *lmp) : PairOxdnaExcv(lmp) {} + virtual ~PairOxdna2Excv() {} + virtual void compute_interaction_sites(double *, double *, double *, double *, double *); }; diff --git a/src/CG-DNA/pair_oxdna_stk.cpp b/src/CG-DNA/pair_oxdna_stk.cpp index 10fa0781f1..63439e3ac4 100644 --- a/src/CG-DNA/pair_oxdna_stk.cpp +++ b/src/CG-DNA/pair_oxdna_stk.cpp @@ -17,20 +17,20 @@ #include "pair_oxdna_stk.h" +#include "atom.h" +#include "atom_vec_ellipsoid.h" +#include "atom_vec_oxdna.h" +#include "comm.h" +#include "error.h" +#include "force.h" +#include "math_extra.h" +#include "memory.h" +#include "mf_oxdna.h" +#include "neighbor.h" + #include #include #include -#include "mf_oxdna.h" -#include "atom.h" -#include "comm.h" -#include "force.h" -#include "neighbor.h" -#include "memory.h" -#include "error.h" - -#include "atom_vec_ellipsoid.h" -#include "atom_vec_oxdna.h" -#include "math_extra.h" using namespace LAMMPS_NS; using namespace MFOxdna; diff --git a/src/CG-DNA/pair_oxrna2_dh.cpp b/src/CG-DNA/pair_oxrna2_dh.cpp index 9ebbabbd1a..f19dbb249b 100644 --- a/src/CG-DNA/pair_oxrna2_dh.cpp +++ b/src/CG-DNA/pair_oxrna2_dh.cpp @@ -1,4 +1,3 @@ -// clang-format off /* ---------------------------------------------------------------------- LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator https://www.lammps.org/, Sandia National Laboratories @@ -19,30 +18,15 @@ using namespace LAMMPS_NS; -/* ---------------------------------------------------------------------- */ - -PairOxrna2Dh::PairOxrna2Dh(LAMMPS *lmp) : PairOxdna2Dh(lmp) -{ - -} - -/* ---------------------------------------------------------------------- */ - -PairOxrna2Dh::~PairOxrna2Dh() -{ - -} - /* ---------------------------------------------------------------------- compute vector COM-sugar-phosphate backbone interaction site in oxRNA2 ------------------------------------------------------------------------- */ -void PairOxrna2Dh::compute_interaction_sites(double e1[3], double /*e2*/[3], - double e3[3], double r[3]) +void PairOxrna2Dh::compute_interaction_sites(double e1[3], double /*e2*/[3], double e3[3], + double r[3]) { - double d_cs_x=-0.4, d_cs_z=+0.2; - - r[0] = d_cs_x*e1[0] + d_cs_z*e3[0]; - r[1] = d_cs_x*e1[1] + d_cs_z*e3[1]; - r[2] = d_cs_x*e1[2] + d_cs_z*e3[2]; + double d_cs_x = -0.4, d_cs_z = +0.2; + r[0] = d_cs_x * e1[0] + d_cs_z * e3[0]; + r[1] = d_cs_x * e1[1] + d_cs_z * e3[1]; + r[2] = d_cs_x * e1[2] + d_cs_z * e3[2]; } diff --git a/src/CG-DNA/pair_oxrna2_dh.h b/src/CG-DNA/pair_oxrna2_dh.h index 1b66cd82ca..016eb5378b 100644 --- a/src/CG-DNA/pair_oxrna2_dh.h +++ b/src/CG-DNA/pair_oxrna2_dh.h @@ -26,8 +26,8 @@ namespace LAMMPS_NS { class PairOxrna2Dh : public PairOxdna2Dh { public: - PairOxrna2Dh(class LAMMPS *); - virtual ~PairOxrna2Dh(); + PairOxrna2Dh(class LAMMPS *) : PairOxdna2Dh(lmp) {} + virtual ~PairOxrna2Dh() {} virtual void compute_interaction_sites(double *, double *, double *, double *); }; diff --git a/src/CG-DNA/pair_oxrna2_excv.cpp b/src/CG-DNA/pair_oxrna2_excv.cpp index 0e0535f0a0..2c1e4ca89f 100644 --- a/src/CG-DNA/pair_oxrna2_excv.cpp +++ b/src/CG-DNA/pair_oxrna2_excv.cpp @@ -21,20 +21,6 @@ using namespace LAMMPS_NS; -/* ---------------------------------------------------------------------- */ - -PairOxrna2Excv::PairOxrna2Excv(LAMMPS *lmp) : PairOxdnaExcv(lmp) -{ - -} - -/* ---------------------------------------------------------------------- */ - -PairOxrna2Excv::~PairOxrna2Excv() -{ - -} - /* ---------------------------------------------------------------------- compute vector COM-excluded volume interaction sites in oxRNA2 ------------------------------------------------------------------------- */ diff --git a/src/CG-DNA/pair_oxrna2_excv.h b/src/CG-DNA/pair_oxrna2_excv.h index 90537f865e..8e671f0b7a 100644 --- a/src/CG-DNA/pair_oxrna2_excv.h +++ b/src/CG-DNA/pair_oxrna2_excv.h @@ -26,8 +26,8 @@ namespace LAMMPS_NS { class PairOxrna2Excv : public PairOxdnaExcv { public: - PairOxrna2Excv(class LAMMPS *); - virtual ~PairOxrna2Excv(); + PairOxrna2Excv(class LAMMPS *) : PairOxdnaExcv(lmp) {} + virtual ~PairOxrna2Excv() {} virtual void compute_interaction_sites(double *, double *, double *, double *, double *); }; diff --git a/src/CG-DNA/pair_oxrna2_hbond.cpp b/src/CG-DNA/pair_oxrna2_hbond.cpp index 31f50816aa..dfa9997af3 100644 --- a/src/CG-DNA/pair_oxrna2_hbond.cpp +++ b/src/CG-DNA/pair_oxrna2_hbond.cpp @@ -1,4 +1,3 @@ -// clang-format off /* ---------------------------------------------------------------------- LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator https://www.lammps.org/, Sandia National Laboratories @@ -48,12 +47,4 @@ PairOxrna2Hbond::PairOxrna2Hbond(LAMMPS *lmp) : PairOxdnaHbond(lmp) alpha_hb[3][1] = 1.00000; alpha_hb[3][2] = 0.58655; alpha_hb[3][3] = 1.00000; - -} - -/* ---------------------------------------------------------------------- */ - -PairOxrna2Hbond::~PairOxrna2Hbond() -{ - } diff --git a/src/CG-DNA/pair_oxrna2_hbond.h b/src/CG-DNA/pair_oxrna2_hbond.h index ed96bda744..fe213c5615 100644 --- a/src/CG-DNA/pair_oxrna2_hbond.h +++ b/src/CG-DNA/pair_oxrna2_hbond.h @@ -27,7 +27,7 @@ namespace LAMMPS_NS { class PairOxrna2Hbond : public PairOxdnaHbond { public: PairOxrna2Hbond(class LAMMPS *); - virtual ~PairOxrna2Hbond(); + virtual ~PairOxrna2Hbond() {} }; } // namespace LAMMPS_NS