From 7cf9ef42a2baaccda713ae00153126eacebd92e4 Mon Sep 17 00:00:00 2001
From: Oliver Henrich <ohenrich@users.noreply.github.com>
Date: Fri, 13 Sep 2019 20:06:09 +0100
Subject: [PATCH 01/21] Enabled unique base-pairing

---
 src/USER-CGDNA/pair_oxdna_hbond.cpp | 21 ++++++++++++++++-----
 src/USER-CGDNA/pair_oxdna_stk.cpp   | 26 +++++++++++++++++++-------
 2 files changed, 35 insertions(+), 12 deletions(-)

diff --git a/src/USER-CGDNA/pair_oxdna_hbond.cpp b/src/USER-CGDNA/pair_oxdna_hbond.cpp
index e9852d0e38..97cb2b7df0 100644
--- a/src/USER-CGDNA/pair_oxdna_hbond.cpp
+++ b/src/USER-CGDNA/pair_oxdna_hbond.cpp
@@ -616,7 +616,7 @@ void PairOxdnaHbond::coeff(int narg, char **arg)
   if (narg != 27) error->all(FLERR,"Incorrect args for pair coefficients in oxdna/hbond");
   if (!allocated) allocate();
 
-  int ilo,ihi,jlo,jhi;
+  int ilo,ihi,jlo,jhi,imod4,jmod4;
   force->bounds(FLERR,arg[0],atom->ntypes,ilo,ihi);
   force->bounds(FLERR,arg[1],atom->ntypes,jlo,jhi);
 
@@ -729,8 +729,13 @@ void PairOxdnaHbond::coeff(int narg, char **arg)
   for (int i = ilo; i <= ihi; i++) {
     for (int j = MAX(jlo,i); j <= jhi; j++) {
 
+      imod4 = i%4;
+      if (imod4 == 0) imod4 = 4;
+      jmod4 = j%4;
+      if (jmod4 == 0) jmod4 = 4;
+
       epsilon_hb[i][j] = epsilon_hb_one;
-      if (seqdepflag) epsilon_hb[i][j] *= alpha_hb[i-1][j-1];
+      if (seqdepflag) epsilon_hb[i][j] *= alpha_hb[imod4-1][jmod4-1];
       a_hb[i][j] = a_hb_one;
       cut_hb_0[i][j] = cut_hb_0_one;
       cut_hb_c[i][j] = cut_hb_c_one;
@@ -741,7 +746,7 @@ void PairOxdnaHbond::coeff(int narg, char **arg)
       b_hb_lo[i][j] = b_hb_lo_one;
       b_hb_hi[i][j] = b_hb_hi_one;
       shift_hb[i][j] = shift_hb_one;
-      if (seqdepflag) shift_hb[i][j] *= alpha_hb[i-1][j-1];
+      if (seqdepflag) shift_hb[i][j] *= alpha_hb[imod4-1][jmod4-1];
 
       a_hb1[i][j] = a_hb1_one;
       theta_hb1_0[i][j] = theta_hb1_0_one;
@@ -820,6 +825,7 @@ void PairOxdnaHbond::init_list(int id, NeighList *ptr)
 
 double PairOxdnaHbond::init_one(int i, int j)
 {
+  int imod4,jmod4;
 
   if (setflag[i][j] == 0) {
     error->all(FLERR,"Coefficient mixing not defined in oxDNA");
@@ -828,8 +834,13 @@ double PairOxdnaHbond::init_one(int i, int j)
     error->all(FLERR,"Offset not supported in oxDNA");
   }
 
+  imod4 = i%4;
+  if (imod4 == 0) imod4 = 4;
+  jmod4 = j%4;
+  if (jmod4 == 0) jmod4 = 4;
+
   if (seqdepflag) {
-    epsilon_hb[j][i] = epsilon_hb[i][j] / alpha_hb[i-1][j-1] * alpha_hb[j-1][i-1];
+    epsilon_hb[j][i] = epsilon_hb[i][j] / alpha_hb[imod4-1][jmod4-1] * alpha_hb[jmod4-1][imod4-1];
   }
   else {
     epsilon_hb[j][i] = epsilon_hb[i][j];
@@ -844,7 +855,7 @@ double PairOxdnaHbond::init_one(int i, int j)
   cut_hb_lc[j][i] = cut_hb_lc[i][j];
   cut_hb_hc[j][i] = cut_hb_hc[i][j];
   if (seqdepflag) {
-    shift_hb[j][i] = shift_hb[i][j] / alpha_hb[i-1][j-1] * alpha_hb[j-1][i-1];
+    shift_hb[j][i] = shift_hb[i][j] / alpha_hb[imod4-1][jmod4-1] * alpha_hb[jmod4-1][imod4-1];
   }
   else {
     shift_hb[j][i] = shift_hb[i][j];
diff --git a/src/USER-CGDNA/pair_oxdna_stk.cpp b/src/USER-CGDNA/pair_oxdna_stk.cpp
index 3d0c4e9136..bab5119b12 100644
--- a/src/USER-CGDNA/pair_oxdna_stk.cpp
+++ b/src/USER-CGDNA/pair_oxdna_stk.cpp
@@ -761,7 +761,7 @@ void PairOxdnaStk::coeff(int narg, char **arg)
   if (narg != 24) error->all(FLERR,"Incorrect args for pair coefficients in oxdna/stk");
   if (!allocated) allocate();
 
-  int ilo,ihi,jlo,jhi;
+  int ilo,ihi,jlo,jhi,imod4,jmod4;
   force->bounds(FLERR,arg[0],atom->ntypes,ilo,ihi);
   force->bounds(FLERR,arg[1],atom->ntypes,jlo,jhi);
 
@@ -852,16 +852,21 @@ void PairOxdnaStk::coeff(int narg, char **arg)
   dtheta_st6_c_one = 1/(a_st6_one*dtheta_st6_ast_one);
 
   b_st1_one = a_st1_one*a_st1_one*cosphi_st1_ast_one*cosphi_st1_ast_one/(1-a_st1_one*cosphi_st1_ast_one*cosphi_st1_ast_one);
-  cosphi_st1_c_one=1/(a_st1_one*cosphi_st1_ast_one);
+  cosphi_st1_c_one = 1/(a_st1_one*cosphi_st1_ast_one);
 
   b_st2_one = a_st2_one*a_st2_one*cosphi_st2_ast_one*cosphi_st2_ast_one/(1-a_st2_one*cosphi_st2_ast_one*cosphi_st2_ast_one);
-  cosphi_st2_c_one=1/(a_st2_one*cosphi_st2_ast_one);
+  cosphi_st2_c_one = 1/(a_st2_one*cosphi_st2_ast_one);
 
   for (int i = ilo; i <= ihi; i++) {
     for (int j = MAX(jlo,i); j <= jhi; j++) {
 
+      imod4 = i%4;
+      if (imod4 == 0) imod4 = 4;
+      jmod4 = j%4;
+      if (jmod4 == 0) jmod4 = 4;
+
       epsilon_st[i][j] = epsilon_st_one;
-      if (seqdepflag) epsilon_st[i][j] *= eta_st[i-1][j-1];
+      if (seqdepflag) epsilon_st[i][j] *= eta_st[imod4-1][jmod4-1];
       a_st[i][j] = a_st_one;
       cut_st_0[i][j] = cut_st_0_one;
       cut_st_c[i][j] = cut_st_c_one;
@@ -872,7 +877,7 @@ void PairOxdnaStk::coeff(int narg, char **arg)
       b_st_lo[i][j] = b_st_lo_one;
       b_st_hi[i][j] = b_st_hi_one;
       shift_st[i][j] = shift_st_one;
-      if (seqdepflag) shift_st[i][j] *= eta_st[i-1][j-1];
+      if (seqdepflag) shift_st[i][j] *= eta_st[imod4-1][jmod4-1];
 
       a_st4[i][j] = a_st4_one;
       theta_st4_0[i][j] = theta_st4_0_one;
@@ -944,6 +949,8 @@ void PairOxdnaStk::init_list(int id, NeighList *ptr)
 double PairOxdnaStk::init_one(int i, int j)
 {
 
+  int imod4,jmod4;
+
   if (setflag[i][j] == 0) {
     error->all(FLERR,"Coefficient mixing not defined in oxDNA");
   }
@@ -951,8 +958,13 @@ double PairOxdnaStk::init_one(int i, int j)
     error->all(FLERR,"Offset not supported in oxDNA");
   }
 
+  imod4 = i%4;
+  if (imod4 == 0) imod4 = 4;
+  jmod4 = j%4;
+  if (jmod4 == 0) jmod4 = 4;
+
   if (seqdepflag) {
-    epsilon_st[j][i] = epsilon_st[i][j]  / eta_st[i-1][j-1] * eta_st[j-1][i-1];
+    epsilon_st[j][i] = epsilon_st[i][j]  / eta_st[imod4-1][jmod4-1] * eta_st[jmod4-1][imod4-1];
   }
   else {
     epsilon_st[j][i] = epsilon_st[i][j];
@@ -967,7 +979,7 @@ double PairOxdnaStk::init_one(int i, int j)
   cut_st_lc[j][i] = cut_st_lc[i][j];
   cut_st_hc[j][i] = cut_st_hc[i][j];
   if (seqdepflag) {
-    shift_st[j][i] = shift_st[i][j] / eta_st[i-1][j-1] * eta_st[j-1][i-1];
+    shift_st[j][i] = shift_st[i][j] / eta_st[imod4-1][jmod4-1] * eta_st[jmod4-1][imod4-1];
   }
   else {
     shift_st[j][i] = shift_st[i][j];

From 7d1cd63e1da2eabeae6f552083eefa2dd6fbf103 Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Thu, 17 Oct 2019 09:46:18 -0400
Subject: [PATCH 02/21] added a safe fread variant with error checking.

---
 src/utils.cpp | 23 +++++++++++++++++++++++
 src/utils.h   | 15 +++++++++++++++
 2 files changed, 38 insertions(+)

diff --git a/src/utils.cpp b/src/utils.cpp
index 5e53a3a09d..8cfdca5bbf 100644
--- a/src/utils.cpp
+++ b/src/utils.cpp
@@ -127,6 +127,29 @@ void utils::sfgets(const char *srcname, int srcline, char *s, int size,
   return;
 }
 
+/* like fread() but aborts with an error or EOF is encountered */
+void sfread(const char *srcname, int srcline, void *s, size_t size,
+                size_t num, FILE *fp, const char *filename, Error *error)
+{
+  size_t rv = fread(s,size,num,fp);
+  if (rv != num) { // something went wrong
+    std::string errmsg;
+
+    if (feof(fp)) {
+      errmsg = "Unexpected end of file while reading file '";
+    } else if (ferror(fp)) {
+      errmsg = "Unexpected error while reading file '";
+    } else {
+      errmsg = "Unexpected short read while reading file '";
+    }
+    errmsg += filename;
+    errmsg += "'";
+
+    if (error) error->one(srcname,srcline,errmsg.c_str());
+  }
+  return;
+}
+
 /* ------------------------------------------------------------------ */
 
 std::string utils::check_packages_for_style(std::string style,
diff --git a/src/utils.h b/src/utils.h
index 5f71bfae76..5fea9bc01a 100644
--- a/src/utils.h
+++ b/src/utils.h
@@ -69,6 +69,21 @@ namespace LAMMPS_NS {
     void sfgets(const char *srcname, int srcline, char *s, int size,
                 FILE *fp, const char *filename, Error *error);
 
+    /** \brief safe wrapper around fread() which aborts on errors
+     *  or EOF and prints a suitable error message to help debugging
+     *
+     *  \param srcname  name of the calling source file (from FLERR macro)
+     *  \param srcline  line in the calling source file (from FLERR macro)
+     *  \param s        buffer for storing the result of fread()
+     *  \param size     size of data elements read by fread()
+     *  \param num      number of data elements read by fread()
+     *  \param fp       file pointer used by fread()
+     *  \param filename file name associated with fp (for error message)
+     *  \param error    pointer to Error class instance (for abort)
+     */
+    void sfread(const char *srcname, int srcline, void *s, size_t size,
+                size_t num, FILE *fp, const char *filename, Error *error);
+
     /** \brief Report if a requested style is in a package or may have a typo
      *
      *  \param style type of style that is to be checked for

From d1581f20a9ffd7b1c56b0ef482061bb3bee0972a Mon Sep 17 00:00:00 2001
From: Oliver Henrich <ohenrich@users.noreply.github.com>
Date: Thu, 17 Oct 2019 15:26:32 +0100
Subject: [PATCH 03/21] Modified initialisation of sequence-dependent stacking
 and h-bonding strength

---
 src/USER-CGDNA/pair_oxdna_hbond.cpp | 32 +++++++++++++++++++++--------
 src/USER-CGDNA/pair_oxdna_hbond.h   |  1 +
 src/USER-CGDNA/pair_oxdna_stk.cpp   | 32 +++++++++++++++++++++--------
 src/USER-CGDNA/pair_oxdna_stk.h     |  1 +
 4 files changed, 50 insertions(+), 16 deletions(-)

diff --git a/src/USER-CGDNA/pair_oxdna_hbond.cpp b/src/USER-CGDNA/pair_oxdna_hbond.cpp
index 97cb2b7df0..3159e51ede 100644
--- a/src/USER-CGDNA/pair_oxdna_hbond.cpp
+++ b/src/USER-CGDNA/pair_oxdna_hbond.cpp
@@ -32,20 +32,36 @@
 using namespace LAMMPS_NS;
 using namespace MFOxdna;
 
-// sequence-specific base-pairing strength
-// A:0 C:1 G:2 T:3, 5'- (i,j) -3'
-static const double alpha_hb[4][4] = 
-{{1.00000,1.00000,1.00000,0.82915},
- {1.00000,1.00000,1.15413,1.00000},
- {1.00000,1.15413,1.00000,1.00000},
- {0.82915,1.00000,1.00000,1.00000}};
-
 /* ---------------------------------------------------------------------- */
 
 PairOxdnaHbond::PairOxdnaHbond(LAMMPS *lmp) : Pair(lmp)
 {
   single_enable = 0;
   writedata = 1;
+
+  // sequence-specific base-pairing strength
+  // A:0 C:1 G:2 T:3, 5'- [i][j] -3'
+   
+  alpha_hb[0][0] = 1.00000;
+  alpha_hb[0][1] = 1.00000;
+  alpha_hb[0][2] = 1.00000;
+  alpha_hb[0][3] = 0.82915;
+
+  alpha_hb[1][0] = 1.00000;
+  alpha_hb[1][1] = 1.00000;
+  alpha_hb[1][2] = 1.15413;
+  alpha_hb[1][3] = 1.00000;
+
+  alpha_hb[2][0] = 1.00000;
+  alpha_hb[2][1] = 1.15413;
+  alpha_hb[2][2] = 1.00000;
+  alpha_hb[2][3] = 1.00000;
+
+  alpha_hb[3][0] = 0.82915;
+  alpha_hb[3][1] = 1.00000;
+  alpha_hb[3][2] = 1.00000;
+  alpha_hb[3][3] = 1.00000;
+
 }
 
 /* ---------------------------------------------------------------------- */
diff --git a/src/USER-CGDNA/pair_oxdna_hbond.h b/src/USER-CGDNA/pair_oxdna_hbond.h
index 028853a087..97098f6aa5 100644
--- a/src/USER-CGDNA/pair_oxdna_hbond.h
+++ b/src/USER-CGDNA/pair_oxdna_hbond.h
@@ -45,6 +45,7 @@ class PairOxdnaHbond : public Pair {
 
  protected:
   // h-bonding interaction
+  double alpha_hb[4][4];
   double **epsilon_hb, **a_hb, **cut_hb_0, **cut_hb_c, **cut_hb_lo, **cut_hb_hi;
   double **cut_hb_lc, **cut_hb_hc, **b_hb_lo, **b_hb_hi, **shift_hb;
   double **cutsq_hb_hc;
diff --git a/src/USER-CGDNA/pair_oxdna_stk.cpp b/src/USER-CGDNA/pair_oxdna_stk.cpp
index bab5119b12..192a6df644 100644
--- a/src/USER-CGDNA/pair_oxdna_stk.cpp
+++ b/src/USER-CGDNA/pair_oxdna_stk.cpp
@@ -32,20 +32,36 @@
 using namespace LAMMPS_NS;
 using namespace MFOxdna;
 
-// sequence-specific stacking strength
-// A:0 C:1 G:2 T:3, 5'- (i,j) -3'
-static const double eta_st[4][4] =
-{{1.11960,1.00852,0.96950,0.99632},
- {1.01889,0.97804,1.02681,0.96950},
- {0.98169,1.05913,0.97804,1.00852},
- {0.94694,0.98169,1.01889,0.96383}};
-
 /* ---------------------------------------------------------------------- */
 
 PairOxdnaStk::PairOxdnaStk(LAMMPS *lmp) : Pair(lmp)
 {
   single_enable = 0;
   writedata = 1;
+
+  // sequence-specific stacking strength
+  // A:0 C:1 G:2 T:3, 5'- [i][j] -3'
+
+  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] = 1.01889;
+  eta_st[1][1] = 0.97804;
+  eta_st[1][2] = 1.02681;
+  eta_st[1][3] = 0.96950;
+
+  eta_st[2][0] = 0.98169;
+  eta_st[2][1] = 1.05913;
+  eta_st[2][2] = 0.97804;
+  eta_st[2][3] = 1.00852;
+
+  eta_st[3][0] = 0.94694;
+  eta_st[3][1] = 0.98169;
+  eta_st[3][2] = 1.01889;
+  eta_st[3][3] = 0.96383;
+
 }
 
 /* ---------------------------------------------------------------------- */
diff --git a/src/USER-CGDNA/pair_oxdna_stk.h b/src/USER-CGDNA/pair_oxdna_stk.h
index 581e87f4b2..7f38cc0899 100644
--- a/src/USER-CGDNA/pair_oxdna_stk.h
+++ b/src/USER-CGDNA/pair_oxdna_stk.h
@@ -45,6 +45,7 @@ class PairOxdnaStk : public Pair {
 
  protected:
   // stacking interaction
+  double eta_st[4][4];
   double stacking_strength(double, double, double);
   double **epsilon_st, **a_st, **cut_st_0, **cut_st_c;
   double **cut_st_lo, **cut_st_hi;

From 68dc2a7966715508e81cf16418748cb173501d17 Mon Sep 17 00:00:00 2001
From: Oliver Henrich <ohenrich@users.noreply.github.com>
Date: Thu, 17 Oct 2019 16:06:06 +0100
Subject: [PATCH 04/21] Added description of quasi-unique base pairing

---
 doc/src/pair_oxdna.txt  | 9 ++++++---
 doc/src/pair_oxdna2.txt | 9 ++++++---
 2 files changed, 12 insertions(+), 6 deletions(-)

diff --git a/doc/src/pair_oxdna.txt b/doc/src/pair_oxdna.txt
index dfcd93c9a8..8f3f9933e6 100644
--- a/doc/src/pair_oxdna.txt
+++ b/doc/src/pair_oxdna.txt
@@ -23,7 +23,7 @@ style1 = {hybrid/overlay oxdna/excv oxdna/stk oxdna/hbond oxdna/xstk oxdna/coaxs
 style2 = {oxdna/excv} or {oxdna/stk} or {oxdna/hbond} or {oxdna/xstk} or {oxdna/coaxstk}
 args = list of arguments for these particular styles :ul
 
-  {oxdna/stk} args = seq T xi kappa 6.0 0.4 0.9 0.32 0.6 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65
+  {oxdna/stk} args = seq T xi kappa 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
     seq = seqav (for average sequence stacking strength) or seqdep (for sequence-dependent stacking strength)
     T = temperature (oxDNA units, 0.1 = 300 K)
     xi = temperature-independent coefficient in stacking strength
@@ -36,7 +36,7 @@ args = list of arguments for these particular styles :ul
 
 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     seqdep 0.1 1.3448 2.6568 6.0 0.4 0.9 0.32 0.6 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     seqdep 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   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 oxdna/hbond   seqdep 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   seqdep 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
@@ -51,7 +51,10 @@ excluded volume interaction {oxdna/excv}, the stacking {oxdna/stk}, cross-stacki
 and coaxial stacking interaction {oxdna/coaxstk} as well
 as the hydrogen-bonding interaction {oxdna/hbond} between complementary pairs of nucleotides on
 opposite strands. Average sequence or sequence-dependent stacking and base-pairing strengths
-are supported "(Sulc)"_#Sulc1.
+are supported "(Sulc)"_#Sulc1. Quasi-unique base-pairing between nucleotides can be achieved by using 
+more complementary pairs of atom types like 5-8 and 6-7, 9-12 and 10-11, 13-16 and 14-15, etc. 
+This prevents the hybridization of in principle complementary bases within Ntypes/4 bases 
+up and down along the backbone.
 
 The exact functional form of the pair styles is rather complex.
 The individual potentials consist of products of modulation factors,
diff --git a/doc/src/pair_oxdna2.txt b/doc/src/pair_oxdna2.txt
index 35e59ac9f5..64a686d5d9 100644
--- a/doc/src/pair_oxdna2.txt
+++ b/doc/src/pair_oxdna2.txt
@@ -24,7 +24,7 @@ style1 = {hybrid/overlay oxdna2/excv oxdna2/stk oxdna2/hbond oxdna2/xstk oxdna2/
 style2 = {oxdna2/excv} or {oxdna2/stk} or {oxdna2/hbond} or {oxdna2/xstk} or {oxdna2/coaxstk} or {oxdna2/dh}
 args = list of arguments for these particular styles :ul
 
-  {oxdna2/stk} args = seq T xi kappa 6.0 0.4 0.9 0.32 0.6 1.3 0 0.8 0.9 0 0.95 0.9 0 0.95 2.0 0.65 2.0 0.65
+  {oxdna2/stk} args = seq T xi kappa 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
     seq = seqav (for average sequence stacking strength) or seqdep (for sequence-dependent stacking strength)
     T = temperature (oxDNA units, 0.1 = 300 K)
     xi = temperature-independent coefficient in stacking strength
@@ -41,7 +41,7 @@ args = list of arguments for these particular styles :ul
 
 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 0.1 1.3523 2.6717 6.0 0.4 0.9 0.32 0.6 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
@@ -57,7 +57,10 @@ excluded volume interaction {oxdna2/excv}, the stacking {oxdna2/stk}, cross-stac
 and coaxial stacking interaction {oxdna2/coaxstk}, electrostatic Debye-Hueckel interaction {oxdna2/dh}
 as well as the hydrogen-bonding interaction {oxdna2/hbond} between complementary pairs of nucleotides on
 opposite strands. Average sequence or sequence-dependent stacking and base-pairing strengths
-are supported "(Sulc)"_#Sulc2.
+are supported "(Sulc)"_#Sulc2. Quasi-unique base-pairing between nucleotides can be achieved by using 
+more complementary pairs of atom types like 5-8 and 6-7, 9-12 and 10-11, 13-16 and 14-15, etc. 
+This prevents the hybridization of in principle complementary bases within Ntypes/4 bases 
+up and down along the backbone.
 
 The exact functional form of the pair styles is rather complex.
 The individual potentials consist of products of modulation factors,

From b29a96203233bc73c74979b41214deeb873ad42e Mon Sep 17 00:00:00 2001
From: Oliver Henrich <ohenrich@users.noreply.github.com>
Date: Thu, 17 Oct 2019 16:16:28 +0100
Subject: [PATCH 05/21] Corrected r_stk_high coefficient

---
 examples/USER/cgdna/examples/oxDNA/duplex1/in.duplex1  | 2 +-
 examples/USER/cgdna/examples/oxDNA/duplex2/in.duplex2  | 2 +-
 examples/USER/cgdna/examples/oxDNA2/duplex1/in.duplex1 | 6 +++---
 examples/USER/cgdna/examples/oxDNA2/duplex2/in.duplex2 | 7 ++++---
 examples/USER/cgdna/examples/oxDNA2/duplex3/in.duplex3 | 6 +++---
 5 files changed, 12 insertions(+), 11 deletions(-)

diff --git a/examples/USER/cgdna/examples/oxDNA/duplex1/in.duplex1 b/examples/USER/cgdna/examples/oxDNA/duplex1/in.duplex1
index 34e17380af..254c551f4e 100644
--- a/examples/USER/cgdna/examples/oxDNA/duplex1/in.duplex1
+++ b/examples/USER/cgdna/examples/oxDNA/duplex1/in.duplex1
@@ -31,7 +31,7 @@ bond_coeff * 2.0 0.25 0.7525
 # 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 0.6 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 ${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/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
diff --git a/examples/USER/cgdna/examples/oxDNA/duplex2/in.duplex2 b/examples/USER/cgdna/examples/oxDNA/duplex2/in.duplex2
index d80e7bbc0e..143e20c70b 100644
--- a/examples/USER/cgdna/examples/oxDNA/duplex2/in.duplex2
+++ b/examples/USER/cgdna/examples/oxDNA/duplex2/in.duplex2
@@ -31,7 +31,7 @@ bond_coeff * 2.0 0.25 0.7525
 # 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 0.6 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 ${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/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
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex1/in.duplex1 b/examples/USER/cgdna/examples/oxDNA2/duplex1/in.duplex1
index 9ff9d3c4db..0f7fd1c0db 100644
--- a/examples/USER/cgdna/examples/oxDNA2/duplex1/in.duplex1
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex1/in.duplex1
@@ -24,14 +24,14 @@ set atom * mass 3.1575
 
 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
 
-# oxDNA pair interactions
+# 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 0.6 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 ${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/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
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex2/in.duplex2 b/examples/USER/cgdna/examples/oxDNA2/duplex2/in.duplex2
index 3850dfcedf..5f2fde4b12 100644
--- a/examples/USER/cgdna/examples/oxDNA2/duplex2/in.duplex2
+++ b/examples/USER/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
+
 units lj
 
 dimension 3
@@ -23,14 +24,14 @@ set atom * mass 3.1575
 
 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
 
-# oxDNA pair interactions
+# 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 0.6 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 ${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/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
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex3/in.duplex3 b/examples/USER/cgdna/examples/oxDNA2/duplex3/in.duplex3
index 51d6334f55..fd75a6fc3f 100644
--- a/examples/USER/cgdna/examples/oxDNA2/duplex3/in.duplex3
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex3/in.duplex3
@@ -24,14 +24,14 @@ set atom * mass 1.0
 
 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
 
-# oxDNA pair interactions
+# 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 0.6 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 ${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/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

From cad62930787efa713c0e9bf5106626f674545174 Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Thu, 17 Oct 2019 11:29:08 -0400
Subject: [PATCH 06/21] use new utils::sfread() utility function in several
 classes

---
 src/angle_hybrid.cpp        |  7 ++++---
 src/angle_zero.cpp          |  3 ++-
 src/bond_hybrid.cpp         |  7 ++++---
 src/bond_zero.cpp           |  3 ++-
 src/dihedral_hybrid.cpp     |  8 +++++---
 src/group.cpp               |  7 ++++---
 src/improper_hybrid.cpp     |  7 ++++---
 src/modify.cpp              | 26 +++++++++++++-------------
 src/pair_beck.cpp           | 19 ++++++++++---------
 src/pair_born.cpp           | 23 ++++++++++++-----------
 src/pair_born_coul_dsf.cpp  | 25 +++++++++++++------------
 src/pair_born_coul_wolf.cpp | 25 +++++++++++++------------
 src/pair_buck.cpp           | 19 ++++++++++---------
 src/pair_buck_coul_cut.cpp  | 23 ++++++++++++-----------
 src/pair_coul_cut.cpp       | 11 ++++++-----
 src/pair_coul_debye.cpp     |  9 +++++----
 src/pair_coul_dsf.cpp       | 11 ++++++-----
 src/pair_coul_wolf.cpp      | 11 ++++++-----
 src/pair_dpd.cpp            | 17 +++++++++--------
 src/pair_dpd_tstat.cpp      |  7 ++++---
 src/utils.cpp               | 26 ++++++++++++++++++++++++--
 src/utils.h                 |  2 +-
 22 files changed, 169 insertions(+), 127 deletions(-)

diff --git a/src/angle_hybrid.cpp b/src/angle_hybrid.cpp
index 6ffbc19d08..b8535e692e 100644
--- a/src/angle_hybrid.cpp
+++ b/src/angle_hybrid.cpp
@@ -21,6 +21,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -334,7 +335,7 @@ void AngleHybrid::write_restart(FILE *fp)
 void AngleHybrid::read_restart(FILE *fp)
 {
   int me = comm->me;
-  if (me == 0) fread(&nstyles,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&nstyles,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&nstyles,1,MPI_INT,0,world);
   styles = new Angle*[nstyles];
   keywords = new char*[nstyles];
@@ -343,10 +344,10 @@ void AngleHybrid::read_restart(FILE *fp)
 
   int n,dummy;
   for (int m = 0; m < nstyles; m++) {
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     keywords[m] = new char[n];
-    if (me == 0) fread(keywords[m],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,keywords[m],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(keywords[m],n,MPI_CHAR,0,world);
     styles[m] = force->new_angle(keywords[m],0,dummy);
     styles[m]->read_restart_settings(fp);
diff --git a/src/angle_zero.cpp b/src/angle_zero.cpp
index 3c92b852b3..5da8e9d5bc 100644
--- a/src/angle_zero.cpp
+++ b/src/angle_zero.cpp
@@ -24,6 +24,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -128,7 +129,7 @@ void AngleZero::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&theta0[1],atom->nangletypes,MPI_DOUBLE,0,world);
 
diff --git a/src/bond_hybrid.cpp b/src/bond_hybrid.cpp
index 2b365014cf..c66d2c1425 100644
--- a/src/bond_hybrid.cpp
+++ b/src/bond_hybrid.cpp
@@ -21,6 +21,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -335,7 +336,7 @@ void BondHybrid::write_restart(FILE *fp)
 void BondHybrid::read_restart(FILE *fp)
 {
   int me = comm->me;
-  if (me == 0) fread(&nstyles,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&nstyles,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&nstyles,1,MPI_INT,0,world);
   styles = new Bond*[nstyles];
   keywords = new char*[nstyles];
@@ -344,10 +345,10 @@ void BondHybrid::read_restart(FILE *fp)
 
   int n,dummy;
   for (int m = 0; m < nstyles; m++) {
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     keywords[m] = new char[n];
-    if (me == 0) fread(keywords[m],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,keywords[m],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(keywords[m],n,MPI_CHAR,0,world);
     styles[m] = force->new_bond(keywords[m],0,dummy);
     styles[m]->read_restart_settings(fp);
diff --git a/src/bond_zero.cpp b/src/bond_zero.cpp
index 9be37c13be..428fd0ace2 100644
--- a/src/bond_zero.cpp
+++ b/src/bond_zero.cpp
@@ -23,6 +23,7 @@
 #include "comm.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -126,7 +127,7 @@ void BondZero::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
 
diff --git a/src/dihedral_hybrid.cpp b/src/dihedral_hybrid.cpp
index 6c0a4338ae..fe755ab85b 100644
--- a/src/dihedral_hybrid.cpp
+++ b/src/dihedral_hybrid.cpp
@@ -21,9 +21,11 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
+
 #define EXTRA 1000
 
 /* ---------------------------------------------------------------------- */
@@ -319,7 +321,7 @@ void DihedralHybrid::write_restart(FILE *fp)
 void DihedralHybrid::read_restart(FILE *fp)
 {
   int me = comm->me;
-  if (me == 0) fread(&nstyles,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&nstyles,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&nstyles,1,MPI_INT,0,world);
   styles = new Dihedral*[nstyles];
   keywords = new char*[nstyles];
@@ -328,10 +330,10 @@ void DihedralHybrid::read_restart(FILE *fp)
 
   int n,dummy;
   for (int m = 0; m < nstyles; m++) {
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     keywords[m] = new char[n];
-    if (me == 0) fread(keywords[m],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,keywords[m],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(keywords[m],n,MPI_CHAR,0,world);
     styles[m] = force->new_dihedral(keywords[m],0,dummy);
     styles[m]->read_restart_settings(fp);
diff --git a/src/group.cpp b/src/group.cpp
index d119964ea1..93cd668194 100644
--- a/src/group.cpp
+++ b/src/group.cpp
@@ -31,6 +31,7 @@
 #include "math_extra.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 #include <map>
 
@@ -735,7 +736,7 @@ void Group::read_restart(FILE *fp)
 
   for (i = 0; i < MAX_GROUP; i++) delete [] names[i];
 
-  if (me == 0) fread(&ngroup,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&ngroup,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&ngroup,1,MPI_INT,0,world);
 
   // use count to not change restart format with deleted groups
@@ -747,11 +748,11 @@ void Group::read_restart(FILE *fp)
       names[i] = NULL;
       continue;
     }
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     if (n) {
       names[i] = new char[n];
-      if (me == 0) fread(names[i],sizeof(char),n,fp);
+      if (me == 0) utils::sfread(FLERR,names[i],sizeof(char),n,fp,NULL,error);
       MPI_Bcast(names[i],n,MPI_CHAR,0,world);
       count++;
     } else names[i] = NULL;
diff --git a/src/improper_hybrid.cpp b/src/improper_hybrid.cpp
index 730a75766c..fe524b838a 100644
--- a/src/improper_hybrid.cpp
+++ b/src/improper_hybrid.cpp
@@ -21,6 +21,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -316,7 +317,7 @@ void ImproperHybrid::write_restart(FILE *fp)
 void ImproperHybrid::read_restart(FILE *fp)
 {
   int me = comm->me;
-  if (me == 0) fread(&nstyles,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&nstyles,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&nstyles,1,MPI_INT,0,world);
   styles = new Improper*[nstyles];
   keywords = new char*[nstyles];
@@ -325,10 +326,10 @@ void ImproperHybrid::read_restart(FILE *fp)
 
   int n,dummy;
   for (int m = 0; m < nstyles; m++) {
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     keywords[m] = new char[n];
-    if (me == 0) fread(keywords[m],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,keywords[m],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(keywords[m],n,MPI_CHAR,0,world);
     styles[m] = force->new_improper(keywords[m],0,dummy);
     styles[m]->read_restart_settings(fp);
diff --git a/src/modify.cpp b/src/modify.cpp
index 109571d531..dc22eecfb0 100644
--- a/src/modify.cpp
+++ b/src/modify.cpp
@@ -1364,7 +1364,7 @@ int Modify::read_restart(FILE *fp)
   // nfix_restart_global = # of restart entries with global state info
 
   int me = comm->me;
-  if (me == 0) fread(&nfix_restart_global,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&nfix_restart_global,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&nfix_restart_global,1,MPI_INT,0,world);
 
   // allocate space for each entry
@@ -1381,22 +1381,22 @@ int Modify::read_restart(FILE *fp)
 
   int n;
   for (int i = 0; i < nfix_restart_global; i++) {
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     id_restart_global[i] = new char[n];
-    if (me == 0) fread(id_restart_global[i],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,id_restart_global[i],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(id_restart_global[i],n,MPI_CHAR,0,world);
 
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     style_restart_global[i] = new char[n];
-    if (me == 0) fread(style_restart_global[i],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,style_restart_global[i],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(style_restart_global[i],n,MPI_CHAR,0,world);
 
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     state_restart_global[i] = new char[n];
-    if (me == 0) fread(state_restart_global[i],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,state_restart_global[i],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(state_restart_global[i],n,MPI_CHAR,0,world);
 
     used_restart_global[i] = 0;
@@ -1406,7 +1406,7 @@ int Modify::read_restart(FILE *fp)
 
   int maxsize = 0;
 
-  if (me == 0) fread(&nfix_restart_peratom,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&nfix_restart_peratom,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&nfix_restart_peratom,1,MPI_INT,0,world);
 
   // allocate space for each entry
@@ -1423,19 +1423,19 @@ int Modify::read_restart(FILE *fp)
   // set index = which set of extra data this fix represents
 
   for (int i = 0; i < nfix_restart_peratom; i++) {
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     id_restart_peratom[i] = new char[n];
-    if (me == 0) fread(id_restart_peratom[i],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,id_restart_peratom[i],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(id_restart_peratom[i],n,MPI_CHAR,0,world);
 
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     style_restart_peratom[i] = new char[n];
-    if (me == 0) fread(style_restart_peratom[i],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,style_restart_peratom[i],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(style_restart_peratom[i],n,MPI_CHAR,0,world);
 
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     maxsize += n;
 
diff --git a/src/pair_beck.cpp b/src/pair_beck.cpp
index b94436b696..1f058b9bd5 100644
--- a/src/pair_beck.cpp
+++ b/src/pair_beck.cpp
@@ -25,6 +25,7 @@
 #include "memory.h"
 #include "error.h"
 #include "math_special.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathSpecial;
@@ -277,16 +278,16 @@ void PairBeck::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&AA[i][j],sizeof(double),1,fp);
-          fread(&BB[i][j],sizeof(double),1,fp);
-          fread(&aa[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&beta[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&AA[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&BB[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&aa[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&beta[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&AA[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&BB[i][j],1,MPI_DOUBLE,0,world);
@@ -316,8 +317,8 @@ void PairBeck::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/pair_born.cpp b/src/pair_born.cpp
index bd993acb56..b0aba57df5 100644
--- a/src/pair_born.cpp
+++ b/src/pair_born.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -329,16 +330,16 @@ void PairBorn::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&d[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&d[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -369,10 +370,10 @@ void PairBorn::write_restart_settings(FILE *fp)
 void PairBorn::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_born_coul_dsf.cpp b/src/pair_born_coul_dsf.cpp
index f7e139c750..3e8c76696b 100644
--- a/src/pair_born_coul_dsf.cpp
+++ b/src/pair_born_coul_dsf.cpp
@@ -28,6 +28,7 @@
 #include "memory.h"
 #include "error.h"
 #include "math_special.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -360,16 +361,16 @@ void PairBornCoulDSF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&d[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&d[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -401,11 +402,11 @@ void PairBornCoulDSF::write_restart_settings(FILE *fp)
 void PairBornCoulDSF::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&alpha,sizeof(double),1,fp);
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&alpha,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&alpha,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_born_coul_wolf.cpp b/src/pair_born_coul_wolf.cpp
index f4d533bdb0..dc4e4b8e3f 100644
--- a/src/pair_born_coul_wolf.cpp
+++ b/src/pair_born_coul_wolf.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -359,16 +360,16 @@ void PairBornCoulWolf::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&d[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&d[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -400,11 +401,11 @@ void PairBornCoulWolf::write_restart_settings(FILE *fp)
 void PairBornCoulWolf::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&alf,sizeof(double),1,fp);
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&alf,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&alf,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_buck.cpp b/src/pair_buck.cpp
index a94ce87891..4a7740e034 100644
--- a/src/pair_buck.cpp
+++ b/src/pair_buck.cpp
@@ -22,6 +22,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -307,14 +308,14 @@ void PairBuck::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -343,10 +344,10 @@ void PairBuck::write_restart_settings(FILE *fp)
 void PairBuck::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_buck_coul_cut.cpp b/src/pair_buck_coul_cut.cpp
index d05c139f71..d74945aa57 100644
--- a/src/pair_buck_coul_cut.cpp
+++ b/src/pair_buck_coul_cut.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -363,15 +364,15 @@ void PairBuckCoulCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -402,11 +403,11 @@ void PairBuckCoulCut::write_restart_settings(FILE *fp)
 void PairBuckCoulCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_coul_cut.cpp b/src/pair_coul_cut.cpp
index 9e6f238eba..ebb3d8ca0d 100644
--- a/src/pair_coul_cut.cpp
+++ b/src/pair_coul_cut.cpp
@@ -22,6 +22,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -244,10 +245,10 @@ void PairCoulCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
-        if (me == 0) fread(&cut[i][j],sizeof(double),1,fp);
+        if (me == 0) utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
       }
     }
@@ -271,9 +272,9 @@ void PairCoulCut::write_restart_settings(FILE *fp)
 void PairCoulCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_coul_debye.cpp b/src/pair_coul_debye.cpp
index 1b87a93701..b45353837a 100644
--- a/src/pair_coul_debye.cpp
+++ b/src/pair_coul_debye.cpp
@@ -19,6 +19,7 @@
 #include "force.h"
 #include "neigh_list.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -145,10 +146,10 @@ void PairCoulDebye::write_restart_settings(FILE *fp)
 void PairCoulDebye::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&kappa,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&kappa,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&kappa,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_coul_dsf.cpp b/src/pair_coul_dsf.cpp
index 22230182b0..0a248e3084 100644
--- a/src/pair_coul_dsf.cpp
+++ b/src/pair_coul_dsf.cpp
@@ -28,6 +28,7 @@
 #include "memory.h"
 #include "math_const.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -252,7 +253,7 @@ void PairCoulDSF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
     }
 }
@@ -276,10 +277,10 @@ void PairCoulDSF::write_restart_settings(FILE *fp)
 void PairCoulDSF::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&alpha,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&alpha,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&alpha,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_coul_wolf.cpp b/src/pair_coul_wolf.cpp
index 15c7839fc6..9c48137270 100644
--- a/src/pair_coul_wolf.cpp
+++ b/src/pair_coul_wolf.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -248,7 +249,7 @@ void PairCoulWolf::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
     }
 }
@@ -272,10 +273,10 @@ void PairCoulWolf::write_restart_settings(FILE *fp)
 void PairCoulWolf::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&alf,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&alf,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&alf,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_dpd.cpp b/src/pair_dpd.cpp
index ec65eaafd6..ef0b7dd21d 100644
--- a/src/pair_dpd.cpp
+++ b/src/pair_dpd.cpp
@@ -27,6 +27,7 @@
 #include "random_mars.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -313,13 +314,13 @@ void PairDPD::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a0[i][j],sizeof(double),1,fp);
-          fread(&gamma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&gamma[i][j],1,MPI_DOUBLE,0,world);
@@ -347,10 +348,10 @@ void PairDPD::write_restart_settings(FILE *fp)
 void PairDPD::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&temperature,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&temperature,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&temperature,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_dpd_tstat.cpp b/src/pair_dpd_tstat.cpp
index 15d7c90b27..96e910d830 100644
--- a/src/pair_dpd_tstat.cpp
+++ b/src/pair_dpd_tstat.cpp
@@ -21,6 +21,7 @@
 #include "comm.h"
 #include "random_mars.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -231,12 +232,12 @@ void PairDPDTstat::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&gamma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&gamma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&gamma[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
diff --git a/src/utils.cpp b/src/utils.cpp
index 8cfdca5bbf..7262f8d8b8 100644
--- a/src/utils.cpp
+++ b/src/utils.cpp
@@ -17,6 +17,10 @@
 #include "lammps.h"
 #include "error.h"
 
+#if defined(__linux)
+#include <unistd.h>  // for readlink
+#endif
+
 /*! \file utils.cpp */
 
 /*
@@ -127,14 +131,32 @@ void utils::sfgets(const char *srcname, int srcline, char *s, int size,
   return;
 }
 
+#define MAXFILEBUF 1024
 /* like fread() but aborts with an error or EOF is encountered */
-void sfread(const char *srcname, int srcline, void *s, size_t size,
-                size_t num, FILE *fp, const char *filename, Error *error)
+void utils::sfread(const char *srcname, int srcline, void *s, size_t size,
+                   size_t num, FILE *fp, const char *filename, Error *error)
 {
+  char inferred_name[MAXFILEBUF];
   size_t rv = fread(s,size,num,fp);
   if (rv != num) { // something went wrong
     std::string errmsg;
 
+    // try to figure out the file name from the file pointer
+    if (!filename) {
+      // on Linux we can infer the name of the open file from /proc
+      // otherwise we set it to "(unknown)"
+#if defined(__linux)
+      char procpath[32];
+      int fd = fileno(fp);
+      snprintf(procpath,32,"/proc/self/fd/%d",fd);
+      memset(inferred_name,0,MAXFILEBUF);
+      readlink(procpath,inferred_name,MAXFILEBUF);
+#else
+      strcpy(inferred_name,"(unknown)");
+#endif
+      filename = inferred_name;
+    }
+
     if (feof(fp)) {
       errmsg = "Unexpected end of file while reading file '";
     } else if (ferror(fp)) {
diff --git a/src/utils.h b/src/utils.h
index 5fea9bc01a..8b18f95c77 100644
--- a/src/utils.h
+++ b/src/utils.h
@@ -78,7 +78,7 @@ namespace LAMMPS_NS {
      *  \param size     size of data elements read by fread()
      *  \param num      number of data elements read by fread()
      *  \param fp       file pointer used by fread()
-     *  \param filename file name associated with fp (for error message)
+     *  \param filename file name associated with fp (may be NULL; then LAMMPS will try to detect)
      *  \param error    pointer to Error class instance (for abort)
      */
     void sfread(const char *srcname, int srcline, void *s, size_t size,

From 63cb0775ef17d27cc3f3d1b18f20923c66c13dde Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Thu, 17 Oct 2019 13:17:19 -0400
Subject: [PATCH 07/21] handle the case where /proc/self/fd/# does not exist
 (anymore)

---
 src/utils.cpp | 3 ++-
 1 file changed, 2 insertions(+), 1 deletion(-)

diff --git a/src/utils.cpp b/src/utils.cpp
index 7262f8d8b8..8f1dadad0b 100644
--- a/src/utils.cpp
+++ b/src/utils.cpp
@@ -150,7 +150,8 @@ void utils::sfread(const char *srcname, int srcline, void *s, size_t size,
       int fd = fileno(fp);
       snprintf(procpath,32,"/proc/self/fd/%d",fd);
       memset(inferred_name,0,MAXFILEBUF);
-      readlink(procpath,inferred_name,MAXFILEBUF);
+      if (readlink(procpath,inferred_name,MAXFILEBUF) <= 0)
+        strcpy(inferred_name,"(unknown)");
 #else
       strcpy(inferred_name,"(unknown)");
 #endif

From 5652154b3cdc0ff6c892e556eea344659f03835a Mon Sep 17 00:00:00 2001
From: Oliver Henrich <ohenrich@users.noreply.github.com>
Date: Thu, 17 Oct 2019 18:37:55 +0100
Subject: [PATCH 08/21] Added log files

---
 .../oxDNA/duplex1/log.07Aug19.duplex1.g++.1   | 1166 ++++++++++++++++
 .../oxDNA/duplex1/log.07Aug19.duplex1.g++.4   | 1166 ++++++++++++++++
 .../oxDNA/duplex2/log.07Aug19.duplex2.g++.1   | 1168 ++++++++++++++++
 .../oxDNA/duplex2/log.07Aug19.duplex2.g++.4   | 1168 ++++++++++++++++
 .../oxDNA2/duplex1/log.07Aug19.duplex1.g++.1  | 1172 ++++++++++++++++
 .../oxDNA2/duplex1/log.07Aug19.duplex1.g++.4  | 1172 ++++++++++++++++
 .../oxDNA2/duplex2/log.07Aug19.duplex2.g++.1  | 1174 +++++++++++++++++
 .../oxDNA2/duplex2/log.07Aug19.duplex2.g++.4  | 1174 +++++++++++++++++
 .../oxDNA2/duplex3/log.07Aug19.duplex3.g++.1  | 1172 ++++++++++++++++
 .../oxDNA2/duplex3/log.07Aug19.duplex3.g++.4  | 1172 ++++++++++++++++
 10 files changed, 11704 insertions(+)
 create mode 100644 examples/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.1
 create mode 100644 examples/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.4
 create mode 100644 examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.1
 create mode 100644 examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.4
 create mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.1
 create mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.4
 create mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.1
 create mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.4
 create mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.1
 create mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.4

diff --git a/examples/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.1 b/examples/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.1
new file mode 100644
index 0000000000..3a4b84bffd
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.1
@@ -0,0 +1,1166 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 9.5e-05 secs
+  read_data CPU = 0.001865 secs
+
+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
+
+# 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
+
+#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 = 1.956
+  ghost atom cutoff = 1.956
+  binsize = 0.978, 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
+WARNING: Communication cutoff 1.956 is shorter than a bond length based estimate of 2.12875. This may lead to errors. (../comm.cpp:685)
+Per MPI rank memory allocation (min/avg/max) = 2.836 | 2.836 | 2.836 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
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+27000  ekin = 0.0958928250746637 |  erot = 0.982114250194058 | epot = -15.7204403209013 | etot = -14.6424332456325
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+30000  ekin = 0.0754407616839748 |  erot = 0.997437949320997 | epot = -15.7153119565981 | etot = -14.6424332455932
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+38000  ekin = 0.0403568280949571 |  erot = 0.927971766616668 | epot = -15.6107618401582 | etot = -14.6424332454465
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+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
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+49000  ekin = 0.069516912445729 |  erot = 0.737684732482671 | epot = -15.4496348904037 | etot = -14.6424332454753
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+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
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+90000  ekin = 0.122199339151899 |  erot = 0.539158097285764 | epot = -15.3037906818476 | etot = -14.64243324541
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+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 17.1797 on 1 procs for 1000000 steps with 10 atoms
+
+Performance: 50291.944 tau/day, 58208.268 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    | 13.871     | 13.871     | 13.871     |   0.0 | 80.74
+Bond    | 0.52454    | 0.52454    | 0.52454    |   0.0 |  3.05
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 0.14987    | 0.14987    | 0.14987    |   0.0 |  0.87
+Output  | 7e-06      | 7e-06      | 7e-06      |   0.0 |  0.00
+Modify  | 2.4075     | 2.4075     | 2.4075     |   0.0 | 14.01
+Other   |            | 0.227      |            |       |  1.32
+
+Nlocal:    10 ave 10 max 10 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Nghost:    0 ave 0 max 0 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Neighs:    45 ave 45 max 45 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+
+Total # of neighbors = 45
+Ave neighs/atom = 4.5
+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/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.4 b/examples/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.4
new file mode 100644
index 0000000000..4616a7453a
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA/duplex1/log.07Aug19.duplex1.g++.4
@@ -0,0 +1,1166 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000216 secs
+  read_data CPU = 0.003061 secs
+
+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
+
+# 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
+
+#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 = 1.956
+  ghost atom cutoff = 1.956
+  binsize = 0.978, 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
+WARNING: Communication cutoff 1.956 is shorter than a bond length based estimate of 2.12875. This may lead to errors. (../comm.cpp:685)
+Per MPI rank memory allocation (min/avg/max) = 7.33 | 7.512 | 7.694 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
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+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
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+960000  ekin = 0.274268068130398 |  erot = 0.377606549450015 | epot = -15.2943078627643 | etot = -14.6424332451839
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+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 18.6281 on 4 procs for 1000000 steps with 10 atoms
+
+Performance: 46381.610 tau/day, 53682.419 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    | 0.50691    | 7.0285     | 12.641     | 197.6 | 37.73
+Bond    | 0.081876   | 0.27627    | 0.44175    |  28.5 |  1.48
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 1.7692     | 2.0629     | 2.3468     |  17.0 | 11.07
+Output  | 1.8e-05    | 2.625e-05  | 3e-05      |   0.0 |  0.00
+Modify  | 0.17309    | 0.88362    | 1.5352     |  58.4 |  4.74
+Other   |            | 8.377      |            |       | 44.97
+
+Nlocal:    2.5 ave 5 max 0 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+Nghost:    7.5 ave 10 max 5 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+Neighs:    18.5 ave 35 max 0 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+
+Total # of neighbors = 74
+Ave neighs/atom = 7.4
+Ave special neighs/atom = 3.6
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:18
diff --git a/examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.1 b/examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.1
new file mode 100644
index 0000000000..be12914ad6
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.1
@@ -0,0 +1,1168 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.0001 secs
+  read_data CPU = 0.001436 secs
+
+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
+
+# 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
+
+#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 = 1.956
+  ghost atom cutoff = 1.956
+  binsize = 0.978, 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
+WARNING: Communication cutoff 1.956 is shorter than a bond length based estimate of 2.12875. This may lead to errors. (../comm.cpp:685)
+Per MPI rank memory allocation (min/avg/max) = 2.838 | 2.838 | 2.838 Mbytes
+Step Temp E_pair E_mol TotEng Press 
+       0            0   -1.5402493 0.0070469125   -1.5332024 6.0760034e-06 
+1000  ekin = 1.54234964773389 |  erot = 1.71563526070267 | epot = -24.5477045187653 | etot = -21.2897196103287
+2000  ekin = 1.85988866919215 |  erot = 1.9424302796508 | epot = -24.4843044999595 | etot = -20.6819855511165
+3000  ekin = 2.68354339452998 |  erot = 2.14216528317607 | epot = -24.4019350693561 | etot = -19.57622639165
+4000  ekin = 2.04461800191989 |  erot = 1.49015219763161 | epot = -24.2959428773347 | etot = -20.7611726777832
+5000  ekin = 1.76794859210155 |  erot = 2.54289684465819 | epot = -24.2337587736863 | etot = -19.9229133369266
+6000  ekin = 3.1106424806079 |  erot = 2.04409805200893 | epot = -24.1585729744133 | etot = -19.0038324417964
+7000  ekin = 3.21360097519306 |  erot = 2.71941303605722 | epot = -24.0566262531609 | etot = -18.1236122419107
+8000  ekin = 2.82489935901743 |  erot = 2.66790555575695 | epot = -24.0194805097633 | etot = -18.526675594989
+9000  ekin = 2.69381302856378 |  erot = 2.59107820129446 | epot = -23.9216126050554 | etot = -18.6367213751972
+10000  ekin = 2.65765007662471 |  erot = 1.95562671446597 | epot = -23.7978334881241 | etot = -19.1845566970334
+11000  ekin = 2.33860420545645 |  erot = 2.06778039137701 | epot = -23.6589739475584 | etot = -19.2525893507249
+12000  ekin = 2.71377849618258 |  erot = 2.08757199120023 | epot = -23.5483571834756 | etot = -18.7470066960928
+13000  ekin = 2.62930153930326 |  erot = 2.36926332727578 | epot = -23.4509629615768 | etot = -18.4523980949977
+14000  ekin = 3.08200416316113 |  erot = 2.52340746291245 | epot = -23.3378147651053 | etot = -17.7324031390317
+15000  ekin = 2.98008664779269 |  erot = 1.871644860882 | epot = -23.1940665570191 | etot = -18.3423350483444
+16000  ekin = 2.18422481774796 |  erot = 2.13029325858585 | epot = -23.0709946755646 | etot = -18.7564765992308
+17000  ekin = 1.86029951221073 |  erot = 2.30856215831156 | epot = -22.9148241979648 | etot = -18.7459625274425
+18000  ekin = 2.26757205264074 |  erot = 1.23282183419698 | epot = -22.7667657090377 | etot = -19.2663718222
+19000  ekin = 2.39717301992408 |  erot = 2.43814713185076 | epot = -22.6249045514987 | etot = -17.7895843997239
+20000  ekin = 2.4972090427325 |  erot = 2.14695469209109 | epot = -22.4687873897505 | etot = -17.8246236549269
+21000  ekin = 2.97591775854817 |  erot = 2.40996811711196 | epot = -22.580475447988 | etot = -17.1945895723278
+22000  ekin = 3.04727168578733 |  erot = 1.83825256427931 | epot = -22.6695853833015 | etot = -17.7840611332348
+23000  ekin = 2.64835731773193 |  erot = 2.22162785501705 | epot = -22.6565689169972 | etot = -17.7865837442483
+24000  ekin = 2.64866576787001 |  erot = 2.80157082833923 | epot = -22.6222797420052 | etot = -17.172043145796
+25000  ekin = 2.29527970143855 |  erot = 2.22049811939068 | epot = -22.6228421013006 | etot = -18.1070642804714
+26000  ekin = 1.6242512251805 |  erot = 2.52390475262917 | epot = -22.6746055892862 | etot = -18.5264496114765
+27000  ekin = 1.74746467550781 |  erot = 3.7138606202505 | epot = -22.7150312690974 | etot = -17.253705973339
+28000  ekin = 2.26500128280479 |  erot = 2.34791343563182 | epot = -22.7926648585827 | etot = -18.1797501401461
+29000  ekin = 2.04774074424512 |  erot = 1.86347261547111 | epot = -22.8081204933408 | etot = -18.8969071336246
+30000  ekin = 2.41140146125466 |  erot = 1.8629691542147 | epot = -22.7764612164305 | etot = -18.5020906009611
+31000  ekin = 2.76447800297261 |  erot = 2.73932534046809 | epot = -22.7808698156252 | etot = -17.2770664721845
+32000  ekin = 2.08103539953574 |  erot = 2.81216171106145 | epot = -22.8081908465747 | etot = -17.9149937359775
+33000  ekin = 2.08672340074227 |  erot = 3.65510023442519 | epot = -22.7575363468642 | etot = -17.0157127116967
+34000  ekin = 2.34180742039869 |  erot = 3.10027175201876 | epot = -22.6657421559553 | etot = -17.2236629835378
+35000  ekin = 2.32430602395272 |  erot = 2.01607522370048 | epot = -22.5813705492547 | etot = -18.2409893016015
+36000  ekin = 1.91917507775106 |  erot = 1.97289747304336 | epot = -22.481118994336 | etot = -18.5890464435415
+37000  ekin = 1.57560528527468 |  erot = 2.63029511887644 | epot = -22.4456699464305 | etot = -18.2397695422794
+38000  ekin = 2.20652731867584 |  erot = 2.89671984141264 | epot = -22.3965902387972 | etot = -17.2933430787087
+39000  ekin = 2.54765822667969 |  erot = 2.47352619735436 | epot = -22.3525131983352 | etot = -17.3313287743011
+40000  ekin = 2.24172560748699 |  erot = 1.87314319107769 | epot = -22.3791956830638 | etot = -18.2643268844991
+41000  ekin = 2.45176361826215 |  erot = 2.49992612251746 | epot = -22.4441192111886 | etot = -17.492429470409
+42000  ekin = 2.68254780786499 |  erot = 2.0438213169699 | epot = -22.4352265851614 | etot = -17.7088574603265
+43000  ekin = 2.39383336858508 |  erot = 1.66587291396323 | epot = -22.4337243898147 | etot = -18.3740181072664
+44000  ekin = 2.30758870966957 |  erot = 2.39381816537747 | epot = -22.4636201484765 | etot = -17.7622132734295
+45000  ekin = 1.84308929771583 |  erot = 2.25880380151545 | epot = -22.5697712917434 | etot = -18.4678781925121
+46000  ekin = 1.98608215049724 |  erot = 3.02136983211364 | epot = -22.5606085774834 | etot = -17.5531565948725
+47000  ekin = 1.31457586857023 |  erot = 1.99780932836914 | epot = -22.5522289127255 | etot = -19.2398437157861
+48000  ekin = 2.59855199680394 |  erot = 1.90772345027383 | epot = -22.5972680906755 | etot = -18.0909926435977
+49000  ekin = 2.32140483916261 |  erot = 2.72932938830521 | epot = -22.6070371995253 | etot = -17.5563029720575
+50000  ekin = 2.48248035385828 |  erot = 3.42713570109106 | epot = -22.5294064222472 | etot = -16.6197903672978
+51000  ekin = 2.73677705777971 |  erot = 1.43285265191039 | epot = -22.4272695862992 | etot = -18.2576398766091
+52000  ekin = 3.03746109762767 |  erot = 1.97878223690382 | epot = -22.4105817052323 | etot = -17.3943383707008
+53000  ekin = 2.4689045601064 |  erot = 4.26434186327669 | epot = -22.4059567857723 | etot = -15.6727103623892
+54000  ekin = 2.48025904071626 |  erot = 2.36957879662633 | epot = -22.4049729842648 | etot = -17.5551351469222
+55000  ekin = 2.28269445417385 |  erot = 1.92149293107792 | epot = -22.4643082993723 | etot = -18.2601209141205
+56000  ekin = 2.36225428889468 |  erot = 2.21818002425494 | epot = -22.5516502452858 | etot = -17.9712159321362
+57000  ekin = 2.5222034650231 |  erot = 2.87044520913644 | epot = -22.6517599833464 | etot = -17.2591113091869
+58000  ekin = 2.50677816066749 |  erot = 2.80087142998997 | epot = -22.7046490897181 | etot = -17.3969994990606
+59000  ekin = 2.7442153349817 |  erot = 2.17375311266844 | epot = -22.7630968852436 | etot = -17.8451284375935
+60000  ekin = 3.28881699963203 |  erot = 1.98491245229836 | epot = -22.7493813857703 | etot = -17.47565193384
+61000  ekin = 2.42749732003947 |  erot = 1.80500042748844 | epot = -22.6954080097403 | etot = -18.4629102622124
+62000  ekin = 2.82051548232979 |  erot = 1.69220614985812 | epot = -22.5840860651656 | etot = -18.0713644329777
+63000  ekin = 3.66818847100114 |  erot = 1.91510536540652 | epot = -22.4235299160084 | etot = -16.8402360796007
+64000  ekin = 3.60192162647095 |  erot = 3.02302140162941 | epot = -22.4028966408393 | etot = -15.777953612739
+65000  ekin = 3.37797300912953 |  erot = 3.90646944425566 | epot = -22.3508227873684 | etot = -15.0663803339832
+66000  ekin = 2.90796062513305 |  erot = 2.46538835419996 | epot = -22.2656130116827 | etot = -16.8922640323497
+67000  ekin = 2.57641483706472 |  erot = 2.10639257083139 | epot = -22.1586423836372 | etot = -17.4758349757411
+68000  ekin = 2.55169027274651 |  erot = 2.46870040285814 | epot = -22.1454741588101 | etot = -17.1250834832055
+69000  ekin = 2.42897294997603 |  erot = 2.86774435615082 | epot = -22.1788582092805 | etot = -16.8821409031537
+70000  ekin = 3.08406596014674 |  erot = 2.51171720098585 | epot = -22.2680651617951 | etot = -16.6722820006625
+71000  ekin = 2.55052721315253 |  erot = 2.49486492124422 | epot = -22.3940848075588 | etot = -17.3486926731621
+72000  ekin = 1.77666138705941 |  erot = 2.52301579845698 | epot = -22.4956655989823 | etot = -18.195988413466
+73000  ekin = 1.86857924146303 |  erot = 2.33110810852355 | epot = -22.5401005215028 | etot = -18.3404131715162
+74000  ekin = 3.14875320805145 |  erot = 2.120028079616 | epot = -22.5354282257997 | etot = -17.2666469381323
+75000  ekin = 2.60566180511119 |  erot = 2.16421143606062 | epot = -22.5109742574449 | etot = -17.7411010162731
+76000  ekin = 1.94500512300058 |  erot = 1.94681992806367 | epot = -22.513456138446 | etot = -18.6216310873818
+77000  ekin = 2.09005510206219 |  erot = 2.13354294429721 | epot = -22.5157248384152 | etot = -18.2921267920558
+78000  ekin = 2.48381695181472 |  erot = 2.49598603867483 | epot = -22.449809286019 | etot = -17.4700062955294
+79000  ekin = 3.09582217320064 |  erot = 2.46630074007713 | epot = -22.3464652405845 | etot = -16.7843423273067
+80000  ekin = 2.51380629427529 |  erot = 1.89207626467031 | epot = -22.2775752521274 | etot = -17.8716926931818
+81000  ekin = 2.32322780911516 |  erot = 2.24954513249786 | epot = -22.2655235360185 | etot = -17.6927505944055
+82000  ekin = 1.54779729878415 |  erot = 2.01487148845306 | epot = -22.2126473128098 | etot = -18.6499785255726
+83000  ekin = 2.24267653112482 |  erot = 3.34721522119021 | epot = -22.2063282117648 | etot = -16.6164364594498
+84000  ekin = 2.86948852339533 |  erot = 2.11915315181828 | epot = -22.2055386975617 | etot = -17.2168970223481
+85000  ekin = 3.13802387827786 |  erot = 2.93900498543376 | epot = -22.2240733080823 | etot = -16.1470444443707
+86000  ekin = 3.46160079449537 |  erot = 2.80798287444336 | epot = -22.2732645073154 | etot = -16.0036808383767
+87000  ekin = 3.63139446909085 |  erot = 2.3166794204513 | epot = -22.2567856660101 | etot = -16.3087117764679
+88000  ekin = 3.15348314879937 |  erot = 2.27857637090329 | epot = -22.2154422326698 | etot = -16.7833827129672
+89000  ekin = 3.30271147105659 |  erot = 1.80791256125565 | epot = -22.1564153597822 | etot = -17.04579132747
+90000  ekin = 2.42655906518195 |  erot = 2.24507038389519 | epot = -21.9481188512568 | etot = -17.2764894021797
+91000  ekin = 1.89051217909395 |  erot = 2.51049066719492 | epot = -21.7877769537305 | etot = -17.3867741074417
+92000  ekin = 2.0783366846668 |  erot = 2.218324246302 | epot = -21.6997103074281 | etot = -17.4030493764594
+93000  ekin = 1.94321435585196 |  erot = 2.99473985773913 | epot = -21.6748650469777 | etot = -16.7369108333866
+94000  ekin = 2.07878576812463 |  erot = 3.37631892101902 | epot = -21.7659932416399 | etot = -16.3108885524962
+95000  ekin = 2.1051772140777 |  erot = 2.08345895044788 | epot = -21.8951718799354 | etot = -17.7065357154098
+96000  ekin = 2.68821593238919 |  erot = 1.86988637992411 | epot = -21.9622848400866 | etot = -17.4041825277733
+97000  ekin = 1.95061152706206 |  erot = 2.81054215683074 | epot = -22.0229813258884 | etot = -17.2618276419956
+98000  ekin = 1.98463063611221 |  erot = 2.05732763357978 | epot = -22.0930102039111 | etot = -18.0510519342191
+99000  ekin = 2.51292852217217 |  erot = 3.54194472638844 | epot = -22.1990887572979 | etot = -16.1442155087373
+100000  ekin = 1.8757570387949 |  erot = 2.36907855808758 | epot = -22.3484095874379 | etot = -18.1035739905555
+101000  ekin = 1.66160772204006 |  erot = 3.59766032223856 | epot = -22.3604908173889 | etot = -17.1012227731103
+102000  ekin = 1.62075182718473 |  erot = 3.34420068488168 | epot = -22.3063629504086 | etot = -17.3414104383422
+103000  ekin = 2.00871148652538 |  erot = 2.33677124900284 | epot = -22.2755578526919 | etot = -17.9300751171637
+104000  ekin = 2.04513709976292 |  erot = 2.74664593650968 | epot = -22.2818713634636 | etot = -17.490088327191
+105000  ekin = 1.87027868596139 |  erot = 1.9892238921824 | epot = -22.2235039092989 | etot = -18.3640013311551
+106000  ekin = 1.71540784443942 |  erot = 1.91779531106878 | epot = -22.2562839843324 | etot = -18.6230808288242
+107000  ekin = 2.61024905591622 |  erot = 1.57446439985465 | epot = -22.3171357124015 | etot = -18.1324222566306
+108000  ekin = 2.13751756724178 |  erot = 2.18822458113097 | epot = -22.2268794585968 | etot = -17.9011373102241
+109000  ekin = 2.24408198608307 |  erot = 2.11438299352725 | epot = -22.076564108576 | etot = -17.7180991289656
+110000  ekin = 1.66706562020821 |  erot = 2.50986066169371 | epot = -22.0833343008135 | etot = -17.9064080189116
+111000  ekin = 2.30463895640873 |  erot = 2.2498256085699 | epot = -22.0940837732695 | etot = -17.5396192082909
+112000  ekin = 2.63019524472748 |  erot = 2.43696110420533 | epot = -22.0953344558745 | etot = -17.0281781069417
+113000  ekin = 2.42282638113981 |  erot = 3.06190927482914 | epot = -22.1061661458172 | etot = -16.6214304898483
+114000  ekin = 2.34214572325658 |  erot = 2.31899235523686 | epot = -22.0941430549287 | etot = -17.4330049764353
+115000  ekin = 1.70336449422736 |  erot = 3.10166879044198 | epot = -22.1252095896431 | etot = -17.3201763049738
+116000  ekin = 1.51705870113214 |  erot = 2.21425252709697 | epot = -22.1823772627204 | etot = -18.4510660344913
+117000  ekin = 1.70129809180508 |  erot = 2.34142425076373 | epot = -22.2067668262467 | etot = -18.1640444836778
+118000  ekin = 2.20482827236051 |  erot = 2.31797148095037 | epot = -22.1855414590756 | etot = -17.6627417057647
+119000  ekin = 2.54272629601484 |  erot = 2.46528921750297 | epot = -22.2113175246519 | etot = -17.2033020111341
+120000  ekin = 1.76640390552554 |  erot = 2.16116304616033 | epot = -22.1536331723645 | etot = -18.2260662206786
+121000  ekin = 2.81281157959689 |  erot = 2.31761005518346 | epot = -22.1492969323238 | etot = -17.0188752975435
+122000  ekin = 3.25156823587966 |  erot = 3.31679050874321 | epot = -22.2050361016165 | etot = -15.6366773569937
+123000  ekin = 2.87462309654082 |  erot = 3.25604816714397 | epot = -22.1785374359393 | etot = -16.0478661722545
+124000  ekin = 2.18213410260632 |  erot = 2.77182209342783 | epot = -22.0161464482697 | etot = -17.0621902522356
+125000  ekin = 1.85317252616068 |  erot = 1.36623599567638 | epot = -21.8721650279343 | etot = -18.6527565060973
+126000  ekin = 2.47747071965844 |  erot = 3.09909384826332 | epot = -21.8840309142636 | etot = -16.3074663463419
+127000  ekin = 2.42177426273027 |  erot = 2.35209644429657 | epot = -21.8861939604609 | etot = -17.112323253434
+128000  ekin = 2.76000040231248 |  erot = 1.82316788372391 | epot = -21.8538456680959 | etot = -17.2706773820595
+129000  ekin = 2.78355536315488 |  erot = 2.888519816215 | epot = -21.9251039267855 | etot = -16.2530287474156
+130000  ekin = 3.26834278926798 |  erot = 2.56228354573333 | epot = -22.0546105678548 | etot = -16.2239842328535
+131000  ekin = 2.64714688907849 |  erot = 2.51107513446137 | epot = -22.096116019268 | etot = -16.9378939957281
+132000  ekin = 2.61847248883525 |  erot = 3.3889916433416 | epot = -22.1218916777657 | etot = -16.1144275455889
+133000  ekin = 2.03408861514006 |  erot = 2.87401070790187 | epot = -22.0785989417619 | etot = -17.17049961872
+134000  ekin = 1.64140897264888 |  erot = 1.66986416585675 | epot = -22.0323643102284 | etot = -18.7210911717227
+135000  ekin = 2.46650096367446 |  erot = 2.11112061110699 | epot = -21.9976572593398 | etot = -17.4200356845584
+136000  ekin = 2.32880805911731 |  erot = 3.05940125193233 | epot = -21.8983392007846 | etot = -16.510129889735
+137000  ekin = 2.7601019905106 |  erot = 2.47443779429795 | epot = -21.7521252642038 | etot = -16.5175854793953
+138000  ekin = 3.30162084678948 |  erot = 1.73084735415552 | epot = -21.7423849642074 | etot = -16.7099167632624
+139000  ekin = 2.76669064053124 |  erot = 1.72642745910432 | epot = -21.8898577306653 | etot = -17.3967396310297
+140000  ekin = 2.73595287215366 |  erot = 2.46891829250481 | epot = -21.9884857831832 | etot = -16.7836146185247
+141000  ekin = 2.79316289615843 |  erot = 2.46753088695596 | epot = -22.0064855648442 | etot = -16.7457917817298
+142000  ekin = 3.51694745558128 |  erot = 3.49862438784826 | epot = -21.962319333545 | etot = -14.9467474901155
+143000  ekin = 2.58689934548697 |  erot = 2.04008576044028 | epot = -21.9563338194556 | etot = -17.3293487135283
+144000  ekin = 3.72611917000993 |  erot = 3.04855733322794 | epot = -21.9536376487795 | etot = -15.1789611455416
+145000  ekin = 3.61191106831146 |  erot = 2.71915407989906 | epot = -21.8705426653329 | etot = -15.5394775171224
+146000  ekin = 3.85060594912678 |  erot = 2.47210219931339 | epot = -21.828585815392 | etot = -15.5058776669519
+147000  ekin = 3.26481933196161 |  erot = 2.06864347299802 | epot = -21.6752809049182 | etot = -16.3418180999586
+148000  ekin = 2.47977997895053 |  erot = 1.65169267241013 | epot = -21.4172781734275 | etot = -17.2858055220668
+149000  ekin = 2.70771685463074 |  erot = 2.28028425953226 | epot = -21.2324293178538 | etot = -16.2444282036908
+150000  ekin = 2.60726181496431 |  erot = 2.88955230103661 | epot = -21.1265494068529 | etot = -15.629735290852
+151000  ekin = 2.06865005733849 |  erot = 2.13537039813292 | epot = -21.0304193709382 | etot = -16.8263989154668
+152000  ekin = 2.41210154812788 |  erot = 2.60104053370076 | epot = -20.8967777045301 | etot = -15.8836356227015
+153000  ekin = 2.12406231442824 |  erot = 2.25444655142795 | epot = -20.9199278716093 | etot = -16.5414190057531
+154000  ekin = 2.34622678455546 |  erot = 2.58439374093404 | epot = -21.0040588663532 | etot = -16.0734383408637
+155000  ekin = 2.08240965570453 |  erot = 3.02621505767145 | epot = -21.0204738431415 | etot = -15.9118491297655
+156000  ekin = 2.04576145796301 |  erot = 3.17151405834468 | epot = -20.8558463949478 | etot = -15.6385708786401
+157000  ekin = 2.36459548410747 |  erot = 1.89207417055427 | epot = -20.8025485082276 | etot = -16.5458788535658
+158000  ekin = 2.16996178916575 |  erot = 2.46547727482115 | epot = -20.8673070433023 | etot = -16.2318679793154
+159000  ekin = 2.86272730849306 |  erot = 2.27590841865057 | epot = -20.9710387207244 | etot = -15.8324029935808
+160000  ekin = 2.19288173853783 |  erot = 2.36312829884112 | epot = -21.0403123366074 | etot = -16.4843022992285
+161000  ekin = 2.14059248149909 |  erot = 2.42872837990481 | epot = -21.1333683100402 | etot = -16.5640474486363
+162000  ekin = 1.76077466564934 |  erot = 2.66561836368342 | epot = -21.1782130850258 | etot = -16.751820055693
+163000  ekin = 2.23068698955416 |  erot = 2.02664945757243 | epot = -21.3281780197228 | etot = -17.0708415725962
+164000  ekin = 2.75358320318999 |  erot = 1.43717365990088 | epot = -21.4675480212853 | etot = -17.2767911581944
+165000  ekin = 2.65171600986478 |  erot = 2.29632253260763 | epot = -21.493178025826 | etot = -16.5451394833535
+166000  ekin = 3.27298673277591 |  erot = 2.41252396730594 | epot = -21.4477711984926 | etot = -15.7622604984108
+167000  ekin = 3.02574105268454 |  erot = 2.02770436019795 | epot = -21.5236773217565 | etot = -16.470231908874
+168000  ekin = 3.14659813654157 |  erot = 1.83746079413209 | epot = -21.5547269116735 | etot = -16.5706679809999
+169000  ekin = 2.22493755697303 |  erot = 2.67175500860651 | epot = -21.466220607731 | etot = -16.5695280421515
+170000  ekin = 2.41921977325642 |  erot = 2.49142716001799 | epot = -21.3123035293872 | etot = -16.4016565961128
+171000  ekin = 1.89798915040775 |  erot = 2.39492100285877 | epot = -21.2153991969518 | etot = -16.9224890436852
+172000  ekin = 2.86894215563085 |  erot = 3.22914449693157 | epot = -21.182735220644 | etot = -15.0846485680816
+173000  ekin = 2.74888252418688 |  erot = 2.13556434483052 | epot = -21.2166792789417 | etot = -16.3322324099243
+174000  ekin = 2.45887587066864 |  erot = 2.23682521338054 | epot = -21.263305665856 | etot = -16.5676045818068
+175000  ekin = 2.84703517745998 |  erot = 2.3938125491638 | epot = -21.2430876358358 | etot = -16.002239909212
+176000  ekin = 2.14025231000119 |  erot = 1.89894722702465 | epot = -21.3238321496633 | etot = -17.2846326126374
+177000  ekin = 2.5795061901144 |  erot = 2.75365074391217 | epot = -21.3022195274207 | etot = -15.9690625933941
+178000  ekin = 1.83122028490792 |  erot = 2.59468068841507 | epot = -21.2483113201278 | etot = -16.8224103468048
+179000  ekin = 2.50706581632049 |  erot = 2.39180466236872 | epot = -21.3152464598323 | etot = -16.4163759811431
+180000  ekin = 1.88211034410738 |  erot = 2.47063835849691 | epot = -21.4741119346399 | etot = -17.1213632320356
+181000  ekin = 1.74209654097779 |  erot = 3.05723824722444 | epot = -21.4808621715441 | etot = -16.6815273833419
+182000  ekin = 1.55789914013104 |  erot = 2.05767448814763 | epot = -21.423526482018 | etot = -17.8079528537393
+183000  ekin = 2.00937540548924 |  erot = 2.80898978674436 | epot = -21.491360735728 | etot = -16.6729955434944
+184000  ekin = 2.69285960778353 |  erot = 2.42969439668745 | epot = -21.6024209898207 | etot = -16.4798669853497
+185000  ekin = 3.01326925127938 |  erot = 3.19083239326424 | epot = -21.673025896793 | etot = -15.4689242522494
+186000  ekin = 3.20830671536381 |  erot = 2.428990168692 | epot = -21.7143665695974 | etot = -16.0770696855416
+187000  ekin = 2.67290610091901 |  erot = 3.415604047156 | epot = -21.6726605039612 | etot = -15.5841503558862
+188000  ekin = 2.89349337388583 |  erot = 3.06258669113778 | epot = -21.6216664732831 | etot = -15.6655864082595
+189000  ekin = 2.65435973176119 |  erot = 1.82043381700643 | epot = -21.5604872976484 | etot = -17.0856937488808
+190000  ekin = 2.21855159698309 |  erot = 1.84826944038784 | epot = -21.5263477340277 | etot = -17.4595266966568
+191000  ekin = 2.26980616064111 |  erot = 2.05944589507645 | epot = -21.4543005141096 | etot = -17.1250484583921
+192000  ekin = 2.27219103053707 |  erot = 3.11210788791053 | epot = -21.4899273087561 | etot = -16.1056283903085
+193000  ekin = 1.95008147026928 |  erot = 1.8964892153402 | epot = -21.4843079374127 | etot = -17.6377372518032
+194000  ekin = 2.45477671526092 |  erot = 2.02723042426762 | epot = -21.3709228769336 | etot = -16.8889157374051
+195000  ekin = 3.09567411006595 |  erot = 2.10081767143638 | epot = -21.3012041149762 | etot = -16.1047123334738
+196000  ekin = 2.67423122149492 |  erot = 2.5073818975552 | epot = -21.2164124023052 | etot = -16.0347992832551
+197000  ekin = 2.50338730962556 |  erot = 2.07349764616723 | epot = -21.0418674869219 | etot = -16.4649825311292
+198000  ekin = 2.66945928982615 |  erot = 1.79012921820211 | epot = -21.0169215356765 | etot = -16.5573330276482
+199000  ekin = 2.53947964790256 |  erot = 2.33176467953654 | epot = -21.0171165577067 | etot = -16.1458722302676
+200000  ekin = 2.90451062704866 |  erot = 1.42170066957003 | epot = -21.0113804229742 | etot = -16.6851691263555
+201000  ekin = 2.68927776239674 |  erot = 1.56650335894555 | epot = -21.024591639958 | etot = -16.7688105186157
+202000  ekin = 2.2601329351618 |  erot = 2.25401443373178 | epot = -20.9769308007641 | etot = -16.4627834318705
+203000  ekin = 2.12073487355488 |  erot = 2.03553028991747 | epot = -20.9190359464919 | etot = -16.7627707830196
+204000  ekin = 2.11829086582789 |  erot = 1.89731962488618 | epot = -20.9376264283537 | etot = -16.9220159376396
+205000  ekin = 1.30964171332167 |  erot = 2.12770406224884 | epot = -20.9991335630718 | etot = -17.5617877875013
+206000  ekin = 1.39940057572523 |  erot = 2.24496791209125 | epot = -20.9639192190619 | etot = -17.3195507312454
+207000  ekin = 1.8871608804017 |  erot = 1.79849326266381 | epot = -21.0552898160204 | etot = -17.3696356729549
+208000  ekin = 1.81558541079754 |  erot = 3.24210836817276 | epot = -21.3060144768833 | etot = -16.248320697913
+209000  ekin = 2.79588064252181 |  erot = 2.34671491738324 | epot = -21.4301997554494 | etot = -16.2876041955444
+210000  ekin = 3.17544887511568 |  erot = 3.12704516116656 | epot = -21.5100449360931 | etot = -15.2075508998109
+211000  ekin = 2.47442327377227 |  erot = 2.0990867711376 | epot = -21.6455723047062 | etot = -17.0720622597963
+212000  ekin = 2.36672302145397 |  erot = 1.93445871446417 | epot = -21.7283038297487 | etot = -17.4271220938306
+213000  ekin = 1.91045426241161 |  erot = 2.52535628540463 | epot = -21.8158508544504 | etot = -17.3800403066341
+214000  ekin = 1.99794025866062 |  erot = 2.49896939492129 | epot = -21.8606548137084 | etot = -17.3637451601265
+215000  ekin = 1.97741561009525 |  erot = 3.17667494473256 | epot = -21.8701701582032 | etot = -16.7160796033754
+216000  ekin = 1.88829990821377 |  erot = 1.87402623825167 | epot = -21.8343889393413 | etot = -18.0720627928758
+217000  ekin = 2.10000293878933 |  erot = 1.95052404495888 | epot = -21.8965404786646 | etot = -17.8460134949164
+218000  ekin = 2.34753598782339 |  erot = 1.696950195044 | epot = -21.8560027679963 | etot = -17.8115165851289
+219000  ekin = 2.497223564463 |  erot = 2.20999914485703 | epot = -21.8797649478059 | etot = -17.1725422384859
+220000  ekin = 1.75274593087922 |  erot = 3.03992746556403 | epot = -21.8491595252171 | etot = -17.0564861287739
+221000  ekin = 1.78874686645809 |  erot = 2.79359542964648 | epot = -21.869798634642 | etot = -17.2874563385374
+222000  ekin = 2.63608430516661 |  erot = 2.86817933637385 | epot = -21.8351218383832 | etot = -16.3308581968427
+223000  ekin = 3.02706758581511 |  erot = 1.93888641555348 | epot = -21.8582453001765 | etot = -16.8922912988079
+224000  ekin = 2.71704451339112 |  erot = 2.42079327531438 | epot = -21.8188420875657 | etot = -16.6810042988602
+225000  ekin = 2.04245190508396 |  erot = 3.38216222891908 | epot = -21.8232190868647 | etot = -16.3986049528616
+226000  ekin = 2.37968015829255 |  erot = 2.38384696857064 | epot = -21.8913549487127 | etot = -17.1278278218495
+227000  ekin = 2.73883397024414 |  erot = 2.62491632372019 | epot = -21.9496900700866 | etot = -16.5859397761223
+228000  ekin = 2.06833362780412 |  erot = 2.25049628751226 | epot = -21.9946760345141 | etot = -17.6758461191977
+229000  ekin = 1.78618617304217 |  erot = 1.8050959150033 | epot = -22.0671964085329 | etot = -18.4759143204874
+230000  ekin = 2.76967283780387 |  erot = 2.22492545317995 | epot = -22.0913590121729 | etot = -17.096760721189
+231000  ekin = 3.15653922952316 |  erot = 2.77099247609324 | epot = -22.0635255129442 | etot = -16.1359938073278
+232000  ekin = 1.86633326635991 |  erot = 1.70672288688982 | epot = -22.0959715052868 | etot = -18.5229153520371
+233000  ekin = 1.75856846080021 |  erot = 1.55694263125625 | epot = -22.0729289884755 | etot = -18.757417896419
+234000  ekin = 2.32322575892498 |  erot = 2.05793864740336 | epot = -21.9849429433607 | etot = -17.6037785370324
+235000  ekin = 1.95327191686568 |  erot = 2.5251933888586 | epot = -21.9357201856671 | etot = -17.4572548799429
+236000  ekin = 2.25952484966859 |  erot = 1.90005304846995 | epot = -21.942247136874 | etot = -17.7826692387355
+237000  ekin = 2.49082301609303 |  erot = 2.65327564887437 | epot = -22.0049130762793 | etot = -16.8608144113119
+238000  ekin = 2.21076048871751 |  erot = 2.74154862479022 | epot = -22.0553236426831 | etot = -17.1030145291753
+239000  ekin = 2.71464884454142 |  erot = 2.48739530580561 | epot = -22.0661894571024 | etot = -16.8641453067553
+240000  ekin = 3.08961933821573 |  erot = 2.17857064931928 | epot = -21.9596599475175 | etot = -16.6914699599825
+241000  ekin = 3.04172562407922 |  erot = 2.64442433974962 | epot = -21.8729500648239 | etot = -16.186800100995
+242000  ekin = 2.21355627539455 |  erot = 2.33429157450905 | epot = -21.7850463200937 | etot = -17.2371984701901
+243000  ekin = 1.52065138183895 |  erot = 2.81375224845252 | epot = -21.7246720043569 | etot = -17.3902683740654
+244000  ekin = 1.9035257658383 |  erot = 2.43821138840077 | epot = -21.6320468184553 | etot = -17.2903096642163
+245000  ekin = 1.96342069667741 |  erot = 2.61760141174562 | epot = -21.5097899449579 | etot = -16.9287678365349
+246000  ekin = 2.05478829283867 |  erot = 2.42643933263095 | epot = -21.4781109635141 | etot = -16.9968833380445
+247000  ekin = 1.54618395739204 |  erot = 2.28537401295508 | epot = -21.4411828355571 | etot = -17.60962486521
+248000  ekin = 1.83924983769608 |  erot = 2.55904554412921 | epot = -21.4587985205917 | etot = -17.0605031387664
+249000  ekin = 1.78703007063825 |  erot = 2.0341134947543 | epot = -21.5166075601389 | etot = -17.6954639947463
+250000  ekin = 1.69317901626952 |  erot = 3.38262002358101 | epot = -21.5380480709887 | etot = -16.4622490311382
+251000  ekin = 2.13799462687096 |  erot = 3.25868442484789 | epot = -21.5254595658407 | etot = -16.1287805141218
+252000  ekin = 2.04357045453397 |  erot = 2.53079336098229 | epot = -21.5456931883613 | etot = -16.9713293728451
+253000  ekin = 1.63287738205388 |  erot = 3.20992823373495 | epot = -21.5622010587546 | etot = -16.7193954429658
+254000  ekin = 2.31269246359595 |  erot = 3.10766702207072 | epot = -21.5505863172023 | etot = -16.1302268315356
+255000  ekin = 2.50767926641465 |  erot = 2.76631276495167 | epot = -21.5288449153182 | etot = -16.2548528839519
+256000  ekin = 1.97163698305487 |  erot = 2.61682132599932 | epot = -21.5273539828766 | etot = -16.9388956738224
+257000  ekin = 2.21091422886156 |  erot = 3.2624387389365 | epot = -21.5385504601778 | etot = -16.0651974923797
+258000  ekin = 2.0351730783025 |  erot = 1.8469346151236 | epot = -21.6544556001777 | etot = -17.7723479067517
+259000  ekin = 2.85718947138203 |  erot = 2.78701165242274 | epot = -21.7587237542941 | etot = -16.1145226304893
+260000  ekin = 2.90387286634677 |  erot = 2.18817434737476 | epot = -21.8080383126912 | etot = -16.7159910989697
+261000  ekin = 2.76190440948559 |  erot = 2.33968169215534 | epot = -21.8592909726424 | etot = -16.7577048710014
+262000  ekin = 3.50919242681177 |  erot = 1.76925994550144 | epot = -21.8779228441576 | etot = -16.5994704718444
+263000  ekin = 3.07696270254057 |  erot = 2.41477320555762 | epot = -21.807856600428 | etot = -16.3161206923298
+264000  ekin = 2.26633389925754 |  erot = 2.04161743361597 | epot = -21.837292812857 | etot = -17.5293414799835
+265000  ekin = 1.95747124461578 |  erot = 2.50813008798838 | epot = -21.8490876266416 | etot = -17.3834862940374
+266000  ekin = 2.34517905801099 |  erot = 3.31486209922485 | epot = -21.8287737874741 | etot = -16.1687326302383
+267000  ekin = 1.7403019336191 |  erot = 2.23366459528058 | epot = -21.699850097441 | etot = -17.7258835685413
+268000  ekin = 2.04858677018809 |  erot = 3.28744422098426 | epot = -21.6459408923622 | etot = -16.3099099011899
+269000  ekin = 1.93146929709292 |  erot = 2.79280735598121 | epot = -21.5497738027119 | etot = -16.8254971496378
+270000  ekin = 2.19788894271021 |  erot = 2.64563279687103 | epot = -21.4165389672397 | etot = -16.5730172276584
+271000  ekin = 2.21923220579694 |  erot = 3.10768708967445 | epot = -21.2197121954352 | etot = -15.8927928999638
+272000  ekin = 2.54992061853164 |  erot = 2.29721880581853 | epot = -21.0816515756818 | etot = -16.2345121513317
+273000  ekin = 1.91461840783801 |  erot = 2.01420401968474 | epot = -21.0503637141725 | etot = -17.1215412866498
+274000  ekin = 1.89671513770877 |  erot = 2.24334386161734 | epot = -21.09671034383 | etot = -16.9566513445039
+275000  ekin = 1.78930707116537 |  erot = 3.0975468786599 | epot = -21.1385700371941 | etot = -16.2517160873688
+276000  ekin = 3.37110328153969 |  erot = 2.4195732425753 | epot = -21.0908388312032 | etot = -15.3001623070883
+277000  ekin = 2.38921825148496 |  erot = 1.50604988822735 | epot = -21.0346208839969 | etot = -17.1393527442846
+278000  ekin = 2.51997301930637 |  erot = 2.14026171776895 | epot = -21.0117379332913 | etot = -16.351503196216
+279000  ekin = 1.88315206280857 |  erot = 2.37342905263992 | epot = -20.9993757709145 | etot = -16.742794655466
+280000  ekin = 2.33534713190787 |  erot = 3.5862646828722 | epot = -20.8573252930133 | etot = -14.9357134782333
+281000  ekin = 1.75252641954511 |  erot = 1.7907930540809 | epot = -20.9036528826791 | etot = -17.3603334090531
+282000  ekin = 2.26373977259215 |  erot = 3.04032073608634 | epot = -20.8497513702237 | etot = -15.5456908615452
+283000  ekin = 2.17833871394429 |  erot = 2.20833158301337 | epot = -20.8002776734785 | etot = -16.4136073765208
+284000  ekin = 1.9148667268656 |  erot = 2.21521993135969 | epot = -20.8277491648056 | etot = -16.6976625065803
+285000  ekin = 3.15634443167765 |  erot = 1.8003323160485 | epot = -21.0046435881196 | etot = -16.0479668403934
+286000  ekin = 3.8487757495733 |  erot = 1.82969969667575 | epot = -21.1628555811447 | etot = -15.4843801348956
+287000  ekin = 3.60615742824732 |  erot = 2.91608688151216 | epot = -21.2126952882302 | etot = -14.6904509784707
+288000  ekin = 3.19613259393802 |  erot = 1.67736393077136 | epot = -21.1713552834963 | etot = -16.297858758787
+289000  ekin = 2.45584885114799 |  erot = 2.77781979747334 | epot = -21.1669115721543 | etot = -15.9332429235329
+290000  ekin = 2.74570408981358 |  erot = 2.40443247852242 | epot = -21.1874427766533 | etot = -16.0373062083173
+291000  ekin = 2.10295274468233 |  erot = 2.37092484671536 | epot = -21.2419107014543 | etot = -16.7680331100566
+292000  ekin = 2.36118713930733 |  erot = 2.05558127949018 | epot = -21.3137361602548 | etot = -16.8969677414573
+293000  ekin = 2.27861963088251 |  erot = 2.35874555054765 | epot = -21.4302415460532 | etot = -16.7928763646231
+294000  ekin = 2.9331598281302 |  erot = 2.90313008187785 | epot = -21.5210917917479 | etot = -15.6848018817398
+295000  ekin = 2.66360761710435 |  erot = 2.28100565751945 | epot = -21.6885021477336 | etot = -16.7438888731098
+296000  ekin = 2.1876782716447 |  erot = 2.90589885547355 | epot = -21.7355037190159 | etot = -16.6419265918976
+297000  ekin = 2.15987738107364 |  erot = 3.29819575592636 | epot = -21.7177655658755 | etot = -16.2596924288755
+298000  ekin = 2.92956976611296 |  erot = 2.36377210613469 | epot = -21.6748271071565 | etot = -16.3814852349089
+299000  ekin = 3.19167138064488 |  erot = 2.23480811780852 | epot = -21.8042612344918 | etot = -16.3777817360384
+300000  ekin = 3.31335728469821 |  erot = 1.38932157247169 | epot = -21.8799906137234 | etot = -17.1773117565535
+301000  ekin = 2.39061971962409 |  erot = 3.30110260608967 | epot = -21.8919200817915 | etot = -16.2001977560777
+302000  ekin = 2.95446070602901 |  erot = 3.2304815881765 | epot = -21.8557645140423 | etot = -15.6708222198368
+303000  ekin = 2.44700205353934 |  erot = 2.60676303242281 | epot = -21.8414046718167 | etot = -16.7876395858546
+304000  ekin = 2.23578509140698 |  erot = 2.68770420047941 | epot = -21.7680601199659 | etot = -16.8445708280795
+305000  ekin = 2.35505207220215 |  erot = 2.38230031155849 | epot = -21.7344089784493 | etot = -16.9970565946886
+306000  ekin = 1.91790567526689 |  erot = 2.9010749400323 | epot = -21.717000482235 | etot = -16.8980198669359
+307000  ekin = 2.48241777758708 |  erot = 2.0836708009946 | epot = -21.6510481218459 | etot = -17.0849595432642
+308000  ekin = 2.77531620706104 |  erot = 2.63103510715158 | epot = -21.6349123878085 | etot = -16.2285610735959
+309000  ekin = 2.30440955942791 |  erot = 2.1249829765834 | epot = -21.5927938975113 | etot = -17.1634013615
+310000  ekin = 2.50879527040005 |  erot = 3.21338829421538 | epot = -21.6043932917724 | etot = -15.882209727157
+311000  ekin = 2.31939145866558 |  erot = 3.03649241514155 | epot = -21.6247503351754 | etot = -16.2688664613682
+312000  ekin = 1.78383134659847 |  erot = 3.26262247889992 | epot = -21.4948144284683 | etot = -16.4483606029699
+313000  ekin = 1.6465994694839 |  erot = 2.08133087588837 | epot = -21.4920309735611 | etot = -17.7641006281888
+314000  ekin = 2.2552391830868 |  erot = 2.55077633299238 | epot = -21.5103692936943 | etot = -16.7043537776152
+315000  ekin = 2.53527343915149 |  erot = 2.13089997124612 | epot = -21.5923709217299 | etot = -16.9261975113323
+316000  ekin = 1.99944427781285 |  erot = 1.80072924409704 | epot = -21.6039893771529 | etot = -17.803815855243
+317000  ekin = 2.11848744585804 |  erot = 2.01459693810074 | epot = -21.5948976630665 | etot = -17.4618132791077
+318000  ekin = 2.29013024301854 |  erot = 1.92405818620914 | epot = -21.564369594692 | etot = -17.3501811654644
+319000  ekin = 1.97314693278018 |  erot = 1.67996578959134 | epot = -21.455480840084 | etot = -17.8023681177125
+320000  ekin = 2.45681719546632 |  erot = 3.0783514449974 | epot = -21.39241255381 | etot = -15.8572439133463
+321000  ekin = 1.85729238455499 |  erot = 2.67083565671244 | epot = -21.4338188292509 | etot = -16.9056907879835
+322000  ekin = 1.96132292396412 |  erot = 3.36792274118282 | epot = -21.3663490830084 | etot = -16.0371034178615
+323000  ekin = 1.94437285233568 |  erot = 2.09558156605688 | epot = -21.4151250968679 | etot = -17.3751706784753
+324000  ekin = 2.229181524904 |  erot = 2.4674418745061 | epot = -21.5323859085629 | etot = -16.8357625091528
+325000  ekin = 2.74582842770392 |  erot = 2.36717454305098 | epot = -21.6443544237971 | etot = -16.5313514530422
+326000  ekin = 1.91124551133375 |  erot = 1.93084217743114 | epot = -21.7077957426601 | etot = -17.8657080538952
+327000  ekin = 3.05627483509655 |  erot = 1.67325209460962 | epot = -21.7948818019127 | etot = -17.0653548722066
+328000  ekin = 2.73933273476856 |  erot = 1.92380912803776 | epot = -21.8364014823585 | etot = -17.1732596195522
+329000  ekin = 2.95907896099514 |  erot = 3.1565416835668 | epot = -21.898199971646 | etot = -15.782579327084
+330000  ekin = 2.90795110595274 |  erot = 2.01765890034967 | epot = -21.9037795505257 | etot = -16.9781695442233
+331000  ekin = 2.27446048340228 |  erot = 2.03754878634057 | epot = -21.8760842049291 | etot = -17.5640749351862
+332000  ekin = 2.43262938612094 |  erot = 3.19219171897212 | epot = -21.9305186945661 | etot = -16.3056975894731
+333000  ekin = 2.47357651298171 |  erot = 2.700610458147 | epot = -22.0416691323271 | etot = -16.8674821611983
+334000  ekin = 2.38171387374892 |  erot = 3.00424927873367 | epot = -22.0746318522987 | etot = -16.6886686998161
+335000  ekin = 2.10465470910016 |  erot = 3.57382014016835 | epot = -22.1175420615631 | etot = -16.4390672122946
+336000  ekin = 2.61374577374184 |  erot = 2.133869272813 | epot = -22.0898825119599 | etot = -17.3422674654051
+337000  ekin = 2.72124526751511 |  erot = 2.748004804814 | epot = -22.076853713162 | etot = -16.6076036408329
+338000  ekin = 1.83524121485422 |  erot = 2.24338894827196 | epot = -22.1591955034455 | etot = -18.0805653403193
+339000  ekin = 1.54928432997333 |  erot = 2.49812246084902 | epot = -22.2022398834669 | etot = -18.1548330926446
+340000  ekin = 1.44405714940631 |  erot = 4.0451327092417 | epot = -22.1149458734012 | etot = -16.6257560147532
+341000  ekin = 1.67447392575554 |  erot = 2.77749751745985 | epot = -22.0760831546714 | etot = -17.624111711456
+342000  ekin = 1.9825676117275 |  erot = 2.71655566521085 | epot = -22.1563522566983 | etot = -17.4572289797599
+343000  ekin = 2.68213676683887 |  erot = 3.16686462846914 | epot = -22.2498477633288 | etot = -16.4008463680208
+344000  ekin = 1.77905771753907 |  erot = 2.19153667254072 | epot = -22.2907212723871 | etot = -18.3201268823073
+345000  ekin = 1.5460499615042 |  erot = 1.85960255696713 | epot = -22.3447003428976 | etot = -18.9390478244263
+346000  ekin = 1.71554664484034 |  erot = 1.79880968736712 | epot = -22.3117022609054 | etot = -18.7973459286979
+347000  ekin = 1.38672912049481 |  erot = 2.61484473767932 | epot = -22.3325032395119 | etot = -18.3309293813378
+348000  ekin = 2.15015924850684 |  erot = 2.86300326453563 | epot = -22.3337312775956 | etot = -17.3205687645531
+349000  ekin = 1.83066085453602 |  erot = 1.98441326494869 | epot = -22.3967822584584 | etot = -18.5817081389737
+350000  ekin = 1.83318738252649 |  erot = 2.56907029661255 | epot = -22.4577827539416 | etot = -18.0555250748025
+351000  ekin = 1.72790505260219 |  erot = 2.87456274671835 | epot = -22.5159555107051 | etot = -17.9134877113846
+352000  ekin = 2.80786740016944 |  erot = 2.0875044812577 | epot = -22.6549834386892 | etot = -17.759611557262
+353000  ekin = 3.5492801472091 |  erot = 1.42584537334882 | epot = -22.6849212734238 | etot = -17.7097957528659
+354000  ekin = 3.49129244374804 |  erot = 2.25156548638802 | epot = -22.6041826206929 | etot = -16.8613246905569
+355000  ekin = 2.06248783371663 |  erot = 2.92733565233051 | epot = -22.5494488364626 | etot = -17.5596253504155
+356000  ekin = 2.13415426306311 |  erot = 3.32668319049642 | epot = -22.6122425286522 | etot = -17.1514050750926
+357000  ekin = 2.75897049849731 |  erot = 2.51843165594441 | epot = -22.6042888591884 | etot = -17.3268867047467
+358000  ekin = 2.51778220496547 |  erot = 2.28374144764325 | epot = -22.5654155469983 | etot = -17.7638918943896
+359000  ekin = 3.2037278512604 |  erot = 2.5552016027623 | epot = -22.6749569097325 | etot = -16.9160274557098
+360000  ekin = 2.52669169359922 |  erot = 1.97563796824026 | epot = -22.7314557612253 | etot = -18.2291260993859
+361000  ekin = 2.60424632123629 |  erot = 2.51068088850828 | epot = -22.771502374375 | etot = -17.6565751646305
+362000  ekin = 2.43350156723209 |  erot = 3.84566788758402 | epot = -22.7352151098033 | etot = -16.4560456549872
+363000  ekin = 2.91069717970493 |  erot = 1.99710098714123 | epot = -22.6302259934473 | etot = -17.7224278266012
+364000  ekin = 2.25538328683251 |  erot = 1.87832387363457 | epot = -22.508362529619 | etot = -18.3746553691519
+365000  ekin = 2.04575884197224 |  erot = 2.79774206841199 | epot = -22.3322627384259 | etot = -17.4887618280416
+366000  ekin = 2.26894187965217 |  erot = 1.94379382552235 | epot = -22.2788727984905 | etot = -18.066137093316
+367000  ekin = 2.82509630766736 |  erot = 2.50361468767087 | epot = -22.3209381619451 | etot = -16.9922271666069
+368000  ekin = 2.81542036602321 |  erot = 2.1873362764449 | epot = -22.4297259451244 | etot = -17.4269693026563
+369000  ekin = 2.30426035796381 |  erot = 2.85653411706989 | epot = -22.4923286665587 | etot = -17.331534191525
+370000  ekin = 2.67871033327546 |  erot = 2.11464921695178 | epot = -22.5780698607969 | etot = -17.7847103105697
+371000  ekin = 2.19281044135006 |  erot = 3.6016596066429 | epot = -22.6424730832336 | etot = -16.8480030352406
+372000  ekin = 1.77481259468411 |  erot = 3.40654744438101 | epot = -22.7147683829007 | etot = -17.5334083438356
+373000  ekin = 2.15551547517191 |  erot = 2.78778252361832 | epot = -22.755949721432 | etot = -17.8126517226417
+374000  ekin = 2.71938368055485 |  erot = 3.58127823243844 | epot = -22.9084433694728 | etot = -16.6077814564795
+375000  ekin = 2.42759321485977 |  erot = 2.97421271787163 | epot = -22.9740378563777 | etot = -17.5722319236463
+376000  ekin = 3.39126830110572 |  erot = 3.24733797625005 | epot = -22.9874015798134 | etot = -16.3487953024577
+377000  ekin = 3.20966733323473 |  erot = 2.6593406036448 | epot = -22.9452111216364 | etot = -17.0762031847569
+378000  ekin = 1.56095946168132 |  erot = 2.6615903394499 | epot = -22.9575870308252 | etot = -18.735037229694
+379000  ekin = 1.94985687485381 |  erot = 2.5408521625583 | epot = -22.9834751642938 | etot = -18.4927661268817
+380000  ekin = 2.65820438237073 |  erot = 2.88045867212572 | epot = -22.9984703542082 | etot = -17.4598072997117
+381000  ekin = 2.97084599252829 |  erot = 2.18892549461573 | epot = -23.0341895570111 | etot = -17.8744180698671
+382000  ekin = 2.61355176942653 |  erot = 2.02938704043227 | epot = -23.0084119715099 | etot = -18.3654731616511
+383000  ekin = 2.03830671072154 |  erot = 2.50516194855526 | epot = -23.0393965606452 | etot = -18.4959279013684
+384000  ekin = 2.1060608733416 |  erot = 2.21840250458949 | epot = -23.0602182522592 | etot = -18.7357548743281
+385000  ekin = 1.89114918519107 |  erot = 1.63701051320101 | epot = -23.0834434146805 | etot = -19.5552837162885
+386000  ekin = 1.55124380123707 |  erot = 1.36147797265396 | epot = -23.1300518396948 | etot = -20.2173300658038
+387000  ekin = 2.19627825752355 |  erot = 1.75751396098972 | epot = -23.1280875332419 | etot = -19.1742953147286
+388000  ekin = 1.96387084539616 |  erot = 1.95852585326806 | epot = -23.0327752892414 | etot = -19.1103785905772
+389000  ekin = 2.50801560941705 |  erot = 2.32519825784834 | epot = -23.0011464671234 | etot = -18.167932599858
+390000  ekin = 2.03596866068489 |  erot = 1.88295618907178 | epot = -22.8810338311574 | etot = -18.9621089814008
+391000  ekin = 1.8098591016452 |  erot = 2.39622167162876 | epot = -22.8195566463199 | etot = -18.613475873046
+392000  ekin = 2.17725370142732 |  erot = 2.87094426544089 | epot = -22.7839731045438 | etot = -17.7357751376756
+393000  ekin = 2.14224634181996 |  erot = 3.1724297430366 | epot = -22.8435025538356 | etot = -17.5288264689791
+394000  ekin = 1.97769550804366 |  erot = 2.16375300420729 | epot = -22.8342667825711 | etot = -18.6928182703201
+395000  ekin = 2.03687268736298 |  erot = 2.49567469731649 | epot = -22.8892034986303 | etot = -18.3566561139508
+396000  ekin = 2.16189109047463 |  erot = 1.95308746486161 | epot = -22.9781386034885 | etot = -18.8631600481523
+397000  ekin = 2.41744222422408 |  erot = 1.65310699287474 | epot = -23.0900453292844 | etot = -19.0194961121856
+398000  ekin = 3.58905654436294 |  erot = 2.5193025650333 | epot = -23.2070733343384 | etot = -17.0987142249422
+399000  ekin = 2.65051654249497 |  erot = 1.78138450529863 | epot = -23.3040478764214 | etot = -18.8721468286278
+400000  ekin = 2.49402752614129 |  erot = 2.10290777432181 | epot = -23.3608759462318 | etot = -18.7639406457687
+401000  ekin = 2.04176177605463 |  erot = 2.154995213856 | epot = -23.403960339401 | etot = -19.2072033494904
+402000  ekin = 2.4450587586146 |  erot = 2.11318097973378 | epot = -23.3975262709887 | etot = -18.8392865326403
+403000  ekin = 2.54858079745147 |  erot = 2.81138206601918 | epot = -23.4760646986769 | etot = -18.1161018352062
+404000  ekin = 2.21063952462117 |  erot = 2.64710865829565 | epot = -23.574696037266 | etot = -18.7169478543492
+405000  ekin = 2.47328118101333 |  erot = 2.40933750599425 | epot = -23.5927917139468 | etot = -18.7101730269392
+406000  ekin = 2.24891173527799 |  erot = 2.23777884116048 | epot = -23.6086191890416 | etot = -19.1219286126031
+407000  ekin = 2.0107940045037 |  erot = 2.78642832526901 | epot = -23.5246032469977 | etot = -18.727380917225
+408000  ekin = 2.59464051790823 |  erot = 2.59123578102095 | epot = -23.4198302602655 | etot = -18.2339539613363
+409000  ekin = 2.37170880608735 |  erot = 2.26136902851216 | epot = -23.3172581937239 | etot = -18.6841803591244
+410000  ekin = 1.99754661347186 |  erot = 1.95523998485755 | epot = -23.2950402043272 | etot = -19.3422536059978
+411000  ekin = 1.8693657058423 |  erot = 2.63899492681176 | epot = -23.249036763304 | etot = -18.7406761306499
+412000  ekin = 1.98214047746227 |  erot = 2.68315820775203 | epot = -23.198735748328 | etot = -18.5334370631137
+413000  ekin = 2.39078873487372 |  erot = 2.65589562872907 | epot = -23.1435198518626 | etot = -18.0968354882598
+414000  ekin = 2.40821090859774 |  erot = 1.75574324408226 | epot = -23.0725048141376 | etot = -18.9085506614576
+415000  ekin = 2.74601981183014 |  erot = 2.43675176686817 | epot = -23.1211711904485 | etot = -17.9383996117502
+416000  ekin = 2.08828454200993 |  erot = 2.7678350652622 | epot = -23.1383119239964 | etot = -18.2821923167243
+417000  ekin = 2.01455344430628 |  erot = 1.95306265456051 | epot = -23.1433633505286 | etot = -19.1757472516618
+418000  ekin = 2.42716528853986 |  erot = 2.57642821145487 | epot = -23.1275317971309 | etot = -18.1239382971362
+419000  ekin = 3.04095103685797 |  erot = 2.58427576972737 | epot = -23.0602279332616 | etot = -17.4350011266763
+420000  ekin = 2.6360746280152 |  erot = 2.44478111019392 | epot = -22.9820923151719 | etot = -17.9012365769628
+421000  ekin = 2.53019765722915 |  erot = 1.78389585255477 | epot = -22.9707435541328 | etot = -18.6566500443489
+422000  ekin = 2.72457425772367 |  erot = 1.6776863488635 | epot = -22.9542997027494 | etot = -18.5520390961622
+423000  ekin = 2.11402997037893 |  erot = 2.55034580375606 | epot = -22.8263851956496 | etot = -18.1620094215146
+424000  ekin = 1.8895880210325 |  erot = 2.31332431343562 | epot = -22.7726668881719 | etot = -18.5697545537038
+425000  ekin = 2.3595116370971 |  erot = 1.95762380637299 | epot = -22.7752082759345 | etot = -18.4580728324644
+426000  ekin = 2.23706657164627 |  erot = 2.60016134755149 | epot = -22.7844114251539 | etot = -17.9471835059561
+427000  ekin = 1.88801598248841 |  erot = 2.12415782350884 | epot = -22.9416586386638 | etot = -18.9294848326665
+428000  ekin = 1.92849031333042 |  erot = 2.44097902588718 | epot = -23.0611368174398 | etot = -18.6916674782222
+429000  ekin = 1.70536802258415 |  erot = 2.14916257389791 | epot = -23.0556586745392 | etot = -19.2011280780571
+430000  ekin = 2.30226095973205 |  erot = 2.14689932813605 | epot = -23.0606502516207 | etot = -18.6114899637526
+431000  ekin = 2.45988288454318 |  erot = 2.42278380298656 | epot = -23.072977722388 | etot = -18.1903110348583
+432000  ekin = 2.80869332724974 |  erot = 2.19954129490929 | epot = -23.0939746542043 | etot = -18.0857400320453
+433000  ekin = 2.21130556188281 |  erot = 1.62882156110629 | epot = -23.1534080352157 | etot = -19.3132809122266
+434000  ekin = 2.60574953870751 |  erot = 2.36088790768805 | epot = -23.1901717047878 | etot = -18.2235342583922
+435000  ekin = 2.30377529593091 |  erot = 2.53917715731258 | epot = -23.1716983948431 | etot = -18.3287459415996
+436000  ekin = 2.42707603554826 |  erot = 2.75234181061923 | epot = -23.2197996577196 | etot = -18.0403818115521
+437000  ekin = 1.65090540276075 |  erot = 3.25345231298367 | epot = -23.2216366145387 | etot = -18.3172788987943
+438000  ekin = 1.56145302974407 |  erot = 2.60950810563797 | epot = -23.1303770792278 | etot = -18.9594159438457
+439000  ekin = 2.30955439722235 |  erot = 1.94011743371101 | epot = -23.1353170794496 | etot = -18.8856452485163
+440000  ekin = 2.53037674867674 |  erot = 3.06527042861028 | epot = -23.1968589452919 | etot = -17.6012117680049
+441000  ekin = 2.80107707952535 |  erot = 2.53664155736543 | epot = -23.1712373428918 | etot = -17.833518706001
+442000  ekin = 2.92536323090713 |  erot = 2.88384500930019 | epot = -23.1123001627208 | etot = -17.3030919225134
+443000  ekin = 1.96543935969483 |  erot = 1.75344963155201 | epot = -23.0380529084377 | etot = -19.3191639171909
+444000  ekin = 2.00309477401364 |  erot = 2.23897509587737 | epot = -22.9472103119533 | etot = -18.7051404420622
+445000  ekin = 2.20302071819723 |  erot = 2.06928381371827 | epot = -22.7775434364172 | etot = -18.5052389045017
+446000  ekin = 2.43487889302299 |  erot = 2.377515560078 | epot = -22.6838190597697 | etot = -17.8714246066687
+447000  ekin = 2.2620819636031 |  erot = 2.41400188145195 | epot = -22.7082516636545 | etot = -18.0321678185995
+448000  ekin = 2.16184472791984 |  erot = 1.93539407204276 | epot = -22.8144859493263 | etot = -18.7172471493637
+449000  ekin = 2.21107967973114 |  erot = 2.3465968297874 | epot = -22.9059503054159 | etot = -18.3482737958973
+450000  ekin = 2.74677740004439 |  erot = 1.97222921372039 | epot = -22.860755926716 | etot = -18.1417493129512
+451000  ekin = 2.2050889378155 |  erot = 2.13042736119388 | epot = -22.8862608894795 | etot = -18.5507445904702
+452000  ekin = 2.52760608607095 |  erot = 2.34006815636601 | epot = -22.9138111972132 | etot = -18.0461369547763
+453000  ekin = 2.23448825172916 |  erot = 1.77834418215733 | epot = -22.887923830179 | etot = -18.8750913962925
+454000  ekin = 2.4343851915949 |  erot = 2.59700848533281 | epot = -22.8184361849035 | etot = -17.7870425079758
+455000  ekin = 2.04195793930991 |  erot = 2.79639043747678 | epot = -22.6032980500353 | etot = -17.7649496732486
+456000  ekin = 2.00799933710202 |  erot = 2.53653815407518 | epot = -22.4355596266521 | etot = -17.8910221354749
+457000  ekin = 2.60426208759882 |  erot = 2.4660961287619 | epot = -22.3409120082077 | etot = -17.270553791847
+458000  ekin = 2.01368468059036 |  erot = 1.99613816245311 | epot = -22.2549400327204 | etot = -18.245117189677
+459000  ekin = 1.73688781588864 |  erot = 2.48572034306896 | epot = -22.2282088298766 | etot = -18.005600670919
+460000  ekin = 1.91682575775988 |  erot = 2.08308677023945 | epot = -22.2211874714415 | etot = -18.2212749434422
+461000  ekin = 1.54933673126937 |  erot = 1.29454502815254 | epot = -22.1945151049366 | etot = -19.3506333455147
+462000  ekin = 2.44160489340629 |  erot = 1.34721473707676 | epot = -22.2846713076969 | etot = -18.4958516772139
+463000  ekin = 2.63165365707666 |  erot = 2.0814376012804 | epot = -22.4004513395624 | etot = -17.6873600812053
+464000  ekin = 2.67929276186416 |  erot = 3.72563793061089 | epot = -22.5200042545287 | etot = -16.1150735620537
+465000  ekin = 1.94880111369478 |  erot = 2.23148844819347 | epot = -22.6855542963289 | etot = -18.5052647344406
+466000  ekin = 2.1385304963889 |  erot = 2.95056624305954 | epot = -22.7822881705531 | etot = -17.6931914311046
+467000  ekin = 2.46452767169614 |  erot = 2.10778480770081 | epot = -22.9485753844865 | etot = -18.3762629050896
+468000  ekin = 1.98589158006998 |  erot = 1.62816092182055 | epot = -23.0180008829523 | etot = -19.4039483810618
+469000  ekin = 2.498810820967 |  erot = 2.63615462725918 | epot = -23.054783396884 | etot = -17.9198179486578
+470000  ekin = 2.91491361681312 |  erot = 3.19115611298995 | epot = -23.0448741101698 | etot = -16.9388043803668
+471000  ekin = 2.37554627514204 |  erot = 1.71739792236247 | epot = -22.9932329645512 | etot = -18.9002887670467
+472000  ekin = 2.18486807923518 |  erot = 2.00687069908099 | epot = -22.9563182572701 | etot = -18.7645794789539
+473000  ekin = 2.36185345820898 |  erot = 2.86259041401026 | epot = -22.9161024426124 | etot = -17.6916585703932
+474000  ekin = 2.17077693495272 |  erot = 2.59376596740917 | epot = -22.7894018760352 | etot = -18.0248589736733
+475000  ekin = 2.37844153079293 |  erot = 2.01112751381906 | epot = -22.6793191497968 | etot = -18.2897501051848
+476000  ekin = 2.08763676439641 |  erot = 2.5964762445522 | epot = -22.6700039875051 | etot = -17.9858909785565
+477000  ekin = 2.52249432714936 |  erot = 3.55251934739866 | epot = -22.6424099194916 | etot = -16.5673962449435
+478000  ekin = 2.40424947791157 |  erot = 2.73239117258612 | epot = -22.5447763252279 | etot = -17.4081356747302
+479000  ekin = 1.27637524434413 |  erot = 2.99749792697948 | epot = -22.4994949498981 | etot = -18.2256217785744
+480000  ekin = 1.81374950293816 |  erot = 2.1438931713594 | epot = -22.4678405170784 | etot = -18.5101978427808
+481000  ekin = 2.39496774186199 |  erot = 3.18299441824516 | epot = -22.4930736763177 | etot = -16.9151115162106
+482000  ekin = 3.21051763720184 |  erot = 2.40962326270832 | epot = -22.4479376181303 | etot = -16.8277967182201
+483000  ekin = 3.06081116762376 |  erot = 2.49856996934408 | epot = -22.4288948733282 | etot = -16.8695137363604
+484000  ekin = 2.7452293328759 |  erot = 2.53012629993102 | epot = -22.483756332919 | etot = -17.2084007001121
+485000  ekin = 3.3310309518052 |  erot = 2.42091818181916 | epot = -22.4922555047181 | etot = -16.7403063710937
+486000  ekin = 1.99323479363108 |  erot = 1.76127718142274 | epot = -22.5432098594131 | etot = -18.7886978843592
+487000  ekin = 2.64825718911654 |  erot = 2.50204426232018 | epot = -22.6407366935241 | etot = -17.4904352420874
+488000  ekin = 1.76385891719471 |  erot = 2.64266555173499 | epot = -22.6990728058785 | etot = -18.2925483369488
+489000  ekin = 2.10357630534276 |  erot = 2.95613916443126 | epot = -22.7877124402072 | etot = -17.7279969704332
+490000  ekin = 2.33515649128315 |  erot = 2.32995416999058 | epot = -22.7920703811402 | etot = -18.1269597198665
+491000  ekin = 2.48752587426648 |  erot = 2.58310949760556 | epot = -22.7834811495388 | etot = -17.7128457776667
+492000  ekin = 3.2982066520449 |  erot = 2.18682924183924 | epot = -22.7674519489923 | etot = -17.2824160551081
+493000  ekin = 3.40238156707507 |  erot = 2.35717041222451 | epot = -22.7149408840448 | etot = -16.9553889047452
+494000  ekin = 3.59348050162499 |  erot = 2.23182460532056 | epot = -22.708168229549 | etot = -16.8828631226035
+495000  ekin = 2.52030309238563 |  erot = 2.16229430067424 | epot = -22.6973031832711 | etot = -18.0147057902112
+496000  ekin = 1.96100991422337 |  erot = 3.58581695215167 | epot = -22.7342002900882 | etot = -17.1873734237132
+497000  ekin = 2.22286479259681 |  erot = 2.49495319949133 | epot = -22.752706201593 | etot = -18.0348882095048
+498000  ekin = 1.71033952564695 |  erot = 2.41331591511583 | epot = -22.7131621100867 | etot = -18.5895066693239
+499000  ekin = 2.4191986430073 |  erot = 2.8234951953182 | epot = -22.7304918052926 | etot = -17.4877979669671
+500000  ekin = 2.76271068346558 |  erot = 2.22796445937143 | epot = -22.810945568044 | etot = -17.820270425207
+501000  ekin = 2.97642553987186 |  erot = 1.97769778889399 | epot = -22.8306304048615 | etot = -17.8765070760957
+502000  ekin = 2.96175345860855 |  erot = 1.80859086419486 | epot = -22.8525538190094 | etot = -18.082209496206
+503000  ekin = 2.51126831088416 |  erot = 2.88572311841927 | epot = -22.8673362278445 | etot = -17.4703447985411
+504000  ekin = 2.84611165351303 |  erot = 2.67626783872459 | epot = -22.784891957601 | etot = -17.2625124653634
+505000  ekin = 2.96124584448914 |  erot = 2.59100575301931 | epot = -22.8251284225259 | etot = -17.2728768250174
+506000  ekin = 2.19858217910528 |  erot = 1.97142936872076 | epot = -22.8530995461461 | etot = -18.6830879983201
+507000  ekin = 2.27398115142402 |  erot = 2.68837996151519 | epot = -22.8141163798141 | etot = -17.8517552668749
+508000  ekin = 2.64439339973838 |  erot = 2.0475646786945 | epot = -22.8146247157345 | etot = -18.1226666373017
+509000  ekin = 2.96023637315629 |  erot = 2.90549934754533 | epot = -22.8719625385966 | etot = -17.006226817895
+510000  ekin = 2.26067558634545 |  erot = 2.8086491851952 | epot = -22.9774448292235 | etot = -17.9081200576829
+511000  ekin = 2.88512738978599 |  erot = 2.15263877534437 | epot = -23.0866728482479 | etot = -18.0489066831176
+512000  ekin = 2.17783748155516 |  erot = 2.31389139764185 | epot = -23.1520181882638 | etot = -18.6602893090668
+513000  ekin = 1.69717952556151 |  erot = 2.88265468656803 | epot = -23.1640284548406 | etot = -18.5841942427111
+514000  ekin = 1.72432024724117 |  erot = 2.32742209152174 | epot = -23.1602225830814 | etot = -19.1084802443185
+515000  ekin = 2.00525337522086 |  erot = 1.80102864435032 | epot = -23.1548763180746 | etot = -19.3485942985034
+516000  ekin = 3.04706172157038 |  erot = 1.54171785431327 | epot = -23.1202751246552 | etot = -18.5314955487715
+517000  ekin = 2.47323892251936 |  erot = 2.10799615007356 | epot = -23.0942246440307 | etot = -18.5129895714378
+518000  ekin = 2.03556879740597 |  erot = 2.51531294708502 | epot = -23.01998934344 | etot = -18.469107598949
+519000  ekin = 1.59255614728459 |  erot = 1.63520468579906 | epot = -22.9787913166931 | etot = -19.7510304836094
+520000  ekin = 2.17210761761844 |  erot = 1.89753667353918 | epot = -22.9877149955356 | etot = -18.918070704378
+521000  ekin = 1.98466680078867 |  erot = 2.09219045542652 | epot = -23.0348541858322 | etot = -18.957996929617
+522000  ekin = 2.72098469914433 |  erot = 2.1956565861946 | epot = -23.1001210576501 | etot = -18.1834797723112
+523000  ekin = 2.26033454380754 |  erot = 1.67112114369622 | epot = -23.1475509854344 | etot = -19.2160952979307
+524000  ekin = 2.34603831546138 |  erot = 2.10546610119491 | epot = -23.1746761633772 | etot = -18.7231717467209
+525000  ekin = 2.13671314300235 |  erot = 2.07172081705865 | epot = -23.241177743004 | etot = -19.032743782943
+526000  ekin = 2.50849953901566 |  erot = 2.27662230434507 | epot = -23.3179050583979 | etot = -18.5327832150372
+527000  ekin = 3.04322527932213 |  erot = 1.8128057083239 | epot = -23.3977373118239 | etot = -18.5417063241779
+528000  ekin = 2.57230318237901 |  erot = 2.54386055260816 | epot = -23.4208428708382 | etot = -18.3046791358511
+529000  ekin = 2.39361269633634 |  erot = 1.91637577362227 | epot = -23.3966015599491 | etot = -19.0866130899905
+530000  ekin = 3.35629379074241 |  erot = 3.41683815876465 | epot = -23.2977853851851 | etot = -16.5246534356781
+531000  ekin = 2.52741741752382 |  erot = 2.3407534240764 | epot = -23.1721175623278 | etot = -18.3039467207275
+532000  ekin = 2.78397051305127 |  erot = 1.78575123294092 | epot = -23.2171711834401 | etot = -18.6474494374479
+533000  ekin = 2.27408274334042 |  erot = 2.01427501035043 | epot = -23.2885684059726 | etot = -19.0002106522818
+534000  ekin = 2.54998010491124 |  erot = 2.01645453645071 | epot = -23.340767920006 | etot = -18.7743332786441
+535000  ekin = 2.49595662250557 |  erot = 2.09586427439367 | epot = -23.3878755759449 | etot = -18.7960546790457
+536000  ekin = 2.47717157546008 |  erot = 1.92116873587366 | epot = -23.3847675210095 | etot = -18.9864272096758
+537000  ekin = 1.75235621440223 |  erot = 2.11852052216088 | epot = -23.4590860280326 | etot = -19.5882092914695
+538000  ekin = 2.19317209186636 |  erot = 2.75191518419655 | epot = -23.5517834707225 | etot = -18.6066961946596
+539000  ekin = 2.16135327665118 |  erot = 2.25935011393787 | epot = -23.5718250119028 | etot = -19.1511216213138
+540000  ekin = 2.35701554620647 |  erot = 1.64495290573329 | epot = -23.5490867129451 | etot = -19.5471182610053
+541000  ekin = 2.61451212811978 |  erot = 2.52550284426681 | epot = -23.5334576350384 | etot = -18.3934426626519
+542000  ekin = 2.78909215024064 |  erot = 2.09346850400964 | epot = -23.5754619290989 | etot = -18.6929012748486
+543000  ekin = 2.77024528778679 |  erot = 1.84116991183092 | epot = -23.4849560716084 | etot = -18.8735408719907
+544000  ekin = 2.1580752918837 |  erot = 1.50139575300258 | epot = -23.4530822422947 | etot = -19.7936111974084
+545000  ekin = 1.7286020488633 |  erot = 2.56468335549414 | epot = -23.4524953434144 | etot = -19.159209939057
+546000  ekin = 2.38494138419347 |  erot = 1.87772638427252 | epot = -23.4950389557033 | etot = -19.2323711872373
+547000  ekin = 2.44871634556834 |  erot = 2.44464466893215 | epot = -23.544915775382 | etot = -18.6515547608815
+548000  ekin = 2.36962922994878 |  erot = 2.40235228488721 | epot = -23.5548428056052 | etot = -18.7828612907692
+549000  ekin = 2.57958168249613 |  erot = 2.04930779813672 | epot = -23.5565149978683 | etot = -18.9276255172355
+550000  ekin = 1.97931366474269 |  erot = 1.85207468704395 | epot = -23.5614067919063 | etot = -19.7300184401196
+551000  ekin = 2.4121774327081 |  erot = 2.03489368862991 | epot = -23.5115216908382 | etot = -19.0644505695002
+552000  ekin = 2.6621149390197 |  erot = 1.41279265378133 | epot = -23.3450678435402 | etot = -19.2701602507391
+553000  ekin = 1.76359346131444 |  erot = 2.63019210822712 | epot = -23.1435570943958 | etot = -18.7497715248542
+554000  ekin = 2.29840754300074 |  erot = 2.34424452982823 | epot = -23.1114395278817 | etot = -18.4687874550527
+555000  ekin = 3.29672420152567 |  erot = 1.64146930698358 | epot = -23.0891292168917 | etot = -18.1509357083825
+556000  ekin = 2.92076699655597 |  erot = 2.59602967895814 | epot = -23.0268314200472 | etot = -17.5100347445331
+557000  ekin = 2.90322014804996 |  erot = 3.1605266889492 | epot = -23.0146480567181 | etot = -16.950901219719
+558000  ekin = 2.78018761002223 |  erot = 2.5982694700676 | epot = -22.7877399275349 | etot = -17.4092828474451
+559000  ekin = 2.48661596771862 |  erot = 3.22596665511857 | epot = -22.8226574327834 | etot = -17.1100748099462
+560000  ekin = 2.34942852601697 |  erot = 2.327731628774 | epot = -22.8255608134696 | etot = -18.1484006586786
+561000  ekin = 2.0520192544917 |  erot = 2.90306975046936 | epot = -22.8488516051139 | etot = -17.8937626001529
+562000  ekin = 2.18821919117372 |  erot = 3.66499439159822 | epot = -22.7618817506902 | etot = -16.9086681679183
+563000  ekin = 3.11505518852414 |  erot = 2.28057725990563 | epot = -22.791430640287 | etot = -17.3957981918573
+564000  ekin = 2.45343120006931 |  erot = 2.36321638506707 | epot = -22.75807077839 | etot = -17.9414231932536
+565000  ekin = 2.7783583550222 |  erot = 2.07073547186411 | epot = -22.7486053888412 | etot = -17.8995115619549
+566000  ekin = 2.43655641927934 |  erot = 2.19832280178868 | epot = -22.7227654505166 | etot = -18.0878862294486
+567000  ekin = 2.71233133108495 |  erot = 2.01281091173406 | epot = -22.8839744455115 | etot = -18.1588322026925
+568000  ekin = 3.12450796157709 |  erot = 1.93520150351062 | epot = -22.9625972279254 | etot = -17.9028877628377
+569000  ekin = 3.72714267701978 |  erot = 2.06562452789051 | epot = -22.9814174117752 | etot = -17.1886502068649
+570000  ekin = 2.68808623045676 |  erot = 2.36042122391806 | epot = -22.9989590266921 | etot = -17.9504515723172
+571000  ekin = 1.97223467321356 |  erot = 2.85558181274648 | epot = -22.9369001315648 | etot = -18.1090836456047
+572000  ekin = 2.41820497321229 |  erot = 2.40910077907643 | epot = -22.934930836907 | etot = -18.1076250846182
+573000  ekin = 1.76702714285011 |  erot = 2.31739567602696 | epot = -22.9768902017483 | etot = -18.8924673828712
+574000  ekin = 2.0874025921411 |  erot = 2.59288012722137 | epot = -23.0518321557917 | etot = -18.3715494364292
+575000  ekin = 2.34020490338785 |  erot = 2.78500973557001 | epot = -23.106579446946 | etot = -17.9813648079881
+576000  ekin = 2.15506609467458 |  erot = 3.30452875380292 | epot = -23.1521162771299 | etot = -17.6925214286524
+577000  ekin = 2.45698150895878 |  erot = 2.31876672704205 | epot = -23.1781917242716 | etot = -18.4024434882707
+578000  ekin = 2.59353106592521 |  erot = 2.33790294336519 | epot = -23.2101395643706 | etot = -18.2787055550802
+579000  ekin = 2.58102015460711 |  erot = 1.71748063175117 | epot = -23.1865014452815 | etot = -18.8880006589232
+580000  ekin = 2.30361750578347 |  erot = 2.8741056437962 | epot = -23.2045008793077 | etot = -18.026777729728
+581000  ekin = 2.45915247103345 |  erot = 2.59640238490727 | epot = -23.1882783600354 | etot = -18.1327235040947
+582000  ekin = 2.33801590725495 |  erot = 3.19256035650618 | epot = -23.2501410058056 | etot = -17.7195647420445
+583000  ekin = 1.95982078382854 |  erot = 2.81944051586209 | epot = -23.4085593869414 | etot = -18.6292980872508
+584000  ekin = 2.00358327245437 |  erot = 1.71267270263011 | epot = -23.4960310960901 | etot = -19.7797751210056
+585000  ekin = 2.28859150562676 |  erot = 2.0630904691126 | epot = -23.5306230166998 | etot = -19.1789410419605
+586000  ekin = 2.21858454582015 |  erot = 1.97776854350182 | epot = -23.4873397268816 | etot = -19.2909866375597
+587000  ekin = 3.70065233550663 |  erot = 1.82187748311298 | epot = -23.4652388428898 | etot = -17.9427090242702
+588000  ekin = 3.49447328534893 |  erot = 2.31981981591505 | epot = -23.3985567739262 | etot = -17.5842636726622
+589000  ekin = 2.66144502802388 |  erot = 3.02756546370718 | epot = -23.2783756079917 | etot = -17.5893651162606
+590000  ekin = 1.52141257336427 |  erot = 2.09874614600564 | epot = -23.1290158071881 | etot = -19.5088570878182
+591000  ekin = 1.82897193042274 |  erot = 1.75592223095375 | epot = -23.0622736076073 | etot = -19.4773794462309
+592000  ekin = 2.49491276892189 |  erot = 2.54829881978519 | epot = -23.054885494985 | etot = -18.0116739062779
+593000  ekin = 2.36845716276157 |  erot = 1.78503341410574 | epot = -23.005264310194 | etot = -18.8517737333267
+594000  ekin = 2.07907010887473 |  erot = 2.14563658430187 | epot = -22.9611396232755 | etot = -18.7364329300989
+595000  ekin = 2.62736231723873 |  erot = 2.03975825744529 | epot = -22.9495489717352 | etot = -18.2824283970512
+596000  ekin = 2.58985967531624 |  erot = 2.12449830164847 | epot = -22.9908505579802 | etot = -18.2764925810155
+597000  ekin = 3.02540042664856 |  erot = 3.14256707367046 | epot = -22.9740991012936 | etot = -16.8061316009745
+598000  ekin = 3.44397104083287 |  erot = 2.86057908398569 | epot = -23.0035411551227 | etot = -16.6989910303041
+599000  ekin = 2.13932500926498 |  erot = 3.49187029024977 | epot = -22.9657391359987 | etot = -17.334543836484
+600000  ekin = 2.19758597945325 |  erot = 2.49610822362373 | epot = -22.9452235009931 | etot = -18.2515292979161
+601000  ekin = 2.80918982916751 |  erot = 2.81768433603374 | epot = -22.8970508934525 | etot = -17.2701767282512
+602000  ekin = 2.30031523379462 |  erot = 2.40907304500536 | epot = -22.8523950981498 | etot = -18.1430068193498
+603000  ekin = 1.91335501396421 |  erot = 1.99518053980753 | epot = -22.7884152302357 | etot = -18.879879676464
+604000  ekin = 2.5976715095492 |  erot = 3.14351403383687 | epot = -22.7430641975848 | etot = -17.0018786541988
+605000  ekin = 2.63203298717973 |  erot = 2.07906613894389 | epot = -22.7307949909782 | etot = -18.0196958648546
+606000  ekin = 2.9467839928978 |  erot = 2.03982213630798 | epot = -22.6555302524726 | etot = -17.6689241232668
+607000  ekin = 2.85272606479019 |  erot = 2.36693467257681 | epot = -22.6318548820143 | etot = -17.4121941446473
+608000  ekin = 3.6642968125636 |  erot = 2.46706737589237 | epot = -22.5724662590777 | etot = -16.4411020706218
+609000  ekin = 2.69343886620625 |  erot = 2.25873504143679 | epot = -22.6007364465804 | etot = -17.6485625389374
+610000  ekin = 2.99904616523659 |  erot = 2.13621966615345 | epot = -22.5973658485054 | etot = -17.4621000171154
+611000  ekin = 3.86832985948945 |  erot = 2.12096644577641 | epot = -22.5702925425382 | etot = -16.5809962372723
+612000  ekin = 2.88515301824619 |  erot = 2.45910554524357 | epot = -22.4848584522585 | etot = -17.1405998887687
+613000  ekin = 2.9367425327116 |  erot = 2.14436169371535 | epot = -22.465526703267 | etot = -17.38442247684
+614000  ekin = 2.791164628763 |  erot = 2.02440953964802 | epot = -22.5207406301148 | etot = -17.7051664617038
+615000  ekin = 2.29338048298908 |  erot = 2.3882887247098 | epot = -22.6082782403584 | etot = -17.9266090326595
+616000  ekin = 1.78195169789474 |  erot = 2.45334803626969 | epot = -22.6887534547644 | etot = -18.4534537206
+617000  ekin = 2.57505808534158 |  erot = 2.55345758187858 | epot = -22.7014638394959 | etot = -17.5729481722758
+618000  ekin = 2.29561379442387 |  erot = 2.680432593555 | epot = -22.629958627306 | etot = -17.6539122393271
+619000  ekin = 1.94323313590202 |  erot = 2.009649111577 | epot = -22.5681911047399 | etot = -18.6153088572609
+620000  ekin = 2.92263589097657 |  erot = 2.15657756066215 | epot = -22.6264664894927 | etot = -17.547253037854
+621000  ekin = 2.90437881656455 |  erot = 1.70649555848316 | epot = -22.6654194475729 | etot = -18.0545450725252
+622000  ekin = 2.03426149564846 |  erot = 2.51826459248401 | epot = -22.6086250578043 | etot = -18.0560989696718
+623000  ekin = 1.98348786592096 |  erot = 3.08484972830227 | epot = -22.6234743341759 | etot = -17.5551367399526
+624000  ekin = 2.08463083558977 |  erot = 2.64004606903046 | epot = -22.6266529328942 | etot = -17.901976028274
+625000  ekin = 2.52963490334088 |  erot = 2.37033264022621 | epot = -22.6750436783155 | etot = -17.7750761347484
+626000  ekin = 2.73147680333726 |  erot = 2.07051651598001 | epot = -22.7272383647964 | etot = -17.9252450454791
+627000  ekin = 2.23447399123207 |  erot = 2.35288557052268 | epot = -22.7136740507756 | etot = -18.1263144890208
+628000  ekin = 2.28933754695897 |  erot = 2.29676268895052 | epot = -22.6176528573237 | etot = -18.0315526214142
+629000  ekin = 2.5355466362136 |  erot = 1.92082543033527 | epot = -22.5693331526923 | etot = -18.1129610861434
+630000  ekin = 3.11700824717167 |  erot = 2.51611049765935 | epot = -22.5144695759914 | etot = -16.8813508311604
+631000  ekin = 2.38844807455605 |  erot = 3.31601650504459 | epot = -22.5190998334877 | etot = -16.8146352538871
+632000  ekin = 2.59939587493747 |  erot = 2.51496212358956 | epot = -22.4711049664696 | etot = -17.3567469679426
+633000  ekin = 2.45338619933598 |  erot = 1.89874016257144 | epot = -22.4394257686937 | etot = -18.0872994067863
+634000  ekin = 2.23819111967046 |  erot = 1.98305652730464 | epot = -22.3433365860708 | etot = -18.1220889390957
+635000  ekin = 2.22438000857701 |  erot = 1.95893208021227 | epot = -22.2877959440852 | etot = -18.1044838552959
+636000  ekin = 2.26938644192168 |  erot = 2.77816773779857 | epot = -22.304696935737 | etot = -17.2571427560167
+637000  ekin = 1.97799147515645 |  erot = 2.59610837639353 | epot = -22.3353238115757 | etot = -17.7612239600257
+638000  ekin = 2.54901279963356 |  erot = 3.14232301833367 | epot = -22.3113570318406 | etot = -16.6200212138734
+639000  ekin = 2.38194254982011 |  erot = 2.49468098011845 | epot = -22.2696251856513 | etot = -17.3930016557128
+640000  ekin = 2.07438054408915 |  erot = 2.20336226777043 | epot = -22.1673693230787 | etot = -17.8896265112191
+641000  ekin = 2.49150296422893 |  erot = 3.53882164550033 | epot = -22.0473233874349 | etot = -16.0169987777057
+642000  ekin = 3.37964058409635 |  erot = 2.18458831029802 | epot = -21.9324522713975 | etot = -16.3682233770031
+643000  ekin = 2.80862431007863 |  erot = 2.40815089193716 | epot = -21.8726014240441 | etot = -16.6558262220283
+644000  ekin = 2.952235016065 |  erot = 1.92776262379328 | epot = -21.826057423183 | etot = -16.9460597833247
+645000  ekin = 4.10488984334312 |  erot = 1.89062109330212 | epot = -21.7981661301139 | etot = -15.8026551934687
+646000  ekin = 2.50234872105284 |  erot = 2.00205075040523 | epot = -21.7221642434957 | etot = -17.2177647720376
+647000  ekin = 2.52267281239588 |  erot = 2.19481558810104 | epot = -21.7438885460027 | etot = -17.0264001455058
+648000  ekin = 2.99344241657583 |  erot = 2.11139263207284 | epot = -21.7373240000025 | etot = -16.6324889513538
+649000  ekin = 2.55027365085816 |  erot = 3.20350991793738 | epot = -21.7192481424448 | etot = -15.9654645736493
+650000  ekin = 3.75163896052813 |  erot = 2.4418921228228 | epot = -21.6756681314987 | etot = -15.4821370481477
+651000  ekin = 3.29740056237165 |  erot = 2.36780448747274 | epot = -21.5372361691658 | etot = -15.8720311193214
+652000  ekin = 2.54645886055824 |  erot = 2.99097829596978 | epot = -21.4549655298412 | etot = -15.9175283733132
+653000  ekin = 2.88682688109756 |  erot = 2.53633970608341 | epot = -21.4696471597398 | etot = -16.0464805725588
+654000  ekin = 2.28614085804932 |  erot = 2.12026601708472 | epot = -21.5642684321318 | etot = -17.1578615569977
+655000  ekin = 2.20709609517087 |  erot = 2.10729950549553 | epot = -21.5349466292622 | etot = -17.2205510285958
+656000  ekin = 2.40310876229413 |  erot = 2.09663823500904 | epot = -21.5631924595209 | etot = -17.0634454622177
+657000  ekin = 2.7886551346751 |  erot = 2.19608839827218 | epot = -21.794507747247 | etot = -16.8097642142997
+658000  ekin = 3.1025713807162 |  erot = 2.59154293692775 | epot = -21.9667559942099 | etot = -16.272641676566
+659000  ekin = 2.88891106020276 |  erot = 3.47010878893494 | epot = -22.0542552611187 | etot = -15.695235411981
+660000  ekin = 2.90074521854052 |  erot = 1.62850743298555 | epot = -22.1003034196589 | etot = -17.5710507681328
+661000  ekin = 3.26666543815737 |  erot = 1.86223225384177 | epot = -22.202664217118 | etot = -17.0737665251188
+662000  ekin = 3.1558491019044 |  erot = 2.16868634291727 | epot = -22.3049478747804 | etot = -16.9804124299587
+663000  ekin = 1.94349853674084 |  erot = 2.45687952722592 | epot = -22.3908978754177 | etot = -17.990519811451
+664000  ekin = 1.454458209604 |  erot = 1.37641815749115 | epot = -22.5088813854797 | etot = -19.6780050183846
+665000  ekin = 1.57568561901953 |  erot = 2.30379312359824 | epot = -22.5957949572926 | etot = -18.7163162146748
+666000  ekin = 2.46162449261636 |  erot = 1.76978614573264 | epot = -22.7431602236663 | etot = -18.5117495853173
+667000  ekin = 2.82410423268351 |  erot = 2.33836663659489 | epot = -22.9350563238977 | etot = -17.7725854546193
+668000  ekin = 2.7371768611619 |  erot = 3.18779777915036 | epot = -23.0188768131826 | etot = -17.0939021728703
+669000  ekin = 3.41035672635338 |  erot = 2.45479601777613 | epot = -23.0718232403885 | etot = -17.206670496259
+670000  ekin = 2.54649164859505 |  erot = 1.99520979169172 | epot = -23.0246775830825 | etot = -18.4829761427958
+671000  ekin = 2.3802025684166 |  erot = 3.0074273699854 | epot = -23.0023479116087 | etot = -17.6147179732067
+672000  ekin = 3.0126952152146 |  erot = 2.55297219144564 | epot = -22.9947723733501 | etot = -17.4291049666899
+673000  ekin = 3.39486270740071 |  erot = 2.38087002620332 | epot = -22.9033457919094 | etot = -17.1276130583054
+674000  ekin = 3.13698489626099 |  erot = 2.10609113054063 | epot = -22.8089270617647 | etot = -17.5658510349631
+675000  ekin = 2.32294130821675 |  erot = 1.5285851482073 | epot = -22.6840603385672 | etot = -18.8325338821431
+676000  ekin = 2.43564726401376 |  erot = 2.26860623636407 | epot = -22.6133446272027 | etot = -17.9090911268249
+677000  ekin = 2.75162757613842 |  erot = 1.94219014743456 | epot = -22.7039380847022 | etot = -18.0101203611292
+678000  ekin = 2.86321973687601 |  erot = 1.66387788364135 | epot = -22.7223510604726 | etot = -18.1952534399552
+679000  ekin = 2.35079208772869 |  erot = 2.70386328048643 | epot = -22.7977445343494 | etot = -17.7430891661343
+680000  ekin = 2.48449675729004 |  erot = 2.90645575582477 | epot = -22.8559375688936 | etot = -17.4649850557788
+681000  ekin = 1.91581136662334 |  erot = 2.58179603882022 | epot = -22.7891325966099 | etot = -18.2915251911663
+682000  ekin = 2.10466427353706 |  erot = 2.69470735868806 | epot = -22.6959043279181 | etot = -17.896532695693
+683000  ekin = 2.34504535409022 |  erot = 2.11592035700792 | epot = -22.5718670441909 | etot = -18.1109013330928
+684000  ekin = 2.87198876498959 |  erot = 2.65732173958707 | epot = -22.4986977268024 | etot = -16.9693872222258
+685000  ekin = 3.03375238110976 |  erot = 2.18190577381517 | epot = -22.4634189289575 | etot = -17.2477607740326
+686000  ekin = 2.46248931777657 |  erot = 2.43025710170916 | epot = -22.4079029677659 | etot = -17.5151565482801
+687000  ekin = 2.74662486817896 |  erot = 1.7960915256241 | epot = -22.3360381567114 | etot = -17.7933217629083
+688000  ekin = 1.81703718003043 |  erot = 2.06511603415636 | epot = -22.3083758541198 | etot = -18.426222639933
+689000  ekin = 2.84202633430564 |  erot = 1.92033962884778 | epot = -22.3752571185822 | etot = -17.6128911554288
+690000  ekin = 2.07525448405017 |  erot = 2.46342632176819 | epot = -22.4633535431152 | etot = -17.9246727372969
+691000  ekin = 2.12558517800138 |  erot = 2.52961097164003 | epot = -22.483426266766 | etot = -17.8282301171246
+692000  ekin = 2.86720433292881 |  erot = 2.65102150657024 | epot = -22.4003374064863 | etot = -16.8821115669873
+693000  ekin = 2.30143055084864 |  erot = 2.5229094638336 | epot = -22.2859681228792 | etot = -17.461628108197
+694000  ekin = 2.88400701080874 |  erot = 2.34320802755438 | epot = -22.206318584282 | etot = -16.9791035459188
+695000  ekin = 2.93184722112895 |  erot = 2.22933507376833 | epot = -22.2348177906806 | etot = -17.0736354957833
+696000  ekin = 2.63173546326796 |  erot = 2.3427536957083 | epot = -22.274597219839 | etot = -17.3001080608628
+697000  ekin = 1.87084079501972 |  erot = 1.78050094908735 | epot = -22.2730387150936 | etot = -18.6216969709865
+698000  ekin = 2.19791428580687 |  erot = 2.8288358175635 | epot = -22.2819378523405 | etot = -17.2551877489701
+699000  ekin = 2.34279295545267 |  erot = 2.07514436344562 | epot = -22.2061425261575 | etot = -17.7882052072592
+700000  ekin = 2.576803119019 |  erot = 2.32167543064961 | epot = -22.1658685747825 | etot = -17.2673900251139
+701000  ekin = 2.9943865807539 |  erot = 1.89982533986206 | epot = -22.2191193266439 | etot = -17.324907406028
+702000  ekin = 2.68548464757459 |  erot = 2.65050744453208 | epot = -22.2547415922757 | etot = -16.918749500169
+703000  ekin = 2.01996957402024 |  erot = 2.04032822241737 | epot = -22.3253693056515 | etot = -18.2650715092139
+704000  ekin = 1.58871069317829 |  erot = 1.64014270467762 | epot = -22.3617232281452 | etot = -19.1328698302893
+705000  ekin = 2.30894157549819 |  erot = 1.90252913035992 | epot = -22.4307958564623 | etot = -18.2193251506042
+706000  ekin = 2.61729186445574 |  erot = 3.218798680391 | epot = -22.5603358780911 | etot = -16.7242453332444
+707000  ekin = 2.60797107906866 |  erot = 2.31455039977395 | epot = -22.7102471053997 | etot = -17.7877256265571
+708000  ekin = 1.81633850341999 |  erot = 2.34822575669415 | epot = -22.841408787855 | etot = -18.6768445277409
+709000  ekin = 1.83541322105378 |  erot = 2.51792380003795 | epot = -23.0137235815795 | etot = -18.6603865604878
+710000  ekin = 2.2142058326246 |  erot = 1.92378721690473 | epot = -23.1433453130909 | etot = -19.0053522635615
+711000  ekin = 2.06744054454475 |  erot = 2.39811709353191 | epot = -23.1532717948857 | etot = -18.687714156809
+712000  ekin = 2.17279472706359 |  erot = 1.75362175342097 | epot = -23.0479262273957 | etot = -19.1215097469111
+713000  ekin = 2.87118830138478 |  erot = 1.54943993787552 | epot = -22.8430575230907 | etot = -18.4224292838304
+714000  ekin = 2.01079466743967 |  erot = 1.87510988392748 | epot = -22.9212969433221 | etot = -19.035392391955
+715000  ekin = 2.49921829589267 |  erot = 1.91934008289236 | epot = -22.9679126658062 | etot = -18.5493542870212
+716000  ekin = 2.94666510633352 |  erot = 2.18714442405523 | epot = -23.0339970974289 | etot = -17.9001875670402
+717000  ekin = 3.07404079722086 |  erot = 2.46628262765132 | epot = -23.1869721551174 | etot = -17.6466487302453
+718000  ekin = 3.4706007837111 |  erot = 2.28206620506092 | epot = -23.2524492340769 | etot = -17.4997822453048
+719000  ekin = 4.08343792096554 |  erot = 3.10429377075216 | epot = -23.2448292181926 | etot = -16.0570975264749
+720000  ekin = 2.52774819763972 |  erot = 1.92867508904583 | epot = -23.1435084559682 | etot = -18.6870851692827
+721000  ekin = 2.58294244811584 |  erot = 2.03830531780331 | epot = -23.0601633758883 | etot = -18.4389156099692
+722000  ekin = 1.94458885450861 |  erot = 2.32008660802526 | epot = -22.9811929404573 | etot = -18.7165174779234
+723000  ekin = 2.41998340576259 |  erot = 2.1236972897937 | epot = -23.0570939793877 | etot = -18.5134132838314
+724000  ekin = 1.90406371300861 |  erot = 1.97533505769878 | epot = -23.1267629042384 | etot = -19.247364133531
+725000  ekin = 2.14287056473421 |  erot = 2.79289687450021 | epot = -23.1695632046138 | etot = -18.2337957653794
+726000  ekin = 2.2642331709972 |  erot = 2.55343019202652 | epot = -23.243290908371 | etot = -18.4256275453472
+727000  ekin = 1.69816397656715 |  erot = 2.64011919415554 | epot = -23.298837689321 | etot = -18.9605545185983
+728000  ekin = 2.23000862561933 |  erot = 3.58521470578671 | epot = -23.3528245832468 | etot = -17.5376012518407
+729000  ekin = 2.70076566380344 |  erot = 1.73367306410749 | epot = -23.3971276122796 | etot = -18.9626888843687
+730000  ekin = 2.5481867380276 |  erot = 2.77394958410254 | epot = -23.3988686964745 | etot = -18.0767323743443
+731000  ekin = 2.69782550956094 |  erot = 2.04855826523076 | epot = -23.4310969813891 | etot = -18.6847132065974
+732000  ekin = 2.79613002753752 |  erot = 1.87867430486715 | epot = -23.4885161441653 | etot = -18.8137118117607
+733000  ekin = 2.20346728125046 |  erot = 2.64365594749975 | epot = -23.5261309431819 | etot = -18.6790077144317
+734000  ekin = 1.69780111261444 |  erot = 2.3091790956079 | epot = -23.5188046470475 | etot = -19.5118244388251
+735000  ekin = 2.18402736165936 |  erot = 2.7205162023087 | epot = -23.4712689506938 | etot = -18.5667253867257
+736000  ekin = 2.26138696009404 |  erot = 1.17083930058802 | epot = -23.4348107178754 | etot = -20.0025844571934
+737000  ekin = 2.22219419044795 |  erot = 3.14114682990361 | epot = -23.3869288757725 | etot = -18.023587855421
+738000  ekin = 1.75464981631084 |  erot = 2.28485941478057 | epot = -23.2709893028053 | etot = -19.2314800717139
+739000  ekin = 1.41806378584361 |  erot = 2.1671403411282 | epot = -23.2213775300889 | etot = -19.6361734031171
+740000  ekin = 1.90901017596351 |  erot = 2.27102763422489 | epot = -23.1829198366047 | etot = -19.0028820264163
+741000  ekin = 1.9930994487751 |  erot = 2.73523269523397 | epot = -23.1169670577824 | etot = -18.3886349137733
+742000  ekin = 1.99876411117686 |  erot = 1.89882876917754 | epot = -23.0300825800851 | etot = -19.1324896997307
+743000  ekin = 1.96472814667687 |  erot = 2.79504722629174 | epot = -22.8990488521609 | etot = -18.1392734791923
+744000  ekin = 2.02442646092311 |  erot = 2.35044838626027 | epot = -22.8186526150799 | etot = -18.4437777678966
+745000  ekin = 1.65344231988822 |  erot = 1.87919095141021 | epot = -22.7624827109091 | etot = -19.2298494396107
+746000  ekin = 2.1034668185472 |  erot = 2.03078530569665 | epot = -22.743454277698 | etot = -18.6092021534542
+747000  ekin = 3.06690414848489 |  erot = 1.67540297869492 | epot = -22.7625979159322 | etot = -18.0202907887524
+748000  ekin = 3.069654144834 |  erot = 1.86014593098644 | epot = -22.8118567150739 | etot = -17.8820566392535
+749000  ekin = 2.53718696167217 |  erot = 2.02710579059033 | epot = -22.8431046011969 | etot = -18.2788118489344
+750000  ekin = 2.75657354808099 |  erot = 2.34953156046291 | epot = -22.9548205390759 | etot = -17.848715430532
+751000  ekin = 2.52290020835147 |  erot = 2.3487376359998 | epot = -23.0238691402084 | etot = -18.1522312958571
+752000  ekin = 2.47222247869325 |  erot = 1.68679846444686 | epot = -22.9958559112492 | etot = -18.836834968109
+753000  ekin = 2.48263277172424 |  erot = 1.54669382815741 | epot = -23.0858212396418 | etot = -19.0564946397602
+754000  ekin = 2.54806257410879 |  erot = 2.26636466676165 | epot = -23.1896472696843 | etot = -18.3752200288138
+755000  ekin = 1.53168409517921 |  erot = 2.22665478278015 | epot = -23.2059118234918 | etot = -19.4475729455324
+756000  ekin = 2.10751715527953 |  erot = 2.4052577432668 | epot = -23.114150245375 | etot = -18.6013753468287
+757000  ekin = 2.93395895491028 |  erot = 2.05821177584909 | epot = -23.0783355599275 | etot = -18.0861648291681
+758000  ekin = 2.38307945406232 |  erot = 2.50598165375058 | epot = -22.9691152621287 | etot = -18.0800541543158
+759000  ekin = 2.60292884338835 |  erot = 2.36916677072546 | epot = -22.7987274767846 | etot = -17.8266318626708
+760000  ekin = 3.2284318196987 |  erot = 2.73822716520638 | epot = -22.6756147646272 | etot = -16.7089557797221
+761000  ekin = 3.41868727786494 |  erot = 1.68975765213406 | epot = -22.5638952547581 | etot = -17.4554503247591
+762000  ekin = 3.43033946346107 |  erot = 2.5283975140253 | epot = -22.3549032489322 | etot = -16.3961662714458
+763000  ekin = 2.65773094814485 |  erot = 1.83975133975561 | epot = -22.234833339183 | etot = -17.7373510512825
+764000  ekin = 2.3815484472129 |  erot = 2.70684992442147 | epot = -22.0890752688231 | etot = -17.0006768971887
+765000  ekin = 2.23212803588897 |  erot = 1.94868597739427 | epot = -21.9918715237933 | etot = -17.81105751051
+766000  ekin = 2.49097891886065 |  erot = 1.96764603993156 | epot = -21.8443436680801 | etot = -17.3857187092879
+767000  ekin = 2.3457921497675 |  erot = 2.64636009163513 | epot = -21.7634962034013 | etot = -16.7713439619986
+768000  ekin = 1.87671147825106 |  erot = 2.05549869178485 | epot = -21.7324638416528 | etot = -17.8002536716169
+769000  ekin = 3.05058687860239 |  erot = 2.66104171022372 | epot = -21.66792195987 | etot = -15.9562933710439
+770000  ekin = 2.44115683640633 |  erot = 1.97554932479749 | epot = -21.644882066475 | etot = -17.2281759052712
+771000  ekin = 2.2368746400443 |  erot = 2.55040970708786 | epot = -21.5811924169692 | etot = -16.793908069837
+772000  ekin = 2.76529680592008 |  erot = 1.97873499811185 | epot = -21.6543448952384 | etot = -16.9103130912064
+773000  ekin = 2.14632888240093 |  erot = 2.41330587525514 | epot = -21.7728828090227 | etot = -17.2132480513667
+774000  ekin = 2.19848545803079 |  erot = 1.9765131024719 | epot = -21.8398858604883 | etot = -17.6648872999856
+775000  ekin = 2.52300137989083 |  erot = 2.80935365273515 | epot = -22.0219985274259 | etot = -16.6896434947999
+776000  ekin = 3.15842485269273 |  erot = 2.47066157093647 | epot = -22.183029096161 | etot = -16.5539426725318
+777000  ekin = 1.91784338934576 |  erot = 1.76045300517084 | epot = -22.2259652888115 | etot = -18.5476688942949
+778000  ekin = 2.93738066043324 |  erot = 2.2945784249029 | epot = -22.2339481852394 | etot = -17.0019890999032
+779000  ekin = 3.09847206114319 |  erot = 2.04557717006051 | epot = -22.240438366259 | etot = -17.0963891350553
+780000  ekin = 2.86127568397807 |  erot = 3.12055135138658 | epot = -22.1865692766137 | etot = -16.204742241249
+781000  ekin = 2.36069914420785 |  erot = 3.53186431088486 | epot = -22.1210563364352 | etot = -16.2284928813425
+782000  ekin = 2.31592690319261 |  erot = 2.85730598644038 | epot = -22.0302855151548 | etot = -16.8570526255218
+783000  ekin = 1.86647729944746 |  erot = 3.03450246093098 | epot = -21.8860143679489 | etot = -16.9850346075704
+784000  ekin = 2.04055627573201 |  erot = 2.26047908607292 | epot = -21.7534271639392 | etot = -17.4523918021343
+785000  ekin = 2.02248469828703 |  erot = 2.13950421850547 | epot = -21.6318967501917 | etot = -17.4699078333992
+786000  ekin = 2.34211746551601 |  erot = 2.34838133643265 | epot = -21.5890308210084 | etot = -16.8985320190597
+787000  ekin = 2.74971447554938 |  erot = 2.24123553296042 | epot = -21.5192132515562 | etot = -16.5282632430464
+788000  ekin = 2.14142056672038 |  erot = 2.27008574684965 | epot = -21.4982362621713 | etot = -17.0867299486013
+789000  ekin = 1.98580913341303 |  erot = 2.00702444041792 | epot = -21.5235331659838 | etot = -17.5306995921528
+790000  ekin = 1.68578263083924 |  erot = 1.43485602862151 | epot = -21.64400815936 | etot = -18.5233694998993
+791000  ekin = 2.13583938840528 |  erot = 2.53730095458943 | epot = -21.7916440698418 | etot = -17.1185037268471
+792000  ekin = 1.71937483898028 |  erot = 2.19563804216009 | epot = -21.8794946709408 | etot = -17.9644817898004
+793000  ekin = 3.15868943755339 |  erot = 1.94575875708421 | epot = -22.0398145404618 | etot = -16.9353663458242
+794000  ekin = 2.45478602538954 |  erot = 3.00825554959563 | epot = -22.0843165283013 | etot = -16.6212749533161
+795000  ekin = 2.87760320917195 |  erot = 3.06920266633563 | epot = -22.1595628991904 | etot = -16.2127570236828
+796000  ekin = 2.29816690595059 |  erot = 1.61510864654315 | epot = -22.1869705548184 | etot = -18.2736950023247
+797000  ekin = 2.19015256067211 |  erot = 3.65734446008355 | epot = -22.1432608090644 | etot = -16.2957637883088
+798000  ekin = 2.12018787925579 |  erot = 2.92822258455554 | epot = -22.1311312789224 | etot = -17.0827208151111
+799000  ekin = 2.49416140154829 |  erot = 2.73328283280218 | epot = -22.0825726051882 | etot = -16.8551283708377
+800000  ekin = 2.18932007838552 |  erot = 2.97640731559392 | epot = -21.979362152191 | etot = -16.8136347582115
+801000  ekin = 2.58827112124839 |  erot = 2.74404424837261 | epot = -21.9108490336924 | etot = -16.5785336640714
+802000  ekin = 3.07870342348167 |  erot = 2.87961505564287 | epot = -21.822560433681 | etot = -15.8642419545565
+803000  ekin = 2.23986243680641 |  erot = 2.50525058807596 | epot = -21.7275940818101 | etot = -16.9824810569277
+804000  ekin = 2.91885860068427 |  erot = 1.5788904045143 | epot = -21.6896376725624 | etot = -17.1918886673638
+805000  ekin = 2.68277363980194 |  erot = 3.05527868915739 | epot = -21.6710764398127 | etot = -15.9330241108534
+806000  ekin = 2.77769607049014 |  erot = 2.18887276909082 | epot = -21.6314833902337 | etot = -16.6649145506527
+807000  ekin = 2.12673239079667 |  erot = 2.86003407600808 | epot = -21.7295924017744 | etot = -16.7428259349697
+808000  ekin = 1.89599614774678 |  erot = 2.29237053227661 | epot = -21.7511361510417 | etot = -17.5627694710183
+809000  ekin = 1.96405066221971 |  erot = 1.92110393348365 | epot = -21.7075506883706 | etot = -17.8223960926673
+810000  ekin = 2.01518137594274 |  erot = 2.60119247286599 | epot = -21.678838587473 | etot = -17.0624647386642
+811000  ekin = 2.31084800889289 |  erot = 1.75270367309064 | epot = -21.6837819033719 | etot = -17.6202302213883
+812000  ekin = 2.57701031002089 |  erot = 2.34932304073588 | epot = -21.7246716033188 | etot = -16.7983382525621
+813000  ekin = 2.87706904926075 |  erot = 2.35686610624155 | epot = -21.837592223605 | etot = -16.6036570681027
+814000  ekin = 2.89908405023865 |  erot = 2.31423299883228 | epot = -21.8379261473902 | etot = -16.6246090983192
+815000  ekin = 2.54050064212256 |  erot = 2.82732568868833 | epot = -21.6068952707049 | etot = -16.2390689398941
+816000  ekin = 2.17040404256386 |  erot = 2.53711088209172 | epot = -21.5560322071983 | etot = -16.8485172825427
+817000  ekin = 1.7842696071831 |  erot = 2.67810959410574 | epot = -21.8738878035325 | etot = -17.4115086022437
+818000  ekin = 2.29659398017838 |  erot = 2.63718862373663 | epot = -22.164277271391 | etot = -17.230494667476
+819000  ekin = 2.15801167884062 |  erot = 2.62095572928875 | epot = -22.1816109590115 | etot = -17.4026435508822
+820000  ekin = 1.94384548213955 |  erot = 2.28597987799276 | epot = -22.0986187375022 | etot = -17.8687933773699
+821000  ekin = 2.10513194007576 |  erot = 2.38698175569218 | epot = -22.1146754444785 | etot = -17.6225617487105
+822000  ekin = 2.24819716786441 |  erot = 2.15258805680875 | epot = -22.0539472940486 | etot = -17.6531620693754
+823000  ekin = 2.26584952085582 |  erot = 2.60619852526611 | epot = -22.0924201800579 | etot = -17.220372133936
+824000  ekin = 1.65187935478513 |  erot = 1.4870311903723 | epot = -22.1682955997986 | etot = -19.0293850546411
+825000  ekin = 1.60213094818648 |  erot = 1.98592524368395 | epot = -22.1687104063708 | etot = -18.5806542145004
+826000  ekin = 1.97430720107255 |  erot = 2.19175014677162 | epot = -22.1061881978655 | etot = -17.9401308500213
+827000  ekin = 2.1793755983405 |  erot = 2.44975419075934 | epot = -21.9704586607304 | etot = -17.3413288716306
+828000  ekin = 1.90399088418587 |  erot = 2.72532994798818 | epot = -21.9585923270583 | etot = -17.3292714948842
+829000  ekin = 2.06478103068883 |  erot = 2.96583035402588 | epot = -21.9849402038682 | etot = -16.9543288191535
+830000  ekin = 1.98920675238979 |  erot = 2.15331250444996 | epot = -22.0339146439702 | etot = -17.8913953871305
+831000  ekin = 2.33567462674689 |  erot = 2.36888807413496 | epot = -22.1271573756461 | etot = -17.4225946747643
+832000  ekin = 2.0119470999192 |  erot = 1.94769143293625 | epot = -22.2038482709588 | etot = -18.2442097381034
+833000  ekin = 2.26025933495881 |  erot = 2.16012558191463 | epot = -22.2882501045414 | etot = -17.867865187668
+834000  ekin = 2.11529426445865 |  erot = 1.52405523315359 | epot = -22.3075608649826 | etot = -18.6682113673703
+835000  ekin = 2.89920750905511 |  erot = 2.7380108175103 | epot = -22.3942491248321 | etot = -16.7570307982667
+836000  ekin = 3.33069528982658 |  erot = 2.42771267807861 | epot = -22.4321737300744 | etot = -16.6737657621692
+837000  ekin = 2.74831774333782 |  erot = 2.31991750378627 | epot = -22.4290234552873 | etot = -17.3607882081632
+838000  ekin = 3.13714871682187 |  erot = 3.21601751721778 | epot = -22.4642383906451 | etot = -16.1110721566054
+839000  ekin = 2.73358272751807 |  erot = 2.60144488190506 | epot = -22.4062682687368 | etot = -17.0712406593137
+840000  ekin = 2.96121930874636 |  erot = 1.42725942278118 | epot = -22.3293755621294 | etot = -17.9408968306019
+841000  ekin = 2.95134811170867 |  erot = 2.67666861874609 | epot = -22.2936348151224 | etot = -16.6656180846677
+842000  ekin = 2.15783928636402 |  erot = 2.30287195796693 | epot = -22.2978011147172 | etot = -17.8370898703863
+843000  ekin = 2.84565152669617 |  erot = 2.05108014775141 | epot = -22.3162908719779 | etot = -17.4195591975303
+844000  ekin = 2.99645803669157 |  erot = 1.50433298006521 | epot = -22.3768320579304 | etot = -17.8760410411737
+845000  ekin = 3.20248025697125 |  erot = 2.27246140825563 | epot = -22.3985708422076 | etot = -16.9236291769807
+846000  ekin = 3.35773945734322 |  erot = 2.54074745551552 | epot = -22.4144833015876 | etot = -16.5159963887289
+847000  ekin = 2.17779203733109 |  erot = 2.7381758118846 | epot = -22.3524825149514 | etot = -17.4365146657357
+848000  ekin = 2.51627348417144 |  erot = 2.81170686694718 | epot = -22.2066307862469 | etot = -16.8786504351283
+849000  ekin = 1.99679455190556 |  erot = 2.56855846773091 | epot = -22.0763062134929 | etot = -17.5109531938564
+850000  ekin = 2.05799123916876 |  erot = 1.80888056240784 | epot = -22.0665032506706 | etot = -18.1996314490939
+851000  ekin = 2.08889793767921 |  erot = 1.8617218179029 | epot = -22.0629711763889 | etot = -18.1123514208068
+852000  ekin = 1.68990805178902 |  erot = 1.42763535981883 | epot = -22.002100112701 | etot = -18.8845567010931
+853000  ekin = 1.99310886654811 |  erot = 3.05226969048295 | epot = -22.0306903552278 | etot = -16.9853117981967
+854000  ekin = 2.98378700534986 |  erot = 2.23102745240541 | epot = -22.1115820238811 | etot = -16.8967675661258
+855000  ekin = 2.17087415585277 |  erot = 2.83781472268789 | epot = -22.1115106395971 | etot = -17.1028217610564
+856000  ekin = 2.42228475387308 |  erot = 1.53328604594478 | epot = -22.0841888628209 | etot = -18.128618063003
+857000  ekin = 2.50431566526893 |  erot = 2.80498769176515 | epot = -21.9881235267534 | etot = -16.6788201697193
+858000  ekin = 2.17333686672378 |  erot = 2.82591115507169 | epot = -21.9093201368614 | etot = -16.910072115066
+859000  ekin = 2.29930070497242 |  erot = 2.3241736893906 | epot = -21.8849849636104 | etot = -17.2615105692473
+860000  ekin = 1.99153024057672 |  erot = 1.9467463860015 | epot = -21.8998709373217 | etot = -17.9615943107435
+861000  ekin = 2.69177523559624 |  erot = 2.23997750036372 | epot = -21.8915522194994 | etot = -16.9597994835394
+862000  ekin = 2.86117050047984 |  erot = 2.41530060322762 | epot = -21.876687883023 | etot = -16.6002167793155
+863000  ekin = 2.59841547044275 |  erot = 3.3501705008543 | epot = -21.8162649771436 | etot = -15.8676790058466
+864000  ekin = 2.92496272611018 |  erot = 2.30350236144452 | epot = -21.7820358973268 | etot = -16.5535708097721
+865000  ekin = 1.94718216128952 |  erot = 2.16572180916631 | epot = -21.7000823492195 | etot = -17.5871783787637
+866000  ekin = 1.99006127871689 |  erot = 1.65011901234954 | epot = -21.6190182409268 | etot = -17.9788379498603
+867000  ekin = 1.76250718110787 |  erot = 3.37958608370305 | epot = -21.5401486584561 | etot = -16.3980553936452
+868000  ekin = 1.845623450314 |  erot = 2.78812196028612 | epot = -21.5771917352235 | etot = -16.9434463246233
+869000  ekin = 2.39300849969204 |  erot = 2.38301618173174 | epot = -21.6710790825578 | etot = -16.8950544011341
+870000  ekin = 1.91899243212541 |  erot = 3.2222244071739 | epot = -21.6734733803871 | etot = -16.5322565410878
+871000  ekin = 3.10255827845531 |  erot = 2.95454268850896 | epot = -21.5913249106744 | etot = -15.5342239437101
+872000  ekin = 2.94582883077842 |  erot = 1.38261935263093 | epot = -21.4597055547832 | etot = -17.1312573713739
+873000  ekin = 2.72830997927424 |  erot = 2.23223699637274 | epot = -21.3657566950046 | etot = -16.4052097193576
+874000  ekin = 2.41464704842015 |  erot = 2.10351476791495 | epot = -21.2635161734954 | etot = -16.7453543571603
+875000  ekin = 2.99468455803482 |  erot = 2.72761242382526 | epot = -21.2488881289381 | etot = -15.526591147078
+876000  ekin = 2.13382009818493 |  erot = 2.23152059294678 | epot = -21.2388603913311 | etot = -16.8735197001994
+877000  ekin = 1.839391763993 |  erot = 1.60727997722601 | epot = -21.2015948102408 | etot = -17.7549230690218
+878000  ekin = 2.01267175782179 |  erot = 2.73109796378377 | epot = -21.2125253160263 | etot = -16.4687555944207
+879000  ekin = 1.42911941081343 |  erot = 2.17371661448624 | epot = -21.1345316334464 | etot = -17.5316956081467
+880000  ekin = 2.10605339224632 |  erot = 2.58847517789128 | epot = -21.0787246891645 | etot = -16.3841961190269
+881000  ekin = 1.54924791070118 |  erot = 2.0068513915418 | epot = -21.1356465207066 | etot = -17.5795472184636
+882000  ekin = 2.19964315713499 |  erot = 2.65509097106008 | epot = -21.2389026935677 | etot = -16.3841685653726
+883000  ekin = 2.20850404171077 |  erot = 2.22833605977578 | epot = -21.3067394383395 | etot = -16.8698993368529
+884000  ekin = 2.76978562647275 |  erot = 2.10395845939756 | epot = -21.3429618615585 | etot = -16.4692177756882
+885000  ekin = 1.93339807672781 |  erot = 1.77156241344967 | epot = -21.3858074096933 | etot = -17.6808469195158
+886000  ekin = 2.00408769971894 |  erot = 3.10736267931441 | epot = -21.3935346347812 | etot = -16.2820842557478
+887000  ekin = 1.96987943750801 |  erot = 2.82035886899743 | epot = -21.3967073105592 | etot = -16.6064690040538
+888000  ekin = 1.91464371566411 |  erot = 2.33371232948867 | epot = -21.4767119016419 | etot = -17.2283558564891
+889000  ekin = 1.88227414130202 |  erot = 2.45915914930409 | epot = -21.5790392436829 | etot = -17.2376059530768
+890000  ekin = 1.84515176532447 |  erot = 2.24992378831494 | epot = -21.6747594004542 | etot = -17.5796838468148
+891000  ekin = 2.6016566869706 |  erot = 2.34500453305754 | epot = -21.8016735536793 | etot = -16.8550123336512
+892000  ekin = 2.7128775188686 |  erot = 2.69544224573133 | epot = -21.9063749565584 | etot = -16.4980551919585
+893000  ekin = 2.17862714611329 |  erot = 2.98452123742224 | epot = -21.9155556335137 | etot = -16.7524072499782
+894000  ekin = 2.52079948361477 |  erot = 2.46355933674926 | epot = -21.915110079455 | etot = -16.930751259091
+895000  ekin = 2.53566097944338 |  erot = 2.45130454442941 | epot = -21.9477860878339 | etot = -16.9608205639611
+896000  ekin = 1.84455393639214 |  erot = 2.77499090684944 | epot = -21.9167554809878 | etot = -17.2972106377462
+897000  ekin = 2.38519326880695 |  erot = 2.01980287317302 | epot = -21.8644918203992 | etot = -17.4594956784193
+898000  ekin = 2.14354914407572 |  erot = 1.89196669459414 | epot = -21.7953104274974 | etot = -17.7597945888275
+899000  ekin = 2.65485657727374 |  erot = 2.32374560038192 | epot = -21.6964754705568 | etot = -16.7178732929012
+900000  ekin = 2.1437154528087 |  erot = 2.28119066740276 | epot = -21.6934954112434 | etot = -17.268589291032
+901000  ekin = 1.93965814946881 |  erot = 1.81495571440911 | epot = -21.7369092433376 | etot = -17.9822953794597
+902000  ekin = 2.60993957981555 |  erot = 2.50321386623392 | epot = -21.6842517568354 | etot = -16.5710983107859
+903000  ekin = 1.87484955546756 |  erot = 2.17008893987963 | epot = -21.6383913984978 | etot = -17.5934529031506
+904000  ekin = 1.87454064845764 |  erot = 2.32484081519397 | epot = -21.5866637125315 | etot = -17.3872822488799
+905000  ekin = 2.31407473814843 |  erot = 2.1509486854239 | epot = -21.5154415841816 | etot = -17.0504181606093
+906000  ekin = 2.49583383758853 |  erot = 2.25091096848465 | epot = -21.5170853902294 | etot = -16.7703405841563
+907000  ekin = 4.19798796104344 |  erot = 2.50305323228071 | epot = -21.5976736513859 | etot = -14.8966324580618
+908000  ekin = 3.26730891548756 |  erot = 2.11222217905481 | epot = -21.7526644402476 | etot = -16.3731333457052
+909000  ekin = 2.64106561110374 |  erot = 1.92197432194202 | epot = -21.8748043207924 | etot = -17.3117643877466
+910000  ekin = 2.61805562731904 |  erot = 2.90737422678701 | epot = -21.9709470207745 | etot = -16.4455171666684
+911000  ekin = 2.62012718860141 |  erot = 4.35318528241846 | epot = -22.0282478750366 | etot = -15.0549354040167
+912000  ekin = 3.07628909273118 |  erot = 3.69371809788395 | epot = -22.0511180009901 | etot = -15.281110810375
+913000  ekin = 2.82956898268831 |  erot = 2.17078429141199 | epot = -22.0149543706266 | etot = -17.0146010965263
+914000  ekin = 2.16386655780066 |  erot = 1.22303673036133 | epot = -21.9243495493209 | etot = -18.5374462611589
+915000  ekin = 1.59447095066509 |  erot = 2.95966391292002 | epot = -21.8264580452026 | etot = -17.2723231816175
+916000  ekin = 2.58365539107523 |  erot = 3.75147270955031 | epot = -21.8922962938608 | etot = -15.5571681932352
+917000  ekin = 3.01643029206974 |  erot = 2.88035639021002 | epot = -21.9150526568514 | etot = -16.0182659745717
+918000  ekin = 2.89929776900147 |  erot = 2.64137394041292 | epot = -21.9078998623094 | etot = -16.367228152895
+919000  ekin = 3.20476671865013 |  erot = 2.76036957969156 | epot = -21.8878055443404 | etot = -15.9226692459988
+920000  ekin = 2.28949350558684 |  erot = 2.38558870046818 | epot = -21.8659406759968 | etot = -17.1908584699418
+921000  ekin = 2.39158312157105 |  erot = 2.44959700788173 | epot = -21.8638974869224 | etot = -17.0227173574697
+922000  ekin = 2.30678787768012 |  erot = 2.42145678067296 | epot = -21.8218369909645 | etot = -17.0935923326115
+923000  ekin = 2.49697778842282 |  erot = 2.66565493744117 | epot = -21.8078634464733 | etot = -16.6452307206093
+924000  ekin = 1.55676047489502 |  erot = 2.97115254541004 | epot = -21.7829722234117 | etot = -17.2550592031067
+925000  ekin = 1.86603413909289 |  erot = 1.96274861601778 | epot = -21.7288604040749 | etot = -17.9000776489642
+926000  ekin = 1.36993364395821 |  erot = 2.11749584641398 | epot = -21.7083442855148 | etot = -18.2209147951426
+927000  ekin = 2.55718977538496 |  erot = 2.0810909504888 | epot = -21.7242353526193 | etot = -17.0859546267455
+928000  ekin = 2.0974272910786 |  erot = 2.73922911267238 | epot = -21.7673808868819 | etot = -16.9307244831309
+929000  ekin = 1.85550591174834 |  erot = 1.84990976935038 | epot = -21.8639426090857 | etot = -18.158526927987
+930000  ekin = 1.99594723517185 |  erot = 2.09151231016389 | epot = -21.8461015073053 | etot = -17.7586419619695
+931000  ekin = 2.45331651079282 |  erot = 1.86703658018613 | epot = -21.7382799817762 | etot = -17.4179268907972
+932000  ekin = 2.76909250526758 |  erot = 2.34990175754268 | epot = -21.7639792890093 | etot = -16.6449850261991
+933000  ekin = 3.0474736633548 |  erot = 2.52740756503519 | epot = -21.6783727845496 | etot = -16.1034915561596
+934000  ekin = 2.93463275640818 |  erot = 2.48893095891024 | epot = -21.5784996926914 | etot = -16.154935977373
+935000  ekin = 2.77799347567548 |  erot = 2.13929358412249 | epot = -21.5334239467005 | etot = -16.6161368869026
+936000  ekin = 2.96529953690397 |  erot = 2.07095365726716 | epot = -21.5249249864244 | etot = -16.4886717922532
+937000  ekin = 3.04850537701749 |  erot = 2.32432162998051 | epot = -21.4386642161072 | etot = -16.0658372091092
+938000  ekin = 2.99262628505359 |  erot = 2.35224559307843 | epot = -21.3457080466207 | etot = -16.0008361684887
+939000  ekin = 2.61238181353702 |  erot = 2.26780356837291 | epot = -21.3079422537804 | etot = -16.4277568718705
+940000  ekin = 2.65930112044941 |  erot = 2.75497479722395 | epot = -21.2170493356503 | etot = -15.802773417977
+941000  ekin = 2.27574261339217 |  erot = 2.61419196501688 | epot = -21.1297657597673 | etot = -16.2398311813582
+942000  ekin = 1.89172011891054 |  erot = 2.82029488513786 | epot = -21.0410099256113 | etot = -16.3289949215629
+943000  ekin = 2.47643464476757 |  erot = 2.34737109151876 | epot = -21.0466687727979 | etot = -16.2228630365116
+944000  ekin = 2.13883995897326 |  erot = 1.92577316206138 | epot = -21.0114219746513 | etot = -16.9468088536167
+945000  ekin = 2.57768697869113 |  erot = 2.2147013612407 | epot = -21.0634624131725 | etot = -16.2710740732407
+946000  ekin = 2.36420709243625 |  erot = 2.89647330776423 | epot = -21.088814693033 | etot = -15.8281342928325
+947000  ekin = 2.07104171538468 |  erot = 1.86575631327234 | epot = -21.1004860950452 | etot = -17.1636880663882
+948000  ekin = 1.85532958802996 |  erot = 1.3695283408655 | epot = -21.1364231315616 | etot = -17.9115652026661
+949000  ekin = 1.76206591178366 |  erot = 2.3173732855863 | epot = -21.1463744779337 | etot = -17.0669352805638
+950000  ekin = 1.72021033353108 |  erot = 2.24191394295308 | epot = -21.1376324866856 | etot = -17.1755082102014
+951000  ekin = 1.96140007830504 |  erot = 2.32248863487759 | epot = -21.1955927656813 | etot = -16.9117040524987
+952000  ekin = 2.93256201500608 |  erot = 2.74550490827502 | epot = -21.2347810245411 | etot = -15.55671410126
+953000  ekin = 2.95031285986317 |  erot = 2.39822873263993 | epot = -21.2526091831331 | etot = -15.90406759063
+954000  ekin = 3.09579074538114 |  erot = 1.98159252445736 | epot = -21.1641538136742 | etot = -16.0867705438357
+955000  ekin = 3.59360323486037 |  erot = 2.06789679071822 | epot = -21.0522880782498 | etot = -15.3907880526712
+956000  ekin = 2.97416074498496 |  erot = 3.66953591785752 | epot = -20.9097603766373 | etot = -14.2660637137949
+957000  ekin = 3.03140562067951 |  erot = 2.66078083760708 | epot = -20.7419058677841 | etot = -15.0497194094975
+958000  ekin = 2.68913434704071 |  erot = 2.94057112873836 | epot = -20.5488384129042 | etot = -14.9191329371251
+959000  ekin = 1.93264217407773 |  erot = 2.45198406257093 | epot = -20.468781161493 | etot = -16.0841549248444
+960000  ekin = 1.49632279167951 |  erot = 3.13346348599985 | epot = -20.4844974178569 | etot = -15.8547111401775
+961000  ekin = 1.96353429663481 |  erot = 2.07553358516995 | epot = -20.4805590123498 | etot = -16.441491130545
+962000  ekin = 2.02830196392006 |  erot = 1.88908496389352 | epot = -20.5374211599972 | etot = -16.6200342321836
+963000  ekin = 1.80829526034561 |  erot = 2.46258345726263 | epot = -20.5841835730968 | etot = -16.3133048554886
+964000  ekin = 2.79449124937197 |  erot = 2.42527551362849 | epot = -20.6238805444481 | etot = -15.4041137814476
+965000  ekin = 2.53493670506136 |  erot = 2.27804362684504 | epot = -20.6549300812152 | etot = -15.8419497493088
+966000  ekin = 2.0920817650402 |  erot = 2.27478990703182 | epot = -20.7044739042411 | etot = -16.3376022321691
+967000  ekin = 1.55562260797661 |  erot = 3.55543363172459 | epot = -20.739375276301 | etot = -15.6283190365998
+968000  ekin = 1.93439891222236 |  erot = 2.37295903815892 | epot = -20.7189229543385 | etot = -16.4115650039573
+969000  ekin = 2.16199728898304 |  erot = 2.46012052524939 | epot = -20.6747113173024 | etot = -16.05259350307
+970000  ekin = 1.84926216722517 |  erot = 2.96951777569265 | epot = -20.6011599981509 | etot = -15.7823800552331
+971000  ekin = 1.93656411083027 |  erot = 3.08724923997924 | epot = -20.5835250734812 | etot = -15.5597117226717
+972000  ekin = 1.90452783927712 |  erot = 2.58230766783158 | epot = -20.578290598021 | etot = -16.0914550909123
+973000  ekin = 2.1922712122506 |  erot = 2.92686386394502 | epot = -20.5868173702649 | etot = -15.4676822940693
+974000  ekin = 2.53094641465528 |  erot = 2.69271305556796 | epot = -20.5382547781502 | etot = -15.314595307927
+975000  ekin = 3.41187201669924 |  erot = 2.32917219553093 | epot = -20.5109803919918 | etot = -14.7699361797616
+976000  ekin = 2.88156114272554 |  erot = 3.10474521611247 | epot = -20.5158119249461 | etot = -14.5295055661081
+977000  ekin = 2.73962881168093 |  erot = 2.50884169958545 | epot = -20.4964590298 | etot = -15.2479885185336
+978000  ekin = 1.79682802545478 |  erot = 2.06924041504343 | epot = -20.4730821934977 | etot = -16.6070137529995
+979000  ekin = 1.86521389998383 |  erot = 2.22151626929009 | epot = -20.4069392895634 | etot = -16.3202091202895
+980000  ekin = 1.92383169177415 |  erot = 1.56425965548878 | epot = -20.3533353734708 | etot = -16.8652440262079
+981000  ekin = 1.5511019928294 |  erot = 2.05381225133935 | epot = -20.3970890782076 | etot = -16.7921748340389
+982000  ekin = 1.85559395816059 |  erot = 1.96991369841494 | epot = -20.499354149896 | etot = -16.6738464933205
+983000  ekin = 2.75061857015335 |  erot = 1.7944840218308 | epot = -20.5241519929378 | etot = -15.9790494009537
+984000  ekin = 3.65069712553538 |  erot = 2.64237329124736 | epot = -20.6374699142712 | etot = -14.3443994974885
+985000  ekin = 2.95637321931061 |  erot = 2.18846412126772 | epot = -20.8122975273334 | etot = -15.6674601867551
+986000  ekin = 2.87072902054599 |  erot = 2.18810434250118 | epot = -20.9390290724606 | etot = -15.8801957094134
+987000  ekin = 3.37463328642758 |  erot = 2.53713666674669 | epot = -21.0098323012659 | etot = -15.0980623480916
+988000  ekin = 3.45107854450337 |  erot = 3.23625536313168 | epot = -21.0554260480417 | etot = -14.3680921404067
+989000  ekin = 2.83591404363755 |  erot = 2.20564156324815 | epot = -21.19499265416 | etot = -16.1534370472743
+990000  ekin = 2.79864389348437 |  erot = 1.8317842666354 | epot = -21.1880268304373 | etot = -16.5575986703175
+991000  ekin = 3.14781925181036 |  erot = 3.20782471808911 | epot = -21.1115234865128 | etot = -14.7558795166133
+992000  ekin = 3.30033725309946 |  erot = 2.62749912694386 | epot = -21.0030296251662 | etot = -15.0751932451229
+993000  ekin = 3.07374297249948 |  erot = 2.22697230616356 | epot = -20.9385586572609 | etot = -15.6378433785979
+994000  ekin = 3.21461776403449 |  erot = 2.80599707993707 | epot = -20.8790524582442 | etot = -14.8584376142726
+995000  ekin = 3.25071478747345 |  erot = 1.73415439498321 | epot = -20.8037804714002 | etot = -15.8189112889435
+996000  ekin = 3.07999632962569 |  erot = 3.18107550500823 | epot = -20.7805295335828 | etot = -14.5194576989488
+997000  ekin = 2.97118118001025 |  erot = 3.14046656474894 | epot = -20.7334885248755 | etot = -14.6218407801163
+998000  ekin = 3.09169861594907 |  erot = 1.99060706981745 | epot = -20.6553134096535 | etot = -15.573007723887
+999000  ekin = 2.07498130576584 |  erot = 2.75045972766921 | epot = -20.616091526295 | etot = -15.7906504928599
+1000000  ekin = 2.07851119592057 |  erot = 2.11869313853035 | epot = -20.4539417072875 | etot = -16.2567373728365
+ 1000000  0.092378275   -1.3359709  0.057599499   -1.1484644 2.8477973e-05 
+Loop time of 36.5086 on 1 procs for 1000000 steps with 16 atoms
+
+Performance: 23665.686 tau/day, 27390.840 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    | 26.481     | 26.481     | 26.481     |   0.0 | 72.53
+Bond    | 0.7951     | 0.7951     | 0.7951     |   0.0 |  2.18
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 0.16717    | 0.16717    | 0.16717    |   0.0 |  0.46
+Output  | 1.1e-05    | 1.1e-05    | 1.1e-05    |   0.0 |  0.00
+Modify  | 8.7926     | 8.7926     | 8.7926     |   0.0 | 24.08
+Other   |            | 0.273      |            |       |  0.75
+
+Nlocal:    16 ave 16 max 16 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Nghost:    0 ave 0 max 0 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Neighs:    102 ave 102 max 102 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+
+Total # of neighbors = 102
+Ave neighs/atom = 6.375
+Ave special neighs/atom = 3.75
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:36
diff --git a/examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.4 b/examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.4
new file mode 100644
index 0000000000..730853a0da
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA/duplex2/log.07Aug19.duplex2.g++.4
@@ -0,0 +1,1168 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000184 secs
+  read_data CPU = 0.003429 secs
+
+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
+
+# 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
+
+#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 = 1.956
+  ghost atom cutoff = 1.956
+  binsize = 0.978, 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
+WARNING: Communication cutoff 1.956 is shorter than a bond length based estimate of 2.12875. This may lead to errors. (../comm.cpp:685)
+Per MPI rank memory allocation (min/avg/max) = 7.455 | 7.637 | 7.819 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 = 1.35294173647286 |  erot = 1.7746327595132 | epot = -21.8324727162454 | etot = -18.7048982202594
+422000  ekin = 1.39101035408782 |  erot = 2.74626781088315 | epot = -21.892204423852 | etot = -17.7549262588811
+423000  ekin = 1.58313118355037 |  erot = 3.07988587276088 | epot = -21.9303489156375 | etot = -17.2673318593263
+424000  ekin = 2.38308976422853 |  erot = 2.02905632834229 | epot = -22.0003513420111 | etot = -17.5882052494403
+425000  ekin = 2.32292982636641 |  erot = 2.54472792699358 | epot = -22.0461884305752 | etot = -17.1785306772153
+426000  ekin = 2.07274921207621 |  erot = 3.12068562025983 | epot = -21.9899604929779 | etot = -16.7965256606418
+427000  ekin = 2.16499158921496 |  erot = 2.43609860560844 | epot = -21.8837565028179 | etot = -17.2826663079945
+428000  ekin = 1.81001230881453 |  erot = 1.65184910311941 | epot = -21.8651168729133 | etot = -18.4032554609794
+429000  ekin = 1.67080799563552 |  erot = 2.55829004033941 | epot = -21.823203822061 | etot = -17.5941057860861
+430000  ekin = 2.68658781224627 |  erot = 2.85919253371561 | epot = -21.8545360487503 | etot = -16.3087557027884
+431000  ekin = 2.77334901985549 |  erot = 1.57746917070685 | epot = -21.8360353910943 | etot = -17.485217200532
+432000  ekin = 2.50244674166437 |  erot = 1.60779258881598 | epot = -21.7381087453319 | etot = -17.6278694148515
+433000  ekin = 1.85649371322474 |  erot = 2.4917335891794 | epot = -21.7919912827364 | etot = -17.4437639803322
+434000  ekin = 2.89302367450635 |  erot = 2.79890045602688 | epot = -21.923157505168 | etot = -16.2312333746347
+435000  ekin = 3.67647442700572 |  erot = 1.38588132381275 | epot = -22.1019777057281 | etot = -17.0396219549096
+436000  ekin = 3.05510329104703 |  erot = 2.00142902882896 | epot = -22.1034257027065 | etot = -17.0468933828305
+437000  ekin = 3.23341172893811 |  erot = 1.78346855436478 | epot = -22.113702088725 | etot = -17.0968218054221
+438000  ekin = 2.86378458795303 |  erot = 1.84588842157477 | epot = -22.072414124752 | etot = -17.3627411152242
+439000  ekin = 2.41407153953135 |  erot = 2.70066632790347 | epot = -22.0535011599235 | etot = -16.9387632924887
+440000  ekin = 2.22110309163133 |  erot = 3.01674685818988 | epot = -22.0773629228071 | etot = -16.8395129729859
+441000  ekin = 2.89520033479411 |  erot = 2.87911130379517 | epot = -22.209849236351 | etot = -16.4355375977617
+442000  ekin = 2.05598301233623 |  erot = 1.73562369066664 | epot = -22.2689079268811 | etot = -18.4773012238783
+443000  ekin = 1.86650631344268 |  erot = 2.00816178040311 | epot = -22.3072964279924 | etot = -18.4326283341466
+444000  ekin = 2.06088560705619 |  erot = 2.15265011198711 | epot = -22.3186686701218 | etot = -18.1051329510785
+445000  ekin = 2.10029110633058 |  erot = 2.2800331405132 | epot = -22.3739249314238 | etot = -17.99360068458
+446000  ekin = 2.42121462246176 |  erot = 2.8536509710476 | epot = -22.4030820729313 | etot = -17.128216479422
+447000  ekin = 2.19905370994783 |  erot = 2.98216231903378 | epot = -22.4760062523441 | etot = -17.2947902233625
+448000  ekin = 2.35344530580996 |  erot = 2.94496431571717 | epot = -22.4927466941726 | etot = -17.1943370726455
+449000  ekin = 2.39032460069844 |  erot = 2.92889137252357 | epot = -22.5027878081879 | etot = -17.1835718349658
+450000  ekin = 1.87543018481826 |  erot = 1.69603328668915 | epot = -22.4562462785527 | etot = -18.8847828070453
+451000  ekin = 2.01850498861611 |  erot = 1.92812989993404 | epot = -22.4817672986218 | etot = -18.5351324100716
+452000  ekin = 1.36652609658347 |  erot = 1.87105620810406 | epot = -22.4501755877893 | etot = -19.2125932831017
+453000  ekin = 2.0599225820261 |  erot = 2.56027964608567 | epot = -22.2765869721545 | etot = -17.6563847440427
+454000  ekin = 1.47421749728914 |  erot = 2.19120144206329 | epot = -22.1381671023588 | etot = -18.4727481630063
+455000  ekin = 1.65550022307771 |  erot = 2.72165814308167 | epot = -21.9904394751434 | etot = -17.613281108984
+456000  ekin = 2.34827062603187 |  erot = 2.00722438151078 | epot = -21.9105114729144 | etot = -17.5550164653718
+457000  ekin = 2.01338249991754 |  erot = 2.37170378033693 | epot = -21.8819790372449 | etot = -17.4968927569904
+458000  ekin = 1.72815421955305 |  erot = 2.26329746701055 | epot = -21.911604405066 | etot = -17.9201527185024
+459000  ekin = 2.48347398227002 |  erot = 2.3237619692994 | epot = -21.9949404038568 | etot = -17.1877044522873
+460000  ekin = 2.18770854699574 |  erot = 2.00081662918321 | epot = -21.9585322440375 | etot = -17.7700070678585
+461000  ekin = 2.27716435663743 |  erot = 2.90195656269068 | epot = -21.8877682177659 | etot = -16.7086472984378
+462000  ekin = 2.61244889701714 |  erot = 1.79757533309512 | epot = -21.9143949779912 | etot = -17.5043707478789
+463000  ekin = 2.55684814656523 |  erot = 3.31200610027655 | epot = -21.8497749242033 | etot = -15.9809206773615
+464000  ekin = 2.15312235839157 |  erot = 2.38947690136822 | epot = -21.7825241097983 | etot = -17.2399248500385
+465000  ekin = 2.5257577253008 |  erot = 3.61331808321474 | epot = -21.7072705251899 | etot = -15.5681947166744
+466000  ekin = 1.97943618964771 |  erot = 2.8868852833762 | epot = -21.7222514097774 | etot = -16.8559299367534
+467000  ekin = 1.62882257493983 |  erot = 2.60892282315519 | epot = -21.8080861041927 | etot = -17.5703407060977
+468000  ekin = 1.09823854644375 |  erot = 3.35073251937298 | epot = -21.8523811012329 | etot = -17.4034100354162
+469000  ekin = 1.70229597385131 |  erot = 2.75889840726388 | epot = -21.8665756757502 | etot = -17.405381294635
+470000  ekin = 1.85844768422772 |  erot = 2.8706546217625 | epot = -21.9036130079376 | etot = -17.1745107019474
+471000  ekin = 2.74399539924327 |  erot = 2.34943354955081 | epot = -21.9543989717239 | etot = -16.8609700229298
+472000  ekin = 2.7182617922689 |  erot = 2.13581917182001 | epot = -22.0449294707038 | etot = -17.1908485066148
+473000  ekin = 2.29380642077304 |  erot = 2.07595163501546 | epot = -22.0706135180041 | etot = -17.7008554622156
+474000  ekin = 2.22690782122655 |  erot = 2.16470599013948 | epot = -22.0704871162386 | etot = -17.6788733048726
+475000  ekin = 2.4978679533329 |  erot = 2.09510196885224 | epot = -22.0509742163569 | etot = -17.4580042941717
+476000  ekin = 2.20264299239668 |  erot = 1.76757923556402 | epot = -21.9427521555982 | etot = -17.9725299276375
+477000  ekin = 2.45872237399503 |  erot = 2.38426997478537 | epot = -21.9051474088982 | etot = -17.0621550601178
+478000  ekin = 1.8990596403089 |  erot = 2.04864356713722 | epot = -21.9114508304737 | etot = -17.9637476230276
+479000  ekin = 2.2713390213749 |  erot = 3.08755197682257 | epot = -21.8872829373265 | etot = -16.5283919391291
+480000  ekin = 1.67015605151468 |  erot = 2.76560365045838 | epot = -21.8968158425889 | etot = -17.4610561406158
+481000  ekin = 1.81882995680353 |  erot = 2.94136105971067 | epot = -21.8571304925408 | etot = -17.0969394760266
+482000  ekin = 2.15305069632652 |  erot = 2.07327897823918 | epot = -21.8152992914385 | etot = -17.5889696168728
+483000  ekin = 1.50004535981758 |  erot = 1.99364343935403 | epot = -21.7843644990947 | etot = -18.2906756999231
+484000  ekin = 1.85234844255529 |  erot = 2.3400023120278 | epot = -21.8614293841666 | etot = -17.6690786295835
+485000  ekin = 1.64682178328831 |  erot = 2.50437862576678 | epot = -21.8969405008956 | etot = -17.7457400918405
+486000  ekin = 1.86104257115938 |  erot = 2.15995925522771 | epot = -21.8879397421696 | etot = -17.8669379157825
+487000  ekin = 2.34639026339217 |  erot = 3.11622773972824 | epot = -21.9707194220382 | etot = -16.5081014189178
+488000  ekin = 2.27484994031488 |  erot = 3.28147617368228 | epot = -21.9426475486812 | etot = -16.3863214346841
+489000  ekin = 2.38811933287365 |  erot = 2.56070014238266 | epot = -21.8600861168089 | etot = -16.9112666415526
+490000  ekin = 2.12976254880773 |  erot = 3.54525746010286 | epot = -21.7617637919249 | etot = -16.0867437830143
+491000  ekin = 2.20850764560418 |  erot = 2.48919239454319 | epot = -21.6468680069132 | etot = -16.9491679667658
+492000  ekin = 2.43957739853024 |  erot = 2.7632318669038 | epot = -21.6230951653168 | etot = -16.4202858998828
+493000  ekin = 1.79391622496105 |  erot = 2.2905251847004 | epot = -21.6945975278841 | etot = -17.6101561182226
+494000  ekin = 2.11542949642227 |  erot = 3.01313865872483 | epot = -21.7637004472039 | etot = -16.6351322920568
+495000  ekin = 2.1568591957283 |  erot = 2.49005677705245 | epot = -21.8783556810053 | etot = -17.2314397082246
+496000  ekin = 2.0603755282602 |  erot = 2.606986291047 | epot = -21.9276220332962 | etot = -17.260260213989
+497000  ekin = 2.52228141248763 |  erot = 1.71013019276801 | epot = -21.8769629373864 | etot = -17.6445513321307
+498000  ekin = 2.1539450080541 |  erot = 1.78777085700022 | epot = -21.8243748366057 | etot = -17.8826589715514
+499000  ekin = 3.01296343053108 |  erot = 1.73934813146709 | epot = -21.839263268044 | etot = -17.0869517060458
+500000  ekin = 2.7664211971855 |  erot = 2.50182215373005 | epot = -21.830671988603 | etot = -16.5624286376875
+501000  ekin = 2.69367571720338 |  erot = 2.99042817784737 | epot = -21.7039103667138 | etot = -16.0198064716631
+502000  ekin = 1.91666556639459 |  erot = 3.89815239299715 | epot = -21.5845300715443 | etot = -15.7697121121525
+503000  ekin = 1.80513448090424 |  erot = 2.94463129244922 | epot = -21.408846856306 | etot = -16.6590810829525
+504000  ekin = 1.70082883689618 |  erot = 3.04312463877849 | epot = -21.3315058298563 | etot = -16.5875523541817
+505000  ekin = 2.75953000022913 |  erot = 2.14635942194521 | epot = -21.3525103549444 | etot = -16.4466209327701
+506000  ekin = 2.29728093923375 |  erot = 2.04403144683578 | epot = -21.3794572010067 | etot = -17.0381448149372
+507000  ekin = 3.17636857959624 |  erot = 2.42164349794529 | epot = -21.4731108320935 | etot = -15.8750987545519
+508000  ekin = 2.53590109429522 |  erot = 2.52790695399208 | epot = -21.6300410847596 | etot = -16.5662330364723
+509000  ekin = 2.12748393236721 |  erot = 2.83071060777934 | epot = -21.7781347526393 | etot = -16.8199402124928
+510000  ekin = 2.16138023827908 |  erot = 1.44739524871433 | epot = -21.8661383228762 | etot = -18.2573628358828
+511000  ekin = 2.5432337386743 |  erot = 2.7710867437818 | epot = -21.9670096484362 | etot = -16.65268916598
+512000  ekin = 2.32820226144234 |  erot = 2.80424931634042 | epot = -22.0177071813426 | etot = -16.8852556035598
+513000  ekin = 2.47700215188742 |  erot = 2.17127792631492 | epot = -22.0110285387343 | etot = -17.362748460532
+514000  ekin = 2.76651136580706 |  erot = 2.55680467976049 | epot = -22.0909970005814 | etot = -16.7676809550139
+515000  ekin = 2.5202331965388 |  erot = 1.82499891391154 | epot = -22.1712715169566 | etot = -17.8260394065062
+516000  ekin = 2.81741012640848 |  erot = 2.22255273815335 | epot = -22.2621950124766 | etot = -17.2222321479148
+517000  ekin = 2.03287831599843 |  erot = 2.04932227860397 | epot = -22.2794486174447 | etot = -18.1972480228423
+518000  ekin = 2.18753527424292 |  erot = 2.76011341951324 | epot = -22.2667176836094 | etot = -17.3190689898532
+519000  ekin = 2.23127004412532 |  erot = 2.23036422155453 | epot = -22.3641437250361 | etot = -17.9025094593563
+520000  ekin = 1.88835704965194 |  erot = 2.20137678015023 | epot = -22.4547788180202 | etot = -18.365044988218
+521000  ekin = 2.57911594310158 |  erot = 1.87216207270883 | epot = -22.6071563154982 | etot = -18.1558782996878
+522000  ekin = 3.47551915105824 |  erot = 1.7762374523623 | epot = -22.6852629490162 | etot = -17.4335063455957
+523000  ekin = 2.84545293485785 |  erot = 2.47507537559666 | epot = -22.727728352182 | etot = -17.4072000417275
+524000  ekin = 2.40278895519472 |  erot = 2.37529684497553 | epot = -22.6643160930411 | etot = -17.8862302928709
+525000  ekin = 1.5950703357501 |  erot = 2.61508341973266 | epot = -22.5633164974796 | etot = -18.3531627419968
+526000  ekin = 1.67007684014044 |  erot = 1.59545284095806 | epot = -22.511319978416 | etot = -19.2457902973175
+527000  ekin = 2.19667533945247 |  erot = 1.9333023124675 | epot = -22.4181345854017 | etot = -18.2881569334817
+528000  ekin = 2.6386695788743 |  erot = 2.84200507572112 | epot = -22.4271496272375 | etot = -16.9464749726421
+529000  ekin = 2.71685924097597 |  erot = 3.01195511036351 | epot = -22.4607209136928 | etot = -16.7319065623533
+530000  ekin = 2.59646038482582 |  erot = 2.1317692819235 | epot = -22.3209630404852 | etot = -17.5927333737359
+531000  ekin = 2.96818211550215 |  erot = 2.35836906019033 | epot = -22.2240561584028 | etot = -16.8975049827104
+532000  ekin = 2.54400448114086 |  erot = 2.32266423688291 | epot = -22.2383323718679 | etot = -17.3716636538441
+533000  ekin = 2.47235456553947 |  erot = 2.96337386592411 | epot = -22.2434312615742 | etot = -16.8077028301106
+534000  ekin = 2.104894788263 |  erot = 2.03894640697442 | epot = -22.2624131617689 | etot = -18.1185719665315
+535000  ekin = 3.76811893478762 |  erot = 2.64694643296526 | epot = -22.2342741399369 | etot = -15.819208772184
+536000  ekin = 2.78932048770647 |  erot = 1.95046774407586 | epot = -22.1710588414062 | etot = -17.4312706096239
+537000  ekin = 2.84547413963847 |  erot = 2.62354406512568 | epot = -22.0792539675812 | etot = -16.610235762817
+538000  ekin = 2.67615418297318 |  erot = 2.08962546790894 | epot = -21.9560559397441 | etot = -17.190276288862
+539000  ekin = 2.73041224389435 |  erot = 2.35761678189142 | epot = -22.0360310245606 | etot = -16.9480019987748
+540000  ekin = 2.45513520817504 |  erot = 2.49807124796169 | epot = -22.1997448500024 | etot = -17.2465383938656
+541000  ekin = 3.48268229748521 |  erot = 2.77797330372247 | epot = -22.2939060084684 | etot = -16.0332504072607
+542000  ekin = 2.48960436886327 |  erot = 2.8733247922981 | epot = -22.3004887690915 | etot = -16.9375596079301
+543000  ekin = 2.34699181381529 |  erot = 2.86167842257192 | epot = -22.3027783678197 | etot = -17.0941081314325
+544000  ekin = 2.22918134297116 |  erot = 1.46827924617159 | epot = -22.2757921511234 | etot = -18.5783315619807
+545000  ekin = 2.45393652663684 |  erot = 2.14178562937395 | epot = -22.2696521197313 | etot = -17.6739299637206
+546000  ekin = 1.98434977645849 |  erot = 2.24144093113159 | epot = -22.232171992891 | etot = -18.0063812853009
+547000  ekin = 2.56230350196472 |  erot = 1.89574625912019 | epot = -22.2013923967025 | etot = -17.7433426356176
+548000  ekin = 1.72907614338158 |  erot = 1.64127030305736 | epot = -22.1897325934373 | etot = -18.8193861469984
+549000  ekin = 1.95696682165777 |  erot = 2.64539988943053 | epot = -22.3281210018679 | etot = -17.7257542907796
+550000  ekin = 1.80672944936439 |  erot = 1.58554489058936 | epot = -22.4379557312283 | etot = -19.0456813912745
+551000  ekin = 2.19785864069661 |  erot = 2.26344341600384 | epot = -22.4944444264338 | etot = -18.0331423697333
+552000  ekin = 2.074442528674 |  erot = 2.49246441473271 | epot = -22.5313734934249 | etot = -17.9644665500182
+553000  ekin = 2.94841939583913 |  erot = 2.12309786300742 | epot = -22.5870982488507 | etot = -17.5155809900042
+554000  ekin = 2.86687820100223 |  erot = 1.94287298381726 | epot = -22.755332978123 | etot = -17.9455817933035
+555000  ekin = 2.43102414091851 |  erot = 2.28708167460999 | epot = -22.8409516497234 | etot = -18.1228458341949
+556000  ekin = 2.31020008885682 |  erot = 2.55815314755914 | epot = -22.8777743355339 | etot = -18.0094210991179
+557000  ekin = 2.81359485404959 |  erot = 1.42586137655668 | epot = -22.93912738 | etot = -18.6996711493938
+558000  ekin = 2.79709708533547 |  erot = 1.99545051650402 | epot = -22.9823826800612 | etot = -18.1898350782217
+559000  ekin = 3.34842854089641 |  erot = 2.30939572175805 | epot = -23.0558646505447 | etot = -17.3980403878902
+560000  ekin = 3.12583165184862 |  erot = 2.33613566970364 | epot = -23.0537007225862 | etot = -17.591733401034
+561000  ekin = 2.91276096736789 |  erot = 2.07459481236915 | epot = -22.9822607654341 | etot = -17.994904985697
+562000  ekin = 3.33017095598494 |  erot = 2.52215992853225 | epot = -22.8889363116258 | etot = -17.0366054271086
+563000  ekin = 2.70200701416855 |  erot = 1.647701133792 | epot = -22.8712722594835 | etot = -18.521564111523
+564000  ekin = 2.82953631474814 |  erot = 2.52900560163797 | epot = -22.8387855460795 | etot = -17.4802436296934
+565000  ekin = 2.67999888917709 |  erot = 2.05091800967451 | epot = -22.7937507048715 | etot = -18.0628338060199
+566000  ekin = 2.32986557500305 |  erot = 2.16379904557212 | epot = -22.8028233873669 | etot = -18.3091587667917
+567000  ekin = 1.92319601586312 |  erot = 2.83258522428555 | epot = -22.7588270107033 | etot = -18.0030457705546
+568000  ekin = 2.1767237164987 |  erot = 2.23391201707387 | epot = -22.7857243432792 | etot = -18.3750886097066
+569000  ekin = 2.44197408396629 |  erot = 2.65159536305571 | epot = -22.7197314796374 | etot = -17.6261620326154
+570000  ekin = 2.4317740620905 |  erot = 1.89764945519459 | epot = -22.6963472615905 | etot = -18.3669237443054
+571000  ekin = 2.86160521289846 |  erot = 2.96804382024776 | epot = -22.6961835038032 | etot = -16.8665344706569
+572000  ekin = 1.92662919536387 |  erot = 3.79135909534693 | epot = -22.6587081618988 | etot = -16.940719871188
+573000  ekin = 2.40137439242945 |  erot = 2.2998261335634 | epot = -22.6365074046859 | etot = -17.935306878693
+574000  ekin = 1.68882589350908 |  erot = 2.3209740449249 | epot = -22.6783832960445 | etot = -18.6685833576106
+575000  ekin = 1.85490665091732 |  erot = 1.85640808911422 | epot = -22.7444448136904 | etot = -19.0331300736588
+576000  ekin = 3.24775679594035 |  erot = 2.9556926821431 | epot = -22.6991990620438 | etot = -16.4957495839603
+577000  ekin = 2.89423151645282 |  erot = 2.87486712706734 | epot = -22.6284365608021 | etot = -16.8593379172819
+578000  ekin = 2.40460916677569 |  erot = 2.78216711024701 | epot = -22.4348874817265 | etot = -17.2481112047038
+579000  ekin = 2.40580528046575 |  erot = 1.99557814482532 | epot = -22.2889136736671 | etot = -17.887530248376
+580000  ekin = 2.69817090358906 |  erot = 1.94741864170503 | epot = -22.1754486864787 | etot = -17.5298591411846
+581000  ekin = 2.06309668646281 |  erot = 2.97621367011722 | epot = -22.0670098600828 | etot = -17.0276995035027
+582000  ekin = 2.33869527454826 |  erot = 3.07898324506956 | epot = -21.9478320300714 | etot = -16.5301535104536
+583000  ekin = 2.23428959741494 |  erot = 2.68476693088862 | epot = -21.837983720672 | etot = -16.9189271923684
+584000  ekin = 2.94321016295283 |  erot = 2.59995039730548 | epot = -21.7517635625831 | etot = -16.2086030023248
+585000  ekin = 2.36063475490837 |  erot = 2.49112677628939 | epot = -21.7173359488816 | etot = -16.8655744176838
+586000  ekin = 3.56583702163526 |  erot = 2.02487858259688 | epot = -21.7707868137138 | etot = -16.1800712094817
+587000  ekin = 3.53727585853245 |  erot = 1.97258932652022 | epot = -21.7665121756112 | etot = -16.2566469905585
+588000  ekin = 2.82339556293758 |  erot = 1.59340504807044 | epot = -21.7545319340973 | etot = -17.3377313230892
+589000  ekin = 2.31627310139818 |  erot = 2.20582604523298 | epot = -21.8199173705564 | etot = -17.2978182239252
+590000  ekin = 2.57616671531331 |  erot = 1.72768273328208 | epot = -21.8427138199642 | etot = -17.5388643713688
+591000  ekin = 1.91473306171853 |  erot = 3.80604384238377 | epot = -21.9351393124188 | etot = -16.2143624083165
+592000  ekin = 2.11222958764659 |  erot = 2.84208333850203 | epot = -21.9639458839076 | etot = -17.0096329577589
+593000  ekin = 1.66462149590471 |  erot = 2.46217253451012 | epot = -21.9921445323971 | etot = -17.8653505019823
+594000  ekin = 1.86314045588477 |  erot = 2.37275936142268 | epot = -22.1149191228505 | etot = -17.879019305543
+595000  ekin = 1.6397125755004 |  erot = 2.14970246798561 | epot = -22.2960530768755 | etot = -18.5066380333895
+596000  ekin = 1.86247376576132 |  erot = 1.56938095427869 | epot = -22.4014957466218 | etot = -18.9696410265818
+597000  ekin = 2.21073901406701 |  erot = 2.3087175693751 | epot = -22.4599242604732 | etot = -17.9404676770311
+598000  ekin = 1.8660134932493 |  erot = 3.02311727399813 | epot = -22.5165298316334 | etot = -17.6273990643859
+599000  ekin = 2.86271635930755 |  erot = 2.19928854437227 | epot = -22.536599708025 | etot = -17.4745948043452
+600000  ekin = 2.65062163067179 |  erot = 2.14533898812782 | epot = -22.4620537969304 | etot = -17.6660931781308
+601000  ekin = 2.97018864875202 |  erot = 3.19824090103878 | epot = -22.3271949752462 | etot = -16.1587654254554
+602000  ekin = 2.93416893709001 |  erot = 2.68627449040958 | epot = -22.2245183728174 | etot = -16.6040749453178
+603000  ekin = 2.5987545006459 |  erot = 2.71301833029978 | epot = -22.1705323477201 | etot = -16.8587595167745
+604000  ekin = 1.79059859762797 |  erot = 2.11515305424794 | epot = -22.1931056020217 | etot = -18.2873539501458
+605000  ekin = 1.82914051863722 |  erot = 2.27656979248766 | epot = -22.2183915784731 | etot = -18.1126812673482
+606000  ekin = 2.33864125390345 |  erot = 2.204164937778 | epot = -22.1617656383863 | etot = -17.6189594467048
+607000  ekin = 2.72666217259876 |  erot = 2.97710334336218 | epot = -22.1572786906588 | etot = -16.4535131746978
+608000  ekin = 2.45226937954678 |  erot = 2.41232790919961 | epot = -22.1263051367364 | etot = -17.2617078479901
+609000  ekin = 1.91032127854288 |  erot = 2.62712516529566 | epot = -22.0127581830193 | etot = -17.4753117391807
+610000  ekin = 3.01319055031108 |  erot = 2.17098104720964 | epot = -21.930499629869 | etot = -16.7463280323483
+611000  ekin = 2.44410994437292 |  erot = 2.75159061185421 | epot = -21.9258193850468 | etot = -16.7301188288197
+612000  ekin = 2.50271115837173 |  erot = 2.16817640692168 | epot = -21.9676183236645 | etot = -17.2967307583711
+613000  ekin = 3.01842230632867 |  erot = 2.12784419676567 | epot = -22.0277467117808 | etot = -16.8814802086864
+614000  ekin = 2.25331711369829 |  erot = 2.99334048390157 | epot = -22.0701464667307 | etot = -16.8234888691309
+615000  ekin = 1.66376443031995 |  erot = 2.63613776051569 | epot = -21.9985978951916 | etot = -17.698695704356
+616000  ekin = 1.89454248699046 |  erot = 2.87318355169532 | epot = -22.0041678369047 | etot = -17.2364417982189
+617000  ekin = 2.14789714287838 |  erot = 2.51249074123956 | epot = -22.0251474680604 | etot = -17.3647595839425
+618000  ekin = 3.11174934178843 |  erot = 2.74374306269141 | epot = -21.980284295602 | etot = -16.1247918911221
+619000  ekin = 3.4103621396818 |  erot = 2.10616794159728 | epot = -21.9557959924961 | etot = -16.4392659112171
+620000  ekin = 4.28430989238205 |  erot = 2.19572475327593 | epot = -21.9033881020935 | etot = -15.4233534564355
+621000  ekin = 3.095687767491 |  erot = 2.55794040804605 | epot = -21.8286763731363 | etot = -16.1750481975993
+622000  ekin = 2.76030419206697 |  erot = 2.60754397958254 | epot = -21.7459002641757 | etot = -16.3780520925262
+623000  ekin = 2.87269212022169 |  erot = 2.90401311950188 | epot = -21.5853226709314 | etot = -15.8086174312079
+624000  ekin = 2.01889500087931 |  erot = 3.41825755609794 | epot = -21.4095311686242 | etot = -15.972378611647
+625000  ekin = 2.87966631754696 |  erot = 2.69115421564282 | epot = -21.2859406043045 | etot = -15.7151200711147
+626000  ekin = 2.56087279949319 |  erot = 2.15801254335178 | epot = -21.2329175358055 | etot = -16.5140321929605
+627000  ekin = 2.30197939613517 |  erot = 2.40176668957968 | epot = -21.2932794652838 | etot = -16.589533379569
+628000  ekin = 2.23988628353727 |  erot = 2.75332535542196 | epot = -21.4558642198861 | etot = -16.4626525809268
+629000  ekin = 2.20891060851904 |  erot = 1.97036896055008 | epot = -21.6109313731644 | etot = -17.4316518040953
+630000  ekin = 2.48711004105954 |  erot = 2.14055508379569 | epot = -21.6286281269544 | etot = -17.0009630020992
+631000  ekin = 2.05035510102044 |  erot = 1.78519131042562 | epot = -21.633635046353 | etot = -17.7980886349069
+632000  ekin = 1.65439924450982 |  erot = 3.28310987077494 | epot = -21.6999899301469 | etot = -16.7624808148621
+633000  ekin = 2.34657988531209 |  erot = 2.34109631044866 | epot = -21.8317647703271 | etot = -17.1440885745664
+634000  ekin = 2.31570267703931 |  erot = 2.471293173825 | epot = -21.8814211467029 | etot = -17.0944252958386
+635000  ekin = 1.99068848818426 |  erot = 3.35493927676211 | epot = -21.9111632351734 | etot = -16.565535470227
+636000  ekin = 2.50156763858621 |  erot = 2.48847742334418 | epot = -21.8752689055209 | etot = -16.8852238435905
+637000  ekin = 2.76558055064046 |  erot = 2.80410341825293 | epot = -21.7874464522771 | etot = -16.2177624833837
+638000  ekin = 2.45488734924466 |  erot = 2.8151636333562 | epot = -21.8973623385979 | etot = -16.627311355997
+639000  ekin = 1.89221088715375 |  erot = 2.13319565970052 | epot = -21.932098303477 | etot = -17.9066917566227
+640000  ekin = 2.12173400886946 |  erot = 3.32302167857403 | epot = -21.8808288554835 | etot = -16.43607316804
+641000  ekin = 2.09554541112561 |  erot = 2.23098450754965 | epot = -21.9203390995501 | etot = -17.5938091808749
+642000  ekin = 2.28696138506763 |  erot = 2.67378976619351 | epot = -21.9723604262127 | etot = -17.0116092749516
+643000  ekin = 2.74450005384908 |  erot = 2.20403941809547 | epot = -21.9235240791533 | etot = -16.9749846072087
+644000  ekin = 2.87909523138453 |  erot = 3.40688779630215 | epot = -21.9417833997401 | etot = -15.6558003720534
+645000  ekin = 2.38284095628022 |  erot = 2.10846397463902 | epot = -21.8306349073152 | etot = -17.3393299763959
+646000  ekin = 2.68568471833193 |  erot = 1.80852105367058 | epot = -21.6853054888873 | etot = -17.1910997168848
+647000  ekin = 2.44462012552757 |  erot = 2.00446720103468 | epot = -21.4974635292911 | etot = -17.0483762027288
+648000  ekin = 2.22150753159448 |  erot = 1.69679185313771 | epot = -21.5947311257684 | etot = -17.6764317410362
+649000  ekin = 2.55943952639506 |  erot = 1.77203724563614 | epot = -22.016770390185 | etot = -17.6852936181538
+650000  ekin = 2.72347255721059 |  erot = 2.20418229003755 | epot = -22.1594214535889 | etot = -17.2317666063407
+651000  ekin = 2.25383373914402 |  erot = 3.26326768595795 | epot = -22.2274805933885 | etot = -16.7103791682865
+652000  ekin = 2.35810253390822 |  erot = 2.29591208392312 | epot = -22.2332195197311 | etot = -17.5792049018997
+653000  ekin = 2.06421004499471 |  erot = 2.14171845474571 | epot = -22.2265612208312 | etot = -18.0206327210908
+654000  ekin = 2.30460304373657 |  erot = 1.85567946278894 | epot = -22.2521914868227 | etot = -18.0919089802972
+655000  ekin = 2.1118882401511 |  erot = 1.79072614414008 | epot = -22.2262193909715 | etot = -18.3236050066803
+656000  ekin = 2.44561836830366 |  erot = 2.32567811025774 | epot = -22.187237628634 | etot = -17.4159411500726
+657000  ekin = 2.45751083141108 |  erot = 2.86439216413737 | epot = -22.1805503246548 | etot = -16.8586473291064
+658000  ekin = 2.49955432693124 |  erot = 2.85472680235229 | epot = -22.1390040132353 | etot = -16.7847228839518
+659000  ekin = 3.37980090980362 |  erot = 2.77552992994233 | epot = -21.9898923341708 | etot = -15.8345614944248
+660000  ekin = 2.6941462621918 |  erot = 1.99094454704572 | epot = -21.839770569098 | etot = -17.1546797598605
+661000  ekin = 2.21049176877593 |  erot = 2.52393650500611 | epot = -21.6857326790217 | etot = -16.9513044052396
+662000  ekin = 2.06962867519899 |  erot = 2.53976085175022 | epot = -21.6239147287108 | etot = -17.0145252017615
+663000  ekin = 2.27770295544224 |  erot = 2.30124717941155 | epot = -21.5870186127932 | etot = -17.0080684779394
+664000  ekin = 2.39061717453214 |  erot = 1.87616423363736 | epot = -21.4930500427881 | etot = -17.2262686346186
+665000  ekin = 2.6692440512318 |  erot = 2.29240983153227 | epot = -21.4402310096657 | etot = -16.4785771269017
+666000  ekin = 1.66318176263893 |  erot = 2.30827907651666 | epot = -21.3477804932103 | etot = -17.3763196540547
+667000  ekin = 1.65573830146343 |  erot = 2.8261361193353 | epot = -21.2651811028886 | etot = -16.7833066820899
+668000  ekin = 2.50126196238916 |  erot = 3.29062396521941 | epot = -21.1310768281354 | etot = -15.3391909005268
+669000  ekin = 1.61008562219097 |  erot = 2.65727107854378 | epot = -21.0513800034041 | etot = -16.7840233026694
+670000  ekin = 2.21851826153844 |  erot = 2.60770568109396 | epot = -20.9727942140714 | etot = -16.146570271439
+671000  ekin = 2.25905318343359 |  erot = 2.1596549557503 | epot = -20.920836534986 | etot = -16.5021283958021
+672000  ekin = 1.93426342346647 |  erot = 1.65365047668441 | epot = -20.8333028169839 | etot = -17.245388916833
+673000  ekin = 1.880896686753 |  erot = 2.07483128120029 | epot = -20.79952620348 | etot = -16.8437982355267
+674000  ekin = 2.067834680573 |  erot = 2.16234064938725 | epot = -20.8176950919606 | etot = -16.5875197620003
+675000  ekin = 2.03952283590142 |  erot = 2.48129689359269 | epot = -20.8297865902612 | etot = -16.3089668607671
+676000  ekin = 2.44687523374789 |  erot = 2.77932995735253 | epot = -20.8513819036484 | etot = -15.625176712548
+677000  ekin = 2.18851088067448 |  erot = 2.61928925664188 | epot = -20.8589021998565 | etot = -16.0511020625401
+678000  ekin = 2.13451298865477 |  erot = 2.78742961560771 | epot = -20.7380850837789 | etot = -15.8161424795164
+679000  ekin = 2.15556981522704 |  erot = 2.17593910434841 | epot = -20.629255081746 | etot = -16.2977461621705
+680000  ekin = 2.07717451414439 |  erot = 2.68436897198808 | epot = -20.6512705044544 | etot = -15.889727018322
+681000  ekin = 2.16836766753576 |  erot = 1.8266629484308 | epot = -20.7392652191905 | etot = -16.744234603224
+682000  ekin = 3.01810965188601 |  erot = 2.39774897550359 | epot = -20.7185667085479 | etot = -15.3027080811583
+683000  ekin = 2.84169666492797 |  erot = 2.09885122074905 | epot = -20.7261705834807 | etot = -15.7856226978037
+684000  ekin = 1.96250352869369 |  erot = 2.99543980855395 | epot = -20.769704567373 | etot = -15.8117612301254
+685000  ekin = 1.50086016290166 |  erot = 2.04478648729578 | epot = -20.778895252848 | etot = -17.2332486026506
+686000  ekin = 2.30092983530379 |  erot = 2.55442118756322 | epot = -20.7673358731011 | etot = -15.9119848502341
+687000  ekin = 1.86053862979304 |  erot = 2.84846934037477 | epot = -20.7009117540898 | etot = -15.9919037839219
+688000  ekin = 2.56859020075851 |  erot = 2.23263295871679 | epot = -20.6563366249256 | etot = -15.8551134654503
+689000  ekin = 2.74930141700632 |  erot = 2.68327386026121 | epot = -20.8092642099637 | etot = -15.3766889326962
+690000  ekin = 2.67477310841299 |  erot = 2.52397256899157 | epot = -21.0730303416649 | etot = -15.8742846642604
+691000  ekin = 2.28465281003007 |  erot = 2.52273866559284 | epot = -21.2401157605126 | etot = -16.4327242848897
+692000  ekin = 2.42087744380445 |  erot = 3.24812320332686 | epot = -21.2665776826931 | etot = -15.5975770355618
+693000  ekin = 2.37642605279042 |  erot = 2.99546830568892 | epot = -21.3330277418611 | etot = -15.9611333833818
+694000  ekin = 2.69750178365984 |  erot = 2.53085866970816 | epot = -21.521485598392 | etot = -16.293125145024
+695000  ekin = 2.49230316198816 |  erot = 1.18105864485318 | epot = -21.6959912399269 | etot = -18.0226294330856
+696000  ekin = 1.86075498586631 |  erot = 1.46501529683133 | epot = -21.6808441671222 | etot = -18.3550738844245
+697000  ekin = 2.40460770445908 |  erot = 2.10461647488795 | epot = -21.7143559347048 | etot = -17.2051317553578
+698000  ekin = 2.32098148261586 |  erot = 1.91506962097517 | epot = -21.7787361369849 | etot = -17.5426850333939
+699000  ekin = 2.44943497732062 |  erot = 2.56143482106644 | epot = -21.7638026578475 | etot = -16.7529328594605
+700000  ekin = 2.13119890669415 |  erot = 2.28802336161955 | epot = -21.6714710604343 | etot = -17.2522487921206
+701000  ekin = 2.1501316931424 |  erot = 2.18565847708908 | epot = -21.5488216255628 | etot = -17.2130314553313
+702000  ekin = 1.57482438035703 |  erot = 1.99931097090509 | epot = -21.5047640382371 | etot = -17.930628686975
+703000  ekin = 2.08829522236785 |  erot = 2.17557396869524 | epot = -21.5242713758433 | etot = -17.2604021847802
+704000  ekin = 2.82144699483839 |  erot = 1.94479401958833 | epot = -21.5462466947694 | etot = -16.7800056803427
+705000  ekin = 2.81019786745821 |  erot = 2.16662483548889 | epot = -21.497690476826 | etot = -16.5208677738789
+706000  ekin = 1.97639068263159 |  erot = 2.31468002405233 | epot = -21.494117475981 | etot = -17.2030467692971
+707000  ekin = 1.90740387464487 |  erot = 2.04436544372038 | epot = -21.5505486138141 | etot = -17.5987792954489
+708000  ekin = 2.4927128838246 |  erot = 2.15829540621564 | epot = -21.5728746117359 | etot = -16.9218663216957
+709000  ekin = 2.89296518644075 |  erot = 2.58120965850486 | epot = -21.6152997801578 | etot = -16.1411249352122
+710000  ekin = 2.18515172086139 |  erot = 2.27924743097099 | epot = -21.5865916502444 | etot = -17.122192498412
+711000  ekin = 2.31589231212299 |  erot = 1.401439259779 | epot = -21.6089597508522 | etot = -17.8916281789502
+712000  ekin = 2.55835611026778 |  erot = 2.27281573655803 | epot = -21.7227687229585 | etot = -16.8915968761327
+713000  ekin = 1.95615391137192 |  erot = 2.31806852238961 | epot = -21.8059432402922 | etot = -17.5317208065307
+714000  ekin = 2.56238583099812 |  erot = 2.10850361056243 | epot = -21.8681675013086 | etot = -17.1972780597481
+715000  ekin = 2.4232111465345 |  erot = 3.74023135295618 | epot = -21.8498336266088 | etot = -15.6863911271181
+716000  ekin = 2.83316600532177 |  erot = 2.84850242081139 | epot = -21.7640231598546 | etot = -16.0823547337214
+717000  ekin = 3.45113934412559 |  erot = 3.205984621772 | epot = -21.667790662391 | etot = -15.0106666964934
+718000  ekin = 3.10736232683018 |  erot = 3.94031338601798 | epot = -21.5629179727886 | etot = -14.5152422599405
+719000  ekin = 2.38564322644681 |  erot = 2.9508981175584 | epot = -21.5481188237003 | etot = -16.211577479695
+720000  ekin = 2.22543420991222 |  erot = 3.14305432696275 | epot = -21.5381615962024 | etot = -16.1696730593274
+721000  ekin = 1.71709109813907 |  erot = 2.2393943036399 | epot = -21.4645851946691 | etot = -17.5080997928901
+722000  ekin = 1.93213958129582 |  erot = 2.81573218276728 | epot = -21.4896847080113 | etot = -16.7418129439482
+723000  ekin = 2.3814534534689 |  erot = 2.55666957995949 | epot = -21.4374887927968 | etot = -16.4993657593684
+724000  ekin = 1.74740284448188 |  erot = 2.45556175689041 | epot = -21.4125175551609 | etot = -17.2095529537886
+725000  ekin = 2.29233638352032 |  erot = 2.9526701477774 | epot = -21.4751392844086 | etot = -16.2301327531109
+726000  ekin = 1.63503646092183 |  erot = 2.30649262262118 | epot = -21.5156851039583 | etot = -17.5741560204153
+727000  ekin = 2.46705454176008 |  erot = 3.19802987014479 | epot = -21.5382715508197 | etot = -15.8731871389148
+728000  ekin = 2.21709576272191 |  erot = 2.16616227421247 | epot = -21.5244744557248 | etot = -17.1412164187904
+729000  ekin = 1.89396537247993 |  erot = 1.66596987620968 | epot = -21.5644109232526 | etot = -18.004475674563
+730000  ekin = 1.78155182892059 |  erot = 2.15399661961712 | epot = -21.5594738957829 | etot = -17.6239254472452
+731000  ekin = 2.16713092512296 |  erot = 2.96875570154115 | epot = -21.4952326145865 | etot = -16.3593459879224
+732000  ekin = 2.40927355189018 |  erot = 2.27189990077001 | epot = -21.3831563581627 | etot = -16.7019829055025
+733000  ekin = 3.04824198143783 |  erot = 2.57289903054808 | epot = -21.429005165309 | etot = -15.8078641533231
+734000  ekin = 2.36703883022854 |  erot = 2.04468815017472 | epot = -21.4926214065432 | etot = -17.0808944261399
+735000  ekin = 2.13292788677937 |  erot = 1.55097035487249 | epot = -21.5455592190822 | etot = -17.8616609774303
+736000  ekin = 2.13562110082196 |  erot = 3.45795834862289 | epot = -21.6515763333194 | etot = -16.0579968838746
+737000  ekin = 1.73550703692746 |  erot = 3.58781244645386 | epot = -21.6785680654269 | etot = -16.3552485820456
+738000  ekin = 2.0113668076702 |  erot = 2.50533140705365 | epot = -21.7068415263434 | etot = -17.1901433116196
+739000  ekin = 1.85122466968334 |  erot = 2.19323904324284 | epot = -21.7211705032463 | etot = -17.6767067903201
+740000  ekin = 2.84677298867338 |  erot = 2.79086338446698 | epot = -21.7460997683893 | etot = -16.108463395249
+741000  ekin = 2.47281769013275 |  erot = 2.90867674862121 | epot = -21.8038806031312 | etot = -16.4223861643773
+742000  ekin = 2.74212748781964 |  erot = 3.26601844940294 | epot = -21.9417105639309 | etot = -15.9335646267083
+743000  ekin = 2.23337436613032 |  erot = 3.2075209993525 | epot = -22.0769938861091 | etot = -16.6360985206263
+744000  ekin = 2.0100758296396 |  erot = 3.7920839882707 | epot = -22.1581491314472 | etot = -16.3559893135369
+745000  ekin = 3.14168435406401 |  erot = 2.32756039064278 | epot = -22.155279170971 | etot = -16.6860344262642
+746000  ekin = 2.96147960587595 |  erot = 2.6491977864153 | epot = -22.131657657659 | etot = -16.5209802653678
+747000  ekin = 2.31713973406909 |  erot = 2.05388385027237 | epot = -22.1362115743712 | etot = -17.7651879900298
+748000  ekin = 2.36228107661837 |  erot = 2.41530550223612 | epot = -22.1703943251347 | etot = -17.3928077462802
+749000  ekin = 2.07006713072585 |  erot = 2.7743291960411 | epot = -22.1708421357978 | etot = -17.3264458090308
+750000  ekin = 1.65834656870048 |  erot = 2.38415657369843 | epot = -22.2465520170919 | etot = -18.204048874693
+751000  ekin = 1.79302728344389 |  erot = 2.82710216006102 | epot = -22.3488339479635 | etot = -17.7287045044586
+752000  ekin = 1.35555517803007 |  erot = 1.4601978358921 | epot = -22.4342877547318 | etot = -19.6185347408097
+753000  ekin = 1.88586262445723 |  erot = 2.44014879801272 | epot = -22.3837690917336 | etot = -18.0577576692637
+754000  ekin = 1.74745498380874 |  erot = 2.73612011854202 | epot = -22.2852965474799 | etot = -17.8017214451291
+755000  ekin = 2.39590781949903 |  erot = 2.41019902787153 | epot = -22.2066358684386 | etot = -17.400529021068
+756000  ekin = 1.83745653598817 |  erot = 2.79024351605602 | epot = -22.133592240187 | etot = -17.5058921881428
+757000  ekin = 1.97281200687049 |  erot = 2.57792722235947 | epot = -22.0604464398181 | etot = -17.5097072105881
+758000  ekin = 1.18945619136922 |  erot = 2.72372183682493 | epot = -21.9899494795137 | etot = -18.0767714513196
+759000  ekin = 2.16230453116658 |  erot = 1.39722896511083 | epot = -22.0003304659983 | etot = -18.4407969697209
+760000  ekin = 2.57253050230033 |  erot = 2.33269711137816 | epot = -22.0357457302398 | etot = -17.1305181165613
+761000  ekin = 2.08545216810508 |  erot = 2.24940559703297 | epot = -22.1132097744114 | etot = -17.7783520092733
+762000  ekin = 2.13509249172208 |  erot = 1.66078369856518 | epot = -22.1380840935026 | etot = -18.3422079032154
+763000  ekin = 2.42851727622126 |  erot = 3.36016749294485 | epot = -22.2079173436288 | etot = -16.4192325744626
+764000  ekin = 2.84703530894743 |  erot = 2.79172375883346 | epot = -22.2143624032421 | etot = -16.5756033354612
+765000  ekin = 1.81325658345262 |  erot = 2.77448180912351 | epot = -22.1194010453623 | etot = -17.5316626527862
+766000  ekin = 2.64831101430988 |  erot = 2.31381649708591 | epot = -21.9919179324216 | etot = -17.0297904210258
+767000  ekin = 2.58949745571041 |  erot = 2.86718473216887 | epot = -21.9087370669524 | etot = -16.4520548790732
+768000  ekin = 1.86313167956692 |  erot = 2.78552244417216 | epot = -21.9381577980074 | etot = -17.2895036742683
+769000  ekin = 2.40162376419982 |  erot = 2.31402374045874 | epot = -22.0373843590673 | etot = -17.3217368544087
+770000  ekin = 2.49146487205159 |  erot = 3.23101926076329 | epot = -22.1439576198693 | etot = -16.4214734870544
+771000  ekin = 2.3322633774286 |  erot = 2.27787220200643 | epot = -22.1812213688414 | etot = -17.5710857894063
+772000  ekin = 2.28990016215835 |  erot = 2.99389364569334 | epot = -22.2765115340955 | etot = -16.9927177262438
+773000  ekin = 2.23002457595115 |  erot = 1.82240115552767 | epot = -22.3379686916384 | etot = -18.2855429601596
+774000  ekin = 2.82350297312971 |  erot = 2.21054815770296 | epot = -22.331524297742 | etot = -17.2974731669094
+775000  ekin = 1.82305982105504 |  erot = 1.8710033654222 | epot = -22.2729891281483 | etot = -18.5789259416711
+776000  ekin = 1.39169167990076 |  erot = 3.16027505319294 | epot = -22.2459295451277 | etot = -17.6939628120339
+777000  ekin = 1.6265637770548 |  erot = 2.80881827044758 | epot = -22.1611617112313 | etot = -17.7257796637289
+778000  ekin = 1.49436478903863 |  erot = 2.24161236856228 | epot = -22.1732646444852 | etot = -18.4372874868843
+779000  ekin = 1.88107404119766 |  erot = 1.90732846459751 | epot = -22.2125828989309 | etot = -18.4241803931357
+780000  ekin = 1.70209634464212 |  erot = 2.30515299210351 | epot = -22.2800747799125 | etot = -18.2728254431668
+781000  ekin = 2.12615575710868 |  erot = 2.56065358398065 | epot = -22.3657963731658 | etot = -17.6789870320765
+782000  ekin = 2.60319344794517 |  erot = 1.95716880667361 | epot = -22.278889588664 | etot = -17.7185273340452
+783000  ekin = 2.19489638548848 |  erot = 2.9003350616753 | epot = -22.2004563501245 | etot = -17.1052249029607
+784000  ekin = 2.84914111009349 |  erot = 2.24051018422877 | epot = -22.2093010900996 | etot = -17.1196497957773
+785000  ekin = 3.14240765153577 |  erot = 2.92860772919915 | epot = -22.2500274240077 | etot = -16.1790120432728
+786000  ekin = 2.83372300736036 |  erot = 3.44593690351847 | epot = -22.2923595270368 | etot = -16.0126996161579
+787000  ekin = 2.41074903520556 |  erot = 3.01381650302091 | epot = -22.2329745868673 | etot = -16.8084090486409
+788000  ekin = 1.99557665602945 |  erot = 2.01600225895996 | epot = -22.1996915458458 | etot = -18.1881126308564
+789000  ekin = 2.46258971641134 |  erot = 2.27406771625315 | epot = -22.1314921413931 | etot = -17.3948347087286
+790000  ekin = 3.5794195002921 |  erot = 2.82440864812442 | epot = -22.0691321886934 | etot = -15.6653040402769
+791000  ekin = 3.1240271028451 |  erot = 2.42401718962738 | epot = -22.0808685046086 | etot = -16.5328242121361
+792000  ekin = 3.95429056548242 |  erot = 1.97241939137156 | epot = -22.0156932891881 | etot = -16.0889833323341
+793000  ekin = 2.26828416500901 |  erot = 2.58677202552917 | epot = -21.9219598803777 | etot = -17.0669036898395
+794000  ekin = 2.16106559150924 |  erot = 2.4431093127412 | epot = -21.7619518452423 | etot = -17.1577769409919
+795000  ekin = 1.62519700428841 |  erot = 2.41826691867446 | epot = -21.6012749849542 | etot = -17.5578110619913
+796000  ekin = 2.18377144801669 |  erot = 2.13093440679002 | epot = -21.4820337714693 | etot = -17.1673279166626
+797000  ekin = 1.81427862345352 |  erot = 1.99534051513422 | epot = -21.473919591557 | etot = -17.6643004529692
+798000  ekin = 2.22012195132989 |  erot = 2.51363796316556 | epot = -21.5008270155092 | etot = -16.7670671010137
+799000  ekin = 1.88984581553594 |  erot = 2.87047971528298 | epot = -21.4708608053325 | etot = -16.7105352745136
+800000  ekin = 2.14235800297793 |  erot = 2.35196377273804 | epot = -21.3792596865245 | etot = -16.8849379108086
+801000  ekin = 1.84302686949433 |  erot = 1.65480855802627 | epot = -21.2211741734437 | etot = -17.7233387459231
+802000  ekin = 2.20305615004887 |  erot = 2.22355768328246 | epot = -21.1073599995259 | etot = -16.6807461661946
+803000  ekin = 2.64836814873033 |  erot = 1.90761871804861 | epot = -21.0752041885471 | etot = -16.5192173217681
+804000  ekin = 2.34495845479317 |  erot = 2.89112045330492 | epot = -21.0176734836814 | etot = -15.7815945755833
+805000  ekin = 1.79915640284781 |  erot = 2.71685844764874 | epot = -20.8858433761952 | etot = -16.3698285256987
+806000  ekin = 1.74992507845556 |  erot = 2.08517047523252 | epot = -20.8503301901419 | etot = -17.0152346364538
+807000  ekin = 1.57172452594495 |  erot = 1.70422569898767 | epot = -20.9092333967052 | etot = -17.6332831717726
+808000  ekin = 2.08106901002531 |  erot = 2.40367065218829 | epot = -20.9858691795981 | etot = -16.5011295173845
+809000  ekin = 2.61736488835992 |  erot = 1.51251405170843 | epot = -20.9790910298502 | etot = -16.8492120897818
+810000  ekin = 3.07344763503492 |  erot = 2.65428122600393 | epot = -20.896297890317 | etot = -15.1685690292781
+811000  ekin = 3.02889983101699 |  erot = 3.61686315729188 | epot = -20.939661602879 | etot = -14.2938986145701
+812000  ekin = 2.13832655324419 |  erot = 2.7919099294265 | epot = -21.0260005012597 | etot = -16.095764018589
+813000  ekin = 2.19077235410927 |  erot = 3.16158040032407 | epot = -21.2169108164964 | etot = -15.864558062063
+814000  ekin = 1.70775111413747 |  erot = 2.98436840501864 | epot = -21.308951189013 | etot = -16.6168316698569
+815000  ekin = 2.14630779714624 |  erot = 2.27335416843265 | epot = -21.3099230783926 | etot = -16.8902611128137
+816000  ekin = 2.70331501775258 |  erot = 1.53093796189123 | epot = -21.3384418834226 | etot = -17.1041889037787
+817000  ekin = 2.55738086811903 |  erot = 2.58558173150041 | epot = -21.4691891608916 | etot = -16.3262265612721
+818000  ekin = 2.27829786328906 |  erot = 2.260897256821 | epot = -21.5162183667694 | etot = -16.9770232466593
+819000  ekin = 2.10478260130361 |  erot = 3.02380855832958 | epot = -21.5292309310153 | etot = -16.4006397713821
+820000  ekin = 2.50608188233135 |  erot = 2.71783485224717 | epot = -21.5036816055507 | etot = -16.2797648709722
+821000  ekin = 2.62609848062628 |  erot = 2.55164634943843 | epot = -21.4787661851639 | etot = -16.3010213550992
+822000  ekin = 3.63941681915299 |  erot = 2.2024689491713 | epot = -21.4688230156577 | etot = -15.6269372473334
+823000  ekin = 3.58953515450024 |  erot = 2.73556206545622 | epot = -21.4650227341942 | etot = -15.1399255142377
+824000  ekin = 4.11304720722591 |  erot = 3.29174595135478 | epot = -21.4062011377905 | etot = -14.0014079792098
+825000  ekin = 2.90620097853795 |  erot = 3.46409084826251 | epot = -21.2436944546109 | etot = -14.8734026278104
+826000  ekin = 1.7218843819517 |  erot = 1.97028277378147 | epot = -21.0473904580338 | etot = -17.3552233023006
+827000  ekin = 1.9124069409458 |  erot = 2.55760488338654 | epot = -20.9206700763424 | etot = -16.45065825201
+828000  ekin = 2.38145056979363 |  erot = 2.55544957149179 | epot = -20.8204865756542 | etot = -15.8835864343688
+829000  ekin = 2.24733826946605 |  erot = 1.78474837345225 | epot = -20.7084449579387 | etot = -16.6763583150204
+830000  ekin = 2.52795893691036 |  erot = 2.3414672428271 | epot = -20.5883731027638 | etot = -15.7189469230263
+831000  ekin = 2.68310001004753 |  erot = 2.07407005901147 | epot = -20.4364451382899 | etot = -15.6792750692309
+832000  ekin = 2.67323424264011 |  erot = 2.02167788192501 | epot = -20.3691783993746 | etot = -15.6742662748095
+833000  ekin = 2.55071664949192 |  erot = 2.59972899624768 | epot = -20.3036213925319 | etot = -15.1531757467923
+834000  ekin = 2.87089088359563 |  erot = 2.32463192225235 | epot = -20.2984653371648 | etot = -15.1029425313168
+835000  ekin = 2.77558903596269 |  erot = 2.73757154391998 | epot = -20.4022293845422 | etot = -14.8890688046595
+836000  ekin = 2.57713146919654 |  erot = 2.85322310545494 | epot = -20.5403137141641 | etot = -15.1099591395126
+837000  ekin = 1.78075406754283 |  erot = 1.97503243561096 | epot = -20.5889142070484 | etot = -16.8331277038946
+838000  ekin = 1.98032617531701 |  erot = 2.79829467073938 | epot = -20.6049667376349 | etot = -15.8263458915785
+839000  ekin = 2.0003179521848 |  erot = 2.70198331564816 | epot = -20.5921495833285 | etot = -15.8898483154956
+840000  ekin = 1.70031236242703 |  erot = 2.95685689490569 | epot = -20.6678372916037 | etot = -16.010668034271
+841000  ekin = 2.77705100359314 |  erot = 2.84742847205068 | epot = -20.7929304121764 | etot = -15.1684509365326
+842000  ekin = 2.54393458307436 |  erot = 2.87172695192628 | epot = -20.8173418291016 | etot = -15.401680294101
+843000  ekin = 2.00273625390939 |  erot = 2.63437491598434 | epot = -20.8053999188197 | etot = -16.168288748926
+844000  ekin = 1.52900749569349 |  erot = 1.92882434140972 | epot = -20.8427655387949 | etot = -17.3849337016917
+845000  ekin = 2.27176799938834 |  erot = 2.308436365406 | epot = -20.9384881501646 | etot = -16.3582837853702
+846000  ekin = 2.06718804989496 |  erot = 2.33108662324979 | epot = -21.0085032159671 | etot = -16.6102285428223
+847000  ekin = 2.457310325364 |  erot = 2.64112097293887 | epot = -20.9624761048838 | etot = -15.8640448065809
+848000  ekin = 2.13894899278459 |  erot = 1.46487099434192 | epot = -20.9909626022984 | etot = -17.3871426151719
+849000  ekin = 2.0007946308419 |  erot = 2.48568109050423 | epot = -20.9995492646628 | etot = -16.5130735433167
+850000  ekin = 2.54186297995285 |  erot = 2.66929613872207 | epot = -20.9906717645298 | etot = -15.7795126458549
+851000  ekin = 2.16443404123472 |  erot = 2.92830981454153 | epot = -20.9932718794597 | etot = -15.9005280236835
+852000  ekin = 2.48255398040851 |  erot = 2.46238001266594 | epot = -21.018749118108 | etot = -16.0738151250335
+853000  ekin = 2.4154146701692 |  erot = 2.97520224443384 | epot = -20.9598722543997 | etot = -15.5692553397967
+854000  ekin = 2.35150751079562 |  erot = 2.85453387569364 | epot = -20.8693696367608 | etot = -15.6633282502715
+855000  ekin = 2.36749640703667 |  erot = 2.06753408358231 | epot = -20.8980197782033 | etot = -16.4629892875844
+856000  ekin = 2.52164598863741 |  erot = 2.75265020302048 | epot = -20.800830948998 | etot = -15.5265347573401
+857000  ekin = 2.55862872070476 |  erot = 3.03030828592915 | epot = -20.6910887919773 | etot = -15.1021517853434
+858000  ekin = 3.12628251408762 |  erot = 2.14554604261068 | epot = -20.6394579492303 | etot = -15.367629392532
+859000  ekin = 2.91259413572112 |  erot = 2.23773675238282 | epot = -20.6611486479508 | etot = -15.5108177598468
+860000  ekin = 2.88318377110752 |  erot = 1.51972062646443 | epot = -20.6828066069552 | etot = -16.2799022093832
+861000  ekin = 2.33529167415754 |  erot = 2.8511661779126 | epot = -20.6796212139896 | etot = -15.4931633619195
+862000  ekin = 3.06091745354043 |  erot = 1.86960550588563 | epot = -20.7257485328209 | etot = -15.7952255733948
+863000  ekin = 2.88295223464283 |  erot = 1.77743902656173 | epot = -20.8340328987095 | etot = -16.1736416375049
+864000  ekin = 2.95602292127632 |  erot = 2.65056410715308 | epot = -21.0162954561449 | etot = -15.4097084277155
+865000  ekin = 3.3172549369506 |  erot = 2.24347319046513 | epot = -21.1441095096618 | etot = -15.583381382246
+866000  ekin = 2.8446879555804 |  erot = 3.16802464112884 | epot = -21.2275167371631 | etot = -15.2148041404539
+867000  ekin = 2.74149808612436 |  erot = 3.09628634794253 | epot = -21.2140642048228 | etot = -15.3762797707559
+868000  ekin = 2.1914148486481 |  erot = 2.23765996064103 | epot = -21.1661691183493 | etot = -16.7370943090602
+869000  ekin = 2.92726848075923 |  erot = 2.49663936074754 | epot = -21.1109612585255 | etot = -15.6870534170188
+870000  ekin = 2.47986538741064 |  erot = 2.11907230969516 | epot = -21.0900293946684 | etot = -16.4910916975626
+871000  ekin = 2.18342640526418 |  erot = 2.37474045896627 | epot = -20.9804914418025 | etot = -16.422324577572
+872000  ekin = 1.52873571215978 |  erot = 2.08908078804673 | epot = -20.9343176993391 | etot = -17.3165011991326
+873000  ekin = 1.39281578471524 |  erot = 2.29034780878958 | epot = -21.0007866828842 | etot = -17.3176230893794
+874000  ekin = 1.40786554880768 |  erot = 2.7700797003235 | epot = -21.1600842742429 | etot = -16.9821390251117
+875000  ekin = 1.18320018517441 |  erot = 2.73058842883511 | epot = -21.2959059488291 | etot = -17.3821173348196
+876000  ekin = 1.8300189393038 |  erot = 2.99586941144886 | epot = -21.3298635968752 | etot = -16.5039752461226
+877000  ekin = 2.38032906471076 |  erot = 2.03722695211226 | epot = -21.415279075283 | etot = -16.99772305846
+878000  ekin = 2.12938516841269 |  erot = 1.75666654131942 | epot = -21.412657760354 | etot = -17.5266060506219
+879000  ekin = 2.23837299177367 |  erot = 2.71307243504656 | epot = -21.4006541150457 | etot = -16.4492086882254
+880000  ekin = 2.68032631557358 |  erot = 2.78439945590096 | epot = -21.4462782448912 | etot = -15.9815524734167
+881000  ekin = 2.86810525851389 |  erot = 2.35959915589953 | epot = -21.4314549447334 | etot = -16.20375053032
+882000  ekin = 2.33172283615115 |  erot = 2.17176020371465 | epot = -21.369535469283 | etot = -16.8660524294172
+883000  ekin = 2.36331150998289 |  erot = 1.97634374053965 | epot = -21.1748990104138 | etot = -16.8352437598913
+884000  ekin = 2.53782271833829 |  erot = 2.25243670168426 | epot = -21.0795767771653 | etot = -16.2893173571427
+885000  ekin = 2.86057103069744 |  erot = 2.27462544190307 | epot = -21.0782171958266 | etot = -15.9430207232261
+886000  ekin = 3.17034195996096 |  erot = 1.74832646729411 | epot = -21.1280719510453 | etot = -16.2094035237903
+887000  ekin = 2.66023408534638 |  erot = 2.49426802108018 | epot = -21.1909579488462 | etot = -16.0364558424197
+888000  ekin = 2.14156056158803 |  erot = 2.83065920295554 | epot = -21.2749898508176 | etot = -16.302770086274
+889000  ekin = 2.13776380125426 |  erot = 2.19994227158627 | epot = -21.1902576201104 | etot = -16.8525515472698
+890000  ekin = 1.76446650263826 |  erot = 2.97354753014624 | epot = -21.2518724314555 | etot = -16.513858398671
+891000  ekin = 1.64433607192947 |  erot = 2.28044235221046 | epot = -21.375947191058 | etot = -17.4511687669181
+892000  ekin = 1.97381907006142 |  erot = 2.35969977765342 | epot = -21.5200869372681 | etot = -17.1865680895533
+893000  ekin = 1.77998159671209 |  erot = 1.83959134574388 | epot = -21.5960425863495 | etot = -17.9764696438935
+894000  ekin = 2.8098996128374 |  erot = 2.80337844303784 | epot = -21.6896955865519 | etot = -16.0764175306767
+895000  ekin = 2.03570642281182 |  erot = 2.73641442629083 | epot = -21.77632807541 | etot = -17.0042072263074
+896000  ekin = 1.6670401968188 |  erot = 2.55842313387756 | epot = -21.9079691828366 | etot = -17.6825058521402
+897000  ekin = 1.79364820755772 |  erot = 2.35937074837062 | epot = -22.0466195733302 | etot = -17.8936006174018
+898000  ekin = 1.8410334890959 |  erot = 2.41596980112091 | epot = -22.0792153246985 | etot = -17.8222120344817
+899000  ekin = 1.6644807831865 |  erot = 3.06295573986189 | epot = -22.0050930291629 | etot = -17.2776565061145
+900000  ekin = 2.15301263014261 |  erot = 2.62503812958041 | epot = -21.9769631774149 | etot = -17.1989124176919
+901000  ekin = 2.4332352507602 |  erot = 2.69661561775584 | epot = -22.0455467285607 | etot = -16.9156958600446
+902000  ekin = 2.57983518470479 |  erot = 2.40634661051273 | epot = -22.0504126836938 | etot = -17.0642308884763
+903000  ekin = 2.38804084084237 |  erot = 2.40369143268286 | epot = -22.0548572254259 | etot = -17.2631249519006
+904000  ekin = 1.9975679938241 |  erot = 3.15736733739655 | epot = -22.0783783499621 | etot = -16.9234430187414
+905000  ekin = 2.28042135995783 |  erot = 2.20746001153526 | epot = -22.092475444409 | etot = -17.6045940729159
+906000  ekin = 2.49914497220397 |  erot = 1.67106173041058 | epot = -22.064929274197 | etot = -17.8947225715825
+907000  ekin = 2.34170753461351 |  erot = 2.16830189815579 | epot = -21.9182395193391 | etot = -17.4082300865698
+908000  ekin = 2.83101675354561 |  erot = 2.39226452568029 | epot = -21.9393923471478 | etot = -16.7161110679219
+909000  ekin = 3.13519044247879 |  erot = 2.07053636961477 | epot = -22.044039894957 | etot = -16.8383130828635
+910000  ekin = 2.91492350277448 |  erot = 3.54269221448406 | epot = -22.1774209001616 | etot = -15.7198051829031
+911000  ekin = 1.86299522014884 |  erot = 2.75425299355676 | epot = -22.2318842654016 | etot = -17.614636051696
+912000  ekin = 2.64270620869814 |  erot = 1.86916034984856 | epot = -22.2816929482531 | etot = -17.7698263897064
+913000  ekin = 2.45835259040075 |  erot = 2.03343540339216 | epot = -22.4051980318983 | etot = -17.9134100381054
+914000  ekin = 2.01630257583654 |  erot = 3.01931541129968 | epot = -22.505580829989 | etot = -17.4699628428528
+915000  ekin = 2.73550820750709 |  erot = 2.14051989379167 | epot = -22.5067223019054 | etot = -17.6306942006067
+916000  ekin = 2.38833694849903 |  erot = 3.26236542376324 | epot = -22.5299732656691 | etot = -16.8792708934068
+917000  ekin = 2.21211072529668 |  erot = 2.24425221182157 | epot = -22.5175498112378 | etot = -18.0611868741195
+918000  ekin = 2.11721632678553 |  erot = 2.05681940825278 | epot = -22.4485798442658 | etot = -18.2745441092275
+919000  ekin = 2.6606540164524 |  erot = 2.41853759346261 | epot = -22.4819256778216 | etot = -17.4027340679066
+920000  ekin = 3.26471044916532 |  erot = 2.75531911342507 | epot = -22.5858600689149 | etot = -16.5658305063245
+921000  ekin = 2.72028388628926 |  erot = 1.96960596371279 | epot = -22.639440275186 | etot = -17.949550425184
+922000  ekin = 1.43428549123066 |  erot = 1.52428475569853 | epot = -22.6914991306332 | etot = -19.732928883704
+923000  ekin = 1.67603986848274 |  erot = 1.86522020655461 | epot = -22.7510571233686 | etot = -19.2097970483312
+924000  ekin = 2.15000311118185 |  erot = 1.53327070095754 | epot = -22.722341324193 | etot = -19.0390675120536
+925000  ekin = 2.27769316315993 |  erot = 1.35582914777291 | epot = -22.6317669747038 | etot = -18.9982446637709
+926000  ekin = 2.00370753803371 |  erot = 2.07123237010035 | epot = -22.5811533157097 | etot = -18.5062134075756
+927000  ekin = 2.51631428248841 |  erot = 1.98711239136866 | epot = -22.6957752134474 | etot = -18.1923485395903
+928000  ekin = 2.57502157703452 |  erot = 2.51449316644154 | epot = -22.8486668477058 | etot = -17.7591521042298
+929000  ekin = 2.66015175923782 |  erot = 1.82991995656989 | epot = -22.8894816710891 | etot = -18.3994099552814
+930000  ekin = 2.41758548277495 |  erot = 2.00977019739401 | epot = -22.9023129289068 | etot = -18.4749572487379
+931000  ekin = 3.01936517399357 |  erot = 2.11115283295648 | epot = -22.8598478032752 | etot = -17.7293297963251
+932000  ekin = 2.34904883629147 |  erot = 1.8713492953404 | epot = -22.900230384769 | etot = -18.6798322531371
+933000  ekin = 2.16775611540091 |  erot = 2.8379626481367 | epot = -22.9075292968864 | etot = -17.9018105333488
+934000  ekin = 2.17428610858913 |  erot = 2.118912762995 | epot = -22.9275911153101 | etot = -18.634392243726
+935000  ekin = 2.35380058127246 |  erot = 2.22719757040087 | epot = -22.9178791070039 | etot = -18.3368809553305
+936000  ekin = 2.29398857252167 |  erot = 2.52122883801966 | epot = -23.0254587453495 | etot = -18.2102413348082
+937000  ekin = 2.32405492839276 |  erot = 2.82571975062451 | epot = -23.1134869099966 | etot = -17.9637122309793
+938000  ekin = 2.46190818228192 |  erot = 1.99586541720566 | epot = -23.1690855883853 | etot = -18.7113119888977
+939000  ekin = 2.99494633358445 |  erot = 2.11200579979089 | epot = -23.1621265982256 | etot = -18.0551744648502
+940000  ekin = 3.76773061527755 |  erot = 2.67954167018355 | epot = -23.1020260319689 | etot = -16.6547537465078
+941000  ekin = 3.15108874053801 |  erot = 2.26610050109567 | epot = -23.0042404655516 | etot = -17.587051223918
+942000  ekin = 3.50311245643908 |  erot = 1.88373602143018 | epot = -22.9671180112669 | etot = -17.5802695333976
+943000  ekin = 3.82043792465856 |  erot = 2.71285823250349 | epot = -22.9404059827705 | etot = -16.4071098256084
+944000  ekin = 2.68278476017665 |  erot = 2.75585489458162 | epot = -22.919058077481 | etot = -17.4804184227228
+945000  ekin = 2.55880828345199 |  erot = 2.02741981318915 | epot = -22.8232630911494 | etot = -18.2370349945083
+946000  ekin = 2.47548691870273 |  erot = 1.66864059361738 | epot = -22.6586979544826 | etot = -18.5145704421625
+947000  ekin = 2.41867478100658 |  erot = 1.99274780926995 | epot = -22.5542133657 | etot = -18.1427907754235
+948000  ekin = 3.54970439277898 |  erot = 2.57756240201335 | epot = -22.4104376157296 | etot = -16.2831708209373
+949000  ekin = 2.9858997616607 |  erot = 2.44208964275301 | epot = -22.197141123001 | etot = -16.7691517185873
+950000  ekin = 1.82147308870195 |  erot = 3.0508389937934 | epot = -22.0435130221227 | etot = -17.1712009396273
+951000  ekin = 2.20031505253436 |  erot = 2.38004890424645 | epot = -22.0174402075992 | etot = -17.4370762508184
+952000  ekin = 2.14165422682636 |  erot = 1.67045420750587 | epot = -21.9875031647927 | etot = -18.1753947304605
+953000  ekin = 2.29833469428311 |  erot = 1.97349532600851 | epot = -21.9532851584681 | etot = -17.6814551381765
+954000  ekin = 1.48835290094507 |  erot = 3.35692451991829 | epot = -21.8812774176255 | etot = -17.0359999967621
+955000  ekin = 1.87513794155826 |  erot = 2.65898918540887 | epot = -21.7919528937349 | etot = -17.2578257667677
+956000  ekin = 1.6947359470094 |  erot = 2.15427252360414 | epot = -21.7268035908356 | etot = -17.8777951202221
+957000  ekin = 1.75579814865835 |  erot = 1.63901039608815 | epot = -21.7007270322021 | etot = -18.3059184874556
+958000  ekin = 1.59869777656518 |  erot = 2.20104985114388 | epot = -21.7023937250484 | etot = -17.9026460973393
+959000  ekin = 2.58438881562724 |  erot = 2.4897790743314 | epot = -21.7153511733982 | etot = -16.6411832834396
+960000  ekin = 2.53916903929276 |  erot = 2.05995138561216 | epot = -21.7134163297425 | etot = -17.1142959048376
+961000  ekin = 2.28282707786747 |  erot = 2.18347157951505 | epot = -21.7152390799839 | etot = -17.2489404226014
+962000  ekin = 1.65520100959905 |  erot = 3.51416445242779 | epot = -21.7329558565077 | etot = -16.5635903944808
+963000  ekin = 1.99568689924178 |  erot = 1.50126173817714 | epot = -21.6847527677603 | etot = -18.1878041303414
+964000  ekin = 2.18616111169191 |  erot = 2.27601428306194 | epot = -21.6212716735791 | etot = -17.1590962788252
+965000  ekin = 2.12688674785305 |  erot = 2.31141713690626 | epot = -21.6018715374843 | etot = -17.163567652725
+966000  ekin = 3.18043989665769 |  erot = 3.42455452205087 | epot = -21.638305203769 | etot = -15.0333107850605
+967000  ekin = 3.07300409154253 |  erot = 2.17511749698305 | epot = -21.5951488445701 | etot = -16.3470272560445
+968000  ekin = 2.0866315065553 |  erot = 2.13997027735021 | epot = -21.5232721871232 | etot = -17.2966704032177
+969000  ekin = 2.26951411936363 |  erot = 2.21822796004343 | epot = -21.4611553284776 | etot = -16.9734132490706
+970000  ekin = 2.49167396599781 |  erot = 2.62083774678041 | epot = -21.4077353682587 | etot = -16.2952236554805
+971000  ekin = 2.497450596106 |  erot = 2.64553775005008 | epot = -21.3712924820093 | etot = -16.2283041358532
+972000  ekin = 3.2069302084461 |  erot = 2.47011294488449 | epot = -21.3144344371103 | etot = -15.6373912837797
+973000  ekin = 3.3593544808794 |  erot = 2.62917582888826 | epot = -21.2433830591838 | etot = -15.2548527494161
+974000  ekin = 2.71069552226069 |  erot = 2.13944446989065 | epot = -21.140426885518 | etot = -16.2902868933666
+975000  ekin = 1.81165819781674 |  erot = 2.10218924092724 | epot = -21.0499905566304 | etot = -17.1361431178865
+976000  ekin = 2.36984742020937 |  erot = 1.38488988265326 | epot = -20.9803229653516 | etot = -17.225585662489
+977000  ekin = 2.83728662155799 |  erot = 3.02976542728587 | epot = -21.086860961914 | etot = -15.2198089130702
+978000  ekin = 3.14169266917129 |  erot = 3.02799812032624 | epot = -21.1408187166748 | etot = -14.9711279271773
+979000  ekin = 3.63725915757345 |  erot = 2.47075910077981 | epot = -21.0348329782418 | etot = -14.9268147198886
+980000  ekin = 3.42622785415584 |  erot = 3.24164435781271 | epot = -20.9604411583363 | etot = -14.2925689463678
+981000  ekin = 2.9282364939793 |  erot = 2.44516658563951 | epot = -20.9993890158381 | etot = -15.6259859362193
+982000  ekin = 2.04558911070081 |  erot = 2.21302288881361 | epot = -21.0172581853275 | etot = -16.7586461858131
+983000  ekin = 2.56053983213182 |  erot = 1.98406283304106 | epot = -21.0054554868711 | etot = -16.4608528216982
+984000  ekin = 2.31455025377678 |  erot = 2.58584391470351 | epot = -21.05287489473 | etot = -16.1524807262497
+985000  ekin = 2.31703817263369 |  erot = 2.99965025262552 | epot = -21.1270579315131 | etot = -15.8103695062539
+986000  ekin = 2.05103854432386 |  erot = 2.1535155091137 | epot = -21.2182405597612 | etot = -17.0136865063237
+987000  ekin = 2.41899263793244 |  erot = 1.58416150281502 | epot = -21.1906087726859 | etot = -17.1874546319385
+988000  ekin = 2.75135283132847 |  erot = 2.70498731016256 | epot = -21.0902697836801 | etot = -15.633929642189
+989000  ekin = 2.29408577956131 |  erot = 2.85656205344492 | epot = -21.0178170251466 | etot = -15.8671691921404
+990000  ekin = 2.23414139649767 |  erot = 2.58987928207188 | epot = -20.9412338597722 | etot = -16.1172131812026
+991000  ekin = 2.20140095465642 |  erot = 2.53421928109186 | epot = -20.8284298905317 | etot = -16.0928096547835
+992000  ekin = 1.73516341340694 |  erot = 2.49726908126816 | epot = -20.8981414535471 | etot = -16.665708958872
+993000  ekin = 1.38883779880923 |  erot = 1.96818984395136 | epot = -20.9939445972527 | etot = -17.6369169544921
+994000  ekin = 1.48978908674571 |  erot = 2.95636513336702 | epot = -21.0608370227912 | etot = -16.6146828026784
+995000  ekin = 2.31404204513712 |  erot = 1.67482961392506 | epot = -21.1264761824826 | etot = -17.1376045234204
+996000  ekin = 2.8977650484701 |  erot = 2.85063328331353 | epot = -21.0879631716189 | etot = -15.3395648398353
+997000  ekin = 3.12980664910276 |  erot = 2.14994147346884 | epot = -21.0789162715404 | etot = -15.7991681489688
+998000  ekin = 2.21592279552962 |  erot = 3.03017611615785 | epot = -20.9989402817529 | etot = -15.7528413700655
+999000  ekin = 2.60947995309596 |  erot = 1.73829419308786 | epot = -20.9136108602424 | etot = -16.5658367140585
+1000000  ekin = 2.32269547490306 |  erot = 2.87794942105205 | epot = -20.9071852604882 | etot = -15.7065403645331
+ 1000000   0.10323091    -1.356822  0.050122912   -1.1615306 0.00013791576 
+Loop time of 36.2166 on 4 procs for 1000000 steps with 16 atoms
+
+Performance: 23856.477 tau/day, 27611.663 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    | 0.54933    | 13.254     | 25.208     | 308.0 | 36.60
+Bond    | 0.08723    | 0.416      | 0.70003    |  44.1 |  1.15
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 2.659      | 2.7239     | 2.7669     |   2.4 |  7.52
+Output  | 1.4e-05    | 2.25e-05   | 2.6e-05    |   0.0 |  0.00
+Modify  | 0.22084    | 2.7927     | 5.3062     | 134.0 |  7.71
+Other   |            | 17.03      |            |       | 47.02
+
+Nlocal:    4 ave 8 max 0 min
+Histogram: 1 1 0 0 0 0 0 0 1 1
+Nghost:    10 ave 12 max 8 min
+Histogram: 1 0 1 0 0 0 0 1 0 1
+Neighs:    39.75 ave 77 max 0 min
+Histogram: 1 1 0 0 0 0 0 0 0 2
+
+Total # of neighbors = 159
+Ave neighs/atom = 9.9375
+Ave special neighs/atom = 3.75
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:36
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.1 b/examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.1
new file mode 100644
index 0000000000..5a8d156ec4
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.1
@@ -0,0 +1,1172 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000116 secs
+  read_data CPU = 0.002026 secs
+
+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
+
+# 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
+
+#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 = 2.6274
+  ghost atom cutoff = 2.6274
+  binsize = 1.3137, 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
+Per MPI rank memory allocation (min/avg/max) = 3.024 | 3.024 | 3.024 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
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+162000  ekin = 0.249133354781009 |  erot = 0.604889772114047 | epot = -15.4715371620415 | etot = -14.6175140351465
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+192000  ekin = 0.251308489708551 |  erot = 0.555858063434352 | epot = -15.4246805881686 | etot = -14.6175140350257
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+282000  ekin = 0.405454262481042 |  erot = 0.564814480005611 | epot = -15.5877827776215 | etot = -14.6175140351348
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+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
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+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
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+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
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+736000  ekin = 0.200007166761159 |  erot = 0.667602683399479 | epot = -15.4851238849135 | etot = -14.6175140347528
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+738000  ekin = 0.188451200585547 |  erot = 0.684300102137718 | epot = -15.4902653375453 | etot = -14.6175140348221
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+743000  ekin = 0.20443350363757 |  erot = 0.684016821527744 | epot = -15.5059643602408 | etot = -14.6175140350755
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+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
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+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
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+778000  ekin = 0.178060391221893 |  erot = 0.377596905889502 | epot = -15.1731713318714 | etot = -14.61751403476
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+783000  ekin = 0.289681273783551 |  erot = 0.495837747641305 | epot = -15.4030330565279 | etot = -14.617514035103
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+792000  ekin = 0.315479253539392 |  erot = 0.716247584423973 | epot = -15.6492408730215 | etot = -14.6175140350582
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+794000  ekin = 0.304617480925239 |  erot = 0.745071299199412 | epot = -15.6672028151708 | etot = -14.6175140350461
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+800000  ekin = 0.280202790631652 |  erot = 0.746105645863969 | epot = -15.643822471626 | etot = -14.6175140351304
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+804000  ekin = 0.258053167891105 |  erot = 0.670993199746629 | epot = -15.5465604026808 | etot = -14.6175140350431
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+820000  ekin = 0.199933211814771 |  erot = 0.445497181488374 | epot = -15.2629444280486 | etot = -14.6175140347454
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+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 18.4193 on 1 procs for 1000000 steps with 10 atoms
+
+Performance: 46907.305 tau/day, 54290.862 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    | 14.935     | 14.935     | 14.935     |   0.0 | 81.08
+Bond    | 0.55556    | 0.55556    | 0.55556    |   0.0 |  3.02
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 0.16028    | 0.16028    | 0.16028    |   0.0 |  0.87
+Output  | 7e-06      | 7e-06      | 7e-06      |   0.0 |  0.00
+Modify  | 2.5402     | 2.5402     | 2.5402     |   0.0 | 13.79
+Other   |            | 0.2285     |            |       |  1.24
+
+Nlocal:    10 ave 10 max 10 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Nghost:    0 ave 0 max 0 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Neighs:    45 ave 45 max 45 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+
+Total # of neighbors = 45
+Ave neighs/atom = 4.5
+Ave special neighs/atom = 3.6
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:18
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.4 b/examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.4
new file mode 100644
index 0000000000..329e720074
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex1/log.07Aug19.duplex1.g++.4
@@ -0,0 +1,1172 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000198 secs
+  read_data CPU = 0.004522 secs
+
+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
+
+# 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
+
+#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 = 2.6274
+  ghost atom cutoff = 2.6274
+  binsize = 1.3137, 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
+Per MPI rank memory allocation (min/avg/max) = 7.653 | 7.835 | 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
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+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
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+111000  ekin = 0.149569382110055 |  erot = 0.891601400936344 | epot = -15.6586848182636 | etot = -14.6175140352172
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+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
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+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
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+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
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+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
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+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
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+142000  ekin = 0.117908250109871 |  erot = 0.332213334114279 | epot = -15.0676356188632 | etot = -14.6175140346391
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+172000  ekin = 0.265471962314995 |  erot = 0.43684655757276 | epot = -15.3198325546728 | etot = -14.617514034785
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+183000  ekin = 0.32960779233749 |  erot = 0.459899520065503 | epot = -15.4070213475091 | etot = -14.6175140351061
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+192000  ekin = 0.251308489707993 |  erot = 0.555858063434326 | epot = -15.4246805881679 | etot = -14.6175140350256
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+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
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+674000  ekin = 0.119064262674211 |  erot = 0.546415679822031 | epot = -15.2829939772145 | etot = -14.6175140347182
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+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 20.7945 on 4 procs for 1000000 steps with 10 atoms
+
+Performance: 41549.361 tau/day, 48089.538 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    | 0.66725    | 7.9254     | 14.304     | 209.9 | 38.11
+Bond    | 0.095496   | 0.30973    | 0.49863    |  30.5 |  1.49
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 1.8943     | 2.1825     | 2.4604     |  15.6 | 10.50
+Output  | 2e-05      | 2.9e-05    | 3.2e-05    |   0.0 |  0.00
+Modify  | 0.18231    | 0.95644    | 1.673      |  62.4 |  4.60
+Other   |            | 9.421      |            |       | 45.30
+
+Nlocal:    2.5 ave 5 max 0 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+Nghost:    7.5 ave 10 max 5 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+Neighs:    18.5 ave 35 max 0 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+
+Total # of neighbors = 74
+Ave neighs/atom = 7.4
+Ave special neighs/atom = 3.6
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:20
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.1 b/examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.1
new file mode 100644
index 0000000000..c934279c1a
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.1
@@ -0,0 +1,1174 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000127 secs
+  read_data CPU = 0.001506 secs
+
+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
+
+# 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
+
+#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 = 2.6274
+  ghost atom cutoff = 2.6274
+  binsize = 1.3137, 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
+Per MPI rank memory allocation (min/avg/max) = 3.026 | 3.026 | 3.026 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 = 2.72073389273301 |  erot = 1.81206134758344 | epot = -21.8246886433981 | etot = -17.2918934030816
+129000  ekin = 2.76648233159587 |  erot = 2.90133130407443 | epot = -21.9103698595755 | etot = -16.2425562239052
+130000  ekin = 3.26919771496399 |  erot = 2.56804213542044 | epot = -22.0468205769693 | etot = -16.2095807265849
+131000  ekin = 2.65797021501453 |  erot = 2.51912811588696 | epot = -22.1046945041584 | etot = -16.9275961732569
+132000  ekin = 2.60615175826329 |  erot = 3.39821871959342 | epot = -22.1393658191679 | etot = -16.1349953413112
+133000  ekin = 2.01702653257964 |  erot = 2.88164356754679 | epot = -22.1083395633022 | etot = -17.2096694631758
+134000  ekin = 1.62732528940444 |  erot = 1.66916296573806 | epot = -22.0617984863721 | etot = -18.7653102312296
+135000  ekin = 2.44472224525446 |  erot = 2.12100291286044 | epot = -22.0290071826116 | etot = -17.4632820244967
+136000  ekin = 2.29361895961086 |  erot = 3.04813516280966 | epot = -21.9240579822781 | etot = -16.5823038598575
+137000  ekin = 2.71943103843212 |  erot = 2.46250134466529 | epot = -21.759346222065 | etot = -16.5774138389676
+138000  ekin = 3.29026615453928 |  erot = 1.74005246857097 | epot = -21.7424803627639 | etot = -16.7121617396537
+139000  ekin = 2.76078280183931 |  erot = 1.72093988964439 | epot = -21.8915740702781 | etot = -17.4098513787944
+140000  ekin = 2.72717929836212 |  erot = 2.46093572161851 | epot = -21.9730696792527 | etot = -16.784954659272
+141000  ekin = 2.79178566984556 |  erot = 2.45152416051809 | epot = -21.9760531770405 | etot = -16.7327433466769
+142000  ekin = 3.51808959230238 |  erot = 3.47662361887462 | epot = -21.9144706671159 | etot = -14.9197574559389
+143000  ekin = 2.56674276565954 |  erot = 2.02320192154355 | epot = -21.887847774869 | etot = -17.2979030876659
+144000  ekin = 3.71876753045239 |  erot = 3.03518010984555 | epot = -21.8693810552709 | etot = -15.115433414973
+145000  ekin = 3.61067898932004 |  erot = 2.70461629179152 | epot = -21.7768865247848 | etot = -15.4615912436733
+146000  ekin = 3.85672431702576 |  erot = 2.48360222237068 | epot = -21.7383083831155 | etot = -15.3979818437191
+147000  ekin = 3.26264642879795 |  erot = 2.07790943830875 | epot = -21.612808589745 | etot = -16.2722527226383
+148000  ekin = 2.49411629896921 |  erot = 1.64570933977901 | epot = -21.3601881264357 | etot = -17.2203624876875
+149000  ekin = 2.73353556199719 |  erot = 2.27529903215971 | epot = -21.180923940444 | etot = -16.1720893462871
+150000  ekin = 2.6282457385967 |  erot = 2.90058901460194 | epot = -21.0864924194498 | etot = -15.5576576662512
+151000  ekin = 2.07954165316093 |  erot = 2.1164125590575 | epot = -20.9951076802445 | etot = -16.7991534680261
+152000  ekin = 2.41868973763601 |  erot = 2.60413735099777 | epot = -20.8520585412647 | etot = -15.8292314526309
+153000  ekin = 2.12569822788918 |  erot = 2.25674944787518 | epot = -20.8874716791535 | etot = -16.5050240033891
+154000  ekin = 2.34486280100484 |  erot = 2.61050919353092 | epot = -20.9924730886396 | etot = -16.0371010941038
+155000  ekin = 2.06912274657395 |  erot = 3.0299583491991 | epot = -21.0207700832301 | etot = -15.921688987457
+156000  ekin = 2.03235057930374 |  erot = 3.18386486882217 | epot = -20.8574059636368 | etot = -15.6411905155109
+157000  ekin = 2.3579061324469 |  erot = 1.91132393217369 | epot = -20.8256173876826 | etot = -16.556387323062
+158000  ekin = 2.17332819176356 |  erot = 2.47832446500284 | epot = -20.9206749462161 | etot = -16.2690222894497
+159000  ekin = 2.87139796431922 |  erot = 2.29125458595932 | epot = -21.0425793637301 | etot = -15.8799268134516
+160000  ekin = 2.19495281512895 |  erot = 2.37206762182712 | epot = -21.12868212155 | etot = -16.5616616845939
+161000  ekin = 2.13209841436583 |  erot = 2.44149028746738 | epot = -21.2267263358883 | etot = -16.6531376340551
+162000  ekin = 1.75046056470489 |  erot = 2.66847316377717 | epot = -21.2792984888785 | etot = -16.8603647603965
+163000  ekin = 2.22203312194875 |  erot = 2.03600602857084 | epot = -21.4244626156303 | etot = -17.1664234651107
+164000  ekin = 2.74926161019501 |  erot = 1.42936965542836 | epot = -21.5631783920293 | etot = -17.384547126406
+165000  ekin = 2.66465183950737 |  erot = 2.28908630196103 | epot = -21.572272285795 | etot = -16.6185341443266
+166000  ekin = 3.29267065001881 |  erot = 2.38564084157004 | epot = -21.5039232020267 | etot = -15.8256117104378
+167000  ekin = 3.03664818915841 |  erot = 2.03669674074452 | epot = -21.5747204885882 | etot = -16.5013755586853
+168000  ekin = 3.16556842965113 |  erot = 1.85206282714724 | epot = -21.6223493129218 | etot = -16.6047180561234
+169000  ekin = 2.24511985727904 |  erot = 2.66889068764969 | epot = -21.5368970033532 | etot = -16.6228864584245
+170000  ekin = 2.43734116474603 |  erot = 2.49716986363814 | epot = -21.3912465276853 | etot = -16.4567354993011
+171000  ekin = 1.90620260936893 |  erot = 2.39687883544744 | epot = -21.3008997539566 | etot = -16.9978183091402
+172000  ekin = 2.87444998880216 |  erot = 3.21713663160875 | epot = -21.2616188758685 | etot = -15.1700322554576
+173000  ekin = 2.74942738368889 |  erot = 2.14120450530294 | epot = -21.2850360200821 | etot = -16.3944041310903
+174000  ekin = 2.4529377396394 |  erot = 2.23261644076142 | epot = -21.3299047479428 | etot = -16.644350567542
+175000  ekin = 2.84864650053625 |  erot = 2.37733794803682 | epot = -21.2943230039461 | etot = -16.068338555373
+176000  ekin = 2.13647755199109 |  erot = 1.89602819204849 | epot = -21.3605335602015 | etot = -17.3280278161619
+177000  ekin = 2.57740970525463 |  erot = 2.74252419383388 | epot = -21.3306809364134 | etot = -16.0107470373249
+178000  ekin = 1.83680522170069 |  erot = 2.5856914127028 | epot = -21.2632846497336 | etot = -16.8407880153301
+179000  ekin = 2.51484018139121 |  erot = 2.38459479892641 | epot = -21.325303559771 | etot = -16.4258685794534
+180000  ekin = 1.88523508330591 |  erot = 2.46381998482447 | epot = -21.4811020579528 | etot = -17.1320469898224
+181000  ekin = 1.75689043588625 |  erot = 3.04324017089631 | epot = -21.474228259015 | etot = -16.6740976522324
+182000  ekin = 1.56534231241504 |  erot = 2.04864866727399 | epot = -21.4129540971941 | etot = -17.798963117505
+183000  ekin = 2.00287899563344 |  erot = 2.82515065812734 | epot = -21.49258719815 | etot = -16.6645575443892
+184000  ekin = 2.68544625765532 |  erot = 2.43626281495748 | epot = -21.6103862218356 | etot = -16.4886771492228
+185000  ekin = 2.99891111533195 |  erot = 3.19602779235331 | epot = -21.6822175762628 | etot = -15.4872786685775
+186000  ekin = 3.18195376963592 |  erot = 2.43765957688182 | epot = -21.7117512273523 | etot = -16.0921378808346
+187000  ekin = 2.64722090162018 |  erot = 3.43145857630564 | epot = -21.6694156065006 | etot = -15.5907361285748
+188000  ekin = 2.8593721905413 |  erot = 3.05764002667605 | epot = -21.6129263142805 | etot = -15.6959140970631
+189000  ekin = 2.64258352431382 |  erot = 1.81957536948003 | epot = -21.5503774009301 | etot = -17.0882185071363
+190000  ekin = 2.2190608435254 |  erot = 1.84740673329965 | epot = -21.5105703637082 | etot = -17.4441027868831
+191000  ekin = 2.27442549063464 |  erot = 2.06581774328105 | epot = -21.4485511972947 | etot = -17.108307963379
+192000  ekin = 2.27419285809427 |  erot = 3.10822480468651 | epot = -21.4844439428341 | etot = -16.1020262800533
+193000  ekin = 1.95256612457884 |  erot = 1.88944690058107 | epot = -21.4719648319093 | etot = -17.6299518067494
+194000  ekin = 2.46290863552507 |  erot = 2.02714246570739 | epot = -21.3483686370757 | etot = -16.8583175358433
+195000  ekin = 3.12615833704228 |  erot = 2.09882827884293 | epot = -21.2854694780647 | etot = -16.0604828621794
+196000  ekin = 2.70126861243405 |  erot = 2.51307250710585 | epot = -21.2052184052664 | etot = -15.9908772857265
+197000  ekin = 2.55113347479427 |  erot = 2.07490331769114 | epot = -21.0379488001649 | etot = -16.4119120076795
+198000  ekin = 2.7091171175815 |  erot = 1.79542986755821 | epot = -21.0311079948236 | etot = -16.5265610096839
+199000  ekin = 2.57086088527333 |  erot = 2.33194065149168 | epot = -21.0448935828999 | etot = -16.1420920461349
+200000  ekin = 2.89149033048946 |  erot = 1.42165157230865 | epot = -21.03770919399 | etot = -16.7245672911919
+201000  ekin = 2.68304721320748 |  erot = 1.55647352804279 | epot = -21.0368254418007 | etot = -16.7973047005504
+202000  ekin = 2.2656487707054 |  erot = 2.24246330836477 | epot = -20.9783437689148 | etot = -16.4702316898446
+203000  ekin = 2.11263799464235 |  erot = 2.0311722239375 | epot = -20.9045528293636 | etot = -16.7607426107837
+204000  ekin = 2.10289033168206 |  erot = 1.89431766090034 | epot = -20.917707897003 | etot = -16.9204999044206
+205000  ekin = 1.32594040742044 |  erot = 2.12787440210413 | epot = -20.9650467335179 | etot = -17.5112319239933
+206000  ekin = 1.37942510627947 |  erot = 2.255876437166 | epot = -20.9344799697865 | etot = -17.299178426341
+207000  ekin = 1.89707208497052 |  erot = 1.80792832329628 | epot = -21.0372131039119 | etot = -17.3322126956451
+208000  ekin = 1.82394216235567 |  erot = 3.24636401083921 | epot = -21.2905133091558 | etot = -16.2202071359609
+209000  ekin = 2.80235035495642 |  erot = 2.34817422826193 | epot = -21.4119988544966 | etot = -16.2614742712782
+210000  ekin = 3.17268831077415 |  erot = 3.11920168004874 | epot = -21.4880486169942 | etot = -15.1961586261713
+211000  ekin = 2.46911290485391 |  erot = 2.09583435351186 | epot = -21.6131156278285 | etot = -17.0481683694628
+212000  ekin = 2.36983963899524 |  erot = 1.93490727968814 | epot = -21.6916906588951 | etot = -17.3869437402117
+213000  ekin = 1.90089387455099 |  erot = 2.5187405361218 | epot = -21.7688631446424 | etot = -17.3492287339696
+214000  ekin = 1.97453946438608 |  erot = 2.49804990679736 | epot = -21.7968032544022 | etot = -17.3242138832188
+215000  ekin = 1.97170537707849 |  erot = 3.1720109210939 | epot = -21.7980499435109 | etot = -16.6543336453385
+216000  ekin = 1.89064429395263 |  erot = 1.88113651267029 | epot = -21.7625464985643 | etot = -17.9907656919414
+217000  ekin = 2.0626433286583 |  erot = 1.95286476791462 | epot = -21.8181895344454 | etot = -17.8026814378725
+218000  ekin = 2.31967181974704 |  erot = 1.6896622434335 | epot = -21.7699992955268 | etot = -17.7606652323462
+219000  ekin = 2.46739391618502 |  erot = 2.20775453602831 | epot = -21.776978875084 | etot = -17.1018304228706
+220000  ekin = 1.73785505731585 |  erot = 3.0372433480804 | epot = -21.7321393101048 | etot = -16.9570409047086
+221000  ekin = 1.778697043089 |  erot = 2.7846909329313 | epot = -21.7425830987872 | etot = -17.1791951227669
+222000  ekin = 2.62634865011186 |  erot = 2.86077326472522 | epot = -21.7007933593054 | etot = -16.2136714444683
+223000  ekin = 3.04431297723215 |  erot = 1.94008328047868 | epot = -21.7188465939138 | etot = -16.734450336203
+224000  ekin = 2.71939424183677 |  erot = 2.42480251627533 | epot = -21.6866518782312 | etot = -16.5424551201191
+225000  ekin = 2.02593449761365 |  erot = 3.37613250979673 | epot = -21.6919775986917 | etot = -16.2899105912813
+226000  ekin = 2.36496088602628 |  erot = 2.39060577783945 | epot = -21.7612411053054 | etot = -17.0056744414397
+227000  ekin = 2.73527371921374 |  erot = 2.63040468048003 | epot = -21.8235720454426 | etot = -16.4578936457488
+228000  ekin = 2.09009153610323 |  erot = 2.26861924367323 | epot = -21.8859446312141 | etot = -17.5272338514377
+229000  ekin = 1.80131280326501 |  erot = 1.7963110804324 | epot = -21.9677974652423 | etot = -18.3701735815449
+230000  ekin = 2.77436270232913 |  erot = 2.22792046726092 | epot = -21.9902739646399 | etot = -16.9879907950498
+231000  ekin = 3.15789416871844 |  erot = 2.77494856675301 | epot = -21.9771750398138 | etot = -16.0443323043424
+232000  ekin = 1.86920525086143 |  erot = 1.70617009970185 | epot = -22.0127465263534 | etot = -18.4373711757901
+233000  ekin = 1.75915660001321 |  erot = 1.56505378532405 | epot = -21.9936912811375 | etot = -18.6694808958002
+234000  ekin = 2.33631680564953 |  erot = 2.05523369254154 | epot = -21.9151391633044 | etot = -17.5235886651133
+235000  ekin = 1.95729755108493 |  erot = 2.52297007842176 | epot = -21.8622583087295 | etot = -17.3819906792228
+236000  ekin = 2.26174488772854 |  erot = 1.90926942275389 | epot = -21.8776848863915 | etot = -17.7066705759091
+237000  ekin = 2.48859859508474 |  erot = 2.6489237604941 | epot = -21.9479801146397 | etot = -16.8104577590608
+238000  ekin = 2.21074117955686 |  erot = 2.74245988956904 | epot = -22.0027094279364 | etot = -17.0495083588105
+239000  ekin = 2.72897236706913 |  erot = 2.49153579775713 | epot = -22.0211522435864 | etot = -16.8006440787602
+240000  ekin = 3.10410575629688 |  erot = 2.19185039149975 | epot = -21.9285399490843 | etot = -16.6325838012877
+241000  ekin = 3.04659381738443 |  erot = 2.65407823399251 | epot = -21.8553999209703 | etot = -16.1547278695933
+242000  ekin = 2.22634814860329 |  erot = 2.33710119371497 | epot = -21.778295180705 | etot = -17.2148458383868
+243000  ekin = 1.53739989500925 |  erot = 2.804422651144 | epot = -21.7210994015014 | etot = -17.3792768553481
+244000  ekin = 1.91594160283678 |  erot = 2.43897673315061 | epot = -21.6239948430905 | etot = -17.2690765071031
+245000  ekin = 1.9573212108497 |  erot = 2.60792757585164 | epot = -21.4969890421964 | etot = -16.931740255495
+246000  ekin = 2.07155268659352 |  erot = 2.40712847472271 | epot = -21.4555802858827 | etot = -16.9768991245664
+247000  ekin = 1.55687592357629 |  erot = 2.27937051296287 | epot = -21.415801560854 | etot = -17.5795551243148
+248000  ekin = 1.83815644169539 |  erot = 2.56757546633135 | epot = -21.4396063392852 | etot = -17.0338744312585
+249000  ekin = 1.79880701831597 |  erot = 2.0439839568354 | epot = -21.5116552123395 | etot = -17.6688642371882
+250000  ekin = 1.6819474109243 |  erot = 3.39458382990459 | epot = -21.5432862054069 | etot = -16.466754964578
+251000  ekin = 2.13148829031636 |  erot = 3.25959517865089 | epot = -21.5335137503413 | etot = -16.142430281374
+252000  ekin = 2.05395839402013 |  erot = 2.53819950912971 | epot = -21.5603119938518 | etot = -16.9681540907019
+253000  ekin = 1.65837982841157 |  erot = 3.21084156386521 | epot = -21.5856483774528 | etot = -16.716426985176
+254000  ekin = 2.32607189562296 |  erot = 3.10904441141191 | epot = -21.5835562113995 | etot = -16.1484399043647
+255000  ekin = 2.50516183463011 |  erot = 2.76806754476897 | epot = -21.5622650070292 | etot = -16.2890356276301
+256000  ekin = 1.97348594928106 |  erot = 2.62554900973971 | epot = -21.5549569513865 | etot = -16.9559219923657
+257000  ekin = 2.23010268129159 |  erot = 3.26394503338319 | epot = -21.5756937773404 | etot = -16.0816460626656
+258000  ekin = 2.0447966409083 |  erot = 1.84671550533958 | epot = -21.6926265414806 | etot = -17.8011143952327
+259000  ekin = 2.87403716266236 |  erot = 2.7890686554313 | epot = -21.799948240906 | etot = -16.1368424228124
+260000  ekin = 2.90780294403218 |  erot = 2.19263097772001 | epot = -21.8560884935551 | etot = -16.7556545718029
+261000  ekin = 2.76828016335186 |  erot = 2.34066383431491 | epot = -21.904753347489 | etot = -16.7958093498223
+262000  ekin = 3.52268021990509 |  erot = 1.77075610541266 | epot = -21.923252751046 | etot = -16.6298164257282
+263000  ekin = 3.08420493567484 |  erot = 2.42539400967894 | epot = -21.8573813915989 | etot = -16.3477824462451
+264000  ekin = 2.24745015945595 |  erot = 2.03541588430139 | epot = -21.8692313889178 | etot = -17.5863653451605
+265000  ekin = 1.92522220276231 |  erot = 2.5003676829468 | epot = -21.7418152763709 | etot = -17.3162253906618
+266000  ekin = 2.39641107663208 |  erot = 3.25288398956727 | epot = -21.6961161037834 | etot = -16.046821037584
+267000  ekin = 1.71111784450077 |  erot = 2.23671058890166 | epot = -21.6618183077995 | etot = -17.7139898743971
+268000  ekin = 2.10089423119538 |  erot = 3.22434301936133 | epot = -21.6199098144813 | etot = -16.2946725639246
+269000  ekin = 1.9625053447265 |  erot = 2.78709438989466 | epot = -21.512378343547 | etot = -16.7627786089258
+270000  ekin = 2.11347862898579 |  erot = 2.66955708081142 | epot = -21.4131997021519 | etot = -16.6301639923547
+271000  ekin = 2.18755627878071 |  erot = 3.10635949745237 | epot = -21.231195119641 | etot = -15.9372793434079
+272000  ekin = 2.53142755489725 |  erot = 2.28018838604503 | epot = -21.0716416692008 | etot = -16.2600257282585
+273000  ekin = 1.9364743445402 |  erot = 1.99261296885892 | epot = -21.007557675667 | etot = -17.0784703622679
+274000  ekin = 1.91013630831847 |  erot = 2.2120127665723 | epot = -21.0477834541013 | etot = -16.9256343792105
+275000  ekin = 1.79273258693701 |  erot = 3.10050032804429 | epot = -21.0858519409205 | etot = -16.1926190259392
+276000  ekin = 3.35719138398128 |  erot = 2.41111345420191 | epot = -21.0304226706007 | etot = -15.2621178324176
+277000  ekin = 2.41774397151369 |  erot = 1.50719443697989 | epot = -20.9759671563228 | etot = -17.0510287478292
+278000  ekin = 2.53951758510302 |  erot = 2.14756601555722 | epot = -20.9653070148297 | etot = -16.2782234141694
+279000  ekin = 1.90856122527452 |  erot = 2.38982437581387 | epot = -20.9745429336076 | etot = -16.6761573325192
+280000  ekin = 2.37131544290542 |  erot = 3.59489996493466 | epot = -20.85613421052 | etot = -14.8899188026799
+281000  ekin = 1.76889591811704 |  erot = 1.7951894912658 | epot = -20.9289254822807 | etot = -17.3648400728979
+282000  ekin = 2.27070827347114 |  erot = 3.05009551199377 | epot = -20.8916515658568 | etot = -15.5708477803919
+283000  ekin = 2.18685960365006 |  erot = 2.20812220616949 | epot = -20.8474969045899 | etot = -16.4525150947704
+284000  ekin = 1.91940159973892 |  erot = 2.20890146173499 | epot = -20.8751887573221 | etot = -16.7468856958482
+285000  ekin = 3.15509933694634 |  erot = 1.80738796351619 | epot = -21.0554892608396 | etot = -16.0930019603771
+286000  ekin = 3.87415003559708 |  erot = 1.83530883692693 | epot = -21.2366462656484 | etot = -15.5271873931244
+287000  ekin = 3.65191681280166 |  erot = 2.913547855761 | epot = -21.3085830740657 | etot = -14.7431184055031
+288000  ekin = 3.25566521528532 |  erot = 1.61409275051713 | epot = -21.3016538192157 | etot = -16.4318958534132
+289000  ekin = 2.57277357969492 |  erot = 2.7865509468974 | epot = -21.2753452951968 | etot = -15.9160207686044
+290000  ekin = 2.70842209282674 |  erot = 2.41918512811132 | epot = -21.2877903800065 | etot = -16.1601831590685
+291000  ekin = 2.06014704473036 |  erot = 2.36104758138505 | epot = -21.2845199368975 | etot = -16.8633253107821
+292000  ekin = 2.28556270655109 |  erot = 2.04929815389926 | epot = -21.3435089189608 | etot = -17.0086480585104
+293000  ekin = 2.24999256733429 |  erot = 2.35234276421049 | epot = -21.4532864362272 | etot = -16.8509511046824
+294000  ekin = 2.93128079968628 |  erot = 2.88901294012339 | epot = -21.5344832077337 | etot = -15.7141894679241
+295000  ekin = 2.66786158124138 |  erot = 2.29144551421467 | epot = -21.6972562684637 | etot = -16.7379491730076
+296000  ekin = 2.20703931624838 |  erot = 2.91798090137806 | epot = -21.7499994740518 | etot = -16.6249792564254
+297000  ekin = 2.17711857895463 |  erot = 3.3139407196584 | epot = -21.7438418246471 | etot = -16.2527825260341
+298000  ekin = 2.91263821701566 |  erot = 2.35687557807243 | epot = -21.7003108484957 | etot = -16.4307970534076
+299000  ekin = 3.16765240032233 |  erot = 2.23927360570976 | epot = -21.8111744518828 | etot = -16.4042484458507
+300000  ekin = 3.29571242152463 |  erot = 1.38932168050636 | epot = -21.8854995787115 | etot = -17.2004654766805
+301000  ekin = 2.38336849338668 |  erot = 3.30873138065989 | epot = -21.9040100279112 | etot = -16.2119101538647
+302000  ekin = 2.92546415072637 |  erot = 3.247691767578 | epot = -21.8700812142841 | etot = -15.6969252959798
+303000  ekin = 2.4103373416559 |  erot = 2.62018947425678 | epot = -21.8591741279587 | etot = -16.828647312046
+304000  ekin = 2.22974120288231 |  erot = 2.69525972032883 | epot = -21.7977946057185 | etot = -16.8727936825074
+305000  ekin = 2.37900884029014 |  erot = 2.39016080950149 | epot = -21.7722637572341 | etot = -17.0030941074424
+306000  ekin = 1.9446171443063 |  erot = 2.89927908625624 | epot = -21.772518921465 | etot = -16.9286226909024
+307000  ekin = 2.51296678773709 |  erot = 2.07871985749639 | epot = -21.7145354205816 | etot = -17.1228487753482
+308000  ekin = 2.81300442192371 |  erot = 2.63068774502107 | epot = -21.7059595575782 | etot = -16.2622673906334
+309000  ekin = 2.33295752921531 |  erot = 2.12114847477695 | epot = -21.6789859227475 | etot = -17.2248799187552
+310000  ekin = 2.52283407385729 |  erot = 3.21577684610766 | epot = -21.6977338722704 | etot = -15.9591229523054
+311000  ekin = 2.34905401714491 |  erot = 3.03961744974846 | epot = -21.7112095513776 | etot = -16.3225380844842
+312000  ekin = 1.82668239636477 |  erot = 3.25882975871633 | epot = -21.5839087054203 | etot = -16.4983965503392
+313000  ekin = 1.63596397844578 |  erot = 2.08106491982899 | epot = -21.6088054377576 | etot = -17.8917765394829
+314000  ekin = 2.27268061655198 |  erot = 2.56861774872119 | epot = -21.622333325343 | etot = -16.7810349600698
+315000  ekin = 2.53123691731374 |  erot = 2.1324731770604 | epot = -21.7018350864597 | etot = -17.0381249920856
+316000  ekin = 1.99511026234591 |  erot = 1.80085053236165 | epot = -21.7165753862862 | etot = -17.9206145915787
+317000  ekin = 2.11342130166581 |  erot = 2.00931752224566 | epot = -21.7049091699378 | etot = -17.5821703460263
+318000  ekin = 2.29657040201996 |  erot = 1.9218952520588 | epot = -21.6732020643863 | etot = -17.4547364103076
+319000  ekin = 1.98100978177984 |  erot = 1.68241530251755 | epot = -21.5700337503682 | etot = -17.9066086660708
+320000  ekin = 2.46277902525288 |  erot = 3.0707129249839 | epot = -21.5118277867106 | etot = -15.9783358364738
+321000  ekin = 1.8533722862421 |  erot = 2.67441728470359 | epot = -21.5413634192757 | etot = -17.01357384833
+322000  ekin = 1.94543884879318 |  erot = 3.3613066315754 | epot = -21.4649757180038 | etot = -16.1582302376352
+323000  ekin = 1.92582236335168 |  erot = 2.08582462630249 | epot = -21.5020070864549 | etot = -17.4903600968007
+324000  ekin = 2.21385975174577 |  erot = 2.45972054558752 | epot = -21.6040339423077 | etot = -16.9304536449744
+325000  ekin = 2.71973574551436 |  erot = 2.37172075216282 | epot = -21.7154750081878 | etot = -16.6240185105106
+326000  ekin = 1.88834012476607 |  erot = 1.92160793718507 | epot = -21.7697066104337 | etot = -17.9597585484825
+327000  ekin = 3.03100650626309 |  erot = 1.66914039489952 | epot = -21.8474776692767 | etot = -17.1473307681141
+328000  ekin = 2.74123304387623 |  erot = 1.9170666048058 | epot = -21.8856206551572 | etot = -17.2273210064752
+329000  ekin = 2.94158338898171 |  erot = 3.13997083102765 | epot = -21.9406516192959 | etot = -15.8590973992865
+330000  ekin = 2.91669398329971 |  erot = 2.01301123001111 | epot = -21.9369752911326 | etot = -17.0072700778218
+331000  ekin = 2.28417665381006 |  erot = 2.04960167200569 | epot = -21.927160006304 | etot = -17.5933816804883
+332000  ekin = 2.4148148688836 |  erot = 3.18178691603942 | epot = -21.9797962539673 | etot = -16.3831944690443
+333000  ekin = 2.45630818257634 |  erot = 2.70954264697347 | epot = -22.0834375892948 | etot = -16.917586759745
+334000  ekin = 2.37347521855933 |  erot = 2.99534828037212 | epot = -22.119902754337 | etot = -16.7510792554055
+335000  ekin = 2.11274250313861 |  erot = 3.56585847378427 | epot = -22.1620352555629 | etot = -16.48343427864
+336000  ekin = 2.63429420241716 |  erot = 2.12841745309053 | epot = -22.1384285356293 | etot = -17.3757168801216
+337000  ekin = 2.74014146566976 |  erot = 2.73588205536329 | epot = -22.1194416289215 | etot = -16.6434181078884
+338000  ekin = 1.84480508690214 |  erot = 2.23455733552335 | epot = -22.1965093971539 | etot = -18.1171469747284
+339000  ekin = 1.56183988387053 |  erot = 2.489100411134 | epot = -22.2396203002948 | etot = -18.1886800052903
+340000  ekin = 1.46409027371678 |  erot = 4.0512372950447 | epot = -22.1584645354502 | etot = -16.6431369666887
+341000  ekin = 1.68589245970878 |  erot = 2.79353148184118 | epot = -22.1393063295445 | etot = -17.6598823879945
+342000  ekin = 1.9632055547669 |  erot = 2.74455536956775 | epot = -22.2008946996018 | etot = -17.4931337752671
+343000  ekin = 2.66782090058793 |  erot = 3.18156117072004 | epot = -22.2922370675599 | etot = -16.4428549962519
+344000  ekin = 1.78878469299216 |  erot = 2.18063379585249 | epot = -22.3229742728833 | etot = -18.3535557840387
+345000  ekin = 1.540972096623 |  erot = 1.85836807653953 | epot = -22.3669594635967 | etot = -18.9676192904341
+346000  ekin = 1.69306131915114 |  erot = 1.80797582028411 | epot = -22.3312791976866 | etot = -18.8302420582514
+347000  ekin = 1.37617258934979 |  erot = 2.61616357123582 | epot = -22.3534264320593 | etot = -18.3610902714737
+348000  ekin = 2.13829045790164 |  erot = 2.85908731375532 | epot = -22.3464198630052 | etot = -17.3490420913483
+349000  ekin = 1.82945196641201 |  erot = 1.97678849263654 | epot = -22.3619223728943 | etot = -18.5556819138458
+350000  ekin = 1.78944470920989 |  erot = 2.50950790539659 | epot = -22.3467767277336 | etot = -18.0478241131271
+351000  ekin = 1.68749587286921 |  erot = 2.81742906170281 | epot = -22.4171372510498 | etot = -17.9122123164778
+352000  ekin = 2.77021178817643 |  erot = 2.15256178979697 | epot = -22.5877268787862 | etot = -17.6649533008128
+353000  ekin = 3.5651579503159 |  erot = 1.46627940614144 | epot = -22.6396840781933 | etot = -17.608246721736
+354000  ekin = 3.44763260550689 |  erot = 2.25092776011915 | epot = -22.5553143373262 | etot = -16.8567539717001
+355000  ekin = 2.03402845200418 |  erot = 2.90906782343746 | epot = -22.5137132330461 | etot = -17.5706169576044
+356000  ekin = 2.10644486273696 |  erot = 3.31938387624324 | epot = -22.5442634045104 | etot = -17.1184346655302
+357000  ekin = 2.76535001946383 |  erot = 2.50873330135166 | epot = -22.52215971412 | etot = -17.2480763933045
+358000  ekin = 2.53751054023787 |  erot = 2.26477084741189 | epot = -22.5103746530379 | etot = -17.7080932653881
+359000  ekin = 3.23570364771486 |  erot = 2.52813698122051 | epot = -22.6019986378314 | etot = -16.838158008896
+360000  ekin = 2.59175576606819 |  erot = 1.97223576668381 | epot = -22.6470028729806 | etot = -18.0830113402286
+361000  ekin = 2.61182361704566 |  erot = 2.50385714239847 | epot = -22.6927829246934 | etot = -17.5771021652493
+362000  ekin = 2.38475515872101 |  erot = 3.84233912950958 | epot = -22.6454854809905 | etot = -16.4183911927599
+363000  ekin = 2.88487115582968 |  erot = 1.98709532428838 | epot = -22.5316518293815 | etot = -17.6596853492635
+364000  ekin = 2.24456282663807 |  erot = 1.87857741688963 | epot = -22.4065988337859 | etot = -18.2834585902582
+365000  ekin = 2.04295690198209 |  erot = 2.81008642631349 | epot = -22.2314366274422 | etot = -17.3783932991466
+366000  ekin = 2.266544192376 |  erot = 1.95642386899595 | epot = -22.1933765521819 | etot = -17.97040849081
+367000  ekin = 2.81580114465084 |  erot = 2.51878026336671 | epot = -22.2503978612043 | etot = -16.9158164531867
+368000  ekin = 2.81616947616975 |  erot = 2.18673959088794 | epot = -22.3700662776457 | etot = -17.367157210588
+369000  ekin = 2.31685128708704 |  erot = 2.8485166214536 | epot = -22.4347113127671 | etot = -17.2693434042264
+370000  ekin = 2.66633369096824 |  erot = 2.10373843245294 | epot = -22.5097473869516 | etot = -17.7396752635304
+371000  ekin = 2.19554700980946 |  erot = 3.61136788339347 | epot = -22.5751109079912 | etot = -16.7681960147883
+372000  ekin = 1.77355024694411 |  erot = 3.42422008956619 | epot = -22.6682235461143 | etot = -17.470453209604
+373000  ekin = 2.14882393689494 |  erot = 2.79102164241389 | epot = -22.7183823639386 | etot = -17.7785367846297
+374000  ekin = 2.69471790401649 |  erot = 3.57888941010137 | epot = -22.8644350080836 | etot = -16.5908276939657
+375000  ekin = 2.40588229328688 |  erot = 2.98559431132055 | epot = -22.9231560989464 | etot = -17.5316794943389
+376000  ekin = 3.36525975858234 |  erot = 3.24749522030667 | epot = -22.9448546765658 | etot = -16.3320996976767
+377000  ekin = 3.1898535090454 |  erot = 2.65440981370779 | epot = -22.8890189773608 | etot = -17.0447556546076
+378000  ekin = 1.54661929765086 |  erot = 2.66304115784623 | epot = -22.8894135140088 | etot = -18.6797530585117
+379000  ekin = 1.93848939303329 |  erot = 2.54534330055222 | epot = -22.9081180555037 | etot = -18.4242853619182
+380000  ekin = 2.66258042260528 |  erot = 2.88895789126712 | epot = -22.9376621442708 | etot = -17.3861238303984
+381000  ekin = 2.95374671041029 |  erot = 2.1769850563328 | epot = -22.9816080577256 | etot = -17.8508762909825
+382000  ekin = 2.58850292280408 |  erot = 2.01885613358327 | epot = -22.9279053853416 | etot = -18.3205463289542
+383000  ekin = 2.01542491830335 |  erot = 2.50444856286716 | epot = -22.9509700194999 | etot = -18.4310965383294
+384000  ekin = 2.10088918623931 |  erot = 2.19861971638621 | epot = -22.9637245689725 | etot = -18.664215666347
+385000  ekin = 1.91381637067085 |  erot = 1.63023926713733 | epot = -22.9798616984434 | etot = -19.4358060606352
+386000  ekin = 1.55997375471681 |  erot = 1.35864886272388 | epot = -23.026401230456 | etot = -20.1077786130153
+387000  ekin = 2.21265030198491 |  erot = 1.7501227932087 | epot = -23.0266356759123 | etot = -19.0638625807187
+388000  ekin = 1.98732621523102 |  erot = 1.96003045102707 | epot = -22.9343684877508 | etot = -18.9870118214927
+389000  ekin = 2.5418388293764 |  erot = 2.33933777400626 | epot = -22.9288764120935 | etot = -18.0476998087109
+390000  ekin = 2.07840415144685 |  erot = 1.88714080084969 | epot = -22.8368099519711 | etot = -18.8712649996745
+391000  ekin = 1.85201287716429 |  erot = 2.41309749069991 | epot = -22.8035614550317 | etot = -18.5384510871675
+392000  ekin = 2.19897450334475 |  erot = 2.90002030847564 | epot = -22.8026053664846 | etot = -17.7036105546642
+393000  ekin = 2.15250422129825 |  erot = 3.1954140871906 | epot = -22.8935871868038 | etot = -17.5456688783149
+394000  ekin = 1.99220043003136 |  erot = 2.14720550675182 | epot = -22.8839525821639 | etot = -18.7445466453807
+395000  ekin = 2.03384825587122 |  erot = 2.5026704188622 | epot = -22.9355340107645 | etot = -18.3990153360311
+396000  ekin = 2.14388612805494 |  erot = 1.95887569078926 | epot = -23.0314147787906 | etot = -18.9286529599464
+397000  ekin = 2.39817268086959 |  erot = 1.65198489715495 | epot = -23.1381610188687 | etot = -19.0880034408442
+398000  ekin = 3.5848529329223 |  erot = 2.5137795193631 | epot = -23.2493671328086 | etot = -17.1507346805232
+399000  ekin = 2.65690410152896 |  erot = 1.78815540583896 | epot = -23.3551071826471 | etot = -18.9100476752792
+400000  ekin = 2.5116972230557 |  erot = 2.10904464709597 | epot = -23.4242760069967 | etot = -18.803534136845
+401000  ekin = 2.05111703519218 |  erot = 2.15375363886755 | epot = -23.4796569613041 | etot = -19.2747862872443
+402000  ekin = 2.43372934314587 |  erot = 2.11260100954187 | epot = -23.4682554876931 | etot = -18.9219251350053
+403000  ekin = 2.53598880596584 |  erot = 2.81278076880176 | epot = -23.5378775828587 | etot = -18.1891080080911
+404000  ekin = 2.18194702425602 |  erot = 2.63711249102604 | epot = -23.6244518702206 | etot = -18.8053923549385
+405000  ekin = 2.45121967393562 |  erot = 2.40500763090291 | epot = -23.6357713162683 | etot = -18.7795440114298
+406000  ekin = 2.21958671378093 |  erot = 2.24922226746756 | epot = -23.6553601287 | etot = -19.1865511474515
+407000  ekin = 1.98564574231222 |  erot = 2.77863717556005 | epot = -23.5607032705187 | etot = -18.7964203526464
+408000  ekin = 2.57646591315375 |  erot = 2.58095218000659 | epot = -23.4398366413677 | etot = -18.2824185482073
+409000  ekin = 2.36945583486912 |  erot = 2.25935935813466 | epot = -23.3294611001761 | etot = -18.7006459071724
+410000  ekin = 2.02254604345491 |  erot = 1.96483214055515 | epot = -23.3122760741247 | etot = -19.3248978901146
+411000  ekin = 1.87895167522371 |  erot = 2.65152784802951 | epot = -23.2919254735047 | etot = -18.7614459502515
+412000  ekin = 1.99369299492691 |  erot = 2.68971636909523 | epot = -23.2559513781021 | etot = -18.57254201408
+413000  ekin = 2.38900558877156 |  erot = 2.64564764432049 | epot = -23.2013938450539 | etot = -18.1667406119618
+414000  ekin = 2.42764300748033 |  erot = 1.75174590229272 | epot = -23.1266922276306 | etot = -18.9473033178576
+415000  ekin = 2.76414124953308 |  erot = 2.44215852210494 | epot = -23.1817305186064 | etot = -17.9754307469683
+416000  ekin = 2.08280868301927 |  erot = 2.76578542751831 | epot = -23.1905832299196 | etot = -18.341989119382
+417000  ekin = 1.99968890800012 |  erot = 1.95787693284286 | epot = -23.194417716001 | etot = -19.236851875158
+418000  ekin = 2.38298881868294 |  erot = 2.55898711987873 | epot = -23.1586352965619 | etot = -18.2166593580002
+419000  ekin = 2.9839633883085 |  erot = 2.57065203496089 | epot = -23.0544780894577 | etot = -17.4998626661883
+420000  ekin = 2.60178854557762 |  erot = 2.46052060802045 | epot = -22.9622762729971 | etot = -17.899967119399
+421000  ekin = 2.51720276737396 |  erot = 1.77804167911051 | epot = -22.9515897224038 | etot = -18.6563452759193
+422000  ekin = 2.7320348139792 |  erot = 1.67298118116889 | epot = -22.9404137463627 | etot = -18.5353977512146
+423000  ekin = 2.13282380031375 |  erot = 2.54987675813572 | epot = -22.8157706530705 | etot = -18.133070094621
+424000  ekin = 1.90610672595356 |  erot = 2.31894231724673 | epot = -22.7787002443962 | etot = -18.553651201196
+425000  ekin = 2.37366400687573 |  erot = 1.95578603620107 | epot = -22.7873996262579 | etot = -18.4579495831811
+426000  ekin = 2.23502410344739 |  erot = 2.60951465135819 | epot = -22.8069525247999 | etot = -17.9624137699943
+427000  ekin = 1.88572309905852 |  erot = 2.12675775194484 | epot = -22.973782602072 | etot = -18.9613017510686
+428000  ekin = 1.93180562731872 |  erot = 2.45432362930894 | epot = -23.1062681387344 | etot = -18.7201388821067
+429000  ekin = 1.72618205037519 |  erot = 2.1638575670951 | epot = -23.1203764425356 | etot = -19.2303368250654
+430000  ekin = 2.31236502680075 |  erot = 2.14057167953237 | epot = -23.127316365141 | etot = -18.6743796588079
+431000  ekin = 2.45859340033276 |  erot = 2.41557475448707 | epot = -23.137683007962 | etot = -18.2635148531422
+432000  ekin = 2.80043339920945 |  erot = 2.19140888866301 | epot = -23.1459051340744 | etot = -18.1540628462019
+433000  ekin = 2.2038223816989 |  erot = 1.62239062651454 | epot = -23.1902054552061 | etot = -19.3639924469927
+434000  ekin = 2.59117398719482 |  erot = 2.35262979682601 | epot = -23.2174180769097 | etot = -18.2736142928889
+435000  ekin = 2.29283868462832 |  erot = 2.54026007379789 | epot = -23.1968654207439 | etot = -18.3637666623176
+436000  ekin = 2.43256920688117 |  erot = 2.74968424233253 | epot = -23.2466230085986 | etot = -18.0643695593849
+437000  ekin = 1.64425125112848 |  erot = 3.23329270267647 | epot = -23.2380191669749 | etot = -18.3604752131699
+438000  ekin = 1.56124620606823 |  erot = 2.60252333491232 | epot = -23.1341667906033 | etot = -18.9703972496228
+439000  ekin = 2.30501653948793 |  erot = 1.93890022921162 | epot = -23.14170715719 | etot = -18.8977903884904
+440000  ekin = 2.52023257151789 |  erot = 3.04669715760005 | epot = -23.2021590525686 | etot = -17.6352293234507
+441000  ekin = 2.79903748157629 |  erot = 2.54578114158762 | epot = -23.1760357267403 | etot = -17.8312171035764
+442000  ekin = 2.93503932875119 |  erot = 2.87674150367343 | epot = -23.1192988997858 | etot = -17.3075180673612
+443000  ekin = 1.96853850230447 |  erot = 1.76444304280728 | epot = -23.0474504745021 | etot = -19.3144689293904
+444000  ekin = 2.00740903163919 |  erot = 2.25338146232896 | epot = -22.9768126386128 | etot = -18.7160221446446
+445000  ekin = 2.22543241532629 |  erot = 2.06325853122729 | epot = -22.8128736901554 | etot = -18.5241827436018
+446000  ekin = 2.44497213168066 |  erot = 2.37296472072563 | epot = -22.7182187420116 | etot = -17.9002818896053
+447000  ekin = 2.27682912672612 |  erot = 2.40590062157627 | epot = -22.73821768508 | etot = -18.0554879367776
+448000  ekin = 2.17717815648414 |  erot = 1.94002353369628 | epot = -22.8515885285926 | etot = -18.7343868384122
+449000  ekin = 2.21957974285234 |  erot = 2.34288028472299 | epot = -22.9413256171992 | etot = -18.3788655896239
+450000  ekin = 2.75054329798646 |  erot = 1.97942707751151 | epot = -22.8960066852305 | etot = -18.1660363097325
+451000  ekin = 2.21127283509867 |  erot = 2.13383865709095 | epot = -22.93012845553 | etot = -18.5850169633403
+452000  ekin = 2.54342208027875 |  erot = 2.35725031977164 | epot = -22.9678192920236 | etot = -18.0671468919732
+453000  ekin = 2.22826691368246 |  erot = 1.78505555998555 | epot = -22.9525856519538 | etot = -18.9392631782858
+454000  ekin = 2.43963081757063 |  erot = 2.59545869820689 | epot = -22.8816014548474 | etot = -17.8465119390699
+455000  ekin = 2.04579285921012 |  erot = 2.79600798010941 | epot = -22.6671256943706 | etot = -17.8253248550511
+456000  ekin = 2.02054568037702 |  erot = 2.5142933737518 | epot = -22.4807651427491 | etot = -17.9459260886202
+457000  ekin = 2.62427297855768 |  erot = 2.43881475758852 | epot = -22.3628471473124 | etot = -17.2997594111662
+458000  ekin = 2.00982157063058 |  erot = 1.99237218757745 | epot = -22.2563036448067 | etot = -18.2541098865987
+459000  ekin = 1.75248702434071 |  erot = 2.49686008961238 | epot = -22.2467888503062 | etot = -17.9974417363531
+460000  ekin = 1.91910131837566 |  erot = 2.07619395094217 | epot = -22.2400567481829 | etot = -18.2447614788651
+461000  ekin = 1.56844353839394 |  erot = 1.28973659789019 | epot = -22.2093526564538 | etot = -19.3511725201697
+462000  ekin = 2.45174884293064 |  erot = 1.36031689293857 | epot = -22.3089787954009 | etot = -18.4969130595317
+463000  ekin = 2.64349839520108 |  erot = 2.07831354185085 | epot = -22.4300376076151 | etot = -17.7082256705631
+464000  ekin = 2.67299819724031 |  erot = 3.73615881795558 | epot = -22.554470130186 | etot = -16.1453131149901
+465000  ekin = 1.95390361110071 |  erot = 2.23920710641231 | epot = -22.7384686297881 | etot = -18.545357912275
+466000  ekin = 2.13348556167989 |  erot = 2.96280610170109 | epot = -22.8443072066537 | etot = -17.7480155432727
+467000  ekin = 2.46613760277875 |  erot = 2.11616591175904 | epot = -23.0265043956358 | etot = -18.444200881098
+468000  ekin = 1.99036864211387 |  erot = 1.62858187482038 | epot = -23.0961237334908 | etot = -19.4771732165565
+469000  ekin = 2.49659836745282 |  erot = 2.63661728128629 | epot = -23.1411267023576 | etot = -18.0079110536185
+470000  ekin = 2.92199371715687 |  erot = 3.21712399422296 | epot = -23.1457817109815 | etot = -17.0066639996017
+471000  ekin = 2.36477645073574 |  erot = 1.72314859686431 | epot = -23.1045733261495 | etot = -19.0166482785494
+472000  ekin = 2.18519498855062 |  erot = 2.00240720258206 | epot = -23.072627104452 | etot = -18.8850249133193
+473000  ekin = 2.3714321613692 |  erot = 2.86124663404655 | epot = -23.0328429128019 | etot = -17.8001641173862
+474000  ekin = 2.1857949588469 |  erot = 2.60051446256873 | epot = -22.9136735669303 | etot = -18.1273641455147
+475000  ekin = 2.39661135768768 |  erot = 2.01358694537797 | epot = -22.813046501162 | etot = -18.4028481980963
+476000  ekin = 2.10676579065005 |  erot = 2.60327856915634 | epot = -22.8119267991277 | etot = -18.1018824393213
+477000  ekin = 2.53295314095718 |  erot = 3.55510942450984 | epot = -22.7955031957515 | etot = -16.7074406302845
+478000  ekin = 2.40630114318287 |  erot = 2.73236241457618 | epot = -22.7034337758127 | etot = -17.5647702180536
+479000  ekin = 1.27745698905519 |  erot = 2.99245403250463 | epot = -22.6605920931777 | etot = -18.3906810716179
+480000  ekin = 1.82390564518045 |  erot = 2.13920354248295 | epot = -22.6299626931083 | etot = -18.6668535054449
+481000  ekin = 2.3880478628611 |  erot = 3.18399864702822 | epot = -22.6553769169915 | etot = -17.0833304071022
+482000  ekin = 3.20116727691415 |  erot = 2.41976760575225 | epot = -22.6125762236254 | etot = -16.991641340959
+483000  ekin = 3.03846588981692 |  erot = 2.48627946336888 | epot = -22.5774232520165 | etot = -17.0526778988307
+484000  ekin = 2.70181776439228 |  erot = 2.52677846233176 | epot = -22.6070502809988 | etot = -17.3784540542748
+485000  ekin = 3.27224317472663 |  erot = 2.42431335826243 | epot = -22.5997277235211 | etot = -16.9031711905321
+486000  ekin = 1.96596043103987 |  erot = 1.75891125021975 | epot = -22.642547970919 | etot = -18.9176762896594
+487000  ekin = 2.6234378417876 |  erot = 2.50755895035553 | epot = -22.7339556642929 | etot = -17.6029588721497
+488000  ekin = 1.75208074499658 |  erot = 2.6448687233026 | epot = -22.7917400975639 | etot = -18.3947906292648
+489000  ekin = 2.08733298303259 |  erot = 2.9523180967106 | epot = -22.881879447047 | etot = -17.8422283673038
+490000  ekin = 2.30760030156363 |  erot = 2.33161319100248 | epot = -22.8847649865187 | etot = -18.2455514939526
+491000  ekin = 2.48196214295004 |  erot = 2.59523958504393 | epot = -22.8776771178079 | etot = -17.800475389814
+492000  ekin = 3.28209206383218 |  erot = 2.1852502939697 | epot = -22.8577625078557 | etot = -17.3904201500538
+493000  ekin = 3.37967323337949 |  erot = 2.35355143859173 | epot = -22.8047552632571 | etot = -17.0715305912858
+494000  ekin = 3.57464120696614 |  erot = 2.24853455202993 | epot = -22.8042956353342 | etot = -16.9811198763381
+495000  ekin = 2.5052992174061 |  erot = 2.15850924694968 | epot = -22.7996067752132 | etot = -18.1357983108574
+496000  ekin = 1.95429188426678 |  erot = 3.5825937389492 | epot = -22.837298805698 | etot = -17.3004131824821
+497000  ekin = 2.22186292996358 |  erot = 2.46502235984734 | epot = -22.8432554612651 | etot = -18.1563701714542
+498000  ekin = 1.72648192614392 |  erot = 2.39641281876546 | epot = -22.7792810810776 | etot = -18.6563863361682
+499000  ekin = 2.44591165293457 |  erot = 2.82720242160824 | epot = -22.7953427712295 | etot = -17.5222286966867
+500000  ekin = 2.7851302139546 |  erot = 2.23270136622152 | epot = -22.8991185931508 | etot = -17.8812870129746
+501000  ekin = 2.99439211318652 |  erot = 1.97783069072832 | epot = -22.9279475016441 | etot = -17.9557246977292
+502000  ekin = 2.9862206030979 |  erot = 1.79973926744011 | epot = -22.956155459855 | etot = -18.170195589317
+503000  ekin = 2.51500932637374 |  erot = 2.88863666961797 | epot = -22.9858023469845 | etot = -17.5821563509928
+504000  ekin = 2.84387999289216 |  erot = 2.69340549636984 | epot = -22.9170131486245 | etot = -17.3797276593625
+505000  ekin = 2.95569075243612 |  erot = 2.602585876956 | epot = -22.9907249028698 | etot = -17.4324482734777
+506000  ekin = 2.19812159740513 |  erot = 1.96718410179931 | epot = -23.0318373952185 | etot = -18.8665316960141
+507000  ekin = 2.26250501037088 |  erot = 2.70461320689487 | epot = -22.9974394720575 | etot = -18.0303212547917
+508000  ekin = 2.63634784309456 |  erot = 2.05036585895923 | epot = -23.0090804345496 | etot = -18.3223667324958
+509000  ekin = 2.94151668821484 |  erot = 2.91160221114196 | epot = -23.0621014211554 | etot = -17.2089825217986
+510000  ekin = 2.26258273420884 |  erot = 2.8155823326395 | epot = -23.1767418648115 | etot = -18.0985767979631
+511000  ekin = 2.89871784417207 |  erot = 2.15651428734314 | epot = -23.2992796007865 | etot = -18.2440474692713
+512000  ekin = 2.18241701331153 |  erot = 2.32471024525139 | epot = -23.3744961479659 | etot = -18.867368889403
+513000  ekin = 1.69086971293502 |  erot = 2.8783745660792 | epot = -23.3843289700052 | etot = -18.8150846909909
+514000  ekin = 1.72546832120935 |  erot = 2.33325616873572 | epot = -23.3798363194193 | etot = -19.3211118294743
+515000  ekin = 1.99840202228396 |  erot = 1.80255577214453 | epot = -23.3747953532199 | etot = -19.5738375587914
+516000  ekin = 3.02853898966319 |  erot = 1.54004582498168 | epot = -23.3386782444955 | etot = -18.7700934298506
+517000  ekin = 2.46344499126943 |  erot = 2.11388687673044 | epot = -23.3135548350045 | etot = -18.7362229670046
+518000  ekin = 2.0362169291028 |  erot = 2.51796163147274 | epot = -23.2504637438686 | etot = -18.6962851832931
+519000  ekin = 1.58660977959654 |  erot = 1.63211831489779 | epot = -23.2081782818072 | etot = -19.9894501873129
+520000  ekin = 2.16318611090781 |  erot = 1.89658879288914 | epot = -23.2096974204855 | etot = -19.1499225166885
+521000  ekin = 1.97684804456375 |  erot = 2.08731550434085 | epot = -23.2527315496486 | etot = -19.188568000744
+522000  ekin = 2.69827007409924 |  erot = 2.19560826391663 | epot = -23.3133573112007 | etot = -18.4194789731848
+523000  ekin = 2.2478363305578 |  erot = 1.67442261891177 | epot = -23.3604551637841 | etot = -19.4381962143146
+524000  ekin = 2.34895041229461 |  erot = 2.10078601700867 | epot = -23.381233923661 | etot = -18.9314974943577
+525000  ekin = 2.13155817393156 |  erot = 2.07239357304026 | epot = -23.4395046885398 | etot = -19.235552941568
+526000  ekin = 2.50234900291801 |  erot = 2.25431525777582 | epot = -23.4988198653879 | etot = -18.7421556046941
+527000  ekin = 3.03511403104629 |  erot = 1.80504692374136 | epot = -23.5562539149297 | etot = -18.7160929601421
+528000  ekin = 2.56074044727573 |  erot = 2.54331285469023 | epot = -23.5735936308822 | etot = -18.4695403289162
+529000  ekin = 2.37500349152887 |  erot = 1.93006279746846 | epot = -23.5580125050353 | etot = -19.252946216038
+530000  ekin = 3.34194424343389 |  erot = 3.41373524710891 | epot = -23.4507267657596 | etot = -16.6950472752168
+531000  ekin = 2.42341072166937 |  erot = 2.35978455298084 | epot = -23.1501712562452 | etot = -18.366975981595
+532000  ekin = 2.58886764526949 |  erot = 1.86996947608086 | epot = -23.1663546344342 | etot = -18.7075175130839
+533000  ekin = 2.18022742299593 |  erot = 2.16045486833456 | epot = -23.380637574335 | etot = -19.0399552830045
+534000  ekin = 2.34791679374047 |  erot = 2.03855517230123 | epot = -23.463831563993 | etot = -19.0773595979513
+535000  ekin = 2.37817813408508 |  erot = 2.07397219148902 | epot = -23.4832900392636 | etot = -19.0311397136895
+536000  ekin = 2.46210672665338 |  erot = 1.8947790016655 | epot = -23.4672059982835 | etot = -19.1103202699646
+537000  ekin = 1.71186030024847 |  erot = 2.1344462698512 | epot = -23.5555571897054 | etot = -19.7092506196057
+538000  ekin = 2.16671541009104 |  erot = 2.76559932728314 | epot = -23.6609154290595 | etot = -18.7286006916853
+539000  ekin = 2.16621132370208 |  erot = 2.29104148484627 | epot = -23.7377569804062 | etot = -19.2805041718579
+540000  ekin = 2.37610335621453 |  erot = 1.63780764528448 | epot = -23.7325177726622 | etot = -19.7186067711632
+541000  ekin = 2.61201541528826 |  erot = 2.52498155703037 | epot = -23.6623419839272 | etot = -18.5253450116085
+542000  ekin = 2.72898292667725 |  erot = 2.10989431729706 | epot = -23.7000798212983 | etot = -18.861202577324
+543000  ekin = 2.72070152721044 |  erot = 1.85641764017256 | epot = -23.6069628280622 | etot = -19.0298436606792
+544000  ekin = 2.11779438939827 |  erot = 1.50576740930398 | epot = -23.5826778503359 | etot = -19.9591160516337
+545000  ekin = 1.70778076743634 |  erot = 2.56995673058895 | epot = -23.583343914622 | etot = -19.3056064165967
+546000  ekin = 2.3805758278215 |  erot = 1.86648142267507 | epot = -23.6114100683877 | etot = -19.3643528178911
+547000  ekin = 2.45245186799104 |  erot = 2.45758854207408 | epot = -23.6611856045782 | etot = -18.7511451945131
+548000  ekin = 2.39042546399151 |  erot = 2.39603897463391 | epot = -23.6735607421256 | etot = -18.8870963035002
+549000  ekin = 2.59234094316699 |  erot = 2.03286284306236 | epot = -23.6646331709071 | etot = -19.0394293846778
+550000  ekin = 1.99320521419403 |  erot = 1.84894458030441 | epot = -23.6669378249973 | etot = -19.8247880304988
+551000  ekin = 2.44898809443739 |  erot = 2.0219242208942 | epot = -23.6235443659669 | etot = -19.1526320506353
+552000  ekin = 2.69502802037877 |  erot = 1.40870700355959 | epot = -23.4610294466586 | etot = -19.3572944227202
+553000  ekin = 1.76133393557171 |  erot = 2.61023484195893 | epot = -23.254624102607 | etot = -18.8830553250764
+554000  ekin = 2.30411800065654 |  erot = 2.33064249173903 | epot = -23.2181242479504 | etot = -18.5833637555548
+555000  ekin = 3.27047384641377 |  erot = 1.6422371773255 | epot = -23.1973795659522 | etot = -18.2846685422129
+556000  ekin = 2.90314776795354 |  erot = 2.59897046564306 | epot = -23.1460736374982 | etot = -17.6439554039016
+557000  ekin = 2.91673821282758 |  erot = 3.16411852075219 | epot = -23.1459806883625 | etot = -17.0651239547827
+558000  ekin = 2.82902946234823 |  erot = 2.71147602500681 | epot = -23.1195640745749 | etot = -17.5790585872199
+559000  ekin = 2.44501247164481 |  erot = 3.2946921444891 | epot = -23.1638653139107 | etot = -17.4241606977768
+560000  ekin = 2.31903153876872 |  erot = 2.34794389762528 | epot = -23.1221343768987 | etot = -18.4551589405047
+561000  ekin = 2.04778211145284 |  erot = 2.88230317636058 | epot = -23.0254469759625 | etot = -18.0953616881491
+562000  ekin = 2.23097749779459 |  erot = 3.71637560430596 | epot = -22.8954878936692 | etot = -16.9481347915687
+563000  ekin = 3.13589796296721 |  erot = 2.30360204009239 | epot = -22.9672461823823 | etot = -17.5277461793227
+564000  ekin = 2.43468506100309 |  erot = 2.37780089042927 | epot = -22.9400399192094 | etot = -18.127553967777
+565000  ekin = 2.74707381978168 |  erot = 2.07635638038451 | epot = -22.9404100305402 | etot = -18.116979830374
+566000  ekin = 2.4222424655432 |  erot = 2.23675573588529 | epot = -22.964317030412 | etot = -18.3053188289835
+567000  ekin = 2.66075150820169 |  erot = 2.00813116398473 | epot = -23.0598382212572 | etot = -18.3909555490708
+568000  ekin = 3.04180913535304 |  erot = 1.98452490185762 | epot = -23.1129541055894 | etot = -18.0866200683787
+569000  ekin = 3.57499094364799 |  erot = 2.06992850387417 | epot = -23.117960007112 | etot = -17.4730405595898
+570000  ekin = 2.66020768003306 |  erot = 2.34012507933247 | epot = -23.1339632056245 | etot = -18.133630446259
+571000  ekin = 1.94924082891001 |  erot = 2.84220462440654 | epot = -23.0609933320748 | etot = -18.2695478787583
+572000  ekin = 2.41536650984725 |  erot = 2.40871845587551 | epot = -23.0560879925718 | etot = -18.232003026849
+573000  ekin = 1.75696177901838 |  erot = 2.31680084915611 | epot = -23.107424588529 | etot = -19.0336619603545
+574000  ekin = 2.1071071848933 |  erot = 2.59270710144433 | epot = -23.1966129698341 | etot = -18.4967986834965
+575000  ekin = 2.37668274547159 |  erot = 2.79832262601946 | epot = -23.2697902014998 | etot = -18.0947848300088
+576000  ekin = 2.17648663043414 |  erot = 3.28534323951364 | epot = -23.3035961850707 | etot = -17.8417663151229
+577000  ekin = 2.48653402473871 |  erot = 2.29382004189646 | epot = -23.3348256872303 | etot = -18.5544716205951
+578000  ekin = 2.63497646120015 |  erot = 2.38541222697017 | epot = -23.3938829535157 | etot = -18.3734942653454
+579000  ekin = 2.68807604490538 |  erot = 1.70832449354964 | epot = -23.3711370904455 | etot = -18.9747365519905
+580000  ekin = 2.35405412912148 |  erot = 2.8553242408976 | epot = -23.3804498064804 | etot = -18.1710714364613
+581000  ekin = 2.45622900796811 |  erot = 2.60461398742566 | epot = -23.3507481421638 | etot = -18.28990514677
+582000  ekin = 2.33821855888559 |  erot = 3.20610340688907 | epot = -23.4193095100182 | etot = -17.8749875442436
+583000  ekin = 1.96183085357235 |  erot = 2.81826367270291 | epot = -23.5872275727996 | etot = -18.8071330465243
+584000  ekin = 2.00096559581716 |  erot = 1.71662185522173 | epot = -23.6766993596687 | etot = -19.9591119086298
+585000  ekin = 2.2650842350347 |  erot = 2.08204874292297 | epot = -23.7234738719865 | etot = -19.3763408940288
+586000  ekin = 2.20207640113325 |  erot = 1.96861811478536 | epot = -23.6859240119471 | etot = -19.5152294960285
+587000  ekin = 3.67938790357027 |  erot = 1.82484412869377 | epot = -23.6634672548209 | etot = -18.1592352225569
+588000  ekin = 3.48089636122829 |  erot = 2.30691916064612 | epot = -23.5643712718911 | etot = -17.7765557500167
+589000  ekin = 2.63030533099327 |  erot = 2.9702466869305 | epot = -23.3767694123201 | etot = -17.7762173943963
+590000  ekin = 1.60813837628253 |  erot = 2.03263132264272 | epot = -23.1946522249358 | etot = -19.5538825260106
+591000  ekin = 1.81653381805571 |  erot = 1.75591263591366 | epot = -23.1302877005862 | etot = -19.5578412466168
+592000  ekin = 2.57247249135485 |  erot = 2.59257155085885 | epot = -23.1533569826366 | etot = -17.9883129404229
+593000  ekin = 2.43678836763256 |  erot = 1.78797409267748 | epot = -23.1035527853187 | etot = -18.8787903250087
+594000  ekin = 2.12126425466624 |  erot = 2.16319102375819 | epot = -23.0537965790237 | etot = -18.7693413005993
+595000  ekin = 2.61494655403376 |  erot = 2.04015446622256 | epot = -23.041588630948 | etot = -18.3864876106917
+596000  ekin = 2.58385979830463 |  erot = 2.125984026295 | epot = -23.0987578414776 | etot = -18.388914016878
+597000  ekin = 3.0356528884646 |  erot = 3.13920569000609 | epot = -23.0959220060406 | etot = -16.92106342757
+598000  ekin = 3.448018111133 |  erot = 2.86438132305443 | epot = -23.1524961324829 | etot = -16.8400966982954
+599000  ekin = 2.14568317629689 |  erot = 3.49762367929462 | epot = -23.1236320419091 | etot = -17.4803251863176
+600000  ekin = 2.20856388598401 |  erot = 2.50873295237986 | epot = -23.1229244675557 | etot = -18.4056276291918
+601000  ekin = 2.82305805419651 |  erot = 2.82785171484619 | epot = -23.093817009667 | etot = -17.4429072406243
+602000  ekin = 2.33756515640057 |  erot = 2.3814563165261 | epot = -23.0592036595801 | etot = -18.3401821866535
+603000  ekin = 1.93163217766375 |  erot = 1.95544716703194 | epot = -22.941151667404 | etot = -19.0540723227083
+604000  ekin = 2.67918576808855 |  erot = 3.14415640026539 | epot = -22.9119901406973 | etot = -17.0886479723434
+605000  ekin = 2.72017891571417 |  erot = 2.06410352610178 | epot = -22.9250944568005 | etot = -18.1408120149845
+606000  ekin = 2.99653903957879 |  erot = 2.03201724640129 | epot = -22.8426486789921 | etot = -17.814092393012
+607000  ekin = 2.88290327274547 |  erot = 2.37629823895312 | epot = -22.8265624505584 | etot = -17.5673609388598
+608000  ekin = 3.6564890765792 |  erot = 2.46096427245297 | epot = -22.7637531347954 | etot = -16.6462997857633
+609000  ekin = 2.67772613172483 |  erot = 2.28052588350936 | epot = -22.784032519386 | etot = -17.8257805041518
+610000  ekin = 2.96660977711584 |  erot = 2.13935236193287 | epot = -22.7753012812081 | etot = -17.6693391421594
+611000  ekin = 3.84936812341098 |  erot = 2.13515328821562 | epot = -22.7555358965927 | etot = -16.7710144849661
+612000  ekin = 2.85991416578252 |  erot = 2.46799936153364 | epot = -22.6670923038619 | etot = -17.3391787765458
+613000  ekin = 2.93458428860956 |  erot = 2.15612272200133 | epot = -22.6620509726505 | etot = -17.5713439620396
+614000  ekin = 2.80109550846435 |  erot = 2.03413630963325 | epot = -22.735929073337 | etot = -17.9006972552394
+615000  ekin = 2.29275572188425 |  erot = 2.37295436060996 | epot = -22.8265717932651 | etot = -18.1608617107709
+616000  ekin = 1.78880182339297 |  erot = 2.46512387757483 | epot = -22.9181914142038 | etot = -18.664265713236
+617000  ekin = 2.58548247747108 |  erot = 2.53734413400793 | epot = -22.9371325341202 | etot = -17.8143059226412
+618000  ekin = 2.31891017470357 |  erot = 2.68587322473765 | epot = -22.8737927646705 | etot = -17.8690093652293
+619000  ekin = 1.95260275466613 |  erot = 2.00546202293513 | epot = -22.8346556656307 | etot = -18.8765908880295
+620000  ekin = 2.9312355259843 |  erot = 2.17154966265513 | epot = -22.9093263040915 | etot = -17.806541115452
+621000  ekin = 2.92251791603671 |  erot = 1.69365790820559 | epot = -22.9491849521548 | etot = -18.3330091279125
+622000  ekin = 2.04583493083921 |  erot = 2.52347309118728 | epot = -22.8885087146283 | etot = -18.3192006926018
+623000  ekin = 1.97949309574552 |  erot = 3.07796024634624 | epot = -22.899088756596 | etot = -17.8416354145043
+624000  ekin = 2.09648243468335 |  erot = 2.65430331108241 | epot = -22.914733999871 | etot = -18.1639482541052
+625000  ekin = 2.53179488470072 |  erot = 2.36095144458489 | epot = -22.9722766139489 | etot = -18.0795302846633
+626000  ekin = 2.71471201325311 |  erot = 2.038002303651 | epot = -23.0006194176227 | etot = -18.2479051007186
+627000  ekin = 2.22374294193216 |  erot = 2.35282114621755 | epot = -22.9588355159151 | etot = -18.3822714277654
+628000  ekin = 2.28003968408293 |  erot = 2.28859673286464 | epot = -22.8537881524811 | etot = -18.2851517355335
+629000  ekin = 2.52123014813329 |  erot = 1.89624895610832 | epot = -22.7908976494591 | etot = -18.3734185452175
+630000  ekin = 3.09551469183927 |  erot = 2.51634259883875 | epot = -22.7156574639271 | etot = -17.1038001732491
+631000  ekin = 2.38491234780997 |  erot = 3.31746706623938 | epot = -22.7274824388449 | etot = -17.0251030247955
+632000  ekin = 2.58509546960735 |  erot = 2.52764681234154 | epot = -22.6801845001954 | etot = -17.5674422182465
+633000  ekin = 2.43450196234921 |  erot = 1.9074646477535 | epot = -22.6545806388637 | etot = -18.312614028761
+634000  ekin = 2.22577935817066 |  erot = 2.00781737526926 | epot = -22.5723806994747 | etot = -18.3387839660348
+635000  ekin = 2.21833116743445 |  erot = 1.98256884900851 | epot = -22.5422908112103 | etot = -18.3413907947673
+636000  ekin = 2.25207449335774 |  erot = 2.77890466668274 | epot = -22.5736742647701 | etot = -17.5426951047296
+637000  ekin = 1.94359576469155 |  erot = 2.6121109986752 | epot = -22.6035657643129 | etot = -18.0478590009461
+638000  ekin = 2.53947002676468 |  erot = 3.14006412371943 | epot = -22.5826147275244 | etot = -16.9030805770402
+639000  ekin = 2.37745481188141 |  erot = 2.49540365345358 | epot = -22.5449630195302 | etot = -17.6721045541952
+640000  ekin = 2.08212454926531 |  erot = 2.21940536991445 | epot = -22.453303862966 | etot = -18.1517739437862
+641000  ekin = 2.47971433110368 |  erot = 3.55852071727848 | epot = -22.3500233136602 | etot = -16.3117882652781
+642000  ekin = 3.38958957156561 |  erot = 2.18184701440171 | epot = -22.2389727056174 | etot = -16.6675361196501
+643000  ekin = 2.84881174665207 |  erot = 2.413254877821 | epot = -22.1927147648616 | etot = -16.9306481403886
+644000  ekin = 2.9788163296922 |  erot = 1.93799042516405 | epot = -22.1764728944767 | etot = -17.2596661396204
+645000  ekin = 4.12550859701587 |  erot = 1.89960014649319 | epot = -22.1706973334318 | etot = -16.1455885899228
+646000  ekin = 2.52696357860359 |  erot = 2.00637360005821 | epot = -22.1102258356952 | etot = -17.5768886570333
+647000  ekin = 2.55512268942677 |  erot = 2.20922204555245 | epot = -22.1538572894812 | etot = -17.389512554502
+648000  ekin = 3.02957533574521 |  erot = 2.11325139659861 | epot = -22.1575349215939 | etot = -17.0147081892501
+649000  ekin = 2.58453912449214 |  erot = 3.20631221677863 | epot = -22.1339073532352 | etot = -16.3430560119644
+650000  ekin = 3.77204744414227 |  erot = 2.43066777037188 | epot = -22.0837500061792 | etot = -15.8810347916651
+651000  ekin = 3.31369677202991 |  erot = 2.36221103045568 | epot = -21.9243902112032 | etot = -16.2484824087176
+652000  ekin = 2.49262898649827 |  erot = 3.02155153905954 | epot = -21.7253342697997 | etot = -16.2111537442419
+653000  ekin = 2.82559687485827 |  erot = 2.53899564631137 | epot = -21.7211782659414 | etot = -16.3565857447718
+654000  ekin = 2.35170683287638 |  erot = 2.15925543988734 | epot = -21.9219546077978 | etot = -17.4109923350341
+655000  ekin = 2.2746913368331 |  erot = 2.12498780379593 | epot = -21.9020101665877 | etot = -17.5023310259586
+656000  ekin = 2.33856358324454 |  erot = 2.10525554685067 | epot = -21.9227166217961 | etot = -17.4788974917008
+657000  ekin = 2.74434355807405 |  erot = 2.19006149870653 | epot = -22.1368388094875 | etot = -17.2024337527069
+658000  ekin = 3.04721032533817 |  erot = 2.59752520159664 | epot = -22.2936626687419 | etot = -16.6489271418071
+659000  ekin = 2.86427564828999 |  erot = 3.42151988715138 | epot = -22.2986314842237 | etot = -16.0128359487823
+660000  ekin = 2.92506899234012 |  erot = 1.63381738879488 | epot = -22.3375917964994 | etot = -17.7787054153644
+661000  ekin = 3.22051797741487 |  erot = 1.86658559874782 | epot = -22.4692759662967 | etot = -17.382172390134
+662000  ekin = 3.06008561550976 |  erot = 2.20194497946945 | epot = -22.5616874184536 | etot = -17.2996568234744
+663000  ekin = 1.91383924631387 |  erot = 2.47155788641765 | epot = -22.6270449564058 | etot = -18.2416478236743
+664000  ekin = 1.43175220258741 |  erot = 1.36481827202384 | epot = -22.714938601816 | etot = -19.9183681272047
+665000  ekin = 1.55751729325324 |  erot = 2.30904543593978 | epot = -22.7903483651339 | etot = -18.9237856359409
+666000  ekin = 2.44554812999981 |  erot = 1.7728381640758 | epot = -22.9292683336281 | etot = -18.7108820395525
+667000  ekin = 2.81292959120154 |  erot = 2.33182461186713 | epot = -23.1152300896738 | etot = -17.9704758866051
+668000  ekin = 2.71701517852366 |  erot = 3.1927510370022 | epot = -23.1898047541379 | etot = -17.2800385386121
+669000  ekin = 3.4211844979108 |  erot = 2.4483988547294 | epot = -23.2367567149657 | etot = -17.3671733623255
+670000  ekin = 2.540272537006 |  erot = 1.98108817711494 | epot = -23.1773017073799 | etot = -18.655940993259
+671000  ekin = 2.38054183576284 |  erot = 2.98341127846263 | epot = -23.1403357669317 | etot = -17.7763826527062
+672000  ekin = 3.02714775234025 |  erot = 2.54429912094893 | epot = -23.1240813931427 | etot = -17.5526345198536
+673000  ekin = 3.42342714962536 |  erot = 2.36764796314287 | epot = -23.0365834633316 | etot = -17.2455083505634
+674000  ekin = 3.1787369792725 |  erot = 2.10003598211897 | epot = -22.9565366380298 | etot = -17.6777636766383
+675000  ekin = 2.35379506516488 |  erot = 1.53509045481238 | epot = -22.8504434741329 | etot = -18.9615579541557
+676000  ekin = 2.44888744246419 |  erot = 2.24653163842729 | epot = -22.7725645250621 | etot = -18.0771454441706
+677000  ekin = 2.75831894151647 |  erot = 1.93124166774781 | epot = -22.8527844251281 | etot = -18.1632238158638
+678000  ekin = 2.86751481243524 |  erot = 1.65310315497864 | epot = -22.8648869805436 | etot = -18.3442690131297
+679000  ekin = 2.34238342331609 |  erot = 2.69036620616395 | epot = -22.9330609670147 | etot = -17.9003113375347
+680000  ekin = 2.47092831167294 |  erot = 2.90821987338148 | epot = -22.9893989293305 | etot = -17.610250744276
+681000  ekin = 1.90592213851373 |  erot = 2.57738203916981 | epot = -22.9226803153478 | etot = -18.4393761376642
+682000  ekin = 2.11776015116235 |  erot = 2.69956516894844 | epot = -22.8385618600593 | etot = -18.0212365399485
+683000  ekin = 2.36569744411279 |  erot = 2.12377742206911 | epot = -22.7248964050232 | etot = -18.2354215388413
+684000  ekin = 2.87481829504096 |  erot = 2.65568540935019 | epot = -22.6557781340276 | etot = -17.1252744296364
+685000  ekin = 3.04590812681261 |  erot = 2.17384411148381 | epot = -22.6239841629455 | etot = -17.4042319246491
+686000  ekin = 2.45732454887051 |  erot = 2.42727693460545 | epot = -22.5554269158738 | etot = -17.6708254323979
+687000  ekin = 2.74615797772517 |  erot = 1.80419114366277 | epot = -22.4906419692597 | etot = -17.9402928478718
+688000  ekin = 1.7920739822545 |  erot = 2.04572898801195 | epot = -22.4080555397627 | etot = -18.5702525694962
+689000  ekin = 2.87658871003945 |  erot = 1.89509928788519 | epot = -22.4597913998897 | etot = -17.6881034019651
+690000  ekin = 2.12362847773645 |  erot = 2.42433705189552 | epot = -22.5737079170673 | etot = -18.0257423874353
+691000  ekin = 2.15963929746743 |  erot = 2.52975117929537 | epot = -22.5896382204305 | etot = -17.9002477436677
+692000  ekin = 2.88714768351631 |  erot = 2.65189982514091 | epot = -22.4796475018852 | etot = -16.9405999932279
+693000  ekin = 2.30934205113368 |  erot = 2.51896960835911 | epot = -22.3454093965687 | etot = -17.5170977370759
+694000  ekin = 2.90083400146798 |  erot = 2.34214046553658 | epot = -22.2620689836397 | etot = -17.0190945166351
+695000  ekin = 2.9577943585455 |  erot = 2.23887088042094 | epot = -22.303054593607 | etot = -17.1063893546405
+696000  ekin = 2.65803880066321 |  erot = 2.33953886943022 | epot = -22.3444459486844 | etot = -17.3468682785909
+697000  ekin = 1.89104688866877 |  erot = 1.78290264315477 | epot = -22.3519476787994 | etot = -18.6779981469758
+698000  ekin = 2.22763370474282 |  erot = 2.82521193129044 | epot = -22.374966668557 | etot = -17.3221210325237
+699000  ekin = 2.35357258316915 |  erot = 2.06864522211151 | epot = -22.302995332199 | etot = -17.8807775269184
+700000  ekin = 2.58206368687336 |  erot = 2.33093601350411 | epot = -22.2613878464485 | etot = -17.3483881460711
+701000  ekin = 2.99704307093403 |  erot = 1.89954183386767 | epot = -22.3232249760621 | etot = -17.4266400712604
+702000  ekin = 2.67512006336489 |  erot = 2.64729282748452 | epot = -22.3604874692709 | etot = -17.0380745784215
+703000  ekin = 2.02348242287829 |  erot = 2.03755058248806 | epot = -22.4348344343157 | etot = -18.3738014289493
+704000  ekin = 1.59657624705204 |  erot = 1.63613322855987 | epot = -22.4674717825454 | etot = -19.2347623069335
+705000  ekin = 2.34019771505867 |  erot = 1.91006554831154 | epot = -22.5441024225864 | etot = -18.2938391592161
+706000  ekin = 2.47926998793354 |  erot = 3.26999075651193 | epot = -22.5117539612542 | etot = -16.7624932168087
+707000  ekin = 2.38604341038216 |  erot = 2.41699636933021 | epot = -22.604009927914 | etot = -17.8009701482016
+708000  ekin = 1.68115636633466 |  erot = 2.34002138995268 | epot = -22.7466665621618 | etot = -18.7254888058744
+709000  ekin = 1.80992626994918 |  erot = 2.57911114058356 | epot = -23.0637398035031 | etot = -18.6747023929704
+710000  ekin = 2.07665974484992 |  erot = 1.83617776589231 | epot = -23.1977961917903 | etot = -19.2849586810481
+711000  ekin = 1.95352231029107 |  erot = 2.41454578486037 | epot = -23.2358193849337 | etot = -18.8677512897822
+712000  ekin = 2.13370686414587 |  erot = 1.78661700982467 | epot = -23.2645434465923 | etot = -19.3442195726217
+713000  ekin = 2.90695161716251 |  erot = 1.55091931636559 | epot = -23.1835772351912 | etot = -18.7257063016631
+714000  ekin = 2.06629801094757 |  erot = 1.86611085535956 | epot = -23.2239032864041 | etot = -19.2914944200969
+715000  ekin = 2.52903922778277 |  erot = 1.94261958015835 | epot = -23.1658397986034 | etot = -18.6941809906622
+716000  ekin = 3.03498992772823 |  erot = 2.21064066235538 | epot = -23.2216970852983 | etot = -17.9760664952147
+717000  ekin = 3.07971375394894 |  erot = 2.47094593918087 | epot = -23.3639588975855 | etot = -17.8132992044557
+718000  ekin = 3.49703192209654 |  erot = 2.27170758510088 | epot = -23.4199184473786 | etot = -17.6511789401811
+719000  ekin = 4.06139770605771 |  erot = 3.10418818480813 | epot = -23.4072026156126 | etot = -16.2416167247468
+720000  ekin = 2.49828440590245 |  erot = 1.90909738802778 | epot = -23.262316602338 | etot = -18.8549348084078
+721000  ekin = 2.57931762358207 |  erot = 1.98570897250437 | epot = -23.1440560046385 | etot = -18.579029408552
+722000  ekin = 2.01081836336836 |  erot = 2.2747167647488 | epot = -23.1040519922181 | etot = -18.8185168641009
+723000  ekin = 2.44097316114449 |  erot = 2.07630856281912 | epot = -23.1828606158314 | etot = -18.6655788918678
+724000  ekin = 1.90797367222605 |  erot = 1.93592443836535 | epot = -23.2376437089983 | etot = -19.3937455984069
+725000  ekin = 2.19373210936071 |  erot = 2.80513028222362 | epot = -23.2888134461385 | etot = -18.2899510545542
+726000  ekin = 2.2764864004673 |  erot = 2.54378150467671 | epot = -23.3354979947709 | etot = -18.5152300896268
+727000  ekin = 1.72219216954142 |  erot = 2.62563304726333 | epot = -23.3703740298761 | etot = -19.0225488130713
+728000  ekin = 2.25087046178847 |  erot = 3.59486012962608 | epot = -23.435416924773 | etot = -17.5896863333584
+729000  ekin = 2.68839033328484 |  erot = 1.72111131116557 | epot = -23.4784810452544 | etot = -19.0689794008039
+730000  ekin = 2.5329756962683 |  erot = 2.7666773813211 | epot = -23.4899025882625 | etot = -18.1902495106731
+731000  ekin = 2.6760609901083 |  erot = 2.04579712240261 | epot = -23.5241973416199 | etot = -18.802339229109
+732000  ekin = 2.77848516459028 |  erot = 1.88432734797838 | epot = -23.5774208145874 | etot = -18.9146083020187
+733000  ekin = 2.18895381088671 |  erot = 2.63471719118119 | epot = -23.6107634586383 | etot = -18.7870924565704
+734000  ekin = 1.69467760927658 |  erot = 2.30338410687055 | epot = -23.5936446347431 | etot = -19.595582918596
+735000  ekin = 2.17749689272956 |  erot = 2.71618098412724 | epot = -23.5330417303215 | etot = -18.6393638534647
+736000  ekin = 2.29375858428166 |  erot = 1.1740900723812 | epot = -23.503450790287 | etot = -20.0356021336242
+737000  ekin = 2.20827752624533 |  erot = 3.11531250945766 | epot = -23.4552023795231 | etot = -18.1316123438201
+738000  ekin = 1.72303720787712 |  erot = 2.28747842674015 | epot = -23.3309270174989 | etot = -19.3204113828816
+739000  ekin = 1.39492824364512 |  erot = 2.17488386602882 | epot = -23.28548996576 | etot = -19.7156778560861
+740000  ekin = 1.90426261774289 |  erot = 2.27825159935278 | epot = -23.2514184467463 | etot = -19.0689042296506
+741000  ekin = 2.02024508457136 |  erot = 2.72073546284876 | epot = -23.1876217096301 | etot = -18.4466411622099
+742000  ekin = 1.97487019042321 |  erot = 1.87541960482772 | epot = -23.0929182320365 | etot = -19.2426284367856
+743000  ekin = 1.96486238454688 |  erot = 2.76982785281128 | epot = -22.9318899502109 | etot = -18.1971997128528
+744000  ekin = 2.04909521933131 |  erot = 2.34373814592941 | epot = -22.8510525613065 | etot = -18.4582191960458
+745000  ekin = 1.66771130319646 |  erot = 1.87270341329448 | epot = -22.7977076876185 | etot = -19.2572929711276
+746000  ekin = 2.11650515037838 |  erot = 2.03542197982564 | epot = -22.7785820280378 | etot = -18.6266548978338
+747000  ekin = 3.07964448387158 |  erot = 1.66910106460583 | epot = -22.8037757029139 | etot = -18.0550301544365
+748000  ekin = 3.03811477337698 |  erot = 1.85631102018694 | epot = -22.8436239146773 | etot = -17.9491981211133
+749000  ekin = 2.53753852426481 |  erot = 2.01199117356573 | epot = -22.860297041716 | etot = -18.3107673438855
+750000  ekin = 2.77210902960465 |  erot = 2.32628560304478 | epot = -22.9528220918576 | etot = -17.8544274592082
+751000  ekin = 2.52040431872467 |  erot = 2.34903725042469 | epot = -23.0127359055533 | etot = -18.1432943364039
+752000  ekin = 2.46408285580806 |  erot = 1.68868786663082 | epot = -22.9901282704654 | etot = -18.8373575480265
+753000  ekin = 2.47364326188914 |  erot = 1.55776271670366 | epot = -23.1135680684223 | etot = -19.0821620898295
+754000  ekin = 2.5278916038673 |  erot = 2.29496804643662 | epot = -23.2403939606523 | etot = -18.4175343103483
+755000  ekin = 1.52934303772527 |  erot = 2.21322404979637 | epot = -23.262110017443 | etot = -19.5195429299214
+756000  ekin = 2.10423967353423 |  erot = 2.40303050505255 | epot = -23.1685739957517 | etot = -18.6613038171649
+757000  ekin = 2.92559629660516 |  erot = 2.0691293568206 | epot = -23.1502917576405 | etot = -18.1555661042147
+758000  ekin = 2.37300490719645 |  erot = 2.51363215153151 | epot = -23.0495756460038 | etot = -18.1629385872758
+759000  ekin = 2.6014595730178 |  erot = 2.39657042348208 | epot = -22.9025259489071 | etot = -17.9044959524072
+760000  ekin = 3.23086874355225 |  erot = 2.77072134903012 | epot = -22.8089299952235 | etot = -16.8073399026412
+761000  ekin = 3.41475369307092 |  erot = 1.70180532416599 | epot = -22.7404708369396 | etot = -17.6239118197027
+762000  ekin = 3.40874473404401 |  erot = 2.52147443954634 | epot = -22.5276669204419 | etot = -16.5974477468515
+763000  ekin = 2.64281892112082 |  erot = 1.82464895439093 | epot = -22.3890167593186 | etot = -17.9215488838069
+764000  ekin = 2.38098664175603 |  erot = 2.71455563654527 | epot = -22.2309521785191 | etot = -17.1354099002178
+765000  ekin = 2.24221473762586 |  erot = 1.94826539133556 | epot = -22.122583392123 | etot = -17.9321032631616
+766000  ekin = 2.50645584526003 |  erot = 1.96129579948818 | epot = -21.9857907119498 | etot = -17.5180390672015
+767000  ekin = 2.34028568638226 |  erot = 2.64592471376141 | epot = -21.9051815399867 | etot = -16.918971139843
+768000  ekin = 1.86752761821211 |  erot = 2.06138447840236 | epot = -21.8874171216963 | etot = -17.9585050250818
+769000  ekin = 3.03590459157853 |  erot = 2.66440802561784 | epot = -21.8247140853503 | etot = -16.124401468154
+770000  ekin = 2.42567220683552 |  erot = 1.97830158892933 | epot = -21.8110526122117 | etot = -17.4070788164468
+771000  ekin = 2.20056711884501 |  erot = 2.53255190976195 | epot = -21.7341162461991 | etot = -17.0009972175921
+772000  ekin = 2.75016173617492 |  erot = 1.98403019503999 | epot = -21.8164316952287 | etot = -17.0822397640138
+773000  ekin = 2.14723076845117 |  erot = 2.41512334908793 | epot = -21.9576017041203 | etot = -17.3952475865812
+774000  ekin = 2.20536023895281 |  erot = 1.98379412617599 | epot = -22.043759647449 | etot = -17.8546052823202
+775000  ekin = 2.53158393271132 |  erot = 2.8225938280108 | epot = -22.2469056379858 | etot = -16.8927278772637
+776000  ekin = 3.15988726149912 |  erot = 2.46223044860468 | epot = -22.4204382258798 | etot = -16.798320515776
+777000  ekin = 1.91542872566335 |  erot = 1.75408058586262 | epot = -22.4517075164596 | etot = -18.7821982049336
+778000  ekin = 2.94665474162607 |  erot = 2.31805831302194 | epot = -22.4632153304498 | etot = -17.1985022758018
+779000  ekin = 3.10970934270731 |  erot = 2.04446179405629 | epot = -22.4851490287702 | etot = -17.3309778920066
+780000  ekin = 2.85215832341045 |  erot = 3.13312086675091 | epot = -22.4501531708741 | etot = -16.4648739807127
+781000  ekin = 2.36733074493229 |  erot = 3.56399648845806 | epot = -22.4171363625471 | etot = -16.4858091291567
+782000  ekin = 2.32796510372074 |  erot = 2.86343667143255 | epot = -22.3438054250098 | etot = -17.1524036498565
+783000  ekin = 1.86439500745061 |  erot = 3.05233385447291 | epot = -22.2079509833896 | etot = -17.2912221214661
+784000  ekin = 2.05476588420882 |  erot = 2.29789997988689 | epot = -22.1006364427793 | etot = -17.7479705786836
+785000  ekin = 2.03879516593738 |  erot = 2.15052527915338 | epot = -22.0056061371158 | etot = -17.816285692025
+786000  ekin = 2.3752160296601 |  erot = 2.32156698168742 | epot = -21.9727988200248 | etot = -17.2760158086773
+787000  ekin = 2.76686314352376 |  erot = 2.23625261993099 | epot = -21.8969600931556 | etot = -16.8938443297008
+788000  ekin = 2.13318993659091 |  erot = 2.25162748275281 | epot = -21.8604178455632 | etot = -17.4756004262194
+789000  ekin = 1.98216852118508 |  erot = 1.98058785261598 | epot = -21.844134033761 | etot = -17.8813776599599
+790000  ekin = 1.67847851427146 |  erot = 1.42560334440858 | epot = -21.941301490604 | etot = -18.837219631924
+791000  ekin = 2.12689982203095 |  erot = 2.53200907087448 | epot = -22.0864434478656 | etot = -17.4275345549602
+792000  ekin = 1.72797703494859 |  erot = 2.22448376175168 | epot = -22.1854190028922 | etot = -18.2329582061919
+793000  ekin = 3.18409314211953 |  erot = 1.94056710411296 | epot = -22.3760603901177 | etot = -17.2514001438852
+794000  ekin = 2.49071782059139 |  erot = 3.01186430180266 | epot = -22.4315505782774 | etot = -16.9289684558833
+795000  ekin = 2.89844296027926 |  erot = 3.07659510288655 | epot = -22.5164404652995 | etot = -16.5414024021337
+796000  ekin = 2.32845268798927 |  erot = 1.62708270564126 | epot = -22.5660647482766 | etot = -18.6105293546461
+797000  ekin = 2.20766900620157 |  erot = 3.6597733457204 | epot = -22.5351911425215 | etot = -16.6677487905995
+798000  ekin = 2.12139450500735 |  erot = 2.94419809776829 | epot = -22.53586560158 | etot = -17.4702729988044
+799000  ekin = 2.48452434226029 |  erot = 2.7415786036137 | epot = -22.4941328101442 | etot = -17.2680298642702
+800000  ekin = 2.17521613585505 |  erot = 2.96480330538541 | epot = -22.3818079549674 | etot = -17.2417885137269
+801000  ekin = 2.54690065539559 |  erot = 2.74966931670846 | epot = -22.3008594124712 | etot = -17.0042894403671
+802000  ekin = 3.02823775407486 |  erot = 2.8915936784506 | epot = -22.2024149184001 | etot = -16.2825834858746
+803000  ekin = 2.21042161290743 |  erot = 2.51594019231142 | epot = -22.1069208353333 | etot = -17.3805590301145
+804000  ekin = 2.91061289296152 |  erot = 1.5830418961718 | epot = -22.0839512655924 | etot = -17.5902964764591
+805000  ekin = 2.67762522194669 |  erot = 3.06970455948968 | epot = -22.0793101970619 | etot = -16.3319804156255
+806000  ekin = 2.75979804034939 |  erot = 2.2176860954027 | epot = -22.0549669082474 | etot = -17.0774827724953
+807000  ekin = 2.11041519443391 |  erot = 2.83915265443807 | epot = -22.1073292774231 | etot = -17.1577614285511
+808000  ekin = 1.84392510139081 |  erot = 2.29797054411878 | epot = -22.0753255923415 | etot = -17.9334299468319
+809000  ekin = 1.93171652686567 |  erot = 1.94021167949754 | epot = -22.0668297694372 | etot = -18.194901563074
+810000  ekin = 1.97774334424761 |  erot = 2.6472977913531 | epot = -22.1020544833021 | etot = -17.4770133477014
+811000  ekin = 2.2417092413671 |  erot = 1.75505259459069 | epot = -22.1062654329495 | etot = -18.1095035969917
+812000  ekin = 2.49053159164605 |  erot = 2.33986799245713 | epot = -22.124141511127 | etot = -17.2937419270238
+813000  ekin = 3.01755249739549 |  erot = 2.24004680047387 | epot = -22.1167722656682 | etot = -16.8591729677989
+814000  ekin = 2.86045886242639 |  erot = 2.24119269343823 | epot = -22.1084535534804 | etot = -17.0068019976158
+815000  ekin = 2.57503557502156 |  erot = 2.76212054641368 | epot = -21.9950519676046 | etot = -16.6578958461694
+816000  ekin = 2.19961906931023 |  erot = 2.59194277056134 | epot = -22.0843443380244 | etot = -17.2927824981528
+817000  ekin = 1.75062364873707 |  erot = 2.66165019507354 | epot = -22.3739862599355 | etot = -17.9617124161249
+818000  ekin = 2.24809257416679 |  erot = 2.59026399650675 | epot = -22.5610524731389 | etot = -17.7226959024654
+819000  ekin = 2.12537334404071 |  erot = 2.59618311382673 | epot = -22.5606510650104 | etot = -17.839094607143
+820000  ekin = 1.93414650390356 |  erot = 2.29085663493509 | epot = -22.4839314706954 | etot = -18.2589283318568
+821000  ekin = 2.11382182469737 |  erot = 2.38685226676536 | epot = -22.47627897247 | etot = -17.9756048810073
+822000  ekin = 2.2613431095799 |  erot = 2.12056938305333 | epot = -22.370909843474 | etot = -17.9889973508408
+823000  ekin = 2.31560863750917 |  erot = 2.60350436456086 | epot = -22.4988996092736 | etot = -17.5797866072036
+824000  ekin = 1.73697879038959 |  erot = 1.5185057021212 | epot = -22.6200401147494 | etot = -19.3645556222386
+825000  ekin = 1.63614248894086 |  erot = 1.97731468932685 | epot = -22.6198150724223 | etot = -19.0063578941546
+826000  ekin = 2.00841233147246 |  erot = 2.17850248200248 | epot = -22.5466518143203 | etot = -18.3597370008454
+827000  ekin = 2.18457105279113 |  erot = 2.44711764942285 | epot = -22.4005870169979 | etot = -17.7688983147839
+828000  ekin = 1.91039404464085 |  erot = 2.73449242191012 | epot = -22.3948651441296 | etot = -17.7499786775786
+829000  ekin = 2.07228257188588 |  erot = 2.97134747466499 | epot = -22.4347910090961 | etot = -17.3911609625452
+830000  ekin = 1.99293621346915 |  erot = 2.15765133255911 | epot = -22.4843800017124 | etot = -18.3337924556842
+831000  ekin = 2.33241187954984 |  erot = 2.37634533076884 | epot = -22.5757045912718 | etot = -17.8669473809531
+832000  ekin = 2.02856108052035 |  erot = 1.94729581180225 | epot = -22.6670251626246 | etot = -18.691168270302
+833000  ekin = 2.28623411522758 |  erot = 2.15108044390973 | epot = -22.7566850878713 | etot = -18.319370528734
+834000  ekin = 2.12105013529711 |  erot = 1.5116778668129 | epot = -22.7735851481702 | etot = -19.1408571460602
+835000  ekin = 2.88531776933573 |  erot = 2.74027641398136 | epot = -22.8585330533172 | etot = -17.2329388700001
+836000  ekin = 3.32070208623905 |  erot = 2.42231134749978 | epot = -22.8959107751695 | etot = -17.1528973414306
+837000  ekin = 2.74149226799164 |  erot = 2.32127198719276 | epot = -22.8906677110002 | etot = -17.8279034558158
+838000  ekin = 3.13302338440878 |  erot = 3.19829232559053 | epot = -22.9166668544453 | etot = -16.585351144446
+839000  ekin = 2.73522885875602 |  erot = 2.61100294075548 | epot = -22.8499426413711 | etot = -17.5037108418596
+840000  ekin = 2.97139629828009 |  erot = 1.43157972743722 | epot = -22.7763904271576 | etot = -18.3734144014403
+841000  ekin = 2.9571795545775 |  erot = 2.67280681737836 | epot = -22.7408850128302 | etot = -17.1108986408743
+842000  ekin = 2.17222575948606 |  erot = 2.30478646820068 | epot = -22.7382440804492 | etot = -18.2612318527624
+843000  ekin = 2.83292824269634 |  erot = 2.04165126380544 | epot = -22.7426687858571 | etot = -17.8680892793554
+844000  ekin = 2.95938970875204 |  erot = 1.50198210425589 | epot = -22.783719790782 | etot = -18.3223479777741
+845000  ekin = 3.16076837184522 |  erot = 2.28216144351779 | epot = -22.7913524647186 | etot = -17.3484226493555
+846000  ekin = 3.3398977708405 |  erot = 2.53602189023877 | epot = -22.7943227793905 | etot = -16.9184031183113
+847000  ekin = 2.14145435242079 |  erot = 2.75036267291773 | epot = -22.7255800042885 | etot = -17.83376297895
+848000  ekin = 2.48912550447967 |  erot = 2.81875176956459 | epot = -22.5834297802211 | etot = -17.2755525061768
+849000  ekin = 1.98023552181666 |  erot = 2.5692134285068 | epot = -22.4587431120173 | etot = -17.9092941616939
+850000  ekin = 2.0475383789703 |  erot = 1.80627608629883 | epot = -22.442868440532 | etot = -18.5890539752628
+851000  ekin = 2.09704360250612 |  erot = 1.85768640504848 | epot = -22.4344168330881 | etot = -18.4796868255335
+852000  ekin = 1.70813487206096 |  erot = 1.42387059402563 | epot = -22.3764553852037 | etot = -19.2444499191171
+853000  ekin = 2.00140314580349 |  erot = 3.04689599134399 | epot = -22.4103147041128 | etot = -17.3620155669653
+854000  ekin = 3.02149896921022 |  erot = 2.22990677084323 | epot = -22.4965128093929 | etot = -17.2451070693394
+855000  ekin = 2.19607047478225 |  erot = 2.83672007906388 | epot = -22.5083573431917 | etot = -17.4755667893456
+856000  ekin = 2.44947669543341 |  erot = 1.52884872890501 | epot = -22.4898047833717 | etot = -18.5114793590332
+857000  ekin = 2.53345481305323 |  erot = 2.80399799726174 | epot = -22.39864736443 | etot = -17.061194554115
+858000  ekin = 2.20266598505728 |  erot = 2.82477658278041 | epot = -22.322749893257 | etot = -17.2953073254193
+859000  ekin = 2.30655855498922 |  erot = 2.31428920065484 | epot = -22.299458676259 | etot = -17.6786109206149
+860000  ekin = 1.99697183524065 |  erot = 1.95028062775308 | epot = -22.3156691349687 | etot = -18.3684166719749
+861000  ekin = 2.69687116915107 |  erot = 2.24433771449493 | epot = -22.3086232893581 | etot = -17.3674144057121
+862000  ekin = 2.86022987586877 |  erot = 2.41684736135787 | epot = -22.2874375572893 | etot = -17.0103603200626
+863000  ekin = 2.60871204568914 |  erot = 3.3557366458487 | epot = -22.2313024399491 | etot = -16.2668537484113
+864000  ekin = 2.90978326967391 |  erot = 2.29745178043259 | epot = -22.1985713670251 | etot = -16.9913363169186
+865000  ekin = 1.92892881804686 |  erot = 2.15731715168145 | epot = -22.0984656787339 | etot = -18.0122197090056
+866000  ekin = 1.96990768776308 |  erot = 1.64764578107637 | epot = -21.9980087709689 | etot = -18.3804553021294
+867000  ekin = 1.75218832670564 |  erot = 3.37220276943672 | epot = -21.9060579112704 | etot = -16.781666815128
+868000  ekin = 1.82818126605702 |  erot = 2.79449094294287 | epot = -21.9401796601767 | etot = -17.3175074511768
+869000  ekin = 2.38095838431442 |  erot = 2.38587739965205 | epot = -22.0329803939138 | etot = -17.2661446099473
+870000  ekin = 1.91334960398162 |  erot = 3.22058637313173 | epot = -22.0372634175766 | etot = -16.9033274404632
+871000  ekin = 3.11762256076551 |  erot = 2.95337521110721 | epot = -21.9585521021423 | etot = -15.8875543302696
+872000  ekin = 2.97995457097216 |  erot = 1.38589789821627 | epot = -21.8388140547637 | etot = -17.4729615855753
+873000  ekin = 2.75063242740213 |  erot = 2.24384409185972 | epot = -21.7621446383558 | etot = -16.767668119094
+874000  ekin = 2.42548187796032 |  erot = 2.11160399589529 | epot = -21.6726796153781 | etot = -17.1355937415225
+875000  ekin = 2.99029080863986 |  erot = 2.74119845235593 | epot = -21.6681717382462 | etot = -15.9366824772504
+876000  ekin = 2.13275197859305 |  erot = 2.233203194222 | epot = -21.6687594523732 | etot = -17.3028042795581
+877000  ekin = 1.83070162423874 |  erot = 1.6010526911626 | epot = -21.6263742280813 | etot = -18.19461991268
+878000  ekin = 2.01997494895548 |  erot = 2.72070409004295 | epot = -21.632105565574 | etot = -16.8914265265756
+879000  ekin = 1.43444833027133 |  erot = 2.17422677437648 | epot = -21.5501867528963 | etot = -17.9415116482485
+880000  ekin = 2.09181862571921 |  erot = 2.57771231025419 | epot = -21.4847603093162 | etot = -16.8152293733428
+881000  ekin = 1.54081572899847 |  erot = 1.98591498012594 | epot = -21.5197472943257 | etot = -17.9930165852013
+882000  ekin = 2.2061903789583 |  erot = 2.64808794630213 | epot = -21.6149395754995 | etot = -16.760661250239
+883000  ekin = 2.22398786469444 |  erot = 2.23146516226547 | epot = -21.6814015671086 | etot = -17.2259485401487
+884000  ekin = 2.78668802039765 |  erot = 2.10130089852047 | epot = -21.7272273228039 | etot = -16.8392384038858
+885000  ekin = 1.92361997638943 |  erot = 1.77572378933155 | epot = -21.7696517903878 | etot = -18.0703080246668
+886000  ekin = 1.99836032534883 |  erot = 3.11596676947403 | epot = -21.7879382713548 | etot = -16.673611176532
+887000  ekin = 1.98879909318866 |  erot = 2.81589132946027 | epot = -21.7923091863043 | etot = -16.9876187636554
+888000  ekin = 1.92041141945741 |  erot = 2.3252911526479 | epot = -21.8607011941373 | etot = -17.614998622032
+889000  ekin = 1.8806357075667 |  erot = 2.46119753007268 | epot = -21.9506056361693 | etot = -17.6087723985299
+890000  ekin = 1.86005551534237 |  erot = 2.25705356539098 | epot = -22.0523870894554 | etot = -17.9352780087221
+891000  ekin = 2.60384568426052 |  erot = 2.35330960558484 | epot = -22.1900620535717 | etot = -17.2329067637263
+892000  ekin = 2.68682478776143 |  erot = 2.69192226449536 | epot = -22.2913421142228 | etot = -16.9125950619661
+893000  ekin = 2.17360632388892 |  erot = 2.98553431183659 | epot = -22.2913111245685 | etot = -17.132170488843
+894000  ekin = 2.52600330506545 |  erot = 2.45861329518365 | epot = -22.2813523194117 | etot = -17.2967357191626
+895000  ekin = 2.51964265942842 |  erot = 2.458508768977 | epot = -22.3090530666537 | etot = -17.3309016382482
+896000  ekin = 1.83970949418621 |  erot = 2.7876698428861 | epot = -22.2816769795447 | etot = -17.6542976424724
+897000  ekin = 2.36177466310812 |  erot = 2.0208895092276 | epot = -22.2244555724411 | etot = -17.8417914001054
+898000  ekin = 2.11475930620727 |  erot = 1.90142689771282 | epot = -22.1399515435435 | etot = -18.1237653396234
+899000  ekin = 2.62628238826603 |  erot = 2.33607509693707 | epot = -22.040854543184 | etot = -17.0784970579809
+900000  ekin = 2.1134311489616 |  erot = 2.28923041198217 | epot = -22.042922147544 | etot = -17.6402605866003
+901000  ekin = 1.9156742929676 |  erot = 1.81441237665855 | epot = -22.0776682049659 | etot = -18.3475815353397
+902000  ekin = 2.56902181313363 |  erot = 2.49856756454338 | epot = -22.0065137105888 | etot = -16.9389243329118
+903000  ekin = 1.85774740371253 |  erot = 2.17490444163848 | epot = -21.9440961512363 | etot = -17.9114443058853
+904000  ekin = 1.86493397406833 |  erot = 2.32873873815716 | epot = -21.8931358584844 | etot = -17.6994631462589
+905000  ekin = 2.31979070947169 |  erot = 2.14360558294755 | epot = -21.824385320242 | etot = -17.3609890278228
+906000  ekin = 2.49844805906095 |  erot = 2.24842339845928 | epot = -21.8343155675942 | etot = -17.087444110074
+907000  ekin = 4.2050069684007 |  erot = 2.50213003512293 | epot = -21.926981437738 | etot = -15.2198444342144
+908000  ekin = 3.27384188266606 |  erot = 2.113986364986 | epot = -22.0851390841283 | etot = -16.6973108364762
+909000  ekin = 2.63126156907554 |  erot = 1.92589592890071 | epot = -22.2067426627273 | etot = -17.649585164751
+910000  ekin = 2.59247391196527 |  erot = 2.91530974700789 | epot = -22.3083595488238 | etot = -16.8005758898507
+911000  ekin = 2.58542931349158 |  erot = 4.35273181589072 | epot = -22.3703725466068 | etot = -15.4322114172245
+912000  ekin = 3.05788115941417 |  erot = 3.70629270837706 | epot = -22.3924331468687 | etot = -15.6282592790774
+913000  ekin = 2.82179099955174 |  erot = 2.17271040546975 | epot = -22.3592523787226 | etot = -17.3647509737011
+914000  ekin = 2.15502438011904 |  erot = 1.21668409626845 | epot = -22.2678100512732 | etot = -18.8961015748857
+915000  ekin = 1.59606663662058 |  erot = 2.96270026674799 | epot = -22.1740650061606 | etot = -17.615298102792
+916000  ekin = 2.59113116114426 |  erot = 3.74925276784446 | epot = -22.2376802645764 | etot = -15.8972963355877
+917000  ekin = 3.04931771481537 |  erot = 2.87183708314021 | epot = -22.2631766381559 | etot = -16.3420218402004
+918000  ekin = 2.92188996322642 |  erot = 2.63336986904281 | epot = -22.2586011448583 | etot = -16.7033413125891
+919000  ekin = 3.21078589975638 |  erot = 2.75946192406924 | epot = -22.2354679015341 | etot = -16.2652200777085
+920000  ekin = 2.28588196467068 |  erot = 2.37332214874002 | epot = -22.2033589800159 | etot = -17.5441548666052
+921000  ekin = 2.38962275209347 |  erot = 2.43661594631483 | epot = -22.1850468087942 | etot = -17.3588081103859
+922000  ekin = 2.30444121290069 |  erot = 2.41446680487179 | epot = -22.1364838134968 | etot = -17.4175757957243
+923000  ekin = 2.49328668364371 |  erot = 2.66692739305866 | epot = -22.1214525565084 | etot = -16.961238479806
+924000  ekin = 1.53749552443357 |  erot = 2.96826070169594 | epot = -22.0894201538095 | etot = -17.58366392768
+925000  ekin = 1.85840160112661 |  erot = 1.96300614534087 | epot = -22.0261080308484 | etot = -18.2047002843809
+926000  ekin = 1.36444139420093 |  erot = 2.1171911056521 | epot = -22.0105169062661 | etot = -18.5288844064131
+927000  ekin = 2.55080456695379 |  erot = 2.08771192494034 | epot = -22.0296775970306 | etot = -17.3911611051365
+928000  ekin = 2.08687563155734 |  erot = 2.73937352627042 | epot = -22.0655254209395 | etot = -17.2392762631117
+929000  ekin = 1.85842465674464 |  erot = 1.85229951899858 | epot = -22.161879510768 | etot = -18.4511553350248
+930000  ekin = 1.98312460976539 |  erot = 2.1107410982594 | epot = -22.14836282055 | etot = -18.0544971125252
+931000  ekin = 2.44403538776918 |  erot = 1.87099700190232 | epot = -22.0455015122594 | etot = -17.7304691225879
+932000  ekin = 2.7450847259232 |  erot = 2.34428750425033 | epot = -22.0610452671158 | etot = -16.9716730369423
+933000  ekin = 3.03611053551161 |  erot = 2.51768120120295 | epot = -21.9625013660046 | etot = -16.4087096292901
+934000  ekin = 2.94656859108538 |  erot = 2.48807299457996 | epot = -21.861427363924 | etot = -16.4267857782587
+935000  ekin = 2.79276097099932 |  erot = 2.14683659927043 | epot = -21.8273092000012 | etot = -16.8877116297315
+936000  ekin = 2.97178317336133 |  erot = 2.07585468409967 | epot = -21.8285263420326 | etot = -16.7808884845716
+937000  ekin = 3.04678623330025 |  erot = 2.3469475727902 | epot = -21.7540111620946 | etot = -16.3602773560041
+938000  ekin = 2.98751343731959 |  erot = 2.36094469095133 | epot = -21.6698990656412 | etot = -16.3214409373703
+939000  ekin = 2.58148991378899 |  erot = 2.28540307033942 | epot = -21.641624391377 | etot = -16.7747314072486
+940000  ekin = 2.64449140269543 |  erot = 2.76444805229845 | epot = -21.5519193090555 | etot = -16.1429798540616
+941000  ekin = 2.27119597888968 |  erot = 2.6047011226429 | epot = -21.4613787017959 | etot = -16.5854816002633
+942000  ekin = 1.87372343217533 |  erot = 2.80846718394805 | epot = -21.3627475231486 | etot = -16.6805569070252
+943000  ekin = 2.47144243861285 |  erot = 2.33780411758964 | epot = -21.3635196463293 | etot = -16.5542730901269
+944000  ekin = 2.13395812695593 |  erot = 1.92152946754219 | epot = -21.3250397924826 | etot = -17.2695521979844
+945000  ekin = 2.55906013749132 |  erot = 2.2064112111687 | epot = -21.3688330068161 | etot = -16.6033616581561
+946000  ekin = 2.36057360323902 |  erot = 2.87561909021941 | epot = -21.3642087487724 | etot = -16.128016055314
+947000  ekin = 2.0664007802554 |  erot = 1.8712733843037 | epot = -21.3615863875836 | etot = -17.4239122230245
+948000  ekin = 1.84827298766581 |  erot = 1.37746869479931 | epot = -21.4042186851624 | etot = -18.1784770026972
+949000  ekin = 1.76268582715986 |  erot = 2.31704980534492 | epot = -21.4240851264671 | etot = -17.3443494939624
+950000  ekin = 1.71596526195605 |  erot = 2.24238613701562 | epot = -21.4136184248624 | etot = -17.4552670258908
+951000  ekin = 1.97739431794919 |  erot = 2.32356723589743 | epot = -21.4746626443703 | etot = -17.1737010905236
+952000  ekin = 2.93969915889367 |  erot = 2.72641565709973 | epot = -21.5183559681327 | etot = -15.8522411521393
+953000  ekin = 2.94576770934606 |  erot = 2.38856498634115 | epot = -21.5141407104899 | etot = -16.1798080148027
+954000  ekin = 3.09120782928501 |  erot = 1.98547863545544 | epot = -21.4220978424351 | etot = -16.3454113776947
+955000  ekin = 3.57635302907509 |  erot = 2.07344226252239 | epot = -21.3055276294275 | etot = -15.65573233783
+956000  ekin = 2.96199697760255 |  erot = 3.68176573533001 | epot = -21.1569123839441 | etot = -14.5131496710115
+957000  ekin = 2.99343140156395 |  erot = 2.6641673976979 | epot = -20.9767503534011 | etot = -15.3191515541393
+958000  ekin = 2.66519710291016 |  erot = 2.94296730915348 | epot = -20.778322783175 | etot = -15.1701583711114
+959000  ekin = 1.92859078964251 |  erot = 2.44737003089627 | epot = -20.7022563699757 | etot = -16.3262955494369
+960000  ekin = 1.49451727360012 |  erot = 3.13583888779427 | epot = -20.7118848436939 | etot = -16.0815286822995
+961000  ekin = 1.95030797402212 |  erot = 2.08601754519332 | epot = -20.7116280307748 | etot = -16.6753025115593
+962000  ekin = 2.02519672504697 |  erot = 1.8993614904036 | epot = -20.7772856698007 | etot = -16.8527274543501
+963000  ekin = 1.81866098250674 |  erot = 2.47413067985077 | epot = -20.8446590259958 | etot = -16.5518673636383
+964000  ekin = 2.82274927013719 |  erot = 2.43518028535965 | epot = -20.9038261011269 | etot = -15.64589654563
+965000  ekin = 2.55107687208175 |  erot = 2.29878175210651 | epot = -20.9717669792334 | etot = -16.1219083550452
+966000  ekin = 2.1200913755337 |  erot = 2.2846988725502 | epot = -21.0606259488472 | etot = -16.6558357007633
+967000  ekin = 1.58229605946639 |  erot = 3.55757301639252 | epot = -21.1224849810159 | etot = -15.982615905157
+968000  ekin = 1.95011274740584 |  erot = 2.3752003899703 | epot = -21.1147445818894 | etot = -16.7894314445132
+969000  ekin = 2.19259033480515 |  erot = 2.45911844664679 | epot = -21.0841141670188 | etot = -16.4324053855669
+970000  ekin = 1.87048608890169 |  erot = 2.95646346755995 | epot = -21.0142741201673 | etot = -16.1873245637056
+971000  ekin = 1.950153162929 |  erot = 3.0717285905854 | epot = -20.9854323440231 | etot = -15.9635505905087
+972000  ekin = 1.93197938125398 |  erot = 2.56232300543577 | epot = -20.9700672251306 | etot = -16.4757648384409
+973000  ekin = 2.21536036218028 |  erot = 2.92680374210101 | epot = -20.9735070987956 | etot = -15.8313429945143
+974000  ekin = 2.53787477442507 |  erot = 2.68950390909793 | epot = -20.9249780227203 | etot = -15.6975993391973
+975000  ekin = 3.3832404833891 |  erot = 2.33888514036507 | epot = -20.8975294326534 | etot = -15.1754038088992
+976000  ekin = 2.84644457799265 |  erot = 3.11578234174529 | epot = -20.8919958508098 | etot = -14.9297689310719
+977000  ekin = 2.71728271399263 |  erot = 2.50842582300821 | epot = -20.8689034899506 | etot = -15.6431949529497
+978000  ekin = 1.79447160570111 |  erot = 2.0736426807417 | epot = -20.8420102217514 | etot = -16.9738959353086
+979000  ekin = 1.87121723303036 |  erot = 2.21930404593537 | epot = -20.7748213462523 | etot = -16.6843000672865
+980000  ekin = 1.92329753072694 |  erot = 1.58075512357095 | epot = -20.7449893755876 | etot = -17.2409367212897
+981000  ekin = 1.54378956643562 |  erot = 2.05667260838343 | epot = -20.8055475552994 | etot = -17.2050853804803
+982000  ekin = 1.84106018589786 |  erot = 1.96434982363189 | epot = -20.9115392638984 | etot = -17.1061292543687
+983000  ekin = 2.72419781781661 |  erot = 1.79041192395563 | epot = -20.935370561762 | etot = -16.4207608199898
+984000  ekin = 3.62592878226169 |  erot = 2.63360520982709 | epot = -21.0391300854773 | etot = -14.7795960933885
+985000  ekin = 2.94852029277516 |  erot = 2.17123324675229 | epot = -21.210668025134 | etot = -16.0909144856065
+986000  ekin = 2.87308205004233 |  erot = 2.17802315487852 | epot = -21.3375937115616 | etot = -16.2864885066408
+987000  ekin = 3.37012638403781 |  erot = 2.51985184465596 | epot = -21.4043627880157 | etot = -15.514384559322
+988000  ekin = 3.46870329025365 |  erot = 3.24288958557111 | epot = -21.4574256625201 | etot = -14.7458327866953
+989000  ekin = 2.84167714920458 |  erot = 2.20794124486355 | epot = -21.6063889534189 | etot = -16.5567705593508
+990000  ekin = 2.79616762915596 |  erot = 1.83962543905575 | epot = -21.6049428673847 | etot = -16.969149799173
+991000  ekin = 3.12376374867622 |  erot = 3.19217780569165 | epot = -21.5124272449002 | etot = -15.1964856905324
+992000  ekin = 3.28266282243327 |  erot = 2.63435990952508 | epot = -21.3973672594977 | etot = -15.4803445275393
+993000  ekin = 3.03845590773447 |  erot = 2.22451011589011 | epot = -21.3214832241627 | etot = -16.0585172005382
+994000  ekin = 3.17417330085466 |  erot = 2.79358287085479 | epot = -21.2400043434466 | etot = -15.2722481717371
+995000  ekin = 3.20646780888655 |  erot = 1.72565517852613 | epot = -21.1372155372729 | etot = -16.2050925498602
+996000  ekin = 3.05109485375234 |  erot = 3.18000631651671 | epot = -21.0952864235923 | etot = -14.8641852533233
+997000  ekin = 2.95625677593347 |  erot = 3.15916554858247 | epot = -21.058148007987 | etot = -14.942725683471
+998000  ekin = 3.06605914614908 |  erot = 1.97682176881012 | epot = -20.9834240684974 | etot = -15.9405431535382
+999000  ekin = 2.08919327368179 |  erot = 2.76364485800616 | epot = -20.9705413117635 | etot = -16.1177031800756
+1000000  ekin = 2.11761701334905 |  erot = 2.1409630347026 | epot = -20.9096627221725 | etot = -16.6510826741208
+ 1000000  0.094116312   -1.3659956  0.059141691   -1.1745029 -3.0654283e-05 
+Loop time of 39.73 on 1 procs for 1000000 steps with 16 atoms
+
+Performance: 21746.777 tau/day, 25169.881 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    | 29.698     | 29.698     | 29.698     |   0.0 | 74.75
+Bond    | 0.84677    | 0.84677    | 0.84677    |   0.0 |  2.13
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 0.15576    | 0.15576    | 0.15576    |   0.0 |  0.39
+Output  | 7e-06      | 7e-06      | 7e-06      |   0.0 |  0.00
+Modify  | 8.7714     | 8.7714     | 8.7714     |   0.0 | 22.08
+Other   |            | 0.2585     |            |       |  0.65
+
+Nlocal:    16 ave 16 max 16 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Nghost:    0 ave 0 max 0 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Neighs:    116 ave 116 max 116 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+
+Total # of neighbors = 116
+Ave neighs/atom = 7.25
+Ave special neighs/atom = 3.75
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:39
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.4 b/examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.4
new file mode 100644
index 0000000000..ba8fd4a657
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex2/log.07Aug19.duplex2.g++.4
@@ -0,0 +1,1174 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000188 secs
+  read_data CPU = 0.002335 secs
+
+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
+
+# 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
+
+#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 = 2.6274
+  ghost atom cutoff = 2.6274
+  binsize = 1.3137, 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
+Per MPI rank memory allocation (min/avg/max) = 7.778 | 7.96 | 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 = 1.80871194953159 |  erot = 1.84151089264678 | epot = -21.8596865313185 | etot = -18.2094636891401
+421000  ekin = 1.25971024821532 |  erot = 1.84154088985399 | epot = -21.8144945739243 | etot = -18.713243435855
+422000  ekin = 1.38801644153196 |  erot = 2.76287955544763 | epot = -21.9448046693442 | etot = -17.7939086723646
+423000  ekin = 1.61378102360038 |  erot = 3.08643589903684 | epot = -21.9876910184367 | etot = -17.2874740957995
+424000  ekin = 2.38187559636676 |  erot = 2.03497345340564 | epot = -22.0529622043822 | etot = -17.6361131546098
+425000  ekin = 2.30172600419957 |  erot = 2.56124787306544 | epot = -22.0909144547264 | etot = -17.2279405774613
+426000  ekin = 2.08135734353848 |  erot = 3.11029155110106 | epot = -22.0318884881515 | etot = -16.8402395935119
+427000  ekin = 2.14905284759742 |  erot = 2.44063059706749 | epot = -21.9221859408584 | etot = -17.3325024961935
+428000  ekin = 1.77884336055357 |  erot = 1.65616500997461 | epot = -21.9003025672496 | etot = -18.4652941967214
+429000  ekin = 1.64634843235491 |  erot = 2.54977814749917 | epot = -21.8505053104909 | etot = -17.6543787306368
+430000  ekin = 2.66566369380165 |  erot = 2.85826638798746 | epot = -21.8749831872768 | etot = -16.3510531054877
+431000  ekin = 2.77262842672213 |  erot = 1.57008239418362 | epot = -21.8682859290024 | etot = -17.5255751080967
+432000  ekin = 2.55459213758159 |  erot = 1.62943387255927 | epot = -21.8357562133881 | etot = -17.6517302032472
+433000  ekin = 1.99645419170627 |  erot = 2.46386731011038 | epot = -21.9426115259012 | etot = -17.4822900240846
+434000  ekin = 3.03855037499723 |  erot = 2.70114732868002 | epot = -22.0521183162706 | etot = -16.3124206125934
+435000  ekin = 3.56249359412514 |  erot = 1.3916907800745 | epot = -22.1907087359577 | etot = -17.236524361758
+436000  ekin = 2.9919519436941 |  erot = 2.00780906096746 | epot = -22.1944569501235 | etot = -17.194695945462
+437000  ekin = 3.22983002449305 |  erot = 1.78457838368284 | epot = -22.2079862630257 | etot = -17.1935778548498
+438000  ekin = 2.89357954274282 |  erot = 1.84712438388029 | epot = -22.1640149633625 | etot = -17.4233110367394
+439000  ekin = 2.43548109922482 |  erot = 2.69725667220989 | epot = -22.15552566419 | etot = -17.0227878927552
+440000  ekin = 2.2623759777343 |  erot = 3.0053291392984 | epot = -22.1911581748161 | etot = -16.9234530577834
+441000  ekin = 2.91169601545459 |  erot = 2.87109172357543 | epot = -22.3349024428918 | etot = -16.5521147038618
+442000  ekin = 2.09099397022228 |  erot = 1.73520313922453 | epot = -22.4051258365299 | etot = -18.5789287270831
+443000  ekin = 1.89190436364779 |  erot = 2.00338805773041 | epot = -22.4571595679749 | etot = -18.5618671465967
+444000  ekin = 2.07260612589383 |  erot = 2.15261859961606 | epot = -22.4762155543905 | etot = -18.2509908288806
+445000  ekin = 2.10794043544074 |  erot = 2.27849500108989 | epot = -22.5289113655649 | etot = -18.1424759290343
+446000  ekin = 2.43249129570082 |  erot = 2.85798785841701 | epot = -22.5578450371516 | etot = -17.2673658830337
+447000  ekin = 2.18427449291498 |  erot = 2.99487058702881 | epot = -22.633209665243 | etot = -17.4540645852992
+448000  ekin = 2.33125251154888 |  erot = 2.9537271150568 | epot = -22.6544934614541 | etot = -17.3695138348484
+449000  ekin = 2.34830834177129 |  erot = 2.93433423081578 | epot = -22.6524261630772 | etot = -17.3697835904901
+450000  ekin = 1.83059864091627 |  erot = 1.69583085832556 | epot = -22.5959718193007 | etot = -19.0695423200588
+451000  ekin = 1.97008420530444 |  erot = 1.93005789483906 | epot = -22.6042016377466 | etot = -18.7040595376031
+452000  ekin = 1.36031716300771 |  erot = 1.88416646481667 | epot = -22.5654500281941 | etot = -19.3209664003698
+453000  ekin = 2.08394677326601 |  erot = 2.55637003071468 | epot = -22.3996731437447 | etot = -17.759356339764
+454000  ekin = 1.46122132979162 |  erot = 2.1932504558799 | epot = -22.2559783518549 | etot = -18.6015065661834
+455000  ekin = 1.66159562683808 |  erot = 2.72214658377912 | epot = -22.1100881227337 | etot = -17.7263459121165
+456000  ekin = 2.35139002285135 |  erot = 1.99736695780608 | epot = -22.0265180206658 | etot = -17.6777610400084
+457000  ekin = 2.02337666353787 |  erot = 2.36288174917835 | epot = -21.9870419865869 | etot = -17.6007835738707
+458000  ekin = 1.74388716034853 |  erot = 2.25704341258625 | epot = -22.0124765184275 | etot = -18.0115459454927
+459000  ekin = 2.51302694941202 |  erot = 2.31610812350976 | epot = -22.0905335599533 | etot = -17.2613984870315
+460000  ekin = 2.20235980851235 |  erot = 2.00073208070752 | epot = -22.0624281815267 | etot = -17.8593362923069
+461000  ekin = 2.27697813860512 |  erot = 2.92153186175593 | epot = -22.0043780203814 | etot = -16.8058680200203
+462000  ekin = 2.61751250591993 |  erot = 1.79446367088042 | epot = -22.034566251344 | etot = -17.6225900745436
+463000  ekin = 2.59076396942114 |  erot = 3.29959067151568 | epot = -21.9680597931617 | etot = -16.0777051522249
+464000  ekin = 2.18897688760924 |  erot = 2.37342380725927 | epot = -21.9014176363544 | etot = -17.3390169414859
+465000  ekin = 2.55336811292171 |  erot = 3.60208553232432 | epot = -21.8218243406516 | etot = -15.6663706954055
+466000  ekin = 1.98087073364117 |  erot = 2.88377492118972 | epot = -21.8240279062597 | etot = -16.9593822514288
+467000  ekin = 1.63963444033068 |  erot = 2.61720118783829 | epot = -21.9072568806945 | etot = -17.6504212525255
+468000  ekin = 1.11353612829142 |  erot = 3.36362638075105 | epot = -21.9675488944805 | etot = -17.490386385438
+469000  ekin = 1.72228182007047 |  erot = 2.77659856111655 | epot = -21.9967286251288 | etot = -17.4978482439417
+470000  ekin = 1.86957223270987 |  erot = 2.88200736733016 | epot = -22.0532435258199 | etot = -17.3016639257798
+471000  ekin = 2.73889257490363 |  erot = 2.33805868565127 | epot = -22.1018048913227 | etot = -17.0248536307678
+472000  ekin = 2.69336835751318 |  erot = 2.14497398823592 | epot = -22.1783319655624 | etot = -17.3399896198133
+473000  ekin = 2.2834012228809 |  erot = 2.08779065134065 | epot = -22.2062566289287 | etot = -17.8350647547071
+474000  ekin = 2.23753393343421 |  erot = 2.18021358366907 | epot = -22.2186470965394 | etot = -17.8008995794361
+475000  ekin = 2.52144972759887 |  erot = 2.10742888877791 | epot = -22.2200376200674 | etot = -17.5911590036907
+476000  ekin = 2.21750839437398 |  erot = 1.76993465858266 | epot = -22.1228407781581 | etot = -18.1353977252014
+477000  ekin = 2.49639604606981 |  erot = 2.38997154938614 | epot = -22.0914213950017 | etot = -17.2050537995458
+478000  ekin = 1.92476411077776 |  erot = 2.05068061613981 | epot = -22.1165013146126 | etot = -18.141056587695
+479000  ekin = 2.27814065534966 |  erot = 3.09902158675158 | epot = -22.1039609371193 | etot = -16.726798695018
+480000  ekin = 1.67684718675217 |  erot = 2.75298455656157 | epot = -22.107572084908 | etot = -17.6777403415942
+481000  ekin = 1.82004035403442 |  erot = 2.94243611851488 | epot = -22.0570042571709 | etot = -17.2945277846216
+482000  ekin = 2.15620792762657 |  erot = 2.07225318674483 | epot = -22.0195504604851 | etot = -17.7910893461137
+483000  ekin = 1.49597937205778 |  erot = 1.99748154603235 | epot = -21.9846691787552 | etot = -18.4912082606651
+484000  ekin = 1.84801031899852 |  erot = 2.3383930614213 | epot = -22.057622803598 | etot = -17.8712194231781
+485000  ekin = 1.63994449952444 |  erot = 2.49474020960602 | epot = -22.0873319631203 | etot = -17.9526472539898
+486000  ekin = 1.86878710017944 |  erot = 2.15121977781065 | epot = -22.0738722433192 | etot = -18.0538653653291
+487000  ekin = 2.36575535267025 |  erot = 3.10125401276719 | epot = -22.1449283981519 | etot = -16.6779190327145
+488000  ekin = 2.28442246943194 |  erot = 3.25683393002513 | epot = -22.0988506325681 | etot = -16.557594233111
+489000  ekin = 2.42271484675 |  erot = 2.54542145912102 | epot = -22.0089541135478 | etot = -17.0408178076768
+490000  ekin = 2.15700463004959 |  erot = 3.54046810332719 | epot = -21.9046622319151 | etot = -16.2071894985383
+491000  ekin = 2.21877065503535 |  erot = 2.48745097433189 | epot = -21.7908019627883 | etot = -17.084580333421
+492000  ekin = 2.42517437413502 |  erot = 2.76311171529555 | epot = -21.7601749752715 | etot = -16.5718888858409
+493000  ekin = 1.78704503482097 |  erot = 2.27560531894265 | epot = -21.8193757259442 | etot = -17.7567253721806
+494000  ekin = 2.08676036701357 |  erot = 2.99995787427429 | epot = -21.8611051542237 | etot = -16.7743869129358
+495000  ekin = 2.13526814465422 |  erot = 2.49327519100043 | epot = -21.9512664264056 | etot = -17.322723090751
+496000  ekin = 2.04396376951351 |  erot = 2.616205394925 | epot = -21.9926597066748 | etot = -17.3324905422363
+497000  ekin = 2.5138400992253 |  erot = 1.7082513952147 | epot = -21.9316573881385 | etot = -17.7095658936985
+498000  ekin = 2.15599563393455 |  erot = 1.7954584756616 | epot = -21.8684844569259 | etot = -17.9170303473298
+499000  ekin = 3.01748439271979 |  erot = 1.75754764004202 | epot = -21.8933218662966 | etot = -17.1182898335348
+500000  ekin = 2.75260982901106 |  erot = 2.51842805388796 | epot = -21.8943946135574 | etot = -16.6233567306584
+501000  ekin = 2.67931288903133 |  erot = 3.01160406637169 | epot = -21.7750232065095 | etot = -16.0841062511065
+502000  ekin = 1.89360306182664 |  erot = 3.89791941021244 | epot = -21.6573468922303 | etot = -15.8658244201912
+503000  ekin = 1.79321931974651 |  erot = 2.94204976962205 | epot = -21.4684952360274 | etot = -16.7332261466588
+504000  ekin = 1.67757593959819 |  erot = 3.03667519772553 | epot = -21.3740498051044 | etot = -16.6597986677806
+505000  ekin = 2.71879314198246 |  erot = 2.13553052885653 | epot = -21.3748517524097 | etot = -16.5205280815707
+506000  ekin = 2.26416011641767 |  erot = 2.0398390357387 | epot = -21.3744734731022 | etot = -17.0704743209458
+507000  ekin = 3.1361217829786 |  erot = 2.43598082432092 | epot = -21.4637546760327 | etot = -15.8916520687332
+508000  ekin = 2.50986106907072 |  erot = 2.54739392181407 | epot = -21.6231060681634 | etot = -16.5658510772786
+509000  ekin = 2.11468804004737 |  erot = 2.82565642150503 | epot = -21.7737120459513 | etot = -16.8333675843989
+510000  ekin = 2.15001055304937 |  erot = 1.42727017491937 | epot = -21.8417870574445 | etot = -18.2645063294758
+511000  ekin = 2.52545394756595 |  erot = 2.75161712587392 | epot = -21.9086876613652 | etot = -16.6316165879253
+512000  ekin = 2.30866784309731 |  erot = 2.74554976662385 | epot = -21.9096028664776 | etot = -16.8553852567564
+513000  ekin = 2.48902345599678 |  erot = 2.14823762928075 | epot = -21.8729373600799 | etot = -17.2356762748023
+514000  ekin = 2.80071109914887 |  erot = 2.54489890263222 | epot = -22.0260959105663 | etot = -16.6804859087852
+515000  ekin = 2.54951114466539 |  erot = 1.81830545608794 | epot = -22.1182236024141 | etot = -17.7504070016608
+516000  ekin = 2.82429114749713 |  erot = 2.22223190254033 | epot = -22.2027443448738 | etot = -17.1562212948364
+517000  ekin = 2.0440652856654 |  erot = 2.05268379810237 | epot = -22.2270328001489 | etot = -18.1302837163811
+518000  ekin = 2.19098614618396 |  erot = 2.7523349010516 | epot = -22.2209877154936 | etot = -17.2776666682581
+519000  ekin = 2.24036502705842 |  erot = 2.22532553600967 | epot = -22.3180679614818 | etot = -17.8523773984137
+520000  ekin = 1.89058003919379 |  erot = 2.20041260684313 | epot = -22.4024099853452 | etot = -18.3114173393082
+521000  ekin = 2.59235690452872 |  erot = 1.87867658572832 | epot = -22.562076955749 | etot = -18.0910434654919
+522000  ekin = 3.47612340255834 |  erot = 1.7709131526267 | epot = -22.6560013672146 | etot = -17.4089648120295
+523000  ekin = 2.8697331156896 |  erot = 2.45931135481363 | epot = -22.7015468187877 | etot = -17.3725023482845
+524000  ekin = 2.43256318748704 |  erot = 2.35726786724124 | epot = -22.6382055947878 | etot = -17.8483745400596
+525000  ekin = 1.5862220801759 |  erot = 2.67712917770356 | epot = -22.6016118927226 | etot = -18.3382606348432
+526000  ekin = 1.68941966580457 |  erot = 1.5638733848976 | epot = -22.5489288531345 | etot = -19.2956358024323
+527000  ekin = 2.25322718958956 |  erot = 1.91908592764601 | epot = -22.4417549635527 | etot = -18.2694418463171
+528000  ekin = 2.66412422381676 |  erot = 2.81704928468163 | epot = -22.4249217233809 | etot = -16.9437482148825
+529000  ekin = 2.68379060052796 |  erot = 3.01205280488721 | epot = -22.4295574265689 | etot = -16.7337140211537
+530000  ekin = 2.58073227215729 |  erot = 2.12870295195894 | epot = -22.2883086480464 | etot = -17.5788734239302
+531000  ekin = 2.96770457160389 |  erot = 2.35391742452841 | epot = -22.1856711738739 | etot = -16.8640491777416
+532000  ekin = 2.56038964370913 |  erot = 2.30878740571672 | epot = -22.1997799918585 | etot = -17.3306029424327
+533000  ekin = 2.47143825522096 |  erot = 2.96338918263318 | epot = -22.2065233272061 | etot = -16.7716958893519
+534000  ekin = 2.10112886915673 |  erot = 2.06170735341251 | epot = -22.2366529232829 | etot = -18.0738167007137
+535000  ekin = 3.76894732289841 |  erot = 2.64646203076619 | epot = -22.2276744548843 | etot = -15.8122651012197
+536000  ekin = 2.7696162230836 |  erot = 1.95805234771211 | epot = -22.1654529173378 | etot = -17.4377843465421
+537000  ekin = 2.84154244437419 |  erot = 2.62704512023094 | epot = -22.0849688339382 | etot = -16.6163812693331
+538000  ekin = 2.68442563578381 |  erot = 2.11441739965432 | epot = -22.0125688846837 | etot = -17.2137258492456
+539000  ekin = 2.71421145807769 |  erot = 2.40915133591281 | epot = -22.1313332530722 | etot = -17.0079704590817
+540000  ekin = 2.43518407250594 |  erot = 2.49363815768251 | epot = -22.2749632551308 | etot = -17.3461410249423
+541000  ekin = 3.40444579850308 |  erot = 2.79359613706622 | epot = -22.3466180642397 | etot = -16.1485761286704
+542000  ekin = 2.43275262454037 |  erot = 2.8926712949891 | epot = -22.3556133688796 | etot = -17.0301894493501
+543000  ekin = 2.33375802900842 |  erot = 2.87822266703542 | epot = -22.354503031092 | etot = -17.1425223350481
+544000  ekin = 2.20372430185484 |  erot = 1.45976141003991 | epot = -22.3227611685585 | etot = -18.6592754566638
+545000  ekin = 2.44172510086271 |  erot = 2.14426798374485 | epot = -22.3064237448696 | etot = -17.720430660262
+546000  ekin = 1.97339115566054 |  erot = 2.22847557914697 | epot = -22.2636677476263 | etot = -18.0618010128188
+547000  ekin = 2.54002001617723 |  erot = 1.88945501268906 | epot = -22.2158143598027 | etot = -17.7863393309365
+548000  ekin = 1.68526456618955 |  erot = 1.65049155866197 | epot = -22.1214578510425 | etot = -18.785701726191
+549000  ekin = 1.87014690614356 |  erot = 2.68376307045224 | epot = -22.3040985050477 | etot = -17.7501885284519
+550000  ekin = 1.81229877740871 |  erot = 1.59166644509217 | epot = -22.4560870327802 | etot = -19.0521218102793
+551000  ekin = 2.18773128797504 |  erot = 2.27087388044657 | epot = -22.5158361799812 | etot = -18.0572310115596
+552000  ekin = 2.05249497087455 |  erot = 2.50761265901319 | epot = -22.5719393540102 | etot = -18.0118317241225
+553000  ekin = 2.95454924363313 |  erot = 2.14558063826841 | epot = -22.6616695566088 | etot = -17.5615396747072
+554000  ekin = 2.82907288726943 |  erot = 1.93583607418193 | epot = -22.8114472173086 | etot = -18.0465382558572
+555000  ekin = 2.39144194814065 |  erot = 2.2690346714923 | epot = -22.8607776699892 | etot = -18.2003010503562
+556000  ekin = 2.29377130416531 |  erot = 2.58082229477443 | epot = -22.9123559572369 | etot = -18.0377623582971
+557000  ekin = 2.83942594504113 |  erot = 1.46630323732685 | epot = -22.9955247836668 | etot = -18.6897956012988
+558000  ekin = 2.74466783679159 |  erot = 2.01704787654692 | epot = -23.0269943374553 | etot = -18.2652786241168
+559000  ekin = 3.32013685758138 |  erot = 2.33070588278053 | epot = -23.0724440783111 | etot = -17.4216013379492
+560000  ekin = 3.06575014862304 |  erot = 2.3240772361437 | epot = -23.058452120381 | etot = -17.6686247356143
+561000  ekin = 2.86678914129224 |  erot = 2.08494050984238 | epot = -22.9757329649367 | etot = -18.0240033138021
+562000  ekin = 3.27279507804287 |  erot = 2.51484206553918 | epot = -22.8763400547029 | etot = -17.0887029111208
+563000  ekin = 2.66038070150058 |  erot = 1.64116530766161 | epot = -22.8496252506975 | etot = -18.5480792415353
+564000  ekin = 2.80463843262516 |  erot = 2.5266606313835 | epot = -22.8040898690867 | etot = -17.4727908050781
+565000  ekin = 2.64623234011006 |  erot = 2.04560086917498 | epot = -22.7528472206811 | etot = -18.061014011396
+566000  ekin = 2.31861442156789 |  erot = 2.17941765713979 | epot = -22.7559143900141 | etot = -18.2578823113064
+567000  ekin = 1.93226018038665 |  erot = 2.82020539323088 | epot = -22.7113049006743 | etot = -17.9588393270567
+568000  ekin = 2.20139908423163 |  erot = 2.2173471641442 | epot = -22.7309883250972 | etot = -18.3122420767214
+569000  ekin = 2.47190977966691 |  erot = 2.65968832242268 | epot = -22.6724326928842 | etot = -17.5408345907946
+570000  ekin = 2.43697670060318 |  erot = 1.88669477532771 | epot = -22.6652860601546 | etot = -18.3416145842237
+571000  ekin = 2.89014026085716 |  erot = 2.95617526869999 | epot = -22.6585089246084 | etot = -16.8121933950513
+572000  ekin = 1.93596118948626 |  erot = 3.77290573984751 | epot = -22.617986049283 | etot = -16.9091191199493
+573000  ekin = 2.4045463471171 |  erot = 2.31316721466246 | epot = -22.5941857447927 | etot = -17.8764721830131
+574000  ekin = 1.69171540489496 |  erot = 2.32939319863948 | epot = -22.6485181547002 | etot = -18.6274095511658
+575000  ekin = 1.84147438222145 |  erot = 1.86451086977537 | epot = -22.7257563443532 | etot = -19.0197710923563
+576000  ekin = 3.22125710715105 |  erot = 2.95826776175095 | epot = -22.6735851458116 | etot = -16.4940602769096
+577000  ekin = 2.86653117003728 |  erot = 2.88010628292138 | epot = -22.6061554079341 | etot = -16.8595179549754
+578000  ekin = 2.38032268318987 |  erot = 2.76710196021751 | epot = -22.4015577816723 | etot = -17.2541331382649
+579000  ekin = 2.40088404436444 |  erot = 1.99411758494037 | epot = -22.2441807849414 | etot = -17.8491791556366
+580000  ekin = 2.62022193893445 |  erot = 1.97772953708398 | epot = -22.0981459564787 | etot = -17.5001944804602
+581000  ekin = 2.04609920382364 |  erot = 3.0202197191752 | epot = -21.9713515823037 | etot = -16.9050326593048
+582000  ekin = 2.17556767215606 |  erot = 3.10885810822424 | epot = -21.8451828402321 | etot = -16.5607570598518
+583000  ekin = 2.12792577884129 |  erot = 2.7142175246668 | epot = -21.8090540347999 | etot = -16.9669107312918
+584000  ekin = 2.99197492146328 |  erot = 2.6185428756741 | epot = -21.8014711662179 | etot = -16.1909533690805
+585000  ekin = 2.41600413666429 |  erot = 2.49968403996098 | epot = -21.7582079751419 | etot = -16.8425197985166
+586000  ekin = 3.57880609498067 |  erot = 1.99026777936244 | epot = -21.7793800190221 | etot = -16.210306144679
+587000  ekin = 3.53569318795882 |  erot = 1.96660845702856 | epot = -21.7574182658133 | etot = -16.255116620826
+588000  ekin = 2.80385841316338 |  erot = 1.58927534150911 | epot = -21.7290695763864 | etot = -17.3359358217139
+589000  ekin = 2.31178332958482 |  erot = 2.19605556561577 | epot = -21.7771889269559 | etot = -17.2693500317553
+590000  ekin = 2.57159955455667 |  erot = 1.71441305781987 | epot = -21.7801644206484 | etot = -17.4941518082718
+591000  ekin = 1.90027597697965 |  erot = 3.80794292513097 | epot = -21.8693595444135 | etot = -16.1611406423028
+592000  ekin = 2.10287592275467 |  erot = 2.85572724854609 | epot = -21.913245820329 | etot = -16.9546426490283
+593000  ekin = 1.6630679389305 |  erot = 2.45937970675131 | epot = -21.9499391362603 | etot = -17.8274914905785
+594000  ekin = 1.85147249869391 |  erot = 2.37596539021724 | epot = -22.0748010854883 | etot = -17.8473631965771
+595000  ekin = 1.62801913987931 |  erot = 2.13760745860405 | epot = -22.2650343535207 | etot = -18.4994077550374
+596000  ekin = 1.8507787756783 |  erot = 1.55277904845736 | epot = -22.3618759263936 | etot = -18.9583181022579
+597000  ekin = 2.21873580046471 |  erot = 2.31247364510899 | epot = -22.4218283315557 | etot = -17.890618885982
+598000  ekin = 1.87152940931079 |  erot = 3.02770945247868 | epot = -22.4928956008977 | etot = -17.5936567391082
+599000  ekin = 2.84160333456022 |  erot = 2.19202304201413 | epot = -22.5210806388342 | etot = -17.4874542622599
+600000  ekin = 2.63824255094171 |  erot = 2.13280883838531 | epot = -22.4361553764614 | etot = -17.6651039871344
+601000  ekin = 2.95991744971104 |  erot = 3.20891387142304 | epot = -22.3089419175364 | etot = -16.1401105964023
+602000  ekin = 2.94287171911394 |  erot = 2.6801544694314 | epot = -22.2205146380182 | etot = -16.5974884494729
+603000  ekin = 2.59651768027528 |  erot = 2.70994674634417 | epot = -22.1626040385702 | etot = -16.8561396119508
+604000  ekin = 1.79237423166219 |  erot = 2.11638057359598 | epot = -22.1934477586593 | etot = -18.2846929534011
+605000  ekin = 1.83068473031177 |  erot = 2.2795743818689 | epot = -22.2254684973409 | etot = -18.1152093851602
+606000  ekin = 2.3318585405123 |  erot = 2.19626289047853 | epot = -22.1692552740621 | etot = -17.6411338430713
+607000  ekin = 2.71184010988538 |  erot = 2.97108975720824 | epot = -22.1536579122904 | etot = -16.4707280451968
+608000  ekin = 2.42009843612052 |  erot = 2.41609650030392 | epot = -22.110570505977 | etot = -17.2743755695526
+609000  ekin = 1.88829617874732 |  erot = 2.63290748875975 | epot = -21.9999822454274 | etot = -17.4787785779203
+610000  ekin = 3.00361337450473 |  erot = 2.17709909276457 | epot = -21.9226199750059 | etot = -16.7419075077366
+611000  ekin = 2.45804405292799 |  erot = 2.74756316868512 | epot = -21.9190479764513 | etot = -16.7134407548382
+612000  ekin = 2.52217588638913 |  erot = 2.13391253924555 | epot = -21.9544188877756 | etot = -17.2983304621409
+613000  ekin = 3.03676008822021 |  erot = 2.11841016157454 | epot = -22.0017416346015 | etot = -16.8465713848068
+614000  ekin = 2.28555718180926 |  erot = 3.0054092802111 | epot = -22.0761965028491 | etot = -16.7852300408287
+615000  ekin = 1.68510287809685 |  erot = 2.62386193001633 | epot = -22.0327006368424 | etot = -17.7237358287293
+616000  ekin = 1.93880828018173 |  erot = 2.84237691352502 | epot = -22.0612297066235 | etot = -17.2800445129167
+617000  ekin = 2.16704933019324 |  erot = 2.51662857724103 | epot = -22.0595683849495 | etot = -17.3758904775152
+618000  ekin = 3.09933970351517 |  erot = 2.74545743402536 | epot = -22.0170483082271 | etot = -16.1722511706866
+619000  ekin = 3.43176670397203 |  erot = 2.12195823326365 | epot = -21.9875785418916 | etot = -16.4338536046559
+620000  ekin = 4.28780554984769 |  erot = 2.22709196760532 | epot = -21.9605251543896 | etot = -15.4456276369365
+621000  ekin = 3.08171244822519 |  erot = 2.57159564010567 | epot = -21.9025163812385 | etot = -16.2492082929076
+622000  ekin = 2.7316886075754 |  erot = 2.62820058118157 | epot = -21.8412338594045 | etot = -16.4813446706475
+623000  ekin = 2.85452079274903 |  erot = 2.89943500147414 | epot = -21.6852443941174 | etot = -15.9312885998942
+624000  ekin = 2.03273271064347 |  erot = 3.41737453659275 | epot = -21.5180611078538 | etot = -16.0679538606176
+625000  ekin = 2.93860287466086 |  erot = 2.6777302302364 | epot = -21.3855450802948 | etot = -15.7692119753975
+626000  ekin = 2.62772208534213 |  erot = 2.18165419852424 | epot = -21.3747765229082 | etot = -16.5654002390418
+627000  ekin = 2.31977818310487 |  erot = 2.39484209061113 | epot = -21.4372090577008 | etot = -16.7225887839848
+628000  ekin = 2.22183190227213 |  erot = 2.76412054255638 | epot = -21.5969078027883 | etot = -16.6109553579598
+629000  ekin = 2.21761787409423 |  erot = 1.98066149405245 | epot = -21.7578561859453 | etot = -17.5595768177986
+630000  ekin = 2.47350494176362 |  erot = 2.13931642231374 | epot = -21.7773766650218 | etot = -17.1645553009445
+631000  ekin = 2.05047278007876 |  erot = 1.79296462014617 | epot = -21.7869475538217 | etot = -17.9435101535968
+632000  ekin = 1.64845667747476 |  erot = 3.28396465847893 | epot = -21.8333012025329 | etot = -16.9008798665792
+633000  ekin = 2.3500132343185 |  erot = 2.3390975332878 | epot = -21.9539301797825 | etot = -17.2648194121762
+634000  ekin = 2.35704893279043 |  erot = 2.46483254513169 | epot = -22.0204072629832 | etot = -17.1985257850611
+635000  ekin = 1.98907577162676 |  erot = 3.37071781675284 | epot = -22.0690924871448 | etot = -16.7092988987652
+636000  ekin = 2.50984196335062 |  erot = 2.48688994533939 | epot = -22.0714906026256 | etot = -17.0747586939356
+637000  ekin = 2.77501317112847 |  erot = 2.80709332215511 | epot = -21.9923972278242 | etot = -16.4102907345407
+638000  ekin = 2.43799129572064 |  erot = 2.7900719850463 | epot = -22.0591413868446 | etot = -16.8310781060777
+639000  ekin = 1.88073995546173 |  erot = 2.09679843998312 | epot = -22.0499554202513 | etot = -18.0724170248065
+640000  ekin = 2.08188045172846 |  erot = 3.35894090591918 | epot = -21.9976614802368 | etot = -16.5568401225891
+641000  ekin = 2.09182367506332 |  erot = 2.24091541077085 | epot = -22.0969663672431 | etot = -17.7642272814089
+642000  ekin = 2.29630816296813 |  erot = 2.69496533496291 | epot = -22.1529742829376 | etot = -17.1617007850065
+643000  ekin = 2.73580847855276 |  erot = 2.20074971448877 | epot = -22.0965451673466 | etot = -17.1599869743051
+644000  ekin = 2.877547382531 |  erot = 3.41752705378106 | epot = -22.1314614085221 | etot = -15.8363869722101
+645000  ekin = 2.42917363330758 |  erot = 2.10617126422418 | epot = -22.0684179655268 | etot = -17.533073067995
+646000  ekin = 2.69471397724187 |  erot = 1.80009045225372 | epot = -21.8990804127739 | etot = -17.4042759832783
+647000  ekin = 2.47700110999565 |  erot = 1.99221351689819 | epot = -21.6986646197608 | etot = -17.229449992867
+648000  ekin = 2.27330015032657 |  erot = 1.67398094476719 | epot = -21.7984825454864 | etot = -17.8512014503927
+649000  ekin = 2.5628574039565 |  erot = 1.74923984575743 | epot = -22.1937498986979 | etot = -17.881652648984
+650000  ekin = 2.76035969172866 |  erot = 2.20984080080438 | epot = -22.3536470081185 | etot = -17.3834465155854
+651000  ekin = 2.262551545237 |  erot = 3.27496991661067 | epot = -22.4274148303114 | etot = -16.8898933684638
+652000  ekin = 2.3727982819665 |  erot = 2.29630046443082 | epot = -22.4456643066011 | etot = -17.7765655602038
+653000  ekin = 2.07651844100825 |  erot = 2.14699861111497 | epot = -22.4487464586908 | etot = -18.2252294065676
+654000  ekin = 2.31499263290336 |  erot = 1.84798657187726 | epot = -22.471548114837 | etot = -18.3085689100564
+655000  ekin = 2.12344600536595 |  erot = 1.79742316518918 | epot = -22.4407504825061 | etot = -18.519881311951
+656000  ekin = 2.44238672537433 |  erot = 2.33314467296101 | epot = -22.4050518721077 | etot = -17.6295204737724
+657000  ekin = 2.44684720738067 |  erot = 2.87010904355218 | epot = -22.3954429054341 | etot = -17.0784866545012
+658000  ekin = 2.49369435044193 |  erot = 2.86933833355583 | epot = -22.3577847118898 | etot = -16.9947520278921
+659000  ekin = 3.38707666874149 |  erot = 2.79117377884123 | epot = -22.2233688708269 | etot = -16.0451184232442
+660000  ekin = 2.69464750718905 |  erot = 1.98877163007961 | epot = -22.0868371976707 | etot = -17.403418060402
+661000  ekin = 2.2148438610813 |  erot = 2.52686187560576 | epot = -21.9324475602905 | etot = -17.1907418236035
+662000  ekin = 2.04483468145689 |  erot = 2.52786214958084 | epot = -21.8656118118386 | etot = -17.2929149808009
+663000  ekin = 2.25554994547888 |  erot = 2.29981193022507 | epot = -21.812115133329 | etot = -17.256753257625
+664000  ekin = 2.38378154392877 |  erot = 1.87242521142835 | epot = -21.7163692740767 | etot = -17.4601625187195
+665000  ekin = 2.64936843119576 |  erot = 2.2989986114753 | epot = -21.6597356727187 | etot = -16.7113686300476
+666000  ekin = 1.64494457505824 |  erot = 2.30638161556456 | epot = -21.5641898301393 | etot = -17.6128636395165
+667000  ekin = 1.65735220589392 |  erot = 2.82614341732318 | epot = -21.4751653585362 | etot = -16.9916697353191
+668000  ekin = 2.49844825113869 |  erot = 3.27950898400314 | epot = -21.3387145475146 | etot = -15.5607573123727
+669000  ekin = 1.61611201967415 |  erot = 2.67203522811057 | epot = -21.2655442255718 | etot = -16.9773969777871
+670000  ekin = 2.23077474650818 |  erot = 2.61363425835144 | epot = -21.2008892493679 | etot = -16.3564802445083
+671000  ekin = 2.26765830930916 |  erot = 2.16388121545907 | epot = -21.1515274648835 | etot = -16.7199879401153
+672000  ekin = 1.94916146819698 |  erot = 1.65479713709716 | epot = -21.0650678898704 | etot = -17.4611092845762
+673000  ekin = 1.92556066199439 |  erot = 2.07900172108796 | epot = -21.0394363569888 | etot = -17.0348739739065
+674000  ekin = 2.12432357869025 |  erot = 2.16781085660272 | epot = -21.0725830613714 | etot = -16.7804486260784
+675000  ekin = 2.06851819258986 |  erot = 2.48317287761026 | epot = -21.1036073609477 | etot = -16.5519162907476
+676000  ekin = 2.45484997181755 |  erot = 2.79183078710855 | epot = -21.1301283632782 | etot = -15.8834476043521
+677000  ekin = 2.20334154136532 |  erot = 2.62444584525113 | epot = -21.1495626618894 | etot = -16.321775275273
+678000  ekin = 2.1472401432145 |  erot = 2.79545747432262 | epot = -21.0405241444794 | etot = -16.0978265269423
+679000  ekin = 2.17033413623502 |  erot = 2.18513653140294 | epot = -20.9421185444833 | etot = -16.5866478768454
+680000  ekin = 2.0995303513191 |  erot = 2.68744418062154 | epot = -20.96987060062 | etot = -16.1828960686793
+681000  ekin = 2.18304447310098 |  erot = 1.84812119436561 | epot = -21.0743862151371 | etot = -17.0432205476705
+682000  ekin = 3.04278123794939 |  erot = 2.40409586716963 | epot = -21.0797568548333 | etot = -15.6328797497143
+683000  ekin = 2.86269023881706 |  erot = 2.09728443896194 | epot = -21.0991655055583 | etot = -16.1391908277793
+684000  ekin = 1.98767037715953 |  erot = 2.99591968828981 | epot = -21.1362036730577 | etot = -16.1526136076083
+685000  ekin = 1.57295457528713 |  erot = 2.03034771002018 | epot = -21.146987158564 | etot = -17.5436848732567
+686000  ekin = 2.37743960028747 |  erot = 2.54064910359146 | epot = -21.1479154694211 | etot = -16.2298267655421
+687000  ekin = 1.90905424981708 |  erot = 2.87649471802563 | epot = -21.1390488337729 | etot = -16.3534998659302
+688000  ekin = 2.6274055742777 |  erot = 2.25087525520177 | epot = -21.1259808926564 | etot = -16.2477000631769
+689000  ekin = 2.6802663035185 |  erot = 2.65264291183039 | epot = -21.2405393346747 | etot = -15.9076301193258
+690000  ekin = 2.56393304559926 |  erot = 2.48495065222978 | epot = -21.4016015121778 | etot = -16.3527178143488
+691000  ekin = 2.1927043501829 |  erot = 2.52704457861404 | epot = -21.506826556612 | etot = -16.787077627815
+692000  ekin = 2.34077396593209 |  erot = 3.24867065054243 | epot = -21.5176021816804 | etot = -15.9281575652059
+693000  ekin = 2.29029075483228 |  erot = 3.0057489559252 | epot = -21.5358866889499 | etot = -16.2398469781924
+694000  ekin = 2.65674046511192 |  erot = 2.58629868712489 | epot = -21.7490636357026 | etot = -16.5060244834658
+695000  ekin = 2.43126197328691 |  erot = 1.19706323700546 | epot = -21.9401398969726 | etot = -18.3118146866802
+696000  ekin = 1.81474808623754 |  erot = 1.46920096781106 | epot = -21.9089223337524 | etot = -18.6249732797038
+697000  ekin = 2.39476771383886 |  erot = 2.11183502257124 | epot = -21.9420332766104 | etot = -17.4354305402003
+698000  ekin = 2.35926337724266 |  erot = 1.92783320549514 | epot = -22.0277191263435 | etot = -17.7406225436058
+699000  ekin = 2.48176872675362 |  erot = 2.56000644090342 | epot = -22.0212596021869 | etot = -16.9794844345298
+700000  ekin = 2.14129959772679 |  erot = 2.29861037684922 | epot = -21.9318234409146 | etot = -17.4919134663386
+701000  ekin = 2.17049668499625 |  erot = 2.20225192400486 | epot = -21.8245513288874 | etot = -17.4518027198863
+702000  ekin = 1.5627527155292 |  erot = 2.01171151000641 | epot = -21.7865003044461 | etot = -18.2120360789105
+703000  ekin = 2.06065227779357 |  erot = 2.17329473717683 | epot = -21.8026608939335 | etot = -17.5687138789631
+704000  ekin = 2.81952809577903 |  erot = 1.94266087393333 | epot = -21.8212186788769 | etot = -17.0590297091645
+705000  ekin = 2.82050127519937 |  erot = 2.18154028834385 | epot = -21.7752102636878 | etot = -16.7731687001446
+706000  ekin = 1.98267828238497 |  erot = 2.32706466032389 | epot = -21.7893242385512 | etot = -17.4795812958423
+707000  ekin = 1.9119199256382 |  erot = 2.05897787647106 | epot = -21.8430722730707 | etot = -17.8721744709615
+708000  ekin = 2.5016490217549 |  erot = 2.18383615173375 | epot = -21.8544847432183 | etot = -17.1689995697297
+709000  ekin = 2.87304116461984 |  erot = 2.56843564623617 | epot = -21.904442472254 | etot = -16.462965661398
+710000  ekin = 2.19867234802447 |  erot = 2.26714812026436 | epot = -21.8819798989583 | etot = -17.4161594306695
+711000  ekin = 2.3389229861775 |  erot = 1.44633862250317 | epot = -21.9197827259336 | etot = -18.1345211172529
+712000  ekin = 2.57005480809076 |  erot = 2.28706559960511 | epot = -22.0346026838636 | etot = -17.1774822761678
+713000  ekin = 1.98393390580317 |  erot = 2.33525788511068 | epot = -22.1280127822608 | etot = -17.8088209913469
+714000  ekin = 2.59844561627729 |  erot = 2.10769412707773 | epot = -22.1916311346269 | etot = -17.4854913912719
+715000  ekin = 2.41851974197058 |  erot = 3.7488852557719 | epot = -22.1607861798611 | etot = -15.9933811821187
+716000  ekin = 2.8418023132582 |  erot = 2.85971600497616 | epot = -22.0686589684412 | etot = -16.3671406502068
+717000  ekin = 3.4484144493586 |  erot = 3.22605040091157 | epot = -21.9727882885698 | etot = -15.2983234382996
+718000  ekin = 3.10436184228427 |  erot = 3.94950630255782 | epot = -21.8709253031511 | etot = -14.817057158309
+719000  ekin = 2.37806574336789 |  erot = 2.95502686702168 | epot = -21.8563367317646 | etot = -16.523244121375
+720000  ekin = 2.2124258408194 |  erot = 3.13473166149202 | epot = -21.832964450767 | etot = -16.4858069484555
+721000  ekin = 1.6946894391771 |  erot = 2.23193742756367 | epot = -21.7424084526643 | etot = -17.8157815859235
+722000  ekin = 1.90287140868432 |  erot = 2.80483524098531 | epot = -21.7497487144859 | etot = -17.0420420648163
+723000  ekin = 2.36731223380046 |  erot = 2.56327951769445 | epot = -21.6831418267135 | etot = -16.7525500752186
+724000  ekin = 1.73555921199202 |  erot = 2.45238016332295 | epot = -21.6581802464112 | etot = -17.4702408710962
+725000  ekin = 2.29059437023039 |  erot = 2.94575894857246 | epot = -21.7174261464808 | etot = -16.481072827678
+726000  ekin = 1.63483147798521 |  erot = 2.30383185500799 | epot = -21.7564933587679 | etot = -17.8178300257747
+727000  ekin = 2.48240653489464 |  erot = 3.20354227059193 | epot = -21.7912108634863 | etot = -16.1052620579997
+728000  ekin = 2.22769215153326 |  erot = 2.1648907299462 | epot = -21.7890771091799 | etot = -17.3964942277004
+729000  ekin = 1.89768095869013 |  erot = 1.65721672588089 | epot = -21.828690265207 | etot = -18.273792580636
+730000  ekin = 1.81050835100381 |  erot = 2.15777747975243 | epot = -21.8264469741817 | etot = -17.8581611434255
+731000  ekin = 2.19898236908282 |  erot = 2.98408098832205 | epot = -21.78613179764 | etot = -16.6030684402352
+732000  ekin = 2.43355047343304 |  erot = 2.27170844305628 | epot = -21.6883863408736 | etot = -16.9831274243842
+733000  ekin = 3.07212273972684 |  erot = 2.56783751855608 | epot = -21.7364921079322 | etot = -16.0965318496493
+734000  ekin = 2.38307322516835 |  erot = 2.02726646964742 | epot = -21.7939757502944 | etot = -17.3836360554786
+735000  ekin = 2.14195880954704 |  erot = 1.55624807241878 | epot = -21.8426856981853 | etot = -18.1444788162195
+736000  ekin = 2.14667447582536 |  erot = 3.43698049451811 | epot = -21.9502105525335 | etot = -16.36655558219
+737000  ekin = 1.74866123585724 |  erot = 3.5826697540454 | epot = -21.968815658378 | etot = -16.6374846684753
+738000  ekin = 2.03996249374858 |  erot = 2.50844136963082 | epot = -22.0013918784186 | etot = -17.4529880150392
+739000  ekin = 1.85238190118677 |  erot = 2.20010970404146 | epot = -22.0186271684577 | etot = -17.9661355632295
+740000  ekin = 2.8386294530065 |  erot = 2.79090377324796 | epot = -22.0338814904879 | etot = -16.4043482642334
+741000  ekin = 2.46678702773208 |  erot = 2.91050038280044 | epot = -22.0853235069127 | etot = -16.7080360963801
+742000  ekin = 2.7152902937519 |  erot = 3.273956530725 | epot = -22.2140748190892 | etot = -16.2248279946123
+743000  ekin = 2.22536600879677 |  erot = 3.2117924712642 | epot = -22.3431375024118 | etot = -16.9059790223509
+744000  ekin = 2.01371736615449 |  erot = 3.7760139384218 | epot = -22.4261509869247 | etot = -16.6364196823485
+745000  ekin = 3.15730296333415 |  erot = 2.31558796250712 | epot = -22.4108926873302 | etot = -16.9380017614889
+746000  ekin = 2.9774013013854 |  erot = 2.63107362961469 | epot = -22.3694265664286 | etot = -16.7609516354285
+747000  ekin = 2.34209064832563 |  erot = 2.04683419375202 | epot = -22.3628627944521 | etot = -17.9739379523744
+748000  ekin = 2.37156256463875 |  erot = 2.40538773919509 | epot = -22.3979208424336 | etot = -17.6209705385998
+749000  ekin = 2.06136855553991 |  erot = 2.76585915349199 | epot = -22.3831536512816 | etot = -17.5559259422497
+750000  ekin = 1.64656775002689 |  erot = 2.38368935068671 | epot = -22.444703911786 | etot = -18.4144468110724
+751000  ekin = 1.78122844885826 |  erot = 2.81833836133587 | epot = -22.533438976529 | etot = -17.9338721663349
+752000  ekin = 1.34730592473948 |  erot = 1.45838401317446 | epot = -22.6090848823224 | etot = -19.8033949444084
+753000  ekin = 1.87571626319838 |  erot = 2.4535466519722 | epot = -22.5588053116254 | etot = -18.2295423964548
+754000  ekin = 1.7497031355263 |  erot = 2.74314075044427 | epot = -22.4698920344377 | etot = -17.9770481484671
+755000  ekin = 2.42081076696332 |  erot = 2.41217357398055 | epot = -22.3964223120253 | etot = -17.5634379710815
+756000  ekin = 1.85475003398 |  erot = 2.78259891044772 | epot = -22.3205962727121 | etot = -17.6832473282843
+757000  ekin = 1.97578050121357 |  erot = 2.51781218539581 | epot = -22.1263927786386 | etot = -17.6328000920292
+758000  ekin = 1.22826853890876 |  erot = 2.60763168332874 | epot = -21.9863700054334 | etot = -18.1504697831958
+759000  ekin = 2.21637457917735 |  erot = 1.43949125248239 | epot = -22.1514665432947 | etot = -18.495600711635
+760000  ekin = 2.68033406797323 |  erot = 2.41719679588396 | epot = -22.2590376675296 | etot = -17.1615068036724
+761000  ekin = 2.1753744063555 |  erot = 2.27171718649737 | epot = -22.3344047362676 | etot = -17.8873131434147
+762000  ekin = 2.18577068124737 |  erot = 1.66829735822053 | epot = -22.3621686129861 | etot = -18.5081005735182
+763000  ekin = 2.45478818575913 |  erot = 3.35299551820638 | epot = -22.4281249366375 | etot = -16.620341232672
+764000  ekin = 2.82872579097199 |  erot = 2.78775814269904 | epot = -22.4216595904294 | etot = -16.8051756567583
+765000  ekin = 1.82575545759014 |  erot = 2.7623896973924 | epot = -22.3222506299713 | etot = -17.7341054749887
+766000  ekin = 2.64667028577447 |  erot = 2.30816231818549 | epot = -22.1784504992491 | etot = -17.2236178952891
+767000  ekin = 2.5751886312018 |  erot = 2.85636091304187 | epot = -22.0829371218307 | etot = -16.651387577587
+768000  ekin = 1.86419535586237 |  erot = 2.77038508826208 | epot = -22.1032134089885 | etot = -17.4686329648641
+769000  ekin = 2.39682103653439 |  erot = 2.30725355924694 | epot = -22.1808553751715 | etot = -17.4767807793902
+770000  ekin = 2.47007838986712 |  erot = 3.23244425991329 | epot = -22.2845706013469 | etot = -16.5820479515665
+771000  ekin = 2.32978280625416 |  erot = 2.29082247939232 | epot = -22.3223780040389 | etot = -17.7017727183924
+772000  ekin = 2.26109456847871 |  erot = 3.00930315380545 | epot = -22.420252339108 | etot = -17.1498546168239
+773000  ekin = 2.23291379974972 |  erot = 1.81993150945886 | epot = -22.4876821856977 | etot = -18.4348368764892
+774000  ekin = 2.82112723374611 |  erot = 2.20399964233337 | epot = -22.478004597296 | etot = -17.4528777212165
+775000  ekin = 1.80765894464447 |  erot = 1.85918506821001 | epot = -22.4072882679054 | etot = -18.7404442550509
+776000  ekin = 1.40021367363829 |  erot = 3.15411215412014 | epot = -22.3650958887673 | etot = -17.8107700610088
+777000  ekin = 1.64184304615234 |  erot = 2.80565056199556 | epot = -22.2758630382018 | etot = -17.8283694300539
+778000  ekin = 1.48552010960747 |  erot = 2.23385655322065 | epot = -22.280627961357 | etot = -18.5612512985288
+779000  ekin = 1.8612416844269 |  erot = 1.89467011122749 | epot = -22.3098169150752 | etot = -18.5539051194208
+780000  ekin = 1.69992943470698 |  erot = 2.31253245347 | epot = -22.3678364729486 | etot = -18.3553745847716
+781000  ekin = 2.09952906112345 |  erot = 2.56012058482576 | epot = -22.4462778123775 | etot = -17.7866281664283
+782000  ekin = 2.5656681981454 |  erot = 1.9584872929859 | epot = -22.3478635193415 | etot = -17.8237080282102
+783000  ekin = 2.16529384416182 |  erot = 2.88344914114146 | epot = -22.2446053910143 | etot = -17.1958624057111
+784000  ekin = 2.82003342353258 |  erot = 2.22795791523759 | epot = -22.2211041777196 | etot = -17.1731128389495
+785000  ekin = 3.1175846654813 |  erot = 2.90935771938994 | epot = -22.2344563156641 | etot = -16.2075139307928
+786000  ekin = 2.80016717549673 |  erot = 3.42867564957491 | epot = -22.2496451559719 | etot = -16.0208023309003
+787000  ekin = 2.38498105317564 |  erot = 3.01080705704523 | epot = -22.1644901078413 | etot = -16.7687019976204
+788000  ekin = 1.98689482841944 |  erot = 2.00265266168408 | epot = -22.1102205855985 | etot = -18.120673095495
+789000  ekin = 2.4429381578802 |  erot = 2.28303571912852 | epot = -22.0438356575627 | etot = -17.317861780554
+790000  ekin = 3.54942607073523 |  erot = 2.80791853998027 | epot = -21.9672470303852 | etot = -15.6099024196697
+791000  ekin = 3.07978044254695 |  erot = 2.4184479370232 | epot = -21.9558944305006 | etot = -16.4576660509305
+792000  ekin = 3.91878473045569 |  erot = 1.9731825502165 | epot = -21.8851857762129 | etot = -15.9932184955407
+793000  ekin = 2.24379464034279 |  erot = 2.58359475602037 | epot = -21.774610681239 | etot = -16.9472212848759
+794000  ekin = 2.14799943871595 |  erot = 2.45378042225321 | epot = -21.6055963838422 | etot = -17.0038165228731
+795000  ekin = 1.62858645550717 |  erot = 2.41208539626204 | epot = -21.4428264365968 | etot = -17.4021545848276
+796000  ekin = 2.20626767900772 |  erot = 2.13905661758329 | epot = -21.3317362060421 | etot = -16.9864119094511
+797000  ekin = 1.82996184067328 |  erot = 1.99906119944911 | epot = -21.3393574083459 | etot = -17.5103343682236
+798000  ekin = 2.25667499558209 |  erot = 2.51245793531 | epot = -21.3768565865699 | etot = -16.6077236556778
+799000  ekin = 1.90911035219009 |  erot = 2.87369878279891 | epot = -21.3617435253194 | etot = -16.5789343903304
+800000  ekin = 2.1677625897713 |  erot = 2.34740172956008 | epot = -21.2761013083254 | etot = -16.7609369889941
+801000  ekin = 1.87638787205728 |  erot = 1.64434088909028 | epot = -21.119685062831 | etot = -17.5989563016834
+802000  ekin = 2.22686790237101 |  erot = 2.21112245128271 | epot = -21.0065136937552 | etot = -16.5685233401014
+803000  ekin = 2.68797844582697 |  erot = 1.9055042783616 | epot = -20.977533512373 | etot = -16.3840507881845
+804000  ekin = 2.34860603481643 |  erot = 2.89571698053518 | epot = -20.9203141084123 | etot = -15.6759910930607
+805000  ekin = 1.76197291834029 |  erot = 2.71253740465393 | epot = -20.7889998983483 | etot = -16.3144895753541
+806000  ekin = 1.7473508020381 |  erot = 2.06758975379032 | epot = -20.7361939926422 | etot = -16.9212534368137
+807000  ekin = 1.56935370454674 |  erot = 1.70438269927346 | epot = -20.7922156879383 | etot = -17.5184792841181
+808000  ekin = 2.10918656723178 |  erot = 2.39856508826456 | epot = -20.8730295437323 | etot = -16.3652778882359
+809000  ekin = 2.64218178293791 |  erot = 1.51718119689586 | epot = -20.8620425969582 | etot = -16.7026796171244
+810000  ekin = 3.0961523233869 |  erot = 2.66382304688042 | epot = -20.7945446198551 | etot = -15.0345692495878
+811000  ekin = 3.04477285154901 |  erot = 3.63336291459452 | epot = -20.8540215443024 | etot = -14.1758857781589
+812000  ekin = 2.15160716251188 |  erot = 2.79673763715996 | epot = -20.9409883926875 | etot = -15.9926435930157
+813000  ekin = 2.1868093512261 |  erot = 3.1736283575579 | epot = -21.1408022790474 | etot = -15.7803645702634
+814000  ekin = 1.7209257269681 |  erot = 2.995751260245 | epot = -21.2437075371712 | etot = -16.5270305499581
+815000  ekin = 2.15299829462668 |  erot = 2.27035656487164 | epot = -21.2458654890398 | etot = -16.8225106295415
+816000  ekin = 2.708122450654 |  erot = 1.52125307187336 | epot = -21.2616781989935 | etot = -17.0323026764662
+817000  ekin = 2.58901717437677 |  erot = 2.58536627670115 | epot = -21.3956545078514 | etot = -16.2212710567734
+818000  ekin = 2.27875756856437 |  erot = 2.24624264725757 | epot = -21.4318935062254 | etot = -16.9068932904035
+819000  ekin = 2.10656184615865 |  erot = 3.01130039050673 | epot = -21.4327594058408 | etot = -16.3148971691754
+820000  ekin = 2.45661353119087 |  erot = 2.7077529494413 | epot = -21.3798106611917 | etot = -16.2154441805595
+821000  ekin = 2.56789243532195 |  erot = 2.54922758508947 | epot = -21.3170915318809 | etot = -16.1999715114695
+822000  ekin = 3.57333066089329 |  erot = 2.21054956102185 | epot = -21.2861057645663 | etot = -15.5022255426512
+823000  ekin = 3.55383413213106 |  erot = 2.72435850620162 | epot = -21.2727846567927 | etot = -14.99459201846
+824000  ekin = 4.1160622349429 |  erot = 3.29139599112171 | epot = -21.2039659493683 | etot = -13.7965077233036
+825000  ekin = 2.91568774544338 |  erot = 3.47057612959321 | epot = -21.0618933558847 | etot = -14.6756294808481
+826000  ekin = 1.71667097443836 |  erot = 1.97830555981831 | epot = -20.8776766681461 | etot = -17.1827001338894
+827000  ekin = 1.87676981471836 |  erot = 2.56467088925009 | epot = -20.7862250182709 | etot = -16.3447843143025
+828000  ekin = 2.38071607948713 |  erot = 2.54624446499464 | epot = -20.7057379171108 | etot = -15.778777372629
+829000  ekin = 2.23087866970087 |  erot = 1.78456567522682 | epot = -20.6078136299299 | etot = -16.5923692850022
+830000  ekin = 2.54758016482261 |  erot = 2.32440405635605 | epot = -20.4881081818274 | etot = -15.6161239606488
+831000  ekin = 2.68445862644274 |  erot = 2.08263260479755 | epot = -20.3542193485845 | etot = -15.5871281173442
+832000  ekin = 2.63412360308726 |  erot = 2.01244922883234 | epot = -20.215817212176 | etot = -15.5692443802564
+833000  ekin = 2.52816532834198 |  erot = 2.59604450500368 | epot = -20.1546011863619 | etot = -15.0303913530162
+834000  ekin = 2.89178882882708 |  erot = 2.32656568068785 | epot = -20.154457994043 | etot = -14.9361034845281
+835000  ekin = 2.77377023733645 |  erot = 2.76167763911259 | epot = -20.2925945781538 | etot = -14.7571467017048
+836000  ekin = 2.5461758373878 |  erot = 2.86272526489883 | epot = -20.4572179712235 | etot = -15.0483168689368
+837000  ekin = 1.73852270651188 |  erot = 1.97943492340463 | epot = -20.5100877279363 | etot = -16.7921300980198
+838000  ekin = 1.97190789156808 |  erot = 2.79058337256635 | epot = -20.5305299708184 | etot = -15.7680387066839
+839000  ekin = 1.97773711155226 |  erot = 2.72413991034567 | epot = -20.5265807034224 | etot = -15.8247036815245
+840000  ekin = 1.7232963874871 |  erot = 2.96738113282628 | epot = -20.6321231069653 | etot = -15.9414455866519
+841000  ekin = 2.83071457484449 |  erot = 2.84941397463216 | epot = -20.7926258530586 | etot = -15.112497303582
+842000  ekin = 2.59731855411368 |  erot = 2.84178819703383 | epot = -20.8313063579289 | etot = -15.3921996067814
+843000  ekin = 2.04928376150596 |  erot = 2.6128843549826 | epot = -20.8099267672999 | etot = -16.1477586508114
+844000  ekin = 1.54583411960153 |  erot = 1.93893729147582 | epot = -20.8613105352918 | etot = -17.3765391242145
+845000  ekin = 2.313825406008 |  erot = 2.32466241883302 | epot = -20.9823282893206 | etot = -16.3438404644796
+846000  ekin = 2.08903634512998 |  erot = 2.31578856009952 | epot = -21.0646153757685 | etot = -16.659790470539
+847000  ekin = 2.4800137362118 |  erot = 2.63006614696695 | epot = -21.0262265568772 | etot = -15.9161466736984
+848000  ekin = 2.15184282735255 |  erot = 1.47311006297176 | epot = -21.0583979355086 | etot = -17.4334450451843
+849000  ekin = 2.01842760273387 |  erot = 2.48110730715332 | epot = -21.0805165806607 | etot = -16.5809816707735
+850000  ekin = 2.55741512224125 |  erot = 2.68263416508461 | epot = -21.0773082596903 | etot = -15.8372589723645
+851000  ekin = 2.18005669935449 |  erot = 2.93569398882535 | epot = -21.0924777064982 | etot = -15.9767270183184
+852000  ekin = 2.4696261459638 |  erot = 2.4702657660563 | epot = -21.121182921383 | etot = -16.1812910093629
+853000  ekin = 2.39950550338299 |  erot = 2.98750142132015 | epot = -21.0612995182632 | etot = -15.67429259356
+854000  ekin = 2.33465924490093 |  erot = 2.85274307519464 | epot = -20.968723969517 | etot = -15.7813216494214
+855000  ekin = 2.34227388182979 |  erot = 2.06894784165371 | epot = -20.9841257021182 | etot = -16.5729039786347
+856000  ekin = 2.50117711580693 |  erot = 2.74791206324422 | epot = -20.8738269143244 | etot = -15.6247377352733
+857000  ekin = 2.54090672086302 |  erot = 3.01990349760065 | epot = -20.7453092144205 | etot = -15.1844989959569
+858000  ekin = 3.06946696795817 |  erot = 2.15496603972173 | epot = -20.6851307548641 | etot = -15.4606977471842
+859000  ekin = 2.8502330341827 |  erot = 2.24419946408453 | epot = -20.6787263175177 | etot = -15.5842938192505
+860000  ekin = 2.81341243833324 |  erot = 1.5197461937082 | epot = -20.6783502445099 | etot = -16.3451916124685
+861000  ekin = 2.27419936469317 |  erot = 2.84736568193217 | epot = -20.6476685348769 | etot = -15.5261034882516
+862000  ekin = 2.99814535919906 |  erot = 1.87200304458178 | epot = -20.6714218686896 | etot = -15.8012734649088
+863000  ekin = 2.82320132781549 |  erot = 1.77959785908837 | epot = -20.7642045825074 | etot = -16.1614053956036
+864000  ekin = 2.91892607599648 |  erot = 2.64325528924267 | epot = -20.9317153856013 | etot = -15.3695340203621
+865000  ekin = 3.32989545880503 |  erot = 2.25510784979563 | epot = -21.0557741374338 | etot = -15.4707708288331
+866000  ekin = 2.85710406140164 |  erot = 3.16185395635697 | epot = -21.1425088224093 | etot = -15.1235508046507
+867000  ekin = 2.74742982523498 |  erot = 3.06773761977147 | epot = -21.134531707449 | etot = -15.3193642624426
+868000  ekin = 2.1948650568198 |  erot = 2.22458860510737 | epot = -21.0697126630058 | etot = -16.6502590010787
+869000  ekin = 2.92239964068215 |  erot = 2.50065925324415 | epot = -21.0149378764857 | etot = -15.5918789825594
+870000  ekin = 2.48931117933877 |  erot = 2.13038554226924 | epot = -20.9976655364141 | etot = -16.3779688148061
+871000  ekin = 2.19107246828585 |  erot = 2.37839051284131 | epot = -20.8765191273408 | etot = -16.3070561462136
+872000  ekin = 1.55081886521514 |  erot = 2.09762459684259 | epot = -20.8521940121747 | etot = -17.2037505501169
+873000  ekin = 1.3896067615701 |  erot = 2.27757856660909 | epot = -20.9255865429236 | etot = -17.2584012147444
+874000  ekin = 1.41282979514325 |  erot = 2.76881886831623 | epot = -21.0901483490343 | etot = -16.9084996855748
+875000  ekin = 1.18979270807644 |  erot = 2.71872907877545 | epot = -21.2270266717576 | etot = -17.3185048849058
+876000  ekin = 1.81100671707876 |  erot = 2.98963277694409 | epot = -21.2472610575188 | etot = -16.4466215634959
+877000  ekin = 2.36243541111364 |  erot = 2.03609143795483 | epot = -21.3277863705839 | etot = -16.9292595215154
+878000  ekin = 2.1245196182468 |  erot = 1.75451707226955 | epot = -21.3222506595257 | etot = -17.4432139690093
+879000  ekin = 2.2716997631568 |  erot = 2.70191568133046 | epot = -21.3119311913778 | etot = -16.3383157468906
+880000  ekin = 2.68326313012635 |  erot = 2.77340532358103 | epot = -21.3535728447366 | etot = -15.8969043910292
+881000  ekin = 2.87483307600208 |  erot = 2.33652901733377 | epot = -21.3292700652532 | etot = -16.1179079719173
+882000  ekin = 2.32758906799515 |  erot = 2.16795489269516 | epot = -21.2584233833351 | etot = -16.7628794226448
+883000  ekin = 2.35908631800798 |  erot = 1.97904048991531 | epot = -21.0655746410777 | etot = -16.7274478331544
+884000  ekin = 2.52269362644082 |  erot = 2.25025361307445 | epot = -20.9641879640375 | etot = -16.1912407245222
+885000  ekin = 2.8471189843883 |  erot = 2.26506458535077 | epot = -20.9641383727441 | etot = -15.8519548030051
+886000  ekin = 3.18322288605135 |  erot = 1.73470875511279 | epot = -21.0012427194847 | etot = -16.0833110783206
+887000  ekin = 2.68813414464725 |  erot = 2.50204216522368 | epot = -21.067976555709 | etot = -15.8778002458381
+888000  ekin = 2.15187544250473 |  erot = 2.83221089603913 | epot = -21.17639007923 | etot = -16.1923037406862
+889000  ekin = 2.16956995574787 |  erot = 2.20198656261183 | epot = -21.1017572530618 | etot = -16.7302007347021
+890000  ekin = 1.78556825977743 |  erot = 2.98410700070926 | epot = -21.186208638226 | etot = -16.4165333777393
+891000  ekin = 1.64917016933854 |  erot = 2.27750403923458 | epot = -21.3189640243096 | etot = -17.3922898157365
+892000  ekin = 1.96583947510742 |  erot = 2.36271973263346 | epot = -21.4596361006042 | etot = -17.1310768928633
+893000  ekin = 1.79314340564254 |  erot = 1.8411107489992 | epot = -21.5470179462123 | etot = -17.9127637915705
+894000  ekin = 2.81442382935654 |  erot = 2.80759818283316 | epot = -21.6538835081476 | etot = -16.0318614959579
+895000  ekin = 2.0070369904664 |  erot = 2.75374249882318 | epot = -21.7499760057857 | etot = -16.9891965164961
+896000  ekin = 1.6507008342202 |  erot = 2.56296228195539 | epot = -21.8927812332095 | etot = -17.6791181170339
+897000  ekin = 1.78139405234358 |  erot = 2.35356223356246 | epot = -22.0286409132692 | etot = -17.8936846273632
+898000  ekin = 1.85207490030026 |  erot = 2.3928555728648 | epot = -22.0495390022753 | etot = -17.8046085291102
+899000  ekin = 1.66216066819287 |  erot = 3.04222938639382 | epot = -21.9579747350567 | etot = -17.25358468047
+900000  ekin = 2.15165827067079 |  erot = 2.62356927804175 | epot = -21.9156104880732 | etot = -17.1403829393607
+901000  ekin = 2.41248642142908 |  erot = 2.69714418093217 | epot = -21.9837417963999 | etot = -16.8741111940386
+902000  ekin = 2.57545214239909 |  erot = 2.40635843208183 | epot = -21.996436412966 | etot = -17.0146258384851
+903000  ekin = 2.40335601179059 |  erot = 2.4057541752901 | epot = -22.0230111828253 | etot = -17.2139009957446
+904000  ekin = 1.99365997109403 |  erot = 3.12264199705152 | epot = -22.0954468558152 | etot = -16.9791448876697
+905000  ekin = 2.45160047861299 |  erot = 2.11889478277434 | epot = -22.0620083174753 | etot = -17.4915130560879
+906000  ekin = 2.69446662881178 |  erot = 1.66991631401456 | epot = -22.0555442490735 | etot = -17.6911613062471
+907000  ekin = 2.5734498863711 |  erot = 2.16877319112329 | epot = -22.0376984236082 | etot = -17.2954753461138
+908000  ekin = 2.9646776076989 |  erot = 2.40252252045294 | epot = -22.0191047803794 | etot = -16.6519046522276
+909000  ekin = 3.12793409264582 |  erot = 2.12009742665766 | epot = -22.0610667288554 | etot = -16.8130352095519
+910000  ekin = 2.92206025021313 |  erot = 3.50302372345592 | epot = -22.1277774480557 | etot = -15.7026934743867
+911000  ekin = 1.85381948048669 |  erot = 2.73401011795404 | epot = -22.1683975531304 | etot = -17.5805679546896
+912000  ekin = 2.64405242900445 |  erot = 1.86324838607163 | epot = -22.2002570143971 | etot = -17.692956199321
+913000  ekin = 2.46824283660223 |  erot = 2.0308633546605 | epot = -22.3203806242275 | etot = -17.8212744329647
+914000  ekin = 2.01871966356282 |  erot = 2.94283156821207 | epot = -22.3513452914152 | etot = -17.3897940596404
+915000  ekin = 2.82676643872102 |  erot = 2.11643553756712 | epot = -22.3640471312087 | etot = -17.4208451549205
+916000  ekin = 2.54227707175729 |  erot = 3.23335822897873 | epot = -22.4652663102875 | etot = -16.6896310095515
+917000  ekin = 2.31676859881433 |  erot = 2.2427200582576 | epot = -22.463585281336 | etot = -17.9040966242641
+918000  ekin = 2.08681780124233 |  erot = 2.05685815910104 | epot = -22.3748058531193 | etot = -18.231129892776
+919000  ekin = 2.60282015977208 |  erot = 2.38968293687319 | epot = -22.3822670579485 | etot = -17.3897639613032
+920000  ekin = 3.21847224306531 |  erot = 2.75010700480466 | epot = -22.4646189595793 | etot = -16.4960397117093
+921000  ekin = 2.67829101318104 |  erot = 1.98386933580364 | epot = -22.5250186592845 | etot = -17.8628583102998
+922000  ekin = 1.43283799739773 |  erot = 1.5210967069851 | epot = -22.5925015236451 | etot = -19.6385668192623
+923000  ekin = 1.69052063428542 |  erot = 1.88300391650268 | epot = -22.66377714455 | etot = -19.0902525937619
+924000  ekin = 2.14340021014736 |  erot = 1.52248843908134 | epot = -22.6402388027506 | etot = -18.9743501535219
+925000  ekin = 2.26091939109784 |  erot = 1.33050454776921 | epot = -22.5227280014394 | etot = -18.9313040625724
+926000  ekin = 2.00930540350536 |  erot = 2.07372939007629 | epot = -22.4428200376094 | etot = -18.3597852440277
+927000  ekin = 2.53289082621251 |  erot = 1.99783542507574 | epot = -22.5727269691716 | etot = -18.0420007178833
+928000  ekin = 2.57275295957812 |  erot = 2.50503787417693 | epot = -22.7397714760282 | etot = -17.6619806422732
+929000  ekin = 2.66131598383108 |  erot = 1.82871097568713 | epot = -22.7889092091996 | etot = -18.2988822496814
+930000  ekin = 2.41369096322635 |  erot = 2.00598415451171 | epot = -22.802343205586 | etot = -18.3826680878479
+931000  ekin = 3.02636364754007 |  erot = 2.115962250161 | epot = -22.7562575819635 | etot = -17.6139316842625
+932000  ekin = 2.34573343934799 |  erot = 1.88269819474441 | epot = -22.8028018252265 | etot = -18.5743701911341
+933000  ekin = 2.16951834533283 |  erot = 2.85677231086964 | epot = -22.8240172791919 | etot = -17.7977266229894
+934000  ekin = 2.17177152489559 |  erot = 2.1194660688678 | epot = -22.8652321779361 | etot = -18.5739945841727
+935000  ekin = 2.34485090948927 |  erot = 2.23417606918545 | epot = -22.85888707632 | etot = -18.2798600976452
+936000  ekin = 2.28188124919415 |  erot = 2.53015822921572 | epot = -22.9782518612072 | etot = -18.1662123827973
+937000  ekin = 2.3061925494295 |  erot = 2.82857457174385 | epot = -23.071665648819 | etot = -17.9368985276457
+938000  ekin = 2.44229226509271 |  erot = 2.00737414808353 | epot = -23.1363676072136 | etot = -18.6867011940373
+939000  ekin = 2.97744015155649 |  erot = 2.1021287084213 | epot = -23.1206613400026 | etot = -18.0410924800248
+940000  ekin = 3.74219661265262 |  erot = 2.68184060115531 | epot = -23.0494489680042 | etot = -16.6254117541962
+941000  ekin = 3.1130700754106 |  erot = 2.2870034463699 | epot = -22.9451834918749 | etot = -17.5451099700944
+942000  ekin = 3.46654816859628 |  erot = 1.87509182259239 | epot = -22.9048558084884 | etot = -17.5632158172997
+943000  ekin = 3.79224818385641 |  erot = 2.70927084823339 | epot = -22.8698482349086 | etot = -16.3683292028188
+944000  ekin = 2.65995525590795 |  erot = 2.74912726816423 | epot = -22.8317889960132 | etot = -17.422706471941
+945000  ekin = 2.54659137616624 |  erot = 2.02239421261018 | epot = -22.725938832337 | etot = -18.1569532435606
+946000  ekin = 2.46388617435412 |  erot = 1.67037983156324 | epot = -22.5545307163887 | etot = -18.4202647104713
+947000  ekin = 2.40803821488282 |  erot = 1.99424876436282 | epot = -22.4581247656853 | etot = -18.0558377864397
+948000  ekin = 3.53604042034895 |  erot = 2.57997877434838 | epot = -22.3226574127033 | etot = -16.206638218006
+949000  ekin = 2.98854271807069 |  erot = 2.434764866082 | epot = -22.1081978358246 | etot = -16.6848902516719
+950000  ekin = 1.85098760333696 |  erot = 3.0113849918017 | epot = -21.9481390655564 | etot = -17.0857664704178
+951000  ekin = 2.24140231384639 |  erot = 2.36101456496684 | epot = -21.9054305662226 | etot = -17.3030136874094
+952000  ekin = 2.1767459614223 |  erot = 1.66164476273624 | epot = -21.8857446244283 | etot = -18.0473539002697
+953000  ekin = 2.32434436644844 |  erot = 1.96780923551529 | epot = -21.864089307184 | etot = -17.5719357052203
+954000  ekin = 1.49071594272054 |  erot = 3.34931219540537 | epot = -21.7966718941878 | etot = -16.9566437560618
+955000  ekin = 1.88457697665867 |  erot = 2.69006961792184 | epot = -21.7221575712775 | etot = -17.147510976697
+956000  ekin = 1.69307087749046 |  erot = 2.16469646035311 | epot = -21.6721199805376 | etot = -17.814352642694
+957000  ekin = 1.73487330688787 |  erot = 1.64307450157792 | epot = -21.6559256952543 | etot = -18.2779778867885
+958000  ekin = 1.60385894866933 |  erot = 2.19168737006627 | epot = -21.6476897105175 | etot = -17.8521433917819
+959000  ekin = 2.59262245343361 |  erot = 2.48219361032086 | epot = -21.6596277279706 | etot = -16.5848116642161
+960000  ekin = 2.55386671368679 |  erot = 2.05771846301768 | epot = -21.6626200672138 | etot = -17.0510348905093
+961000  ekin = 2.27765806186204 |  erot = 2.17958354193562 | epot = -21.6544957188758 | etot = -17.1972541150782
+962000  ekin = 1.66004639932187 |  erot = 3.51004740828816 | epot = -21.6650529510449 | etot = -16.4949591434349
+963000  ekin = 1.98935936955203 |  erot = 1.50490949194663 | epot = -21.6088711497269 | etot = -18.1146022882282
+964000  ekin = 2.17983717879189 |  erot = 2.29031074234418 | epot = -21.5586262428098 | etot = -17.0884783216737
+965000  ekin = 2.10787439045543 |  erot = 2.3221077885109 | epot = -21.5497920382512 | etot = -17.1198098592849
+966000  ekin = 3.1408040905672 |  erot = 3.41823133718854 | epot = -21.5836404263088 | etot = -15.024604998553
+967000  ekin = 3.0568623124503 |  erot = 2.1733206632131 | epot = -21.5260931467358 | etot = -16.2959101710724
+968000  ekin = 2.05064192877792 |  erot = 2.14124924922397 | epot = -21.4479972163209 | etot = -17.256106038319
+969000  ekin = 2.21517858837652 |  erot = 2.21735686304378 | epot = -21.3822587820383 | etot = -16.949723330618
+970000  ekin = 2.44665062708039 |  erot = 2.63919176763313 | epot = -21.3192840477868 | etot = -16.2334416530733
+971000  ekin = 2.47241679333997 |  erot = 2.68621090896417 | epot = -21.3036698600044 | etot = -16.1450421577003
+972000  ekin = 3.18976408247808 |  erot = 2.45901954667695 | epot = -21.2523934460448 | etot = -15.6036098168898
+973000  ekin = 3.35475115149161 |  erot = 2.61012752320778 | epot = -21.183068859057 | etot = -15.2181901843576
+974000  ekin = 2.71127807449815 |  erot = 2.12974355852032 | epot = -21.0816906098712 | etot = -16.2406689768528
+975000  ekin = 1.81295894463494 |  erot = 2.0759564976921 | epot = -20.9964165264669 | etot = -17.1075010841398
+976000  ekin = 2.37619926790761 |  erot = 1.37981441384236 | epot = -20.8930101654836 | etot = -17.1369964837336
+977000  ekin = 2.85555210767404 |  erot = 3.03619369635208 | epot = -21.0095574945917 | etot = -15.1178116905656
+978000  ekin = 3.13849116757388 |  erot = 3.01118356119965 | epot = -21.0732326779663 | etot = -14.9235579491928
+979000  ekin = 3.64170438280054 |  erot = 2.4612126795782 | epot = -20.9593695826044 | etot = -14.8564525202257
+980000  ekin = 3.43680535726821 |  erot = 3.27333588575053 | epot = -20.9004670674903 | etot = -14.1903258244715
+981000  ekin = 2.95806185202903 |  erot = 2.46811293942083 | epot = -20.9868038459701 | etot = -15.5606290545202
+982000  ekin = 2.05823037945997 |  erot = 2.23573651589999 | epot = -21.0420814071854 | etot = -16.7481145118254
+983000  ekin = 2.5553610304344 |  erot = 1.97272050888114 | epot = -21.0434200461188 | etot = -16.5153385068032
+984000  ekin = 2.32140326985734 |  erot = 2.58284655378618 | epot = -21.0826601835729 | etot = -16.1784103599294
+985000  ekin = 2.30327577152247 |  erot = 3.01569210622987 | epot = -21.1731422974947 | etot = -15.8541744197424
+986000  ekin = 2.0247579133688 |  erot = 2.17885674714069 | epot = -21.2745593334952 | etot = -17.0709446729857
+987000  ekin = 2.38610984160001 |  erot = 1.60437579739602 | epot = -21.2569575649582 | etot = -17.2664719259622
+988000  ekin = 2.73926231299059 |  erot = 2.71146350841208 | epot = -21.1552791211025 | etot = -15.7045532996999
+989000  ekin = 2.26697151561908 |  erot = 2.87750604798637 | epot = -21.0937789068058 | etot = -15.9493013432004
+990000  ekin = 2.20943106152859 |  erot = 2.59684886899357 | epot = -21.0203331776818 | etot = -16.2140532471596
+991000  ekin = 2.18249266283082 |  erot = 2.54649657411172 | epot = -20.9130337682104 | etot = -16.1840445312679
+992000  ekin = 1.6979885228163 |  erot = 2.49592807829765 | epot = -20.97584958751 | etot = -16.781932986396
+993000  ekin = 1.37413745875443 |  erot = 1.97736806672932 | epot = -21.0653195519547 | etot = -17.713814026471
+994000  ekin = 1.46489942286098 |  erot = 2.9578292103502 | epot = -21.126186746174 | etot = -16.7034581129629
+995000  ekin = 2.313206084368 |  erot = 1.68064795849453 | epot = -21.1907262676309 | etot = -17.1968722247684
+996000  ekin = 2.91635623044139 |  erot = 2.86817278212845 | epot = -21.1749728841882 | etot = -15.3904438716184
+997000  ekin = 3.14117227050211 |  erot = 2.13892951607983 | epot = -21.1714996184258 | etot = -15.8913978318439
+998000  ekin = 2.24297046385175 |  erot = 3.02327291553881 | epot = -21.1032039558864 | etot = -15.8369605764958
+999000  ekin = 2.61553981530106 |  erot = 1.7387289184571 | epot = -21.0217257279766 | etot = -16.6674569942185
+1000000  ekin = 2.34012577497833 |  erot = 2.86436388995813 | epot = -21.0201566044041 | etot = -15.8156669394676
+ 1000000   0.10400559   -1.3746133  0.060853481   -1.1675019 0.00013752759 
+Loop time of 44.9291 on 4 procs for 1000000 steps with 16 atoms
+
+Performance: 19230.287 tau/day, 22257.276 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    | 0.75183    | 16.839     | 31.47      | 339.4 | 37.48
+Bond    | 0.10416    | 0.48181    | 0.82289    |  46.2 |  1.07
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 3.0032     | 3.0414     | 3.0759     |   1.7 |  6.77
+Output  | 1.6e-05    | 2.2e-05    | 2.4e-05    |   0.0 |  0.00
+Modify  | 0.25426    | 2.929      | 5.4956     | 134.9 |  6.52
+Other   |            | 21.64      |            |       | 48.16
+
+Nlocal:    4 ave 8 max 0 min
+Histogram: 1 1 0 0 0 0 0 0 1 1
+Nghost:    11 ave 14 max 8 min
+Histogram: 1 1 0 0 0 0 0 0 1 1
+Neighs:    46 ave 89 max 0 min
+Histogram: 1 1 0 0 0 0 0 0 0 2
+
+Total # of neighbors = 184
+Ave neighs/atom = 11.5
+Ave special neighs/atom = 3.75
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:44
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.1 b/examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.1
new file mode 100644
index 0000000000..8f70e9ec96
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.1
@@ -0,0 +1,1172 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000145 secs
+  read_data CPU = 0.001965 secs
+
+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
+
+# 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
+
+#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 = 2.6274
+  ghost atom cutoff = 2.6274
+  binsize = 1.3137, 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
+Per MPI rank memory allocation (min/avg/max) = 3.024 | 3.024 | 3.024 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
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+249000  ekin = 0.19270275205643 |  erot = 0.369429135338942 | epot = -15.1870356295232 | etot = -14.6249037421279
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+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
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+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
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+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
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+292000  ekin = 0.177952173600894 |  erot = 0.345613807734655 | epot = -15.1484697233998 | etot = -14.6249037420642
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+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
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+308000  ekin = 0.400159443093576 |  erot = 0.533493670193517 | epot = -15.5585568557963 | etot = -14.6249037425092
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+322000  ekin = 0.256418665980724 |  erot = 0.632847556381818 | epot = -15.5141699646656 | etot = -14.6249037423031
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+342000  ekin = 0.359561251230654 |  erot = 0.555400700218385 | epot = -15.5398656939398 | etot = -14.6249037424907
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+415000  ekin = 0.17237708181679 |  erot = 0.612465324291743 | epot = -15.4097461483867 | etot = -14.6249037422781
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+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
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+420000  ekin = 0.123652074078926 |  erot = 0.656133267678405 | epot = -15.404689083913 | etot = -14.6249037421557
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+440000  ekin = 0.207897417438809 |  erot = 0.678304934040255 | epot = -15.5111060939441 | etot = -14.624903742465
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+494000  ekin = 0.341487883386483 |  erot = 0.279918789013753 | epot = -15.2463104147992 | etot = -14.624903742399
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+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
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+578000  ekin = 0.360700785231361 |  erot = 0.47785688313413 | epot = -15.4634614107286 | etot = -14.6249037423631
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+580000  ekin = 0.342901425190256 |  erot = 0.480981430412058 | epot = -15.4487865980916 | etot = -14.6249037424893
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+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
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+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
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+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
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+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
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+604000  ekin = 0.393886240081566 |  erot = 0.717231476889447 | epot = -15.7360214598369 | etot = -14.6249037428659
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+613000  ekin = 0.252415280668682 |  erot = 0.694851301360247 | epot = -15.5721703244136 | etot = -14.6249037423847
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+616000  ekin = 0.221078258759054 |  erot = 0.650117838828839 | epot = -15.496099840071 | etot = -14.6249037424831
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+618000  ekin = 0.198621509656023 |  erot = 0.613617132100535 | epot = -15.4371423842165 | etot = -14.6249037424599
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+630000  ekin = 0.196798066695247 |  erot = 0.411519917957055 | epot = -15.2332217267955 | etot = -14.6249037421432
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+634000  ekin = 0.249833574953511 |  erot = 0.411060882467202 | epot = -15.2857981997609 | etot = -14.6249037423402
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+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
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+650000  ekin = 0.218457489209268 |  erot = 0.253342374384922 | epot = -15.0967036055725 | etot = -14.6249037419783
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+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
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+673000  ekin = 0.450699702661522 |  erot = 0.241319095058617 | epot = -15.3169225401686 | etot = -14.6249037424485
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+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
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+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
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+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 25.9663 on 1 procs for 1000000 steps with 10 atoms
+
+Performance: 33273.840 tau/day, 38511.388 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    | 21.428     | 21.428     | 21.428     |   0.0 | 82.52
+Bond    | 0.76981    | 0.76981    | 0.76981    |   0.0 |  2.96
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 0.25709    | 0.25709    | 0.25709    |   0.0 |  0.99
+Output  | 9e-06      | 9e-06      | 9e-06      |   0.0 |  0.00
+Modify  | 3.1584     | 3.1584     | 3.1584     |   0.0 | 12.16
+Other   |            | 0.3534     |            |       |  1.36
+
+Nlocal:    10 ave 10 max 10 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Nghost:    0 ave 0 max 0 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+Neighs:    45 ave 45 max 45 min
+Histogram: 1 0 0 0 0 0 0 0 0 0
+
+Total # of neighbors = 45
+Ave neighs/atom = 4.5
+Ave special neighs/atom = 3.6
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:25
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.4 b/examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.4
new file mode 100644
index 0000000000..f110e20906
--- /dev/null
+++ b/examples/USER/cgdna/examples/oxDNA2/duplex3/log.07Aug19.duplex3.g++.4
@@ -0,0 +1,1172 @@
+LAMMPS (7 Aug 2019)
+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
+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 = 0.000188 secs
+  read_data CPU = 0.002791 secs
+
+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
+
+# 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
+
+#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 = 2.6274
+  ghost atom cutoff = 2.6274
+  binsize = 1.3137, 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
+Per MPI rank memory allocation (min/avg/max) = 7.653 | 7.835 | 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
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+247000  ekin = 0.210297920408214 |  erot = 0.371017759432552 | epot = -15.2062194220322 | etot = -14.6249037421914
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+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
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+252000  ekin = 0.178147956309189 |  erot = 0.372229589272153 | epot = -15.1752812876364 | etot = -14.624903742055
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+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
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+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
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+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
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+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
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+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
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+292000  ekin = 0.177952173600193 |  erot = 0.345613807734964 | epot = -15.1484697233995 | etot = -14.6249037420643
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+296000  ekin = 0.258174229752594 |  erot = 0.388857685536638 | epot = -15.2719356575669 | etot = -14.6249037422777
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+302000  ekin = 0.384446573101029 |  erot = 0.469364841860584 | epot = -15.478715157604 | etot = -14.6249037426423
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+304000  ekin = 0.405211709647263 |  erot = 0.492516637287232 | epot = -15.5226320896016 | etot = -14.6249037426671
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+309000  ekin = 0.391535685674106 |  erot = 0.543422788904079 | epot = -15.5598622170332 | etot = -14.624903742455
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+319000  ekin = 0.283852816310304 |  erot = 0.626369338623922 | epot = -15.5351258973303 | etot = -14.624903742396
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+322000  ekin = 0.256418665980307 |  erot = 0.632847556381831 | epot = -15.5141699646654 | etot = -14.6249037423032
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+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
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+330000  ekin = 0.275999298196813 |  erot = 0.612161709808654 | epot = -15.5130647502395 | etot = -14.624903742234
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+362000  ekin = 0.266656268947586 |  erot = 0.586437607933159 | epot = -15.4779976193564 | etot = -14.6249037424757
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+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
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+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
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+383000  ekin = 0.177749902922565 |  erot = 0.262494318474771 | epot = -15.0651479633987 | etot = -14.6249037420014
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+521000  ekin = 0.350310207444023 |  erot = 0.30906098360492 | epot = -15.2842749332187 | etot = -14.6249037421697
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+524000  ekin = 0.324955020060425 |  erot = 0.336661144000779 | epot = -15.2865199063054 | etot = -14.6249037422442
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+526000  ekin = 0.310071537936686 |  erot = 0.359150063852697 | epot = -15.2941253440357 | etot = -14.6249037422464
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+529000  ekin = 0.290839689447108 |  erot = 0.397128838352017 | epot = -15.3128722700896 | etot = -14.6249037422905
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+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
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+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
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+568000  ekin = 0.436733840917554 |  erot = 0.485743252286935 | epot = -15.5473808358579 | etot = -14.6249037426534
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+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
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+604000  ekin = 0.393886240081525 |  erot = 0.717231476889702 | epot = -15.7360214598372 | etot = -14.624903742866
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+654000  ekin = 0.259425494352017 |  erot = 0.20850030571605 | epot = -15.0928295424613 | etot = -14.6249037423932
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+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
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+665000  ekin = 0.378766116436051 |  erot = 0.153254852725981 | epot = -15.1569247114091 | etot = -14.6249037422471
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+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
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+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
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+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
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+686000  ekin = 0.333560575457532 |  erot = 0.385449795149527 | epot = -15.3439141128706 | etot = -14.6249037422635
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+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
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+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
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+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
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+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
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+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
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+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
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+756000  ekin = 0.267052130149329 |  erot = 0.324553861439878 | epot = -15.2165097335856 | etot = -14.6249037419964
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+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
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+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
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+770000  ekin = 0.23606686040605 |  erot = 0.255889903618604 | epot = -15.1168605059919 | etot = -14.6249037419673
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+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
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+790000  ekin = 0.34654788283668 |  erot = 0.339772664563971 | epot = -15.3112242897311 | etot = -14.6249037423304
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+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
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+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
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+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
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+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 20.0167 on 4 procs for 1000000 steps with 10 atoms
+
+Performance: 43164.007 tau/day, 49958.342 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    | 0.59089    | 7.5652     | 13.908     | 205.5 | 37.79
+Bond    | 0.090803   | 0.29363    | 0.47758    |  29.6 |  1.47
+Neigh   | 0          | 0          | 0          |   0.0 |  0.00
+Comm    | 1.7298     | 2.0312     | 2.2983     |  16.6 | 10.15
+Output  | 1.4e-05    | 2.075e-05  | 2.3e-05    |   0.0 |  0.00
+Modify  | 0.17638    | 0.90613    | 1.5893     |  60.1 |  4.53
+Other   |            | 9.22       |            |       | 46.06
+
+Nlocal:    2.5 ave 5 max 0 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+Nghost:    7.5 ave 10 max 5 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+Neighs:    18.5 ave 35 max 0 min
+Histogram: 1 0 1 0 0 0 0 0 1 1
+
+Total # of neighbors = 74
+Ave neighs/atom = 7.4
+Ave special neighs/atom = 3.6
+Neighbor list builds = 0
+Dangerous builds = 0
+
+#write_restart config.${number}.*
+Total wall time: 0:00:20

From 84165da4e744b94daf47f836dfab8278f59cb87f Mon Sep 17 00:00:00 2001
From: Oliver Henrich <ohenrich@users.noreply.github.com>
Date: Thu, 17 Oct 2019 19:34:04 +0100
Subject: [PATCH 09/21] Deleted old log files

---
 .../oxDNA/duplex1/log.18Jun19.duplex1.g++.1   | 1165 ----------------
 .../oxDNA/duplex1/log.18Jun19.duplex1.g++.4   | 1165 ----------------
 .../oxDNA/duplex2/log.18Jun19.duplex2.g++.1   | 1167 ----------------
 .../oxDNA/duplex2/log.18Jun19.duplex2.g++.4   | 1167 ----------------
 .../oxDNA2/duplex1/log.18Jun19.duplex1.g++.1  | 1172 ----------------
 .../oxDNA2/duplex1/log.18Jun19.duplex1.g++.4  | 1172 ----------------
 .../oxDNA2/duplex2/log.18Jun19.duplex2.g++.1  | 1173 -----------------
 .../oxDNA2/duplex2/log.18Jun19.duplex2.g++.4  | 1173 -----------------
 .../oxDNA2/duplex3/log.18Jun19.duplex3.g++.1  | 1172 ----------------
 .../oxDNA2/duplex3/log.18Jun19.duplex3.g++.4  | 1172 ----------------
 10 files changed, 11698 deletions(-)
 delete mode 100644 examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.1
 delete mode 100644 examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.4
 delete mode 100644 examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.1
 delete mode 100644 examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.4
 delete mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.1
 delete mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.4
 delete mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.1
 delete mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.4
 delete mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.1
 delete mode 100644 examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.4

diff --git a/examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.1 b/examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.1
deleted file mode 100644
index 8b1c5c3807..0000000000
--- a/examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.1
+++ /dev/null
@@ -1,1165 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 5e-05 secs
-  read_data CPU = 0.001522 secs
-
-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
-
-# 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 0.6 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 0.6 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
-
-#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 = 1.92828
-  ghost atom cutoff = 1.92828
-  binsize = 0.964142, bins = 42 42 42
-  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
-Per MPI rank memory allocation (min/avg/max) = 2.859 | 2.859 | 2.859 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 = 0.917661024683964 | epot = -15.6829066555277 | etot = -14.6424332457083
-24000  ekin = 0.116595521408284 |  erot = 0.938759014332096 | epot = -15.6977877814267 | etot = -14.6424332456863
-25000  ekin = 0.109911323474816 |  erot = 0.956471207347236 | epot = -15.7088157764882 | etot = -14.6424332456662
-26000  ekin = 0.102953426207644 |  erot = 0.970893163953198 | epot = -15.7162798358091 | etot = -14.6424332456483
-27000  ekin = 0.0958928250746637 |  erot = 0.982114250194049 | epot = -15.7204403209013 | etot = -14.6424332456326
-28000  ekin = 0.0888759410950343 |  erot = 0.990219731539835 | epot = -15.7215289182535 | etot = -14.6424332456186
-29000  ekin = 0.0820250748773376 |  erot = 0.995296041202909 | epot = -15.719754361686 | etot = -14.6424332456058
-30000  ekin = 0.0754407616839748 |  erot = 0.997437949320991 | epot = -15.7153119565981 | etot = -14.6424332455932
-31000  ekin = 0.0692054432610605 |  erot = 0.996756332762285 | epot = -15.7083950216035 | etot = -14.6424332455802
-32000  ekin = 0.0633878377978472 |  erot = 0.993385345349211 | epot = -15.699206428713 | etot = -14.6424332455659
-33000  ekin = 0.0580474070871663 |  erot = 0.987487973309961 | epot = -15.6879686259471 | etot = -14.64243324555
-34000  ekin = 0.0532383791888181 |  erot = 0.979259192921736 | epot = -15.6749308176426 | etot = -14.642433245532
-35000  ekin = 0.0490128758307997 |  erot = 0.968926197407215 | epot = -15.66037231875 | etot = -14.642433245512
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-756000  ekin = 0.173994962646486 |  erot = 0.518897676280608 | epot = -15.3353258841311 | etot = -14.642433245204
-757000  ekin = 0.173693190270073 |  erot = 0.518265706177119 | epot = -15.3343921417132 | etot = -14.642433245266
-758000  ekin = 0.175243155014324 |  erot = 0.517307659815294 | epot = -15.3349840601735 | etot = -14.6424332453439
-759000  ekin = 0.178203703092602 |  erot = 0.515231902157482 | epot = -15.3358688506779 | etot = -14.6424332454278
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-762000  ekin = 0.190149235945104 |  erot = 0.494891409026585 | epot = -15.3274738905921 | etot = -14.6424332456204
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-764000  ekin = 0.195785552426496 |  erot = 0.465087294345703 | epot = -15.3033060924053 | etot = -14.6424332456331
-765000  ekin = 0.196989678184872 |  erot = 0.445303873487263 | epot = -15.2847267972702 | etot = -14.6424332455981
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-768000  ekin = 0.194513096652813 |  erot = 0.37366293895697 | epot = -15.2106092809754 | etot = -14.6424332453656
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-772000  ekin = 0.18977434185156 |  erot = 0.286697153922422 | epot = -15.1189047407765 | etot = -14.6424332450026
-773000  ekin = 0.191286034501482 |  erot = 0.273271857838015 | epot = -15.1069911372911 | etot = -14.6424332449516
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-775000  ekin = 0.199490639679827 |  erot = 0.261194193157327 | epot = -15.1031180777734 | etot = -14.6424332449363
-776000  ekin = 0.206067477065984 |  erot = 0.26296580393673 | epot = -15.1114665259772 | etot = -14.6424332449745
-777000  ekin = 0.213875019086146 |  erot = 0.269778568413633 | epot = -15.1260868325404 | etot = -14.6424332450407
-778000  ekin = 0.222366868965164 |  erot = 0.281188790676632 | epot = -15.1459889047712 | etot = -14.6424332451294
-779000  ekin = 0.230862102268941 |  erot = 0.2965359441758 | epot = -15.1698312916782 | etot = -14.6424332452334
-780000  ekin = 0.238608567019415 |  erot = 0.314993169090579 | epot = -15.1960349814538 | etot = -14.6424332453438
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-782000  ekin = 0.248927612478521 |  erot = 0.357478674283205 | epot = -15.2488395323088 | etot = -14.642433245547
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-785000  ekin = 0.243793133450592 |  erot = 0.421566090460737 | epot = -15.3077924696064 | etot = -14.6424332456951
-786000  ekin = 0.23598950185229 |  erot = 0.440255905200772 | epot = -15.3186786527377 | etot = -14.6424332456846
-787000  ekin = 0.225617610784087 |  erot = 0.457030673426299 | epot = -15.3250815298539 | etot = -14.6424332456436
-788000  ekin = 0.213330260901152 |  erot = 0.471895861690097 | epot = -15.3276593681662 | etot = -14.642433245575
-789000  ekin = 0.19997849967651 |  erot = 0.485087183877581 | epot = -15.3274989290384 | etot = -14.6424332454844
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-791000  ekin = 0.174114766792028 |  erot = 0.508362048565589 | epot = -15.3249100606257 | etot = -14.6424332452681
-792000  ekin = 0.163702420431615 |  erot = 0.519746739177318 | epot = -15.3258824047698 | etot = -14.6424332451609
-793000  ekin = 0.156252224966357 |  erot = 0.531940822986537 | epot = -15.3306262930203 | etot = -14.6424332450674
-794000  ekin = 0.152510350035351 |  erot = 0.545660777312736 | epot = -15.3406043723442 | etot = -14.6424332449961
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-798000  ekin = 0.179709603433377 |  erot = 0.625560121844245 | epot = -15.4477029703127 | etot = -14.642433245035
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-804000  ekin = 0.2851105414574 |  erot = 0.797588259155217 | epot = -15.7251320464048 | etot = -14.6424332457922
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-806000  ekin = 0.306666387686443 |  erot = 0.839373432909784 | epot = -15.7884730665875 | etot = -14.6424332459913
-807000  ekin = 0.311506975554881 |  erot = 0.852035914442116 | epot = -15.8059761360445 | etot = -14.6424332460475
-808000  ekin = 0.31204517625202 |  erot = 0.858093398524567 | epot = -15.8125718208467 | etot = -14.6424332460701
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-810000  ekin = 0.3005272205585 |  erot = 0.848831113925777 | epot = -15.7917915804977 | etot = -14.6424332460134
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-814000  ekin = 0.23945308058907 |  erot = 0.752176980195558 | epot = -15.63406330638 | etot = -14.6424332455953
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-817000  ekin = 0.18252126107488 |  erot = 0.639675603864852 | epot = -15.4646301101504 | etot = -14.6424332452107
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-820000  ekin = 0.138078032174191 |  erot = 0.528474068971486 | epot = -15.3089853460871 | etot = -14.6424332449414
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-822000  ekin = 0.122284066133841 |  erot = 0.467617125513468 | epot = -15.2323344365177 | etot = -14.6424332448704
-823000  ekin = 0.119278020922153 |  erot = 0.442666228475553 | epot = -15.2043774942682 | etot = -14.6424332448705
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-825000  ekin = 0.122931110514093 |  erot = 0.403904342218594 | epot = -15.1692686976687 | etot = -14.6424332449361
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-828000  ekin = 0.148430331610601 |  erot = 0.368094906955077 | epot = -15.1589584837195 | etot = -14.6424332451538
-829000  ekin = 0.160453205764727 |  erot = 0.359651737503703 | epot = -15.1625381885089 | etot = -14.6424332452404
-830000  ekin = 0.173291382900529 |  erot = 0.351735589536635 | epot = -15.1674602177621 | etot = -14.642433245325
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-833000  ekin = 0.210968084885577 |  erot = 0.324658115180513 | epot = -15.1780594455764 | etot = -14.6424332455103
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-836000  ekin = 0.238363132178559 |  erot = 0.285116039954826 | epot = -15.1659124176508 | etot = -14.6424332455174
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-838000  ekin = 0.248642320238245 |  erot = 0.253003904099761 | epot = -15.144079469765 | etot = -14.642433245427
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-840000  ekin = 0.253557306828097 |  erot = 0.221424057159249 | epot = -15.1174146092912 | etot = -14.6424332453038
-841000  ekin = 0.254567562695129 |  erot = 0.20774147574213 | epot = -15.1047422836817 | etot = -14.6424332452444
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-843000  ekin = 0.25478313076125 |  erot = 0.188382921786766 | epot = -15.0855992976989 | etot = -14.6424332451509
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-846000  ekin = 0.253120504189248 |  erot = 0.187583282240197 | epot = -15.0831370315218 | etot = -14.6424332450923
-847000  ekin = 0.252671650081459 |  erot = 0.195866742639432 | epot = -15.0909716378146 | etot = -14.6424332450937
-848000  ekin = 0.252580915304066 |  erot = 0.208294222463377 | epot = -15.103308382873 | etot = -14.6424332451056
-849000  ekin = 0.253039966843089 |  erot = 0.224511555531961 | epot = -15.1199847675035 | etot = -14.6424332451285
-850000  ekin = 0.254204001794782 |  erot = 0.244010590097847 | epot = -15.1406478370558 | etot = -14.6424332451632
-851000  ekin = 0.256148339024743 |  erot = 0.266162563602639 | epot = -15.1647441478372 | etot = -14.6424332452098
-852000  ekin = 0.258829686440357 |  erot = 0.290257858698255 | epot = -15.1915207904057 | etot = -14.6424332452671
-853000  ekin = 0.262064657830147 |  erot = 0.315549558167899 | epot = -15.2200474613301 | etot = -14.642433245332
-854000  ekin = 0.265534116125842 |  erot = 0.341297947736774 | epot = -15.2492653092626 | etot = -14.6424332454
-855000  ekin = 0.268815174658127 |  erot = 0.36681300443161 | epot = -15.2780614245547 | etot = -14.642433245465
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-857000  ekin = 0.272939108069131 |  erot = 0.414849750475003 | epot = -15.3302221041064 | etot = -14.6424332455623
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-862000  ekin = 0.255758797180063 |  erot = 0.504799761302306 | epot = -15.4029918039677 | etot = -14.6424332454854
-863000  ekin = 0.248003564343451 |  erot = 0.517921532815844 | epot = -15.4083583425857 | etot = -14.6424332454264
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-876000  ekin = 0.243827877955837 |  erot = 0.684945735792129 | epot = -15.5712068590658 | etot = -14.6424332453179
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-881000  ekin = 0.302128778463176 |  erot = 0.724613422802369 | epot = -15.6691754468184 | etot = -14.6424332455529
-882000  ekin = 0.311822304069024 |  erot = 0.725201068168812 | epot = -15.6794566178103 | etot = -14.6424332455725
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-885000  ekin = 0.332330882217347 |  erot = 0.710323349665211 | epot = -15.6850874774409 | etot = -14.6424332455584
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-890000  ekin = 0.342328347583419 |  erot = 0.637256013160556 | epot = -15.6220176061914 | etot = -14.6424332454474
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-892000  ekin = 0.342214057419104 |  erot = 0.593979026501831 | epot = -15.5786263293753 | etot = -14.6424332454543
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-894000  ekin = 0.340117934122997 |  erot = 0.542587519912816 | epot = -15.525138699541 | etot = -14.6424332455052
-895000  ekin = 0.337605044786637 |  erot = 0.513616778977938 | epot = -15.4936550693051 | etot = -14.6424332455405
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-898000  ekin = 0.317936017621265 |  erot = 0.413480165458539 | epot = -15.3738494287041 | etot = -14.6424332456243
-899000  ekin = 0.305389123795979 |  erot = 0.376280077469313 | epot = -15.3241024468894 | etot = -14.6424332456241
-900000  ekin = 0.289072881395148 |  erot = 0.337830752319287 | epot = -15.2693368793143 | etot = -14.6424332455999
-901000  ekin = 0.268822686259622 |  erot = 0.298764046957452 | epot = -15.2100199787646 | etot = -14.6424332455475
-902000  ekin = 0.244791653968919 |  erot = 0.259850521118035 | epot = -15.1470754205513 | etot = -14.6424332454644
-903000  ekin = 0.217514571462472 |  erot = 0.221968047210473 | epot = -15.0819158640236 | etot = -14.6424332453507
-904000  ekin = 0.187939204411346 |  erot = 0.186059692012592 | epot = -15.0164321416341 | etot = -14.6424332452102
-905000  ekin = 0.157410847731204 |  erot = 0.153084564883822 | epot = -14.9529286576653 | etot = -14.6424332450503
-906000  ekin = 0.127599356271268 |  erot = 0.123965703545286 | epot = -14.8939983046991 | etot = -14.6424332448825
-907000  ekin = 0.100365589130667 |  erot = 0.0995389863896931 | epot = -14.8423378202422 | etot = -14.6424332447218
-908000  ekin = 0.0775759855945855 |  erot = 0.0805066337401435 | epot = -14.800515863919 | etot = -14.6424332445842
-909000  ekin = 0.0608876950034 |  erot = 0.0673982354567511 | epot = -14.7707191749454 | etot = -14.6424332444853
-910000  ekin = 0.0515382922989042 |  erot = 0.0605415547706379 | epot = -14.7545130915067 | etot = -14.6424332444371
-911000  ekin = 0.0501789452911252 |  erot = 0.0600446989620123 | epot = -14.7526568886991 | etot = -14.642433244446
-912000  ekin = 0.0567846925755769 |  erot = 0.0657906450221707 | epot = -14.7650085821085 | etot = -14.6424332445108
-913000  ekin = 0.0706603747975489 |  erot = 0.0774445361855688 | epot = -14.790538155607 | etot = -14.6424332446239
-914000  ekin = 0.0905398584143666 |  erot = 0.0944735694282315 | epot = -14.8274466726145 | etot = -14.6424332447719
-915000  ekin = 0.114756144633904 |  erot = 0.116178630204502 | epot = -14.8733680197774 | etot = -14.642433244939
-916000  ekin = 0.141447043407684 |  erot = 0.141736093135102 | epot = -14.9256163816514 | etot = -14.6424332451087
-917000  ekin = 0.168758535424836 |  erot = 0.170247440483737 | epot = -14.9814392211754 | etot = -14.6424332452668
-918000  ekin = 0.195014913443954 |  erot = 0.200793639362701 | epot = -15.0382417982093 | etot = -14.6424332454026
-919000  ekin = 0.218837422087121 |  erot = 0.232490666329554 | epot = -15.0937613339258 | etot = -14.6424332455091
-920000  ekin = 0.239206641026195 |  erot = 0.264542267085039 | epot = -15.1461821536945 | etot = -14.6424332455832
-921000  ekin = 0.25547457715008 |  erot = 0.296286050795184 | epot = -15.1941938735701 | etot = -14.6424332456248
-922000  ekin = 0.267338631216139 |  erot = 0.327229363198297 | epot = -15.2370012400506 | etot = -14.6424332456361
-923000  ekin = 0.274791412213564 |  erot = 0.357072039930916 | epot = -15.2742966977653 | etot = -14.6424332456208
-924000  ekin = 0.278059017514789 |  erot = 0.385714059426418 | epot = -15.306206322525 | etot = -14.6424332455838
-925000  ekin = 0.277537405165931 |  erot = 0.413247220089643 | epot = -15.333217870786 | etot = -14.6424332455304
-926000  ekin = 0.273733135235124 |  erot = 0.439931173656047 | epot = -15.3560975543575 | etot = -14.6424332454664
-927000  ekin = 0.267211859637652 |  erot = 0.466155363877246 | epot = -15.3758004689123 | etot = -14.6424332453974
-928000  ekin = 0.258555847531632 |  erot = 0.492389553497958 | epot = -15.3933786463587 | etot = -14.6424332453291
-929000  ekin = 0.248330567886967 |  erot = 0.519126582977394 | epot = -15.4098903961312 | etot = -14.6424332452668
-930000  ekin = 0.23705974716086 |  erot = 0.546821711627624 | epot = -15.4263147040038 | etot = -14.6424332452153
-931000  ekin = 0.225208144800234 |  erot = 0.575833282919438 | epot = -15.4434746728981 | etot = -14.6424332451784
-932000  ekin = 0.213171319360063 |  erot = 0.606369490847652 | epot = -15.4619740553666 | etot = -14.6424332451589
-933000  ekin = 0.201271722990057 |  erot = 0.638445690374705 | epot = -15.4821506585231 | etot = -14.6424332451583
-934000  ekin = 0.189760460104366 |  erot = 0.67185600669489 | epot = -15.5040497119762 | etot = -14.6424332451769
-935000  ekin = 0.178823941832753 |  erot = 0.706161996583042 | epot = -15.5274191836291 | etot = -14.6424332452133
-936000  ekin = 0.168594479109611 |  erot = 0.74069986583281 | epot = -15.5517275902074 | etot = -14.642433245265
-937000  ekin = 0.159163635629916 |  erot = 0.774606336201627 | epot = -15.5762032171597 | etot = -14.6424332453281
-938000  ekin = 0.150596971910416 |  erot = 0.806861786791798 | epot = -15.5998920041003 | etot = -14.6424332453981
-939000  ekin = 0.142948711628538 |  erot = 0.83634788352242 | epot = -15.6217298406206 | etot = -14.6424332454696
-940000  ekin = 0.136274889167971 |  erot = 0.861915676024924 | epot = -15.6406238107303 | etot = -14.6424332455374
-941000  ekin = 0.130643703196498 |  erot = 0.882459199117052 | epot = -15.6555361479098 | etot = -14.6424332455962
-942000  ekin = 0.126142088159105 |  erot = 0.896989065169274 | epot = -15.66556439897 | etot = -14.6424332456417
-943000  ekin = 0.122877886109369 |  erot = 0.904700444356692 | epot = -15.6700115761362 | etot = -14.6424332456702
-944000  ekin = 0.120977407412015 |  erot = 0.905030230235472 | epot = -15.6684408833271 | etot = -14.6424332456797
-945000  ekin = 0.120578563691314 |  erot = 0.897699054744981 | epot = -15.6607108641056 | etot = -14.6424332456693
-946000  ekin = 0.121820103594724 |  erot = 0.882735070928503 | epot = -15.646988420163 | etot = -14.6424332456398
-947000  ekin = 0.124827761130805 |  erot = 0.860477935596992 | epot = -15.6277389423211 | etot = -14.6424332455933
-948000  ekin = 0.129698334170726 |  erot = 0.831563037038998 | epot = -15.6036946167428 | etot = -14.642433245533
-949000  ekin = 0.136482857560392 |  erot = 0.796887554723542 | epot = -15.5758036577472 | etot = -14.6424332454633
-950000  ekin = 0.145170138933426 |  erot = 0.757561255989732 | epot = -15.5451646403121 | etot = -14.642433245389
-951000  ekin = 0.155672002997215 |  erot = 0.714845916095059 | epot = -15.5129511644075 | etot = -14.6424332453152
-952000  ekin = 0.167811650837965 |  erot = 0.67008783325118 | epot = -15.480332729336 | etot = -14.6424332452469
-953000  ekin = 0.181316579472455 |  erot = 0.624648095212333 | epot = -15.4483979198734 | etot = -14.6424332451886
-954000  ekin = 0.195817500701693 |  erot = 0.579835080695355 | epot = -15.4180858265408 | etot = -14.6424332451437
-955000  ekin = 0.210854606876419 |  erot = 0.536843219767442 | epot = -15.3901310717585 | etot = -14.6424332451147
-956000  ekin = 0.22589229983617 |  erot = 0.496701376789191 | epot = -15.3650269217278 | etot = -14.6424332451025
-957000  ekin = 0.240343066496498 |  erot = 0.460233438090612 | epot = -15.3430097496938 | etot = -14.6424332451067
-958000  ekin = 0.253600493836355 |  erot = 0.428032849889929 | epot = -15.3240665888515 | etot = -14.6424332451252
-959000  ekin = 0.265080433744447 |  erot = 0.400452005453988 | epot = -15.3079656843532 | etot = -14.6424332451548
-960000  ekin = 0.274268068126047 |  erot = 0.37760654944402 | epot = -15.294307862761 | etot = -14.6424332451909
-961000  ekin = 0.280767177998564 |  erot = 0.359393861243516 | epot = -15.2825942844706 | etot = -14.6424332452285
-962000  ekin = 0.284346484058158 |  erot = 0.34552419881024 | epot = -15.2723039281308 | etot = -14.6424332452624
-963000  ekin = 0.284976816084592 |  erot = 0.335562232322765 | epot = -15.2629722936953 | etot = -14.6424332452879
-964000  ekin = 0.282852494243092 |  erot = 0.328975986490651 | epot = -15.2542617260353 | etot = -14.6424332453015
-965000  ekin = 0.278391086611333 |  erot = 0.325189577593016 | epot = -15.2460139095058 | etot = -14.6424332453015
-966000  ekin = 0.272207924676324 |  erot = 0.323635640145639 | epot = -15.2382768101098 | etot = -14.6424332452879
-967000  ekin = 0.265065367868708 |  erot = 0.323803079983033 | epot = -15.2313016931144 | etot = -14.6424332452627
-968000  ekin = 0.257801293713459 |  erot = 0.325275872287221 | epot = -15.2255104112304 | etot = -14.6424332452297
-969000  ekin = 0.251245661475255 |  erot = 0.327759142573571 | epot = -15.2214380492424 | etot = -14.6424332451936
-970000  ekin = 0.246137008995617 |  erot = 0.331089781179348 | epot = -15.2196600353345 | etot = -14.6424332451595
-971000  ekin = 0.243051319619918 |  erot = 0.335230325664218 | epot = -15.220714890416 | etot = -14.6424332451318
-972000  ekin = 0.242353409643632 |  erot = 0.340246678804405 | epot = -15.2250333335622 | etot = -14.6424332451142
-973000  ekin = 0.2441763381681 |  erot = 0.346272190710886 | epot = -15.2328817739879 | etot = -14.642433245109
-974000  ekin = 0.248428661663904 |  erot = 0.353462430362299 | epot = -15.2443243371435 | etot = -14.6424332451173
-975000  ekin = 0.254824314808745 |  erot = 0.361946299431111 | epot = -15.2592038593792 | etot = -14.6424332451394
-976000  ekin = 0.26292684882563 |  erot = 0.371779749930331 | epot = -15.2771398439303 | etot = -14.6424332451743
-977000  ekin = 0.27219923533505 |  erot = 0.382908123264369 | epot = -15.29754060382 | etot = -14.6424332452206
-978000  ekin = 0.282052066854694 |  erot = 0.395142048097406 | epot = -15.3196273602282 | etot = -14.6424332452761
-979000  ekin = 0.291885751915604 |  erot = 0.408150081470976 | epot = -15.3424690787245 | etot = -14.6424332453379
-980000  ekin = 0.301125083790157 |  erot = 0.421469125221772 | epot = -15.3650274544147 | etot = -14.6424332454028
-981000  ekin = 0.309246535916217 |  erot = 0.434531423655031 | epot = -15.3862112050381 | etot = -14.6424332454669
-982000  ekin = 0.315799497488439 |  erot = 0.446704965614828 | epot = -15.4049377086292 | etot = -14.642433245526
-983000  ekin = 0.320422573217629 |  erot = 0.457342632741568 | epot = -15.4201984515353 | etot = -14.6424332455761
-984000  ekin = 0.322855465254252 |  erot = 0.465834622596749 | epot = -15.4311233334646 | etot = -14.6424332456136
-985000  ekin = 0.322946302470394 |  erot = 0.47165859097122 | epot = -15.4370381390773 | etot = -14.6424332456357
-986000  ekin = 0.320653917800696 |  erot = 0.474422556587648 | epot = -15.437509720029 | etot = -14.6424332456406
-987000  ekin = 0.31604462735714 |  erot = 0.473896755512796 | epot = -15.4323746284979 | etot = -14.642433245628
-988000  ekin = 0.309283477263999 |  erot = 0.470032116942454 | epot = -15.4217488398048 | etot = -14.6424332455984
-989000  ekin = 0.300620522164939 |  erot = 0.462964620619315 | epot = -15.406018388338 | etot = -14.6424332455537
-990000  ekin = 0.290373280687637 |  erot = 0.453006262992374 | epot = -15.3858127891766 | etot = -14.6424332454965
-991000  ekin = 0.278906915702925 |  erot = 0.440624526216757 | epot = -15.3619646873499 | etot = -14.6424332454302
-992000  ekin = 0.266613826413316 |  erot = 0.42641300688875 | epot = -15.3354600786602 | etot = -14.6424332453582
-993000  ekin = 0.253894212445666 |  erot = 0.411056197521998 | epot = -15.3073836552517 | etot = -14.6424332452841
-994000  ekin = 0.241138837000196 |  erot = 0.395291372385701 | epot = -15.2788634545969 | etot = -14.642433245211
-995000  ekin = 0.228714768908018 |  erot = 0.379870207852185 | epot = -15.2510182219023 | etot = -14.6424332451421
-996000  ekin = 0.216954417472331 |  erot = 0.365522282703969 | epot = -15.2249099452561 | etot = -14.6424332450798
-997000  ekin = 0.206147766458768 |  erot = 0.352922066134627 | epot = -15.2015030776195 | etot = -14.6424332450261
-998000  ekin = 0.196537413161314 |  erot = 0.34266049598664 | epot = -15.1816311541306 | etot = -14.6424332449827
-999000  ekin = 0.188315843917132 |  erot = 0.335221830000276 | epot = -15.1659709188677 | etot = -14.6424332449503
-1000000  ekin = 0.181624323072266 |  erot = 0.330966139643081 | epot = -15.1550237076453 | etot = -14.6424332449299
- 1000000  0.013453654   -1.5270261  0.011523695   -1.4973399 -8.4815516e-05 
-Loop time of 18.9591 on 1 procs for 1000000 steps with 10 atoms
-
-Performance: 45571.887 tau/day, 52745.239 timesteps/s
-98.5% CPU use with 1 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 15.272     | 15.272     | 15.272     |   0.0 | 80.55
-Bond    | 0.58511    | 0.58511    | 0.58511    |   0.0 |  3.09
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 0.19027    | 0.19027    | 0.19027    |   0.0 |  1.00
-Output  | 8e-06      | 8e-06      | 8e-06      |   0.0 |  0.00
-Modify  | 2.6225     | 2.6225     | 2.6225     |   0.0 | 13.83
-Other   |            | 0.2893     |            |       |  1.53
-
-Nlocal:    10 ave 10 max 10 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Nghost:    0 ave 0 max 0 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Neighs:    43 ave 43 max 43 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-
-Total # of neighbors = 43
-Ave neighs/atom = 4.3
-Ave special neighs/atom = 3.6
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:18
diff --git a/examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.4 b/examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.4
deleted file mode 100644
index 59800043d3..0000000000
--- a/examples/USER/cgdna/examples/oxDNA/duplex1/log.18Jun19.duplex1.g++.4
+++ /dev/null
@@ -1,1165 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000462 secs
-  read_data CPU = 0.004857 secs
-
-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
-
-# 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 0.6 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 0.6 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
-
-#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 = 1.92828
-  ghost atom cutoff = 1.92828
-  binsize = 0.964142, bins = 42 42 42
-  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
-Per MPI rank memory allocation (min/avg/max) = 7.341 | 7.523 | 7.705 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 = 0.18508629569211 | epot = -14.8759145965832 | etot = -14.642433245172
-8000  ekin = 0.0604909336919856 |  erot = 0.235071307523581 | epot = -14.9379954864767 | etot = -14.6424332452611
-9000  ekin = 0.0728137406439518 |  erot = 0.288273694501614 | epot = -15.003520680497 | etot = -14.6424332453514
-10000  ekin = 0.0849615563084574 |  erot = 0.343654369293588 | epot = -15.0710491710418 | etot = -14.6424332454398
-11000  ekin = 0.0965486715044103 |  erot = 0.400187932108392 | epot = -15.1391698491357 | etot = -14.6424332455229
-12000  ekin = 0.107221466282716 |  erot = 0.456896095459393 | epot = -15.2065508073401 | etot = -14.642433245598
-13000  ekin = 0.116672809719361 |  erot = 0.512877765427946 | epot = -15.27198382081 | etot = -14.6424332456627
-14000  ekin = 0.124654073730849 |  erot = 0.567333962045503 | epot = -15.3344212814915 | etot = -14.6424332457151
-15000  ekin = 0.130983939684084 |  erot = 0.619586028257146 | epot = -15.3930032136957 | etot = -14.6424332457544
-16000  ekin = 0.135553354544703 |  erot = 0.66908602849033 | epot = -15.4470726288154 | etot = -14.6424332457804
-17000  ekin = 0.138326263958104 |  erot = 0.715418858086103 | epot = -15.4961783678378 | etot = -14.6424332457936
-18000  ekin = 0.139336096663942 |  erot = 0.758296324628468 | epot = -15.5400656670878 | etot = -14.6424332457954
-19000  ekin = 0.138678360045107 |  erot = 0.797544234276629 | epot = -15.5786558401095 | etot = -14.6424332457878
-20000  ekin = 0.136500074655344 |  erot = 0.83308420441182 | epot = -15.6120175248401 | etot = -14.642433245773
-21000  ekin = 0.13298706528568 |  erot = 0.864912408453368 | epot = -15.6403327194924 | etot = -14.6424332457533
-22000  ekin = 0.128350288213599 |  erot = 0.893077649558725 | epot = -15.6638611835035 | etot = -14.6424332457311
-23000  ekin = 0.122812385135574 |  erot = 0.917661024684598 | epot = -15.6829066555285 | etot = -14.6424332457083
-24000  ekin = 0.116595521408358 |  erot = 0.938759014332585 | epot = -15.6977877814273 | etot = -14.6424332456863
-25000  ekin = 0.109911323474882 |  erot = 0.95647120734756 | epot = -15.7088157764886 | etot = -14.6424332456662
-26000  ekin = 0.102953426207684 |  erot = 0.970893163953299 | epot = -15.7162798358093 | etot = -14.6424332456483
-27000  ekin = 0.0958928250746602 |  erot = 0.982114250193902 | epot = -15.7204403209011 | etot = -14.6424332456326
-28000  ekin = 0.08887594109497 |  erot = 0.990219731539409 | epot = -15.721528918253 | etot = -14.6424332456186
-29000  ekin = 0.0820250748771992 |  erot = 0.995296041202176 | epot = -15.7197543616852 | etot = -14.6424332456058
-30000  ekin = 0.0754407616837525 |  erot = 0.997437949319921 | epot = -15.7153119565969 | etot = -14.6424332455933
-31000  ekin = 0.0692054432607511 |  erot = 0.996756332760935 | epot = -15.708395021602 | etot = -14.6424332455803
-32000  ekin = 0.0633878377974532 |  erot = 0.993385345347625 | epot = -15.6992064287111 | etot = -14.6424332455661
-33000  ekin = 0.0580474070866977 |  erot = 0.987487973308193 | epot = -15.6879686259451 | etot = -14.6424332455502
-34000  ekin = 0.0532383791882916 |  erot = 0.979259192919847 | epot = -15.6749308176403 | etot = -14.6424332455322
-35000  ekin = 0.0490128758302373 |  erot = 0.96892619740531 | epot = -15.6603723187477 | etot = -14.6424332455122
-36000  ekin = 0.0454228081405034 |  erot = 0.956745409624112 | epot = -15.6446014632554 | etot = -14.6424332454908
-37000  ekin = 0.0425203357170931 |  erot = 0.942996237999014 | epot = -15.6279498191848 | etot = -14.6424332454687
-38000  ekin = 0.0403568280944582 |  erot = 0.927971766615185 | epot = -15.6107618401563 | etot = -14.6424332454467
-39000  ekin = 0.0389804214208553 |  erot = 0.911966804108842 | epot = -15.5933804709559 | etot = -14.6424332454262
-40000  ekin = 0.0384324238853386 |  erot = 0.89526395956212 | epot = -15.5761296288558 | etot = -14.6424332454083
-41000  ekin = 0.0387429860406854 |  erot = 0.878118672837898 | epot = -15.559294904273 | etot = -14.6424332453944
-42000  ekin = 0.0399266053637397 |  erot = 0.860744395135588 | epot = -15.543104245885 | etot = -14.6424332453857
-43000  ekin = 0.041978156101278 |  erot = 0.84329936535652 | epot = -15.5277107668409 | etot = -14.6424332453831
-44000  ekin = 0.044870189409001 |  erot = 0.825876603313516 | epot = -15.5131800381094 | etot = -14.6424332453868
-45000  ekin = 0.0485521857416513 |  erot = 0.808498758186241 | epot = -15.4994841893249 | etot = -14.642433245397
-46000  ekin = 0.0529522094038552 |  erot = 0.791119212188506 | epot = -15.486504667005 | etot = -14.6424332454127
-47000  ekin = 0.0579809824244721 |  erot = 0.773630265884098 | epot = -15.4740444937409 | etot = -14.6424332454323
-48000  ekin = 0.0635377846502182 |  erot = 0.755878310838203 | epot = -15.4618493409424 | etot = -14.6424332454539
-49000  ekin = 0.0695169124467202 |  erot = 0.737684732484798 | epot = -15.4496348904071 | etot = -14.6424332454756
-50000  ekin = 0.0758129058465097 |  erot = 0.718870126220151 | epot = -15.437116277562 | etot = -14.6424332454953
-51000  ekin = 0.0823226638652294 |  erot = 0.699278599520714 | epot = -15.424034508898 | etot = -14.642433245512
-52000  ekin = 0.0889431481344998 |  erot = 0.67879880710002 | epot = -15.4101752007595 | etot = -14.642433245525
-53000  ekin = 0.0955646689265025 |  erot = 0.657379086771117 | epot = -15.3953770012321 | etot = -14.6424332455345
-54000  ekin = 0.10206147751016 |  erot = 0.635035489169276 | epot = -15.3795302122208 | etot = -14.6424332455414
-55000  ekin = 0.108282960174665 |  erot = 0.611853171347244 | epot = -15.362569377068 | etot = -14.6424332455461
-56000  ekin = 0.114049426282277 |  erot = 0.587982945924297 | epot = -15.3444656177552 | etot = -14.6424332455486
-57000  ekin = 0.119155806187163 |  erot = 0.563635255922951 | epot = -15.3252243076589 | etot = -14.6424332455488
-58000  ekin = 0.123384552305545 |  erot = 0.539073355222428 | epot = -15.3048911530734 | etot = -14.6424332455454
-59000  ekin = 0.126526300954853 |  erot = 0.514606324858911 | epot = -15.2835658713509 | etot = -14.6424332455371
-60000  ekin = 0.128404399836229 |  erot = 0.490581338840044 | epot = -15.261418984199 | etot = -14.6424332455227
-61000  ekin = 0.128898142361897 |  erot = 0.467373892400972 | epot = -15.2387052802646 | etot = -14.6424332455018
-62000  ekin = 0.127959880289726 |  erot = 0.445374820086222 | epot = -15.2157679458511 | etot = -14.6424332454752
-63000  ekin = 0.125622870624277 |  erot = 0.424973765387148 | epot = -15.1930298814554 | etot = -14.642433245444
-64000  ekin = 0.121999044842466 |  erot = 0.406539918572074 | epot = -15.1709722088251 | etot = -14.6424332454105
-65000  ekin = 0.117268056618551 |  erot = 0.390401831020312 | epot = -15.1501031330161 | etot = -14.6424332453772
-66000  ekin = 0.11166038525652 |  erot = 0.376828594078856 | epot = -15.1309222246818 | etot = -14.6424332453464
-67000  ekin = 0.105437746904482 |  erot = 0.366014539811009 | epot = -15.1138855320359 | etot = -14.6424332453204
-68000  ekin = 0.0988737375602389 |  erot = 0.358069014155077 | epot = -15.0993759970158 | etot = -14.6424332453005
-69000  ekin = 0.0922368286498126 |  erot = 0.353011948771943 | epot = -15.0876820227093 | etot = -14.6424332452876
-70000  ekin = 0.0857769015271899 |  erot = 0.350775174164931 | epot = -15.078985320974 | etot = -14.6424332452819
-71000  ekin = 0.0797156921641249 |  erot = 0.351208844245481 | epot = -15.0733577816927 | etot = -14.6424332452831
-72000  ekin = 0.0742409440407228 |  erot = 0.354092037747166 | epot = -15.0707662270784 | etot = -14.6424332452906
-73000  ekin = 0.069503749870388 |  erot = 0.359146526961232 | epot = -15.0710835221349 | etot = -14.6424332453033
-74000  ekin = 0.065618449742691 |  erot = 0.366052769878692 | epot = -15.0741044649412 | etot = -14.6424332453199
-75000  ekin = 0.0626644690394284 |  erot = 0.374467290033975 | epot = -15.0795650044124 | etot = -14.642433245339
-76000  ekin = 0.0606895535091863 |  erot = 0.384040683403432 | epot = -15.087163482272 | etot = -14.6424332453594
-77000  ekin = 0.0597139401241188 |  erot = 0.394435495892894 | epot = -15.0965826813962 | etot = -14.6424332453792
-78000  ekin = 0.0597350629875199 |  erot = 0.405343151481916 | epot = -15.107511459867 | etot = -14.6424332453975
-79000  ekin = 0.0607324264361021 |  erot = 0.4164990176427 | epot = -15.1196646894919 | etot = -14.6424332454131
-80000  ekin = 0.0626722904954161 |  erot = 0.427694630238743 | epot = -15.1328001661592 | etot = -14.6424332454251
-81000  ekin = 0.0655118235331528 |  erot = 0.438786127849131 | epot = -15.1467311968152 | etot = -14.6424332454329
-82000  ekin = 0.0692024020836604 |  erot = 0.449698113830624 | epot = -15.1613337613509 | etot = -14.6424332454366
-83000  ekin = 0.0736917936904884 |  erot = 0.460422490740831 | epot = -15.1765475298676 | etot = -14.6424332454363
-84000  ekin = 0.0789250526542207 |  erot = 0.471012272295187 | epot = -15.1923705703823 | etot = -14.6424332454329
-85000  ekin = 0.0848440878742484 |  erot = 0.481570908650517 | epot = -15.2088482419521 | etot = -14.6424332454273
-86000  ekin = 0.0913860133243867 |  erot = 0.492238169206351 | epot = -15.2260574279515 | etot = -14.6424332454207
-87000  ekin = 0.0984805441186007 |  erot = 0.503174014617495 | epot = -15.2440878041506 | etot = -14.6424332454146
-88000  ekin = 0.106046830302566 |  erot = 0.514542076496893 | epot = -15.2630221522094 | etot = -14.6424332454099
-89000  ekin = 0.113990204125935 |  erot = 0.526494309539958 | epot = -15.2829177590739 | etot = -14.642433245408
-90000  ekin = 0.122199339149549 |  erot = 0.539158097286396 | epot = -15.3037906818453 | etot = -14.6424332454094
-91000  ekin = 0.130544275968789 |  erot = 0.552626637866402 | epot = -15.3256041592497 | etot = -14.6424332454146
-92000  ekin = 0.138875666145969 |  erot = 0.566952900962838 | epot = -15.3482618125326 | etot = -14.6424332454238
-93000  ekin = 0.14702544061161 |  erot = 0.582146933738122 | epot = -15.3716056197866 | etot = -14.6424332454369
-94000  ekin = 0.154808946844654 |  erot = 0.598175891801918 | epot = -15.3954180841001 | etot = -14.6424332454535
-95000  ekin = 0.162028449598908 |  erot = 0.614965942454569 | epot = -15.4194276375267 | etot = -14.6424332454732
-96000  ekin = 0.168477779664562 |  erot = 0.632405154082769 | epot = -15.4433161792427 | etot = -14.6424332454953
-97000  ekin = 0.173947863023519 |  erot = 0.650346631629065 | epot = -15.466727740172 | etot = -14.6424332455194
-98000  ekin = 0.178232875001165 |  erot = 0.668611435746703 | epot = -15.4892775562927 | etot = -14.6424332455449
-99000  ekin = 0.181136831923469 |  erot = 0.686991165056991 | epot = -15.5105612425515 | etot = -14.6424332455711
-100000  ekin = 0.182480533640974 |  erot = 0.705250413408614 | epot = -15.530164192647 | etot = -14.6424332455974
-101000  ekin = 0.182108871449632 |  erot = 0.723129571004103 | epot = -15.5476716880769 | etot = -14.6424332456232
-102000  ekin = 0.179898581168339 |  erot = 0.740348571091352 | epot = -15.5626803979071 | etot = -14.6424332456474
-103000  ekin = 0.17576651760657 |  erot = 0.756612167827034 | epot = -15.5748119311029 | etot = -14.6424332456693
-104000  ekin = 0.169678431534372 |  erot = 0.771617166852996 | epot = -15.5837288440748 | etot = -14.6424332456874
-105000  ekin = 0.161658036036246 |  erot = 0.785061742963598 | epot = -15.5891530247003 | etot = -14.6424332457005
-106000  ekin = 0.151795867650305 |  erot = 0.796656613426427 | epot = -15.5908857267839 | etot = -14.6424332457071
-107000  ekin = 0.140257112952978 |  erot = 0.806137449199291 | epot = -15.5888278078584 | etot = -14.6424332457061
-108000  ekin = 0.127287240201874 |  erot = 0.813277564483374 | epot = -15.5829980503819 | etot = -14.6424332456966
-109000  ekin = 0.113214025491877 |  erot = 0.817899691736857 | epot = -15.5735469629067 | etot = -14.642433245678
-110000  ekin = 0.0984444823817425 |  erot = 0.819885578056442 | epot = -15.5607633060887 | etot = -14.6424332456505
-111000  ekin = 0.0834553769378644 |  erot = 0.819182262548316 | epot = -15.5450708851012 | etot = -14.6424332456151
-112000  ekin = 0.0687764915886182 |  erot = 0.815804215096852 | epot = -15.5270139522588 | etot = -14.6424332455734
-113000  ekin = 0.0549665904044371 |  erot = 0.809830999846678 | epot = -15.507230835779 | etot = -14.6424332455279
-114000  ekin = 0.04258305831357 |  erot = 0.801400700352889 | epot = -15.486417004148 | etot = -14.6424332454815
-115000  ekin = 0.0321472802146729 |  erot = 0.790699910050576 | epot = -15.4652804357026 | etot = -14.6424332454374
-116000  ekin = 0.0241087780358441 |  erot = 0.77795154667576 | epot = -15.4444935701102 | etot = -14.6424332453986
-117000  ekin = 0.0188117102739907 |  erot = 0.763402004774545 | epot = -15.4246469604164 | etot = -14.6424332453678
-118000  ekin = 0.0164673894168237 |  erot = 0.747309167856841 | epot = -15.4062098026205 | etot = -14.6424332453468
-119000  ekin = 0.0171359296540399 |  erot = 0.72993256457469 | epot = -15.3895017395652 | etot = -14.6424332453364
-120000  ekin = 0.0207190822436548 |  erot = 0.711526526248979 | epot = -15.3746788538292 | etot = -14.6424332453366
-121000  ekin = 0.0269649552324778 |  erot = 0.692336677371657 | epot = -15.3617348779503 | etot = -14.6424332453462
-122000  ekin = 0.0354839220302051 |  erot = 0.672599570211917 | epot = -15.3505167376055 | etot = -14.6424332453634
-123000  ekin = 0.0457738626455503 |  erot = 0.652544850162978 | epot = -15.3407519581944 | etot = -14.6424332453859
-124000  ekin = 0.0572521324300892 |  erot = 0.632399068063538 | epot = -15.3320844459047 | etot = -14.6424332454111
-125000  ekin = 0.0692913736007693 |  erot = 0.612390156183436 | epot = -15.3241147752204 | etot = -14.6424332454362
-126000  ekin = 0.0812564128179015 |  erot = 0.592751635107163 | epot = -15.3164412933838 | etot = -14.6424332454587
-127000  ekin = 0.0925398817831139 |  erot = 0.573725774405781 | epot = -15.3086989016655 | etot = -14.6424332454766
-128000  ekin = 0.102594692019405 |  erot = 0.555565138942023 | epot = -15.3005930764495 | etot = -14.6424332454881
-129000  ekin = 0.110961953874467 |  erot = 0.538532171476875 | epot = -15.2919273708433 | etot = -14.6424332454919
-130000  ekin = 0.117293279473242 |  erot = 0.52289666445288 | epot = -15.2826231894136 | etot = -14.6424332454874
-131000  ekin = 0.121366644775211 |  erot = 0.508931150171171 | epot = -15.272731040421 | etot = -14.6424332454746
-132000  ekin = 0.123095155540088 |  erot = 0.496904390905875 | epot = -15.2624327918998 | etot = -14.6424332454539
-133000  ekin = 0.122528239671731 |  erot = 0.487073282997897 | epot = -15.2520347680959 | etot = -14.6424332454262
-134000  ekin = 0.119845042601891 |  erot = 0.47967360117123 | epot = -15.2419518891664 | etot = -14.6424332453933
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-853000  ekin = 0.262064657828587 |  erot = 0.315549558167727 | epot = -15.2200474613225 | etot = -14.6424332453262
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-855000  ekin = 0.26881517465358 |  erot = 0.366813004430893 | epot = -15.2780614245436 | etot = -14.6424332454591
-856000  ekin = 0.271435486954603 |  erot = 0.391492007901445 | epot = -15.305360740371 | etot = -14.642433245515
-857000  ekin = 0.272939108063008 |  erot = 0.414849750473414 | epot = -15.3302221040928 | etot = -14.6424332455564
-858000  ekin = 0.272951155039785 |  erot = 0.436539390688027 | epot = -15.3519237913071 | etot = -14.6424332455793
-859000  ekin = 0.271229880676472 |  erot = 0.456362750059341 | epot = -15.3700258763176 | etot = -14.6424332455817
-860000  ekin = 0.267698633833911 |  erot = 0.474269718460682 | epot = -15.3844015978589 | etot = -14.6424332455643
-861000  ekin = 0.262455001752904 |  erot = 0.490347316007815 | epot = -15.3952355632896 | etot = -14.6424332455289
-862000  ekin = 0.255758797176706 |  erot = 0.504799761298941 | epot = -15.402991803955 | etot = -14.6424332454794
-863000  ekin = 0.248003564341433 |  erot = 0.517921532812514 | epot = -15.4083583425743 | etot = -14.6424332454204
-864000  ekin = 0.23967765558487 |  erot = 0.5300658235034 | epot = -15.4121767244453 | etot = -14.642433245357
-865000  ekin = 0.23132088944539 |  erot = 0.541610953534341 | epot = -15.4153650882739 | etot = -14.6424332452941
-866000  ekin = 0.223481813676297 |  erot = 0.552927233331988 | epot = -15.4188422922445 | etot = -14.6424332452362
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-870000  ekin = 0.206606153000455 |  erot = 0.601459626890416 | epot = -15.4504990250046 | etot = -14.6424332451137
-871000  ekin = 0.207568796758621 |  erot = 0.615058451105655 | epot = -15.4650604929822 | etot = -14.6424332451179
-872000  ekin = 0.210843969902065 |  erot = 0.62915187575959 | epot = -15.4824290907976 | etot = -14.642433245136
-873000  ekin = 0.216347593119461 |  erot = 0.643519970833663 | epot = -15.5023008091198 | etot = -14.6424332451666
-874000  ekin = 0.223886305143511 |  erot = 0.65785990973072 | epot = -15.5241794600822 | etot = -14.6424332452079
-875000  ekin = 0.233169807553207 |  erot = 0.67180466221101 | epot = -15.5474077150216 | etot = -14.6424332452574
-876000  ekin = 0.243827877963662 |  erot = 0.684945735800061 | epot = -15.5712068590757 | etot = -14.642433245312
-877000  ekin = 0.255431632545988 |  erot = 0.696858567354671 | epot = -15.5947234452691 | etot = -14.6424332453684
-878000  ekin = 0.267518408513276 |  erot = 0.707128927388885 | epot = -15.6170805813255 | etot = -14.6424332454234
-879000  ekin = 0.279619300259048 |  erot = 0.71537849572129 | epot = -15.6374310414537 | etot = -14.6424332454734
-880000  ekin = 0.291287955020511 |  erot = 0.721287639199272 | epot = -15.6550088397353 | etot = -14.6424332455155
-881000  ekin = 0.30212877846463 |  erot = 0.724613422810775 | epot = -15.6691754468226 | etot = -14.6424332455472
-882000  ekin = 0.311822304068824 |  erot = 0.725201068176889 | epot = -15.6794566178125 | etot = -14.6424332455668
-883000  ekin = 0.320145243787706 |  erot = 0.722987481104172 | epot = -15.6855659704655 | etot = -14.6424332455736
-884000  ekin = 0.326982762198909 |  erot = 0.717996120159159 | epot = -15.6874121279265 | etot = -14.6424332455684
-885000  ekin = 0.332330882212481 |  erot = 0.710323349672059 | epot = -15.6850874774374 | etot = -14.6424332455528
-886000  ekin = 0.33628767333099 |  erot = 0.700117442976239 | epot = -15.678838361837 | etot = -14.6424332455298
-887000  ekin = 0.339032964151614 |  erot = 0.687552454437006 | epot = -15.6690186640916 | etot = -14.642433245503
-888000  ekin = 0.340797654544347 |  erot = 0.67280010094551 | epot = -15.6560310009666 | etot = -14.6424332454768
-889000  ekin = 0.341825106158976 |  erot = 0.656003407102339 | epot = -15.6402617587166 | etot = -14.6424332454552
-890000  ekin = 0.342328347575176 |  erot = 0.63725601316603 | epot = -15.6220176061831 | etot = -14.6424332454419
-891000  ekin = 0.342447730492056 |  erot = 0.616590618570594 | epot = -15.601471594502 | etot = -14.6424332454393
-892000  ekin = 0.342214057411724 |  erot = 0.593979026506924 | epot = -15.5786263293674 | etot = -14.6424332454488
-893000  ekin = 0.341522004910123 |  erot = 0.569344767734232 | epot = -15.5533000181139 | etot = -14.6424332454695
-894000  ekin = 0.340117934117577 |  erot = 0.542587519917294 | epot = -15.5251386995343 | etot = -14.6424332454994
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-896000  ekin = 0.333467462872322 |  erot = 0.482390775175684 | epot = -15.4582914836184 | etot = -14.6424332455704
-897000  ekin = 0.327113397522066 |  erot = 0.448955709004578 | epot = -15.418502352127 | etot = -14.6424332456003
-898000  ekin = 0.317936017621476 |  erot = 0.413480165460528 | epot = -15.3738494287003 | etot = -14.6424332456182
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-902000  ekin = 0.244791653973738 |  erot = 0.259850521116738 | epot = -15.1470754205486 | etot = -14.6424332454581
-903000  ekin = 0.217514571467803 |  erot = 0.221968047208507 | epot = -15.0819158640206 | etot = -14.6424332453443
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-906000  ekin = 0.127599356275899 |  erot = 0.123965703542346 | epot = -14.8939983046941 | etot = -14.6424332448759
-907000  ekin = 0.100365589134322 |  erot = 0.0995389863868474 | epot = -14.8423378202363 | etot = -14.6424332447151
-908000  ekin = 0.077575985596966 |  erot = 0.0805066337376087 | epot = -14.800515863912 | etot = -14.6424332445775
-909000  ekin = 0.0608876950043041 |  erot = 0.0673982354547353 | epot = -14.7707191749375 | etot = -14.6424332444784
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-911000  ekin = 0.0501789452889699 |  erot = 0.0600446989615507 | epot = -14.7526568886895 | etot = -14.642433244439
-912000  ekin = 0.0567846925720978 |  erot = 0.065790645022677 | epot = -14.7650085820984 | etot = -14.6424332445036
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-915000  ekin = 0.114756144628398 |  erot = 0.116178630208142 | epot = -14.8733680197681 | etot = -14.6424332449316
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-920000  ekin = 0.239206641023718 |  erot = 0.264542267092076 | epot = -15.1461821536915 | etot = -14.6424332455757
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-925000  ekin = 0.277537405168372 |  erot = 0.41324722009601 | epot = -15.3332178707874 | etot = -14.642433245523
-926000  ekin = 0.273733135238329 |  erot = 0.439931173662005 | epot = -15.3560975543592 | etot = -14.6424332454589
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-930000  ekin = 0.237059747166165 |  erot = 0.546821711632301 | epot = -15.4263147040064 | etot = -14.6424332452079
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-932000  ekin = 0.213171319365827 |  erot = 0.606369490852174 | epot = -15.4619740553694 | etot = -14.6424332451514
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-937000  ekin = 0.159163635634861 |  erot = 0.774606336206385 | epot = -15.5762032171619 | etot = -14.6424332453207
-938000  ekin = 0.150596971914849 |  erot = 0.806861786796458 | epot = -15.5998920041019 | etot = -14.6424332453906
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-940000  ekin = 0.136274889171099 |  erot = 0.861915676028948 | epot = -15.64062381073 | etot = -14.6424332455299
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-943000  ekin = 0.122877886110172 |  erot = 0.904700444358873 | epot = -15.6700115761318 | etot = -14.6424332456628
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-946000  ekin = 0.12182010359348 |  erot = 0.882735070928404 | epot = -15.6469884201544 | etot = -14.6424332456325
-947000  ekin = 0.124827761129084 |  erot = 0.86047793559626 | epot = -15.6277389423113 | etot = -14.642433245586
-948000  ekin = 0.129698334168674 |  erot = 0.831563037037796 | epot = -15.6036946167321 | etot = -14.6424332455257
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-950000  ekin = 0.14517013893121 |  erot = 0.757561255988166 | epot = -15.545164640301 | etot = -14.6424332453816
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-952000  ekin = 0.167811650836291 |  erot = 0.670087833250127 | epot = -15.480332729326 | etot = -14.6424332452396
-953000  ekin = 0.181316579471303 |  erot = 0.624648095211848 | epot = -15.4483979198644 | etot = -14.6424332451812
-954000  ekin = 0.195817500701208 |  erot = 0.579835080695611 | epot = -15.4180858265331 | etot = -14.6424332451363
-955000  ekin = 0.21085460687672 |  erot = 0.536843219768569 | epot = -15.3901310717525 | etot = -14.6424332451072
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-957000  ekin = 0.240343066498587 |  erot = 0.460233438093626 | epot = -15.3430097496914 | etot = -14.6424332450992
-958000  ekin = 0.253600493839353 |  erot = 0.428032849893872 | epot = -15.324066588851 | etot = -14.6424332451178
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-960000  ekin = 0.274268068130606 |  erot = 0.377606549449485 | epot = -15.2943078627635 | etot = -14.6424332451834
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-963000  ekin = 0.28497681608998 |  erot = 0.33556223232907 | epot = -15.2629722936994 | etot = -14.6424332452804
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-967000  ekin = 0.265065367870864 |  erot = 0.323803079987444 | epot = -15.2313016931133 | etot = -14.642433245255
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-970000  ekin = 0.246137008993216 |  erot = 0.331089781181249 | epot = -15.2196600353262 | etot = -14.6424332451517
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-980000  ekin = 0.301125083789936 |  erot = 0.421469125223117 | epot = -15.365027454408 | etot = -14.642433245395
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-988000  ekin = 0.309283477268975 |  erot = 0.470032116945433 | epot = -15.421748839805 | etot = -14.6424332455906
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-990000  ekin = 0.290373280691476 |  erot = 0.45300626299518 | epot = -15.3858127891754 | etot = -14.6424332454887
-991000  ekin = 0.278906915705959 |  erot = 0.440624526219509 | epot = -15.3619646873478 | etot = -14.6424332454224
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-993000  ekin = 0.253894212446822 |  erot = 0.411056197524864 | epot = -15.3073836552479 | etot = -14.6424332452762
-994000  ekin = 0.241138837000364 |  erot = 0.395291372388786 | epot = -15.2788634545923 | etot = -14.6424332452032
-995000  ekin = 0.228714768907212 |  erot = 0.379870207855612 | epot = -15.2510182218971 | etot = -14.6424332451343
-996000  ekin = 0.2169544174706 |  erot = 0.365522282707863 | epot = -15.2249099452504 | etot = -14.642433245072
-997000  ekin = 0.206147766456188 |  erot = 0.352922066139109 | epot = -15.2015030776136 | etot = -14.6424332450183
-998000  ekin = 0.196537413157987 |  erot = 0.342660495991805 | epot = -15.1816311541246 | etot = -14.6424332449748
-999000  ekin = 0.188315843913178 |  erot = 0.335221830006205 | epot = -15.1659709188618 | etot = -14.6424332449424
-1000000  ekin = 0.181624323067817 |  erot = 0.330966139649826 | epot = -15.1550237076397 | etot = -14.642433244922
- 1000000  0.013453654   -1.5270261  0.011523695   -1.4973399 -8.4815516e-05 
-Loop time of 29.1595 on 4 procs for 1000000 steps with 10 atoms
-
-Performance: 29630.171 tau/day, 34294.179 timesteps/s
-96.5% CPU use with 4 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 0.8549     | 9.7585     | 17.369     | 226.0 | 33.47
-Bond    | 0.12382    | 0.38401    | 0.60938    |  32.9 |  1.32
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 2.9104     | 3.7862     | 4.6404     |  31.7 | 12.98
-Output  | 2e-05      | 2.775e-05  | 3.1e-05    |   0.0 |  0.00
-Modify  | 0.27411    | 1.1629     | 1.994      |  64.7 |  3.99
-Other   |            | 14.07      |            |       | 48.24
-
-Nlocal:    2.5 ave 5 max 0 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-Nghost:    7.5 ave 10 max 5 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-Neighs:    17.5 ave 33 max 0 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-
-Total # of neighbors = 70
-Ave neighs/atom = 7
-Ave special neighs/atom = 3.6
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:29
diff --git a/examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.1 b/examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.1
deleted file mode 100644
index 29eaec2dab..0000000000
--- a/examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.1
+++ /dev/null
@@ -1,1167 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000135 secs
-  read_data CPU = 0.002118 secs
-
-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
-
-# 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 0.6 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 0.6 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
-
-#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 = 1.92828
-  ghost atom cutoff = 1.92828
-  binsize = 0.964142, bins = 42 42 42
-  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
-Per MPI rank memory allocation (min/avg/max) = 2.861 | 2.861 | 2.861 Mbytes
-Step Temp E_pair E_mol TotEng Press 
-       0            0   -1.5402493 0.0070469125   -1.5332024 6.0760034e-06 
-1000  ekin = 1.54234964773389 |  erot = 1.71563526070267 | epot = -24.5477045187653 | etot = -21.2897196103287
-2000  ekin = 1.85988866919215 |  erot = 1.9424302796508 | epot = -24.4843044999595 | etot = -20.6819855511165
-3000  ekin = 2.68354339452998 |  erot = 2.14216528317607 | epot = -24.4019350693561 | etot = -19.57622639165
-4000  ekin = 2.04461800191989 |  erot = 1.49015219763161 | epot = -24.2959428773347 | etot = -20.7611726777832
-5000  ekin = 1.76794859210155 |  erot = 2.54289684465819 | epot = -24.2337587736863 | etot = -19.9229133369266
-6000  ekin = 3.1106424806079 |  erot = 2.04409805200893 | epot = -24.1585729744133 | etot = -19.0038324417964
-7000  ekin = 3.21360097519306 |  erot = 2.71941303605722 | epot = -24.0566262531609 | etot = -18.1236122419107
-8000  ekin = 2.82489935901743 |  erot = 2.66790555575695 | epot = -24.0194805097633 | etot = -18.526675594989
-9000  ekin = 2.69381302856378 |  erot = 2.59107820129446 | epot = -23.9216126050554 | etot = -18.6367213751972
-10000  ekin = 2.65765007662471 |  erot = 1.95562671446597 | epot = -23.7978334881241 | etot = -19.1845566970334
-11000  ekin = 2.33860420545645 |  erot = 2.067780391377 | epot = -23.6589739475584 | etot = -19.2525893507249
-12000  ekin = 2.71377849618258 |  erot = 2.08757199120023 | epot = -23.5483571834756 | etot = -18.7470066960928
-13000  ekin = 2.62930153930326 |  erot = 2.36926332727578 | epot = -23.4509629615768 | etot = -18.4523980949977
-14000  ekin = 3.08200416316113 |  erot = 2.52340746291244 | epot = -23.3378147651053 | etot = -17.7324031390317
-15000  ekin = 2.98008664779269 |  erot = 1.871644860882 | epot = -23.1940665570191 | etot = -18.3423350483444
-16000  ekin = 2.18422481774796 |  erot = 2.13029325858584 | epot = -23.0709946755646 | etot = -18.7564765992308
-17000  ekin = 1.86029951221073 |  erot = 2.30856215831156 | epot = -22.9148241979648 | etot = -18.7459625274425
-18000  ekin = 2.26757205264074 |  erot = 1.23282183419698 | epot = -22.7667657090377 | etot = -19.2663718222
-19000  ekin = 2.39717301992408 |  erot = 2.43814713185077 | epot = -22.6249045514987 | etot = -17.7895843997239
-20000  ekin = 2.4972090427325 |  erot = 2.14695469209109 | epot = -22.4687873897505 | etot = -17.824623654927
-21000  ekin = 2.97591775854817 |  erot = 2.40996811711195 | epot = -22.580475447988 | etot = -17.1945895723278
-22000  ekin = 3.04727168578733 |  erot = 1.83825256427932 | epot = -22.6695853833015 | etot = -17.7840611332348
-23000  ekin = 2.64835731773193 |  erot = 2.22162785501705 | epot = -22.6565689169972 | etot = -17.7865837442483
-24000  ekin = 2.64866576787001 |  erot = 2.80157082833922 | epot = -22.6222797420052 | etot = -17.172043145796
-25000  ekin = 2.29527970143855 |  erot = 2.22049811939069 | epot = -22.6228421013006 | etot = -18.1070642804714
-26000  ekin = 1.6242512251805 |  erot = 2.52390475262917 | epot = -22.6746055892862 | etot = -18.5264496114765
-27000  ekin = 1.74746467550781 |  erot = 3.7138606202505 | epot = -22.7150312690973 | etot = -17.253705973339
-28000  ekin = 2.26500128280479 |  erot = 2.34791343563183 | epot = -22.7926648585827 | etot = -18.179750140146
-29000  ekin = 2.04774074424512 |  erot = 1.86347261547111 | epot = -22.8081204933408 | etot = -18.8969071336246
-30000  ekin = 2.41140146125466 |  erot = 1.86296915421469 | epot = -22.7764612164305 | etot = -18.5020906009612
-31000  ekin = 2.76447800297261 |  erot = 2.7393253404681 | epot = -22.7808698156252 | etot = -17.2770664721845
-32000  ekin = 2.08103539953574 |  erot = 2.81216171106146 | epot = -22.8081908465747 | etot = -17.9149937359775
-33000  ekin = 2.08672340074227 |  erot = 3.65510023442519 | epot = -22.7575363468642 | etot = -17.0157127116967
-34000  ekin = 2.34180742039869 |  erot = 3.10027175201874 | epot = -22.6657421559553 | etot = -17.2236629835378
-35000  ekin = 2.32430602395272 |  erot = 2.01607522370048 | epot = -22.5813705492547 | etot = -18.2409893016015
-36000  ekin = 1.91917507775106 |  erot = 1.97289747304336 | epot = -22.481118994336 | etot = -18.5890464435416
-37000  ekin = 1.57560528527468 |  erot = 2.63029511887642 | epot = -22.4456699464305 | etot = -18.2397695422794
-38000  ekin = 2.20652731867584 |  erot = 2.89671984141264 | epot = -22.3965902387972 | etot = -17.2933430787087
-39000  ekin = 2.54765822667968 |  erot = 2.47352619735437 | epot = -22.3525131983352 | etot = -17.3313287743012
-40000  ekin = 2.24172560748699 |  erot = 1.87314319107769 | epot = -22.3791956830638 | etot = -18.2643268844991
-41000  ekin = 2.45176361826215 |  erot = 2.49992612251747 | epot = -22.4441192111887 | etot = -17.492429470409
-42000  ekin = 2.68254780786499 |  erot = 2.04382131696989 | epot = -22.4352265851614 | etot = -17.7088574603266
-43000  ekin = 2.39383336858508 |  erot = 1.66587291396325 | epot = -22.4337243898148 | etot = -18.3740181072664
-44000  ekin = 2.30758870966958 |  erot = 2.39381816537748 | epot = -22.4636201484766 | etot = -17.7622132734295
-45000  ekin = 1.84308929771583 |  erot = 2.25880380151546 | epot = -22.5697712917435 | etot = -18.4678781925122
-46000  ekin = 1.98608215049724 |  erot = 3.02136983211363 | epot = -22.5606085774834 | etot = -17.5531565948725
-47000  ekin = 1.31457586857024 |  erot = 1.99780932836913 | epot = -22.5522289127255 | etot = -19.2398437157862
-48000  ekin = 2.59855199680394 |  erot = 1.90772345027383 | epot = -22.5972680906756 | etot = -18.0909926435978
-49000  ekin = 2.32140483916261 |  erot = 2.72932938830521 | epot = -22.6070371995253 | etot = -17.5563029720575
-50000  ekin = 2.48248035385828 |  erot = 3.42713570109107 | epot = -22.5294064222472 | etot = -16.6197903672979
-51000  ekin = 2.73677705777971 |  erot = 1.43285265191038 | epot = -22.4272695862992 | etot = -18.2576398766091
-52000  ekin = 3.03746109762767 |  erot = 1.97878223690383 | epot = -22.4105817052324 | etot = -17.3943383707009
-53000  ekin = 2.4689045601064 |  erot = 4.26434186327668 | epot = -22.4059567857723 | etot = -15.6727103623892
-54000  ekin = 2.48025904071626 |  erot = 2.36957879662632 | epot = -22.4049729842648 | etot = -17.5551351469222
-55000  ekin = 2.28269445417385 |  erot = 1.92149293107792 | epot = -22.4643082993723 | etot = -18.2601209141205
-56000  ekin = 2.36225428889468 |  erot = 2.21818002425493 | epot = -22.5516502452859 | etot = -17.9712159321363
-57000  ekin = 2.5222034650231 |  erot = 2.87044520913643 | epot = -22.6517599833465 | etot = -17.259111309187
-58000  ekin = 2.50677816066749 |  erot = 2.80087142998998 | epot = -22.7046490897181 | etot = -17.3969994990606
-59000  ekin = 2.7442153349817 |  erot = 2.17375311266844 | epot = -22.7630968852437 | etot = -17.8451284375935
-60000  ekin = 3.28881699963202 |  erot = 1.98491245229834 | epot = -22.7493813857704 | etot = -17.47565193384
-61000  ekin = 2.42749732003947 |  erot = 1.80500042748845 | epot = -22.6954080097403 | etot = -18.4629102622124
-62000  ekin = 2.82051548232979 |  erot = 1.69220614985812 | epot = -22.5840860651657 | etot = -18.0713644329778
-63000  ekin = 3.66818847100113 |  erot = 1.91510536540651 | epot = -22.4235299160084 | etot = -16.8402360796008
-64000  ekin = 3.60192162647095 |  erot = 3.02302140162941 | epot = -22.4028966408394 | etot = -15.777953612739
-65000  ekin = 3.37797300912952 |  erot = 3.90646944425564 | epot = -22.3508227873685 | etot = -15.0663803339833
-66000  ekin = 2.90796062513305 |  erot = 2.46538835419998 | epot = -22.2656130116827 | etot = -16.8922640323497
-67000  ekin = 2.57641483706472 |  erot = 2.1063925708314 | epot = -22.1586423836372 | etot = -17.4758349757411
-68000  ekin = 2.5516902727465 |  erot = 2.46870040285813 | epot = -22.1454741588102 | etot = -17.1250834832056
-69000  ekin = 2.42897294997603 |  erot = 2.86774435615082 | epot = -22.1788582092806 | etot = -16.8821409031537
-70000  ekin = 3.08406596014674 |  erot = 2.51171720098584 | epot = -22.2680651617951 | etot = -16.6722820006626
-71000  ekin = 2.55052721315253 |  erot = 2.49486492124423 | epot = -22.3940848075589 | etot = -17.3486926731621
-72000  ekin = 1.77666138705941 |  erot = 2.52301579845699 | epot = -22.4956655989824 | etot = -18.195988413466
-73000  ekin = 1.86857924146303 |  erot = 2.33110810852355 | epot = -22.5401005215029 | etot = -18.3404131715163
-74000  ekin = 3.14875320805144 |  erot = 2.12002807961601 | epot = -22.5354282257998 | etot = -17.2666469381323
-75000  ekin = 2.60566180511119 |  erot = 2.16421143606062 | epot = -22.5109742574449 | etot = -17.7411010162731
-76000  ekin = 1.94500512300058 |  erot = 1.94681992806367 | epot = -22.5134561384461 | etot = -18.6216310873819
-77000  ekin = 2.09005510206219 |  erot = 2.13354294429721 | epot = -22.5157248384152 | etot = -18.2921267920558
-78000  ekin = 2.48381695181472 |  erot = 2.49598603867482 | epot = -22.449809286019 | etot = -17.4700062955295
-79000  ekin = 3.09582217320064 |  erot = 2.46630074007712 | epot = -22.3464652405845 | etot = -16.7843423273068
-80000  ekin = 2.51380629427529 |  erot = 1.89207626467031 | epot = -22.2775752521275 | etot = -17.8716926931819
-81000  ekin = 2.32322780911516 |  erot = 2.24954513249787 | epot = -22.2655235360186 | etot = -17.6927505944055
-82000  ekin = 1.54779729878415 |  erot = 2.01487148845307 | epot = -22.2126473128098 | etot = -18.6499785255726
-83000  ekin = 2.24267653112482 |  erot = 3.34721522119025 | epot = -22.2063282117648 | etot = -16.6164364594498
-84000  ekin = 2.86948852339533 |  erot = 2.11915315181827 | epot = -22.2055386975617 | etot = -17.2168970223481
-85000  ekin = 3.13802387827786 |  erot = 2.93900498543376 | epot = -22.2240733080824 | etot = -16.1470444443708
-86000  ekin = 3.46160079449538 |  erot = 2.80798287444336 | epot = -22.2732645073155 | etot = -16.0036808383767
-87000  ekin = 3.63139446909085 |  erot = 2.3166794204513 | epot = -22.2567856660101 | etot = -16.308711776468
-88000  ekin = 3.15348314879937 |  erot = 2.2785763709033 | epot = -22.2154422326699 | etot = -16.7833827129672
-89000  ekin = 3.30271147105659 |  erot = 1.80791256125564 | epot = -22.1564153597823 | etot = -17.04579132747
-90000  ekin = 2.42655906518194 |  erot = 2.24507038389518 | epot = -21.9481188512569 | etot = -17.2764894021798
-91000  ekin = 1.89051217909395 |  erot = 2.51049066719493 | epot = -21.7877769537306 | etot = -17.3867741074417
-92000  ekin = 2.07833668466679 |  erot = 2.218324246302 | epot = -21.6997103074282 | etot = -17.4030493764594
-93000  ekin = 1.94321435585196 |  erot = 2.99473985773914 | epot = -21.6748650469777 | etot = -16.7369108333866
-94000  ekin = 2.07878576812463 |  erot = 3.37631892101902 | epot = -21.7659932416399 | etot = -16.3108885524963
-95000  ekin = 2.10517721407769 |  erot = 2.08345895044788 | epot = -21.8951718799354 | etot = -17.7065357154098
-96000  ekin = 2.68821593238919 |  erot = 1.86988637992409 | epot = -21.9622848400866 | etot = -17.4041825277733
-97000  ekin = 1.95061152706206 |  erot = 2.81054215683073 | epot = -22.0229813258884 | etot = -17.2618276419957
-98000  ekin = 1.98463063611221 |  erot = 2.05732763357977 | epot = -22.0930102039112 | etot = -18.0510519342192
-99000  ekin = 2.51292852217217 |  erot = 3.54194472638845 | epot = -22.199088757298 | etot = -16.1442155087374
-100000  ekin = 1.8757570387949 |  erot = 2.3690785580876 | epot = -22.348409587438 | etot = -18.1035739905555
-101000  ekin = 1.66160772204006 |  erot = 3.59766032223856 | epot = -22.3604908173889 | etot = -17.1012227731103
-102000  ekin = 1.62075182718474 |  erot = 3.3442006848817 | epot = -22.3063629504087 | etot = -17.3414104383422
-103000  ekin = 2.00871148652538 |  erot = 2.33677124900284 | epot = -22.275557852692 | etot = -17.9300751171637
-104000  ekin = 2.04513709976292 |  erot = 2.74664593650967 | epot = -22.2818713634637 | etot = -17.4900883271911
-105000  ekin = 1.87027868596139 |  erot = 1.98922389218239 | epot = -22.223503909299 | etot = -18.3640013311552
-106000  ekin = 1.71540784443942 |  erot = 1.9177953110688 | epot = -22.2562839843324 | etot = -18.6230808288242
-107000  ekin = 2.61024905591622 |  erot = 1.57446439985464 | epot = -22.3171357124015 | etot = -18.1324222566306
-108000  ekin = 2.13751756724178 |  erot = 2.18822458113098 | epot = -22.2268794585969 | etot = -17.9011373102241
-109000  ekin = 2.24408198608307 |  erot = 2.11438299352724 | epot = -22.076564108576 | etot = -17.7180991289657
-110000  ekin = 1.66706562020821 |  erot = 2.50986066169373 | epot = -22.0833343008135 | etot = -17.9064080189116
-111000  ekin = 2.30463895640872 |  erot = 2.24982560856989 | epot = -22.0940837732696 | etot = -17.539619208291
-112000  ekin = 2.63019524472749 |  erot = 2.43696110420532 | epot = -22.0953344558745 | etot = -17.0281781069417
-113000  ekin = 2.42282638113981 |  erot = 3.06190927482913 | epot = -22.1061661458173 | etot = -16.6214304898484
-114000  ekin = 2.34214572325658 |  erot = 2.31899235523686 | epot = -22.0941430549288 | etot = -17.4330049764353
-115000  ekin = 1.70336449422736 |  erot = 3.10166879044198 | epot = -22.1252095896431 | etot = -17.3201763049738
-116000  ekin = 1.51705870113214 |  erot = 2.21425252709695 | epot = -22.1823772627204 | etot = -18.4510660344913
-117000  ekin = 1.70129809180508 |  erot = 2.34142425076372 | epot = -22.2067668262467 | etot = -18.1640444836779
-118000  ekin = 2.20482827236051 |  erot = 2.3179714809504 | epot = -22.1855414590757 | etot = -17.6627417057647
-119000  ekin = 2.54272629601484 |  erot = 2.46528921750297 | epot = -22.2113175246519 | etot = -17.2033020111341
-120000  ekin = 1.76640390552554 |  erot = 2.16116304616032 | epot = -22.1536331723646 | etot = -18.2260662206787
-121000  ekin = 2.81281157959688 |  erot = 2.31761005518346 | epot = -22.1492969323239 | etot = -17.0188752975435
-122000  ekin = 3.25156823587966 |  erot = 3.31679050874322 | epot = -22.2050361016166 | etot = -15.6366773569938
-123000  ekin = 2.87462309654081 |  erot = 3.25604816714397 | epot = -22.1785374359393 | etot = -16.0478661722546
-124000  ekin = 2.18213410260632 |  erot = 2.77182209342785 | epot = -22.0161464482698 | etot = -17.0621902522356
-125000  ekin = 1.85317252616068 |  erot = 1.36623599567638 | epot = -21.8721650279344 | etot = -18.6527565060973
-126000  ekin = 2.47747071965844 |  erot = 3.09909384826334 | epot = -21.8840309142636 | etot = -16.3074663463419
-127000  ekin = 2.42177426273027 |  erot = 2.35209644429656 | epot = -21.8861939604609 | etot = -17.1123232534341
-128000  ekin = 2.76000040231245 |  erot = 1.8231678837239 | epot = -21.8538456680958 | etot = -17.2706773820595
-129000  ekin = 2.78355536315491 |  erot = 2.88851981621501 | epot = -21.9251039267855 | etot = -16.2530287474156
-130000  ekin = 3.26834278926799 |  erot = 2.56228354573336 | epot = -22.0546105678549 | etot = -16.2239842328536
-131000  ekin = 2.64714688907849 |  erot = 2.51107513446137 | epot = -22.0961160192681 | etot = -16.9378939957282
-132000  ekin = 2.61847248883524 |  erot = 3.38899164334156 | epot = -22.1218916777659 | etot = -16.1144275455891
-133000  ekin = 2.03408861514006 |  erot = 2.87401070790187 | epot = -22.0785989417621 | etot = -17.1704996187202
-134000  ekin = 1.64140897264888 |  erot = 1.66986416585675 | epot = -22.0323643102285 | etot = -18.7210911717228
-135000  ekin = 2.46650096367446 |  erot = 2.111120611107 | epot = -21.9976572593399 | etot = -17.4200356845585
-136000  ekin = 2.32880805911731 |  erot = 3.05940125193231 | epot = -21.8983392007847 | etot = -16.5101298897351
-137000  ekin = 2.7601019905106 |  erot = 2.47443779429795 | epot = -21.752125264204 | etot = -16.5175854793954
-138000  ekin = 3.30162084678948 |  erot = 1.73084735415554 | epot = -21.7423849642075 | etot = -16.7099167632625
-139000  ekin = 2.76669064053124 |  erot = 1.72642745910431 | epot = -21.8898577306654 | etot = -17.3967396310298
-140000  ekin = 2.73595287215366 |  erot = 2.46891829250481 | epot = -21.9884857831833 | etot = -16.7836146185249
-141000  ekin = 2.79316289615844 |  erot = 2.46753088695597 | epot = -22.0064855648443 | etot = -16.7457917817299
-142000  ekin = 3.51694745558129 |  erot = 3.49862438784827 | epot = -21.9623193335451 | etot = -14.9467474901156
-143000  ekin = 2.58689934548697 |  erot = 2.04008576044027 | epot = -21.9563338194557 | etot = -17.3293487135285
-144000  ekin = 3.72611917000993 |  erot = 3.04855733322793 | epot = -21.9536376487796 | etot = -15.1789611455417
-145000  ekin = 3.61191106831147 |  erot = 2.71915407989904 | epot = -21.870542665333 | etot = -15.5394775171225
-146000  ekin = 3.85060594912677 |  erot = 2.47210219931339 | epot = -21.8285858153921 | etot = -15.505877666952
-147000  ekin = 3.26481933196161 |  erot = 2.06864347299802 | epot = -21.6752809049183 | etot = -16.3418180999587
-148000  ekin = 2.47977997895053 |  erot = 1.65169267241014 | epot = -21.4172781734276 | etot = -17.2858055220669
-149000  ekin = 2.70771685463074 |  erot = 2.28028425953227 | epot = -21.2324293178539 | etot = -16.2444282036909
-150000  ekin = 2.60726181496431 |  erot = 2.88955230103659 | epot = -21.126549406853 | etot = -15.6297352908521
-151000  ekin = 2.06865005733849 |  erot = 2.13537039813292 | epot = -21.0304193709383 | etot = -16.8263989154669
-152000  ekin = 2.41210154812787 |  erot = 2.60104053370075 | epot = -20.8967777045302 | etot = -15.8836356227016
-153000  ekin = 2.12406231442824 |  erot = 2.25444655142795 | epot = -20.9199278716094 | etot = -16.5414190057532
-154000  ekin = 2.34622678455546 |  erot = 2.58439374093403 | epot = -21.0040588663533 | etot = -16.0734383408638
-155000  ekin = 2.08240965570452 |  erot = 3.02621505767145 | epot = -21.0204738431416 | etot = -15.9118491297656
-156000  ekin = 2.04576145796301 |  erot = 3.17151405834467 | epot = -20.8558463949479 | etot = -15.6385708786402
-157000  ekin = 2.36459548410747 |  erot = 1.89207417055424 | epot = -20.8025485082277 | etot = -16.545878853566
-158000  ekin = 2.16996178916575 |  erot = 2.46547727482113 | epot = -20.8673070433024 | etot = -16.2318679793155
-159000  ekin = 2.86272730849306 |  erot = 2.27590841865057 | epot = -20.9710387207245 | etot = -15.8324029935809
-160000  ekin = 2.19288173853782 |  erot = 2.36312829884111 | epot = -21.0403123366075 | etot = -16.4843022992286
-161000  ekin = 2.14059248149909 |  erot = 2.4287283799048 | epot = -21.1333683100403 | etot = -16.5640474486365
-162000  ekin = 1.76077466564934 |  erot = 2.66561836368342 | epot = -21.1782130850259 | etot = -16.7518200556931
-163000  ekin = 2.23068698955417 |  erot = 2.02664945757243 | epot = -21.3281780197228 | etot = -17.0708415725963
-164000  ekin = 2.75358320318999 |  erot = 1.43717365990088 | epot = -21.4675480212853 | etot = -17.2767911581945
-165000  ekin = 2.65171600986478 |  erot = 2.29632253260765 | epot = -21.493178025826 | etot = -16.5451394833536
-166000  ekin = 3.27298673277591 |  erot = 2.41252396730596 | epot = -21.4477711984927 | etot = -15.7622604984108
-167000  ekin = 3.02574105268454 |  erot = 2.02770436019795 | epot = -21.5236773217566 | etot = -16.4702319088741
-168000  ekin = 3.14659813654158 |  erot = 1.8374607941321 | epot = -21.5547269116736 | etot = -16.5706679809999
-169000  ekin = 2.22493755697302 |  erot = 2.67175500860652 | epot = -21.4662206077311 | etot = -16.5695280421515
-170000  ekin = 2.41921977325643 |  erot = 2.49142716001801 | epot = -21.3123035293873 | etot = -16.4016565961128
-171000  ekin = 1.89798915040775 |  erot = 2.39492100285877 | epot = -21.2153991969519 | etot = -16.9224890436853
-172000  ekin = 2.86894215563086 |  erot = 3.22914449693158 | epot = -21.1827352206441 | etot = -15.0846485680816
-173000  ekin = 2.74888252418688 |  erot = 2.13556434483052 | epot = -21.2166792789418 | etot = -16.3322324099244
-174000  ekin = 2.45887587066864 |  erot = 2.23682521338056 | epot = -21.2633056658561 | etot = -16.5676045818069
-175000  ekin = 2.84703517745999 |  erot = 2.39381254916381 | epot = -21.2430876358358 | etot = -16.002239909212
-176000  ekin = 2.14025231000119 |  erot = 1.89894722702466 | epot = -21.3238321496633 | etot = -17.2846326126375
-177000  ekin = 2.5795061901144 |  erot = 2.75365074391219 | epot = -21.3022195274207 | etot = -15.9690625933941
-178000  ekin = 1.83122028490793 |  erot = 2.59468068841507 | epot = -21.2483113201278 | etot = -16.8224103468048
-179000  ekin = 2.50706581632049 |  erot = 2.3918046623687 | epot = -21.3152464598324 | etot = -16.4163759811432
-180000  ekin = 1.88211034410738 |  erot = 2.47063835849692 | epot = -21.4741119346399 | etot = -17.1213632320356
-181000  ekin = 1.74209654097779 |  erot = 3.05723824722444 | epot = -21.4808621715442 | etot = -16.681527383342
-182000  ekin = 1.55789914013104 |  erot = 2.05767448814763 | epot = -21.423526482018 | etot = -17.8079528537394
-183000  ekin = 2.00937540548925 |  erot = 2.80898978674436 | epot = -21.491360735728 | etot = -16.6729955434944
-184000  ekin = 2.69285960778353 |  erot = 2.42969439668747 | epot = -21.6024209898208 | etot = -16.4798669853498
-185000  ekin = 3.01326925127938 |  erot = 3.19083239326424 | epot = -21.6730258967931 | etot = -15.4689242522495
-186000  ekin = 3.2083067153638 |  erot = 2.42899016869201 | epot = -21.7143665695974 | etot = -16.0770696855416
-187000  ekin = 2.672906100919 |  erot = 3.41560404715603 | epot = -21.6726605039613 | etot = -15.5841503558862
-188000  ekin = 2.89349337388582 |  erot = 3.06258669113775 | epot = -21.6216664732832 | etot = -15.6655864082597
-189000  ekin = 2.65435973176118 |  erot = 1.82043381700644 | epot = -21.5604872976485 | etot = -17.0856937488809
-190000  ekin = 2.21855159698309 |  erot = 1.84826944038784 | epot = -21.5263477340278 | etot = -17.4595266966569
-191000  ekin = 2.26980616064111 |  erot = 2.05944589507645 | epot = -21.4543005141097 | etot = -17.1250484583921
-192000  ekin = 2.27219103053707 |  erot = 3.11210788791052 | epot = -21.4899273087562 | etot = -16.1056283903086
-193000  ekin = 1.95008147026928 |  erot = 1.89648921534019 | epot = -21.4843079374128 | etot = -17.6377372518033
-194000  ekin = 2.45477671526091 |  erot = 2.0272304242676 | epot = -21.3709228769337 | etot = -16.8889157374052
-195000  ekin = 3.09567411006595 |  erot = 2.10081767143638 | epot = -21.3012041149762 | etot = -16.1047123334739
-196000  ekin = 2.67423122149492 |  erot = 2.50738189755519 | epot = -21.2164124023053 | etot = -16.0347992832552
-197000  ekin = 2.50338730962556 |  erot = 2.07349764616723 | epot = -21.041867486922 | etot = -16.4649825311292
-198000  ekin = 2.66945928982616 |  erot = 1.79012921820209 | epot = -21.0169215356766 | etot = -16.5573330276483
-199000  ekin = 2.53947964790256 |  erot = 2.33176467953655 | epot = -21.0171165577067 | etot = -16.1458722302676
-200000  ekin = 2.90451062704866 |  erot = 1.42170066957004 | epot = -21.0113804229743 | etot = -16.6851691263556
-201000  ekin = 2.68927776239674 |  erot = 1.56650335894554 | epot = -21.0245916399581 | etot = -16.7688105186158
-202000  ekin = 2.2601329351618 |  erot = 2.25401443373177 | epot = -20.9769308007641 | etot = -16.4627834318706
-203000  ekin = 2.12073487355488 |  erot = 2.03553028991747 | epot = -20.919035946492 | etot = -16.7627707830197
-204000  ekin = 2.11829086582788 |  erot = 1.89731962488617 | epot = -20.9376264283538 | etot = -16.9220159376397
-205000  ekin = 1.30964171332167 |  erot = 2.12770406224885 | epot = -20.9991335630718 | etot = -17.5617877875013
-206000  ekin = 1.39940057572522 |  erot = 2.24496791209126 | epot = -20.963919219062 | etot = -17.3195507312455
-207000  ekin = 1.8871608804017 |  erot = 1.79849326266382 | epot = -21.0552898160204 | etot = -17.3696356729549
-208000  ekin = 1.81558541079753 |  erot = 3.24210836817276 | epot = -21.3060144768834 | etot = -16.2483206979131
-209000  ekin = 2.79588064252181 |  erot = 2.3467149173832 | epot = -21.4301997554495 | etot = -16.2876041955445
-210000  ekin = 3.17544887511567 |  erot = 3.12704516116654 | epot = -21.5100449360932 | etot = -15.2075508998109
-211000  ekin = 2.47442327377226 |  erot = 2.0990867711376 | epot = -21.6455723047062 | etot = -17.0720622597963
-212000  ekin = 2.36672302145397 |  erot = 1.93445871446419 | epot = -21.7283038297487 | etot = -17.4271220938306
-213000  ekin = 1.91045426241161 |  erot = 2.52535628540462 | epot = -21.8158508544504 | etot = -17.3800403066341
-214000  ekin = 1.99794025866061 |  erot = 2.49896939492127 | epot = -21.8606548137084 | etot = -17.3637451601266
-215000  ekin = 1.97741561009525 |  erot = 3.17667494473254 | epot = -21.8701701582032 | etot = -16.7160796033754
-216000  ekin = 1.88829990821377 |  erot = 1.87402623825167 | epot = -21.8343889393413 | etot = -18.0720627928759
-217000  ekin = 2.10000293878932 |  erot = 1.95052404495887 | epot = -21.8965404786646 | etot = -17.8460134949164
-218000  ekin = 2.34753598782339 |  erot = 1.69695019504401 | epot = -21.8560027679962 | etot = -17.8115165851288
-219000  ekin = 2.497223564463 |  erot = 2.20999914485705 | epot = -21.8797649478059 | etot = -17.1725422384859
-220000  ekin = 1.75274593087921 |  erot = 3.03992746556406 | epot = -21.8491595252171 | etot = -17.0564861287739
-221000  ekin = 1.78874686645809 |  erot = 2.79359542964647 | epot = -21.869798634642 | etot = -17.2874563385375
-222000  ekin = 2.63608430516661 |  erot = 2.86817933637385 | epot = -21.8351218383832 | etot = -16.3308581968427
-223000  ekin = 3.02706758581511 |  erot = 1.93888641555348 | epot = -21.8582453001765 | etot = -16.8922912988079
-224000  ekin = 2.71704451339112 |  erot = 2.42079327531441 | epot = -21.8188420875657 | etot = -16.6810042988601
-225000  ekin = 2.04245190508395 |  erot = 3.38216222891907 | epot = -21.8232190868647 | etot = -16.3986049528616
-226000  ekin = 2.37968015829255 |  erot = 2.38384696857065 | epot = -21.8913549487127 | etot = -17.1278278218495
-227000  ekin = 2.73883397024414 |  erot = 2.62491632372019 | epot = -21.9496900700867 | etot = -16.5859397761223
-228000  ekin = 2.06833362780412 |  erot = 2.25049628751225 | epot = -21.9946760345141 | etot = -17.6758461191977
-229000  ekin = 1.78618617304217 |  erot = 1.80509591500329 | epot = -22.0671964085329 | etot = -18.4759143204874
-230000  ekin = 2.76967283780387 |  erot = 2.22492545317995 | epot = -22.0913590121729 | etot = -17.0967607211891
-231000  ekin = 3.15653922952316 |  erot = 2.77099247609325 | epot = -22.0635255129442 | etot = -16.1359938073278
-232000  ekin = 1.86633326635991 |  erot = 1.70672288688982 | epot = -22.0959715052869 | etot = -18.5229153520371
-233000  ekin = 1.75856846080021 |  erot = 1.55694263125625 | epot = -22.0729289884755 | etot = -18.7574178964191
-234000  ekin = 2.32322575892498 |  erot = 2.05793864740336 | epot = -21.9849429433607 | etot = -17.6037785370324
-235000  ekin = 1.95327191686568 |  erot = 2.52519338885861 | epot = -21.9357201856672 | etot = -17.4572548799429
-236000  ekin = 2.25952484966859 |  erot = 1.90005304846995 | epot = -21.9422471368741 | etot = -17.7826692387355
-237000  ekin = 2.49082301609303 |  erot = 2.65327564887437 | epot = -22.0049130762794 | etot = -16.860814411312
-238000  ekin = 2.21076048871751 |  erot = 2.74154862479023 | epot = -22.0553236426831 | etot = -17.1030145291754
-239000  ekin = 2.71464884454142 |  erot = 2.48739530580561 | epot = -22.0661894571024 | etot = -16.8641453067554
-240000  ekin = 3.08961933821573 |  erot = 2.17857064931927 | epot = -21.9596599475175 | etot = -16.6914699599825
-241000  ekin = 3.04172562407922 |  erot = 2.64442433974962 | epot = -21.872950064824 | etot = -16.1868001009951
-242000  ekin = 2.21355627539455 |  erot = 2.33429157450905 | epot = -21.7850463200938 | etot = -17.2371984701902
-243000  ekin = 1.52065138183895 |  erot = 2.81375224845254 | epot = -21.724672004357 | etot = -17.3902683740655
-244000  ekin = 1.90352576583831 |  erot = 2.43821138840079 | epot = -21.6320468184555 | etot = -17.2903096642164
-245000  ekin = 1.96342069667742 |  erot = 2.61760141174562 | epot = -21.509789944958 | etot = -16.928767836535
-246000  ekin = 2.05478829283868 |  erot = 2.42643933263093 | epot = -21.4781109635143 | etot = -16.9968833380447
-247000  ekin = 1.54618395739204 |  erot = 2.28537401295509 | epot = -21.4411828355572 | etot = -17.6096248652101
-248000  ekin = 1.83924983769609 |  erot = 2.55904554412921 | epot = -21.4587985205918 | etot = -17.0605031387665
-249000  ekin = 1.78703007063825 |  erot = 2.03411349475431 | epot = -21.516607560139 | etot = -17.6954639947464
-250000  ekin = 1.69317901626952 |  erot = 3.382620023581 | epot = -21.5380480709889 | etot = -16.4622490311384
-251000  ekin = 2.13799462687096 |  erot = 3.25868442484789 | epot = -21.5254595658408 | etot = -16.1287805141219
-252000  ekin = 2.04357045453396 |  erot = 2.53079336098227 | epot = -21.5456931883614 | etot = -16.9713293728452
-253000  ekin = 1.63287738205387 |  erot = 3.20992823373492 | epot = -21.5622010587548 | etot = -16.719395442966
-254000  ekin = 2.31269246359595 |  erot = 3.10766702207071 | epot = -21.5505863172024 | etot = -16.1302268315358
-255000  ekin = 2.50767926641465 |  erot = 2.76631276495167 | epot = -21.5288449153183 | etot = -16.254852883952
-256000  ekin = 1.97163698305487 |  erot = 2.61682132599931 | epot = -21.5273539828767 | etot = -16.9388956738225
-257000  ekin = 2.21091422886157 |  erot = 3.2624387389365 | epot = -21.5385504601779 | etot = -16.0651974923798
-258000  ekin = 2.0351730783025 |  erot = 1.84693461512361 | epot = -21.6544556001779 | etot = -17.7723479067518
-259000  ekin = 2.85718947138204 |  erot = 2.78701165242275 | epot = -21.7587237542941 | etot = -16.1145226304893
-260000  ekin = 2.90387286634678 |  erot = 2.18817434737477 | epot = -21.8080383126913 | etot = -16.7159910989698
-261000  ekin = 2.76190440948559 |  erot = 2.33968169215532 | epot = -21.8592909726424 | etot = -16.7577048710015
-262000  ekin = 3.50919242681178 |  erot = 1.76925994550144 | epot = -21.8779228441577 | etot = -16.5994704718445
-263000  ekin = 3.07696270254058 |  erot = 2.41477320555763 | epot = -21.8078566004281 | etot = -16.3161206923299
-264000  ekin = 2.26633389925754 |  erot = 2.04161743361595 | epot = -21.8372928128571 | etot = -17.5293414799836
-265000  ekin = 1.95747124461577 |  erot = 2.5081300879884 | epot = -21.8490876266416 | etot = -17.3834862940375
-266000  ekin = 2.34517905801099 |  erot = 3.31486209922478 | epot = -21.8287737874741 | etot = -16.1687326302383
-267000  ekin = 1.74030193361906 |  erot = 2.23366459528059 | epot = -21.699850097441 | etot = -17.7258835685413
-268000  ekin = 2.04858677018814 |  erot = 3.28744422098426 | epot = -21.6459408923623 | etot = -16.3099099011899
-269000  ekin = 1.93146929709294 |  erot = 2.79280735598121 | epot = -21.549773802712 | etot = -16.8254971496378
-270000  ekin = 2.19788894271016 |  erot = 2.64563279687103 | epot = -21.4165389672397 | etot = -16.5730172276585
-271000  ekin = 2.21923220579694 |  erot = 3.10768708967444 | epot = -21.2197121954353 | etot = -15.8927928999639
-272000  ekin = 2.54992061853163 |  erot = 2.29721880581853 | epot = -21.0816515756819 | etot = -16.2345121513317
-273000  ekin = 1.914618407838 |  erot = 2.01420401968473 | epot = -21.0503637141725 | etot = -17.1215412866498
-274000  ekin = 1.89671513770876 |  erot = 2.24334386161735 | epot = -21.0967103438301 | etot = -16.9566513445039
-275000  ekin = 1.78930707116537 |  erot = 3.09754687865994 | epot = -21.1385700371941 | etot = -16.2517160873688
-276000  ekin = 3.37110328153971 |  erot = 2.41957324257529 | epot = -21.0908388312033 | etot = -15.3001623070883
-277000  ekin = 2.38921825148496 |  erot = 1.50604988822737 | epot = -21.034620883997 | etot = -17.1393527442847
-278000  ekin = 2.51997301930638 |  erot = 2.14026171776896 | epot = -21.0117379332914 | etot = -16.351503196216
-279000  ekin = 1.88315206280857 |  erot = 2.37342905263994 | epot = -20.9993757709145 | etot = -16.742794655466
-280000  ekin = 2.33534713190787 |  erot = 3.58626468287222 | epot = -20.8573252930133 | etot = -14.9357134782332
-281000  ekin = 1.75252641954511 |  erot = 1.7907930540809 | epot = -20.9036528826792 | etot = -17.3603334090531
-282000  ekin = 2.26373977259215 |  erot = 3.04032073608633 | epot = -20.8497513702237 | etot = -15.5456908615452
-283000  ekin = 2.1783387139443 |  erot = 2.20833158301333 | epot = -20.8002776734785 | etot = -16.4136073765209
-284000  ekin = 1.9148667268656 |  erot = 2.21521993135969 | epot = -20.8277491648056 | etot = -16.6976625065804
-285000  ekin = 3.15634443167765 |  erot = 1.80033231604849 | epot = -21.0046435881196 | etot = -16.0479668403934
-286000  ekin = 3.84877574957331 |  erot = 1.82969969667577 | epot = -21.1628555811447 | etot = -15.4843801348956
-287000  ekin = 3.60615742824732 |  erot = 2.91608688151215 | epot = -21.2126952882302 | etot = -14.6904509784708
-288000  ekin = 3.19613259393802 |  erot = 1.67736393077137 | epot = -21.1713552834963 | etot = -16.297858758787
-289000  ekin = 2.45584885114799 |  erot = 2.77781979747336 | epot = -21.1669115721543 | etot = -15.9332429235329
-290000  ekin = 2.74570408981357 |  erot = 2.40443247852242 | epot = -21.1874427766533 | etot = -16.0373062083173
-291000  ekin = 2.10295274468233 |  erot = 2.37092484671539 | epot = -21.2419107014544 | etot = -16.7680331100567
-292000  ekin = 2.36118713930732 |  erot = 2.05558127949017 | epot = -21.3137361602548 | etot = -16.8969677414573
-293000  ekin = 2.2786196308825 |  erot = 2.35874555054765 | epot = -21.4302415460533 | etot = -16.7928763646231
-294000  ekin = 2.93315982813019 |  erot = 2.90313008187785 | epot = -21.5210917917479 | etot = -15.6848018817399
-295000  ekin = 2.66360761710434 |  erot = 2.28100565751945 | epot = -21.6885021477336 | etot = -16.7438888731098
-296000  ekin = 2.18767827164471 |  erot = 2.90589885547353 | epot = -21.7355037190159 | etot = -16.6419265918977
-297000  ekin = 2.15987738107365 |  erot = 3.29819575592636 | epot = -21.7177655658756 | etot = -16.2596924288756
-298000  ekin = 2.92956976611296 |  erot = 2.36377210613469 | epot = -21.6748271071566 | etot = -16.3814852349089
-299000  ekin = 3.19167138064488 |  erot = 2.23480811780853 | epot = -21.8042612344918 | etot = -16.3777817360384
-300000  ekin = 3.3133572846982 |  erot = 1.38932157247169 | epot = -21.8799906137235 | etot = -17.1773117565536
-301000  ekin = 2.39061971962408 |  erot = 3.30110260608963 | epot = -21.8919200817915 | etot = -16.2001977560778
-302000  ekin = 2.954460706029 |  erot = 3.2304815881765 | epot = -21.8557645140423 | etot = -15.6708222198368
-303000  ekin = 2.44700205353933 |  erot = 2.60676303242282 | epot = -21.8414046718167 | etot = -16.7876395858546
-304000  ekin = 2.23578509140697 |  erot = 2.68770420047938 | epot = -21.7680601199659 | etot = -16.8445708280796
-305000  ekin = 2.35505207220215 |  erot = 2.3823003115585 | epot = -21.7344089784493 | etot = -16.9970565946887
-306000  ekin = 1.91790567526689 |  erot = 2.90107494003232 | epot = -21.7170004822351 | etot = -16.8980198669359
-307000  ekin = 2.48241777758708 |  erot = 2.0836708009946 | epot = -21.6510481218459 | etot = -17.0849595432642
-308000  ekin = 2.77531620706104 |  erot = 2.63103510715158 | epot = -21.6349123878086 | etot = -16.2285610735959
-309000  ekin = 2.30440955942791 |  erot = 2.1249829765834 | epot = -21.5927938975113 | etot = -17.1634013615
-310000  ekin = 2.50879527040005 |  erot = 3.21338829421535 | epot = -21.6043932917725 | etot = -15.8822097271571
-311000  ekin = 2.31939145866558 |  erot = 3.03649241514151 | epot = -21.6247503351754 | etot = -16.2688664613683
-312000  ekin = 1.78383134659847 |  erot = 3.26262247889992 | epot = -21.4948144284683 | etot = -16.4483606029699
-313000  ekin = 1.6465994694839 |  erot = 2.08133087588833 | epot = -21.4920309735611 | etot = -17.7641006281889
-314000  ekin = 2.2552391830868 |  erot = 2.55077633299239 | epot = -21.5103692936944 | etot = -16.7043537776152
-315000  ekin = 2.5352734391515 |  erot = 2.13089997124613 | epot = -21.5923709217299 | etot = -16.9261975113323
-316000  ekin = 1.99944427781285 |  erot = 1.80072924409704 | epot = -21.6039893771529 | etot = -17.803815855243
-317000  ekin = 2.11848744585804 |  erot = 2.01459693810075 | epot = -21.5948976630665 | etot = -17.4618132791077
-318000  ekin = 2.29013024301854 |  erot = 1.92405818620914 | epot = -21.5643695946921 | etot = -17.3501811654644
-319000  ekin = 1.97314693278018 |  erot = 1.67996578959134 | epot = -21.4554808400841 | etot = -17.8023681177126
-320000  ekin = 2.45681719546631 |  erot = 3.07835144499744 | epot = -21.3924125538101 | etot = -15.8572439133463
-321000  ekin = 1.85729238455498 |  erot = 2.67083565671245 | epot = -21.433818829251 | etot = -16.9056907879836
-322000  ekin = 1.96132292396412 |  erot = 3.36792274118279 | epot = -21.3663490830085 | etot = -16.0371034178616
-323000  ekin = 1.94437285233567 |  erot = 2.09558156605687 | epot = -21.4151250968679 | etot = -17.3751706784754
-324000  ekin = 2.229181524904 |  erot = 2.4674418745061 | epot = -21.532385908563 | etot = -16.8357625091529
-325000  ekin = 2.74582842770392 |  erot = 2.36717454305098 | epot = -21.6443544237971 | etot = -16.5313514530422
-326000  ekin = 1.91124551133375 |  erot = 1.93084217743114 | epot = -21.7077957426602 | etot = -17.8657080538953
-327000  ekin = 3.05627483509655 |  erot = 1.67325209460963 | epot = -21.7948818019128 | etot = -17.0653548722066
-328000  ekin = 2.73933273476856 |  erot = 1.92380912803777 | epot = -21.8364014823586 | etot = -17.1732596195523
-329000  ekin = 2.95907896099514 |  erot = 3.15654168356681 | epot = -21.898199971646 | etot = -15.7825793270841
-330000  ekin = 2.90795110595274 |  erot = 2.01765890034968 | epot = -21.9037795505258 | etot = -16.9781695442234
-331000  ekin = 2.27446048340228 |  erot = 2.03754878634056 | epot = -21.8760842049291 | etot = -17.5640749351863
-332000  ekin = 2.43262938612094 |  erot = 3.19219171897213 | epot = -21.9305186945662 | etot = -16.3056975894732
-333000  ekin = 2.47357651298171 |  erot = 2.70061045814697 | epot = -22.0416691323271 | etot = -16.8674821611985
-334000  ekin = 2.38171387374892 |  erot = 3.00424927873366 | epot = -22.0746318522988 | etot = -16.6886686998162
-335000  ekin = 2.10465470910016 |  erot = 3.57382014016833 | epot = -22.1175420615632 | etot = -16.4390672122947
-336000  ekin = 2.61374577374183 |  erot = 2.13386927281299 | epot = -22.08988251196 | etot = -17.3422674654052
-337000  ekin = 2.72124526751511 |  erot = 2.74800480481403 | epot = -22.0768537131621 | etot = -16.607603640833
-338000  ekin = 1.83524121485421 |  erot = 2.24338894827196 | epot = -22.1591955034455 | etot = -18.0805653403194
-339000  ekin = 1.54928432997334 |  erot = 2.49812246084905 | epot = -22.202239883467 | etot = -18.1548330926446
-340000  ekin = 1.44405714940632 |  erot = 4.0451327092417 | epot = -22.1149458734013 | etot = -16.6257560147533
-341000  ekin = 1.67447392575555 |  erot = 2.77749751745982 | epot = -22.0760831546714 | etot = -17.624111711456
-342000  ekin = 1.9825676117275 |  erot = 2.71655566521084 | epot = -22.1563522566984 | etot = -17.45722897976
-343000  ekin = 2.68213676683887 |  erot = 3.16686462846914 | epot = -22.2498477633288 | etot = -16.4008463680208
-344000  ekin = 1.77905771753907 |  erot = 2.19153667254074 | epot = -22.2907212723871 | etot = -18.3201268823073
-345000  ekin = 1.5460499615042 |  erot = 1.85960255696712 | epot = -22.3447003428977 | etot = -18.9390478244264
-346000  ekin = 1.71554664484034 |  erot = 1.79880968736714 | epot = -22.3117022609055 | etot = -18.797345928698
-347000  ekin = 1.38672912049481 |  erot = 2.61484473767931 | epot = -22.332503239512 | etot = -18.3309293813379
-348000  ekin = 2.15015924850684 |  erot = 2.86300326453563 | epot = -22.3337312775957 | etot = -17.3205687645532
-349000  ekin = 1.83066085453602 |  erot = 1.9844132649487 | epot = -22.3967822584585 | etot = -18.5817081389738
-350000  ekin = 1.83318738252649 |  erot = 2.56907029661254 | epot = -22.4577827539416 | etot = -18.0555250748026
-351000  ekin = 1.72790505260219 |  erot = 2.87456274671834 | epot = -22.5159555107051 | etot = -17.9134877113846
-352000  ekin = 2.80786740016944 |  erot = 2.08750448125769 | epot = -22.6549834386892 | etot = -17.7596115572621
-353000  ekin = 3.5492801472091 |  erot = 1.42584537334883 | epot = -22.6849212734238 | etot = -17.7097957528659
-354000  ekin = 3.49129244374804 |  erot = 2.25156548638802 | epot = -22.604182620693 | etot = -16.861324690557
-355000  ekin = 2.06248783371663 |  erot = 2.92733565233054 | epot = -22.5494488364627 | etot = -17.5596253504155
-356000  ekin = 2.13415426306312 |  erot = 3.32668319049641 | epot = -22.6122425286523 | etot = -17.1514050750927
-357000  ekin = 2.75897049849731 |  erot = 2.51843165594436 | epot = -22.6042888591885 | etot = -17.3268867047468
-358000  ekin = 2.51778220496547 |  erot = 2.28374144764325 | epot = -22.5654155469984 | etot = -17.7638918943897
-359000  ekin = 3.2037278512604 |  erot = 2.5552016027623 | epot = -22.6749569097326 | etot = -16.91602745571
-360000  ekin = 2.52669169359923 |  erot = 1.97563796824025 | epot = -22.7314557612254 | etot = -18.229126099386
-361000  ekin = 2.60424632123629 |  erot = 2.51068088850826 | epot = -22.7715023743751 | etot = -17.6565751646306
-362000  ekin = 2.43350156723209 |  erot = 3.84566788758402 | epot = -22.7352151098034 | etot = -16.4560456549873
-363000  ekin = 2.91069717970492 |  erot = 1.99710098714122 | epot = -22.6302259934474 | etot = -17.7224278266013
-364000  ekin = 2.2553832868325 |  erot = 1.87832387363455 | epot = -22.5083625296191 | etot = -18.374655369152
-365000  ekin = 2.04575884197224 |  erot = 2.797742068412 | epot = -22.332262738426 | etot = -17.4887618280417
-366000  ekin = 2.26894187965217 |  erot = 1.94379382552235 | epot = -22.2788727984906 | etot = -18.0661370933161
-367000  ekin = 2.82509630766737 |  erot = 2.50361468767084 | epot = -22.3209381619452 | etot = -16.992227166607
-368000  ekin = 2.81542036602322 |  erot = 2.18733627644489 | epot = -22.4297259451244 | etot = -17.4269693026563
-369000  ekin = 2.30426035796382 |  erot = 2.85653411706989 | epot = -22.4923286665588 | etot = -17.3315341915251
-370000  ekin = 2.67871033327547 |  erot = 2.11464921695177 | epot = -22.578069860797 | etot = -17.7847103105697
-371000  ekin = 2.19281044135007 |  erot = 3.60165960664287 | epot = -22.6424730832337 | etot = -16.8480030352407
-372000  ekin = 1.77481259468411 |  erot = 3.406547444381 | epot = -22.7147683829008 | etot = -17.5334083438357
-373000  ekin = 2.15551547517191 |  erot = 2.7877825236183 | epot = -22.7559497214321 | etot = -17.8126517226419
-374000  ekin = 2.71938368055486 |  erot = 3.58127823243842 | epot = -22.9084433694729 | etot = -16.6077814564796
-375000  ekin = 2.42759321485976 |  erot = 2.9742127178716 | epot = -22.9740378563778 | etot = -17.5722319236464
-376000  ekin = 3.39126830110572 |  erot = 3.24733797625004 | epot = -22.9874015798135 | etot = -16.3487953024578
-377000  ekin = 3.20966733323472 |  erot = 2.65934060364476 | epot = -22.9452111216365 | etot = -17.076203184757
-378000  ekin = 1.56095946168131 |  erot = 2.66159033944991 | epot = -22.9575870308253 | etot = -18.7350372296941
-379000  ekin = 1.9498568748538 |  erot = 2.54085216255828 | epot = -22.9834751642939 | etot = -18.4927661268818
-380000  ekin = 2.65820438237073 |  erot = 2.88045867212573 | epot = -22.9984703542083 | etot = -17.4598072997118
-381000  ekin = 2.97084599252829 |  erot = 2.18892549461574 | epot = -23.0341895570111 | etot = -17.8744180698671
-382000  ekin = 2.61355176942653 |  erot = 2.02938704043227 | epot = -23.00841197151 | etot = -18.3654731616512
-383000  ekin = 2.03830671072154 |  erot = 2.50516194855525 | epot = -23.0393965606452 | etot = -18.4959279013684
-384000  ekin = 2.1060608733416 |  erot = 2.2184025045895 | epot = -23.0602182522593 | etot = -18.7357548743282
-385000  ekin = 1.89114918519107 |  erot = 1.63701051320103 | epot = -23.0834434146806 | etot = -19.5552837162885
-386000  ekin = 1.55124380123707 |  erot = 1.36147797265396 | epot = -23.1300518396949 | etot = -20.2173300658039
-387000  ekin = 2.19627825752355 |  erot = 1.75751396098972 | epot = -23.1280875332419 | etot = -19.1742953147287
-388000  ekin = 1.96387084539616 |  erot = 1.95852585326804 | epot = -23.0327752892415 | etot = -19.1103785905773
-389000  ekin = 2.50801560941705 |  erot = 2.32519825784836 | epot = -23.0011464671235 | etot = -18.1679325998581
-390000  ekin = 2.03596866068489 |  erot = 1.88295618907177 | epot = -22.8810338311575 | etot = -18.9621089814009
-391000  ekin = 1.8098591016452 |  erot = 2.39622167162874 | epot = -22.81955664632 | etot = -18.613475873046
-392000  ekin = 2.17725370142733 |  erot = 2.87094426544089 | epot = -22.7839731045438 | etot = -17.7357751376756
-393000  ekin = 2.14224634181997 |  erot = 3.17242974303658 | epot = -22.8435025538357 | etot = -17.5288264689792
-394000  ekin = 1.97769550804367 |  erot = 2.16375300420729 | epot = -22.8342667825711 | etot = -18.6928182703201
-395000  ekin = 2.03687268736298 |  erot = 2.49567469731651 | epot = -22.8892034986303 | etot = -18.3566561139508
-396000  ekin = 2.16189109047463 |  erot = 1.95308746486161 | epot = -22.9781386034885 | etot = -18.8631600481523
-397000  ekin = 2.41744222422408 |  erot = 1.65310699287476 | epot = -23.0900453292844 | etot = -19.0194961121856
-398000  ekin = 3.58905654436294 |  erot = 2.51930256503331 | epot = -23.2070733343384 | etot = -17.0987142249422
-399000  ekin = 2.65051654249497 |  erot = 1.78138450529865 | epot = -23.3040478764215 | etot = -18.8721468286279
-400000  ekin = 2.49402752614129 |  erot = 2.10290777432183 | epot = -23.3608759462318 | etot = -18.7639406457687
-401000  ekin = 2.04176177605462 |  erot = 2.154995213856 | epot = -23.4039603394011 | etot = -19.2072033494905
-402000  ekin = 2.44505875861459 |  erot = 2.11318097973378 | epot = -23.3975262709888 | etot = -18.8392865326404
-403000  ekin = 2.54858079745147 |  erot = 2.81138206601919 | epot = -23.476064698677 | etot = -18.1161018352063
-404000  ekin = 2.21063952462117 |  erot = 2.64710865829565 | epot = -23.574696037266 | etot = -18.7169478543492
-405000  ekin = 2.47328118101332 |  erot = 2.40933750599425 | epot = -23.5927917139469 | etot = -18.7101730269393
-406000  ekin = 2.24891173527799 |  erot = 2.23777884116047 | epot = -23.6086191890417 | etot = -19.1219286126032
-407000  ekin = 2.0107940045037 |  erot = 2.78642832526904 | epot = -23.5246032469978 | etot = -18.727380917225
-408000  ekin = 2.59464051790823 |  erot = 2.59123578102097 | epot = -23.4198302602656 | etot = -18.2339539613364
-409000  ekin = 2.37170880608734 |  erot = 2.26136902851213 | epot = -23.317258193724 | etot = -18.6841803591245
-410000  ekin = 1.99754661347185 |  erot = 1.95523998485755 | epot = -23.2950402043273 | etot = -19.3422536059979
-411000  ekin = 1.8693657058423 |  erot = 2.63899492681176 | epot = -23.2490367633041 | etot = -18.74067613065
-412000  ekin = 1.98214047746227 |  erot = 2.68315820775202 | epot = -23.1987357483281 | etot = -18.5334370631139
-413000  ekin = 2.39078873487373 |  erot = 2.65589562872907 | epot = -23.1435198518627 | etot = -18.0968354882599
-414000  ekin = 2.40821090859775 |  erot = 1.75574324408225 | epot = -23.0725048141377 | etot = -18.9085506614577
-415000  ekin = 2.74601981183015 |  erot = 2.43675176686816 | epot = -23.1211711904486 | etot = -17.9383996117503
-416000  ekin = 2.08828454200993 |  erot = 2.76783506526218 | epot = -23.1383119239965 | etot = -18.2821923167244
-417000  ekin = 2.01455344430628 |  erot = 1.95306265456051 | epot = -23.1433633505287 | etot = -19.1757472516619
-418000  ekin = 2.42716528853985 |  erot = 2.57642821145486 | epot = -23.127531797131 | etot = -18.1239382971363
-419000  ekin = 3.04095103685797 |  erot = 2.58427576972734 | epot = -23.0602279332617 | etot = -17.4350011266764
-420000  ekin = 2.6360746280152 |  erot = 2.44478111019393 | epot = -22.982092315172 | etot = -17.9012365769629
-421000  ekin = 2.53019765722915 |  erot = 1.78389585255477 | epot = -22.9707435541329 | etot = -18.6566500443489
-422000  ekin = 2.72457425772367 |  erot = 1.67768634886349 | epot = -22.9542997027495 | etot = -18.5520390961623
-423000  ekin = 2.11402997037893 |  erot = 2.55034580375608 | epot = -22.8263851956497 | etot = -18.1620094215147
-424000  ekin = 1.8895880210325 |  erot = 2.31332431343561 | epot = -22.772666888172 | etot = -18.5697545537039
-425000  ekin = 2.3595116370971 |  erot = 1.95762380637298 | epot = -22.7752082759346 | etot = -18.4580728324645
-426000  ekin = 2.23706657164627 |  erot = 2.60016134755148 | epot = -22.7844114251539 | etot = -17.9471835059562
-427000  ekin = 1.88801598248841 |  erot = 2.12415782350886 | epot = -22.9416586386639 | etot = -18.9294848326666
-428000  ekin = 1.92849031333042 |  erot = 2.44097902588716 | epot = -23.0611368174399 | etot = -18.6916674782223
-429000  ekin = 1.70536802258415 |  erot = 2.14916257389792 | epot = -23.0556586745393 | etot = -19.2011280780572
-430000  ekin = 2.30226095973205 |  erot = 2.14689932813604 | epot = -23.0606502516208 | etot = -18.6114899637527
-431000  ekin = 2.45988288454318 |  erot = 2.42278380298657 | epot = -23.0729777223881 | etot = -18.1903110348583
-432000  ekin = 2.80869332724974 |  erot = 2.19954129490925 | epot = -23.0939746542044 | etot = -18.0857400320454
-433000  ekin = 2.21130556188282 |  erot = 1.62882156110628 | epot = -23.1534080352157 | etot = -19.3132809122266
-434000  ekin = 2.60574953870752 |  erot = 2.36088790768803 | epot = -23.1901717047879 | etot = -18.2235342583923
-435000  ekin = 2.30377529593091 |  erot = 2.53917715731259 | epot = -23.1716983948432 | etot = -18.3287459415997
-436000  ekin = 2.42707603554825 |  erot = 2.75234181061924 | epot = -23.2197996577197 | etot = -18.0403818115522
-437000  ekin = 1.65090540276074 |  erot = 3.25345231298367 | epot = -23.2216366145388 | etot = -18.3172788987944
-438000  ekin = 1.56145302974407 |  erot = 2.60950810563796 | epot = -23.1303770792278 | etot = -18.9594159438458
-439000  ekin = 2.30955439722234 |  erot = 1.94011743371103 | epot = -23.1353170794497 | etot = -18.8856452485163
-440000  ekin = 2.53037674867674 |  erot = 3.0652704286103 | epot = -23.196858945292 | etot = -17.601211768005
-441000  ekin = 2.80107707952534 |  erot = 2.53664155736544 | epot = -23.1712373428919 | etot = -17.8335187060011
-442000  ekin = 2.92536323090713 |  erot = 2.88384500930017 | epot = -23.1123001627208 | etot = -17.3030919225135
-443000  ekin = 1.96543935969482 |  erot = 1.753449631552 | epot = -23.0380529084377 | etot = -19.3191639171909
-444000  ekin = 2.00309477401363 |  erot = 2.23897509587739 | epot = -22.9472103119533 | etot = -18.7051404420623
-445000  ekin = 2.20302071819722 |  erot = 2.06928381371828 | epot = -22.7775434364172 | etot = -18.5052389045017
-446000  ekin = 2.43487889302299 |  erot = 2.37751556007798 | epot = -22.6838190597697 | etot = -17.8714246066687
-447000  ekin = 2.2620819636031 |  erot = 2.41400188145197 | epot = -22.7082516636546 | etot = -18.0321678185995
-448000  ekin = 2.16184472791984 |  erot = 1.93539407204278 | epot = -22.8144859493263 | etot = -18.7172471493637
-449000  ekin = 2.21107967973114 |  erot = 2.34659682978741 | epot = -22.9059503054159 | etot = -18.3482737958974
-450000  ekin = 2.74677740004439 |  erot = 1.97222921372039 | epot = -22.860755926716 | etot = -18.1417493129513
-451000  ekin = 2.2050889378155 |  erot = 2.13042736119389 | epot = -22.8862608894796 | etot = -18.5507445904702
-452000  ekin = 2.52760608607095 |  erot = 2.34006815636601 | epot = -22.9138111972133 | etot = -18.0461369547763
-453000  ekin = 2.23448825172916 |  erot = 1.77834418215733 | epot = -22.8879238301791 | etot = -18.8750913962926
-454000  ekin = 2.4343851915949 |  erot = 2.59700848533281 | epot = -22.8184361849036 | etot = -17.7870425079759
-455000  ekin = 2.04195793930991 |  erot = 2.79639043747681 | epot = -22.6032980500354 | etot = -17.7649496732487
-456000  ekin = 2.00799933710202 |  erot = 2.53653815407518 | epot = -22.4355596266522 | etot = -17.891022135475
-457000  ekin = 2.60426208759883 |  erot = 2.46609612876191 | epot = -22.3409120082078 | etot = -17.270553791847
-458000  ekin = 2.01368468059037 |  erot = 1.9961381624531 | epot = -22.2549400327205 | etot = -18.2451171896771
-459000  ekin = 1.73688781588865 |  erot = 2.48572034306896 | epot = -22.2282088298767 | etot = -18.0056006709191
-460000  ekin = 1.91682575775988 |  erot = 2.08308677023944 | epot = -22.2211874714416 | etot = -18.2212749434423
-461000  ekin = 1.54933673126938 |  erot = 1.29454502815255 | epot = -22.1945151049368 | etot = -19.3506333455148
-462000  ekin = 2.44160489340629 |  erot = 1.34721473707676 | epot = -22.284671307697 | etot = -18.495851677214
-463000  ekin = 2.63165365707667 |  erot = 2.08143760128039 | epot = -22.4004513395625 | etot = -17.6873600812055
-464000  ekin = 2.67929276186416 |  erot = 3.72563793061087 | epot = -22.5200042545289 | etot = -16.1150735620538
-465000  ekin = 1.94880111369479 |  erot = 2.23148844819348 | epot = -22.685554296329 | etot = -18.5052647344407
-466000  ekin = 2.13853049638891 |  erot = 2.95056624305957 | epot = -22.7822881705531 | etot = -17.6931914311046
-467000  ekin = 2.46452767169615 |  erot = 2.1077848077008 | epot = -22.9485753844866 | etot = -18.3762629050896
-468000  ekin = 1.98589158006998 |  erot = 1.62816092182055 | epot = -23.0180008829524 | etot = -19.4039483810618
-469000  ekin = 2.498810820967 |  erot = 2.6361546272592 | epot = -23.0547833968841 | etot = -17.9198179486579
-470000  ekin = 2.91491361681313 |  erot = 3.19115611298998 | epot = -23.0448741101699 | etot = -16.9388043803668
-471000  ekin = 2.37554627514204 |  erot = 1.71739792236247 | epot = -22.9932329645513 | etot = -18.9002887670468
-472000  ekin = 2.18486807923518 |  erot = 2.00687069908099 | epot = -22.9563182572702 | etot = -18.764579478954
-473000  ekin = 2.36185345820899 |  erot = 2.86259041401023 | epot = -22.9161024426125 | etot = -17.6916585703933
-474000  ekin = 2.17077693495272 |  erot = 2.59376596740919 | epot = -22.7894018760352 | etot = -18.0248589736733
-475000  ekin = 2.37844153079293 |  erot = 2.01112751381907 | epot = -22.6793191497969 | etot = -18.2897501051849
-476000  ekin = 2.0876367643964 |  erot = 2.59647624455221 | epot = -22.6700039875052 | etot = -17.9858909785566
-477000  ekin = 2.52249432714936 |  erot = 3.55251934739867 | epot = -22.6424099194916 | etot = -16.5673962449436
-478000  ekin = 2.40424947791157 |  erot = 2.7323911725861 | epot = -22.544776325228 | etot = -17.4081356747303
-479000  ekin = 1.27637524434413 |  erot = 2.99749792697945 | epot = -22.4994949498981 | etot = -18.2256217785745
-480000  ekin = 1.81374950293817 |  erot = 2.14389317135939 | epot = -22.4678405170784 | etot = -18.5101978427809
-481000  ekin = 2.39496774186199 |  erot = 3.18299441824521 | epot = -22.4930736763177 | etot = -16.9151115162105
-482000  ekin = 3.21051763720184 |  erot = 2.40962326270833 | epot = -22.4479376181304 | etot = -16.8277967182202
-483000  ekin = 3.06081116762377 |  erot = 2.49856996934407 | epot = -22.4288948733283 | etot = -16.8695137363604
-484000  ekin = 2.7452293328759 |  erot = 2.53012629993099 | epot = -22.483756332919 | etot = -17.2084007001121
-485000  ekin = 3.33103095180521 |  erot = 2.42091818181918 | epot = -22.4922555047182 | etot = -16.7403063710938
-486000  ekin = 1.99323479363108 |  erot = 1.76127718142275 | epot = -22.5432098594131 | etot = -18.7886978843593
-487000  ekin = 2.64825718911654 |  erot = 2.50204426232017 | epot = -22.6407366935241 | etot = -17.4904352420874
-488000  ekin = 1.76385891719471 |  erot = 2.64266555173498 | epot = -22.6990728058786 | etot = -18.2925483369489
-489000  ekin = 2.10357630534276 |  erot = 2.95613916443127 | epot = -22.7877124402073 | etot = -17.7279969704332
-490000  ekin = 2.33515649128314 |  erot = 2.32995416999058 | epot = -22.7920703811403 | etot = -18.1269597198666
-491000  ekin = 2.48752587426647 |  erot = 2.58310949760555 | epot = -22.7834811495388 | etot = -17.7128457776668
-492000  ekin = 3.29820665204489 |  erot = 2.18682924183924 | epot = -22.7674519489923 | etot = -17.2824160551082
-493000  ekin = 3.40238156707506 |  erot = 2.35717041222451 | epot = -22.7149408840448 | etot = -16.9553889047452
-494000  ekin = 3.59348050162499 |  erot = 2.23182460532058 | epot = -22.7081682295491 | etot = -16.8828631226035
-495000  ekin = 2.52030309238562 |  erot = 2.16229430067423 | epot = -22.6973031832711 | etot = -18.0147057902113
-496000  ekin = 1.96100991422337 |  erot = 3.58581695215166 | epot = -22.7342002900882 | etot = -17.1873734237132
-497000  ekin = 2.2228647925968 |  erot = 2.49495319949133 | epot = -22.752706201593 | etot = -18.0348882095048
-498000  ekin = 1.71033952564695 |  erot = 2.41331591511584 | epot = -22.7131621100867 | etot = -18.589506669324
-499000  ekin = 2.41919864300729 |  erot = 2.82349519531821 | epot = -22.7304918052927 | etot = -17.4877979669672
-500000  ekin = 2.76271068346558 |  erot = 2.22796445937143 | epot = -22.810945568044 | etot = -17.820270425207
-501000  ekin = 2.97642553987186 |  erot = 1.97769778889399 | epot = -22.8306304048616 | etot = -17.8765070760957
-502000  ekin = 2.96175345860856 |  erot = 1.80859086419487 | epot = -22.8525538190094 | etot = -18.082209496206
-503000  ekin = 2.51126831088417 |  erot = 2.88572311841927 | epot = -22.8673362278446 | etot = -17.4703447985412
-504000  ekin = 2.84611165351303 |  erot = 2.67626783872459 | epot = -22.784891957601 | etot = -17.2625124653634
-505000  ekin = 2.96124584448914 |  erot = 2.59100575301934 | epot = -22.8251284225258 | etot = -17.2728768250174
-506000  ekin = 2.19858217910528 |  erot = 1.97142936872076 | epot = -22.8530995461462 | etot = -18.6830879983201
-507000  ekin = 2.27398115142402 |  erot = 2.68837996151517 | epot = -22.8141163798141 | etot = -17.8517552668749
-508000  ekin = 2.64439339973837 |  erot = 2.04756467869449 | epot = -22.8146247157345 | etot = -18.1226666373017
-509000  ekin = 2.96023637315629 |  erot = 2.90549934754532 | epot = -22.8719625385967 | etot = -17.0062268178951
-510000  ekin = 2.26067558634546 |  erot = 2.80864918519521 | epot = -22.9774448292236 | etot = -17.9081200576829
-511000  ekin = 2.88512738978599 |  erot = 2.15263877534437 | epot = -23.086672848248 | etot = -18.0489066831176
-512000  ekin = 2.17783748155516 |  erot = 2.31389139764186 | epot = -23.1520181882638 | etot = -18.6602893090668
-513000  ekin = 1.69717952556151 |  erot = 2.88265468656805 | epot = -23.1640284548407 | etot = -18.5841942427111
-514000  ekin = 1.72432024724117 |  erot = 2.32742209152174 | epot = -23.1602225830814 | etot = -19.1084802443185
-515000  ekin = 2.00525337522086 |  erot = 1.80102864435032 | epot = -23.1548763180746 | etot = -19.3485942985034
-516000  ekin = 3.04706172157038 |  erot = 1.54171785431326 | epot = -23.1202751246552 | etot = -18.5314955487716
-517000  ekin = 2.47323892251936 |  erot = 2.10799615007355 | epot = -23.0942246440307 | etot = -18.5129895714378
-518000  ekin = 2.03556879740597 |  erot = 2.51531294708502 | epot = -23.01998934344 | etot = -18.4691075989491
-519000  ekin = 1.59255614728459 |  erot = 1.63520468579907 | epot = -22.9787913166931 | etot = -19.7510304836094
-520000  ekin = 2.17210761761845 |  erot = 1.8975366735392 | epot = -22.9877149955356 | etot = -18.918070704378
-521000  ekin = 1.98466680078867 |  erot = 2.09219045542651 | epot = -23.0348541858322 | etot = -18.9579969296171
-522000  ekin = 2.72098469914434 |  erot = 2.19565658619456 | epot = -23.1001210576502 | etot = -18.1834797723113
-523000  ekin = 2.26033454380754 |  erot = 1.67112114369622 | epot = -23.1475509854345 | etot = -19.2160952979307
-524000  ekin = 2.34603831546138 |  erot = 2.1054661011949 | epot = -23.1746761633773 | etot = -18.723171746721
-525000  ekin = 2.13671314300235 |  erot = 2.07172081705863 | epot = -23.241177743004 | etot = -19.032743782943
-526000  ekin = 2.50849953901566 |  erot = 2.27662230434506 | epot = -23.3179050583979 | etot = -18.5327832150372
-527000  ekin = 3.04322527932213 |  erot = 1.8128057083239 | epot = -23.3977373118239 | etot = -18.5417063241779
-528000  ekin = 2.572303182379 |  erot = 2.54386055260816 | epot = -23.4208428708383 | etot = -18.3046791358511
-529000  ekin = 2.39361269633634 |  erot = 1.91637577362227 | epot = -23.3966015599491 | etot = -19.0866130899905
-530000  ekin = 3.3562937907424 |  erot = 3.41683815876463 | epot = -23.2977853851852 | etot = -16.5246534356781
-531000  ekin = 2.52741741752381 |  erot = 2.34075342407645 | epot = -23.1721175623278 | etot = -18.3039467207275
-532000  ekin = 2.78397051305127 |  erot = 1.78575123294094 | epot = -23.2171711834401 | etot = -18.6474494374479
-533000  ekin = 2.27408274334042 |  erot = 2.01427501035043 | epot = -23.2885684059727 | etot = -19.0002106522818
-534000  ekin = 2.54998010491125 |  erot = 2.0164545364507 | epot = -23.340767920006 | etot = -18.7743332786441
-535000  ekin = 2.49595662250557 |  erot = 2.09586427439366 | epot = -23.3878755759449 | etot = -18.7960546790457
-536000  ekin = 2.47717157546008 |  erot = 1.92116873587364 | epot = -23.3847675210095 | etot = -18.9864272096758
-537000  ekin = 1.75235621440219 |  erot = 2.11852052216092 | epot = -23.4590860280326 | etot = -19.5882092914695
-538000  ekin = 2.19317209186629 |  erot = 2.75191518419657 | epot = -23.5517834707225 | etot = -18.6066961946597
-539000  ekin = 2.16135327665114 |  erot = 2.25935011393788 | epot = -23.5718250119029 | etot = -19.1511216213139
-540000  ekin = 2.35701554620647 |  erot = 1.6449529057333 | epot = -23.5490867129451 | etot = -19.5471182610054
-541000  ekin = 2.61451212811978 |  erot = 2.52550284426682 | epot = -23.5334576350385 | etot = -18.3934426626519
-542000  ekin = 2.78909215024063 |  erot = 2.09346850400965 | epot = -23.5754619290989 | etot = -18.6929012748486
-543000  ekin = 2.77024528778678 |  erot = 1.84116991183092 | epot = -23.4849560716084 | etot = -18.8735408719907
-544000  ekin = 2.15807529188369 |  erot = 1.50139575300257 | epot = -23.4530822422947 | etot = -19.7936111974084
-545000  ekin = 1.72860204886329 |  erot = 2.56468335549414 | epot = -23.4524953434144 | etot = -19.159209939057
-546000  ekin = 2.38494138419348 |  erot = 1.87772638427254 | epot = -23.4950389557033 | etot = -19.2323711872372
-547000  ekin = 2.44871634556835 |  erot = 2.44464466893214 | epot = -23.544915775382 | etot = -18.6515547608815
-548000  ekin = 2.36962922994878 |  erot = 2.40235228488721 | epot = -23.5548428056052 | etot = -18.7828612907692
-549000  ekin = 2.57958168249614 |  erot = 2.04930779813674 | epot = -23.5565149978683 | etot = -18.9276255172355
-550000  ekin = 1.9793136647427 |  erot = 1.85207468704394 | epot = -23.5614067919063 | etot = -19.7300184401196
-551000  ekin = 2.4121774327081 |  erot = 2.0348936886299 | epot = -23.5115216908382 | etot = -19.0644505695002
-552000  ekin = 2.6621149390197 |  erot = 1.41279265378133 | epot = -23.3450678435402 | etot = -19.2701602507391
-553000  ekin = 1.76359346131444 |  erot = 2.63019210822711 | epot = -23.1435570943958 | etot = -18.7497715248542
-554000  ekin = 2.29840754300073 |  erot = 2.34424452982823 | epot = -23.1114395278817 | etot = -18.4687874550527
-555000  ekin = 3.29672420152566 |  erot = 1.64146930698359 | epot = -23.0891292168918 | etot = -18.1509357083825
-556000  ekin = 2.92076699655596 |  erot = 2.59602967895818 | epot = -23.0268314200472 | etot = -17.5100347445331
-557000  ekin = 2.90322014804994 |  erot = 3.16052668894921 | epot = -23.0146480567181 | etot = -16.950901219719
-558000  ekin = 2.78018761002222 |  erot = 2.59826947006759 | epot = -22.7877399275349 | etot = -17.4092828474451
-559000  ekin = 2.48661596771862 |  erot = 3.22596665511856 | epot = -22.8226574327834 | etot = -17.1100748099462
-560000  ekin = 2.34942852601698 |  erot = 2.32773162877396 | epot = -22.8255608134696 | etot = -18.1484006586786
-561000  ekin = 2.0520192544917 |  erot = 2.90306975046936 | epot = -22.8488516051139 | etot = -17.8937626001529
-562000  ekin = 2.18821919117372 |  erot = 3.66499439159819 | epot = -22.7618817506902 | etot = -16.9086681679183
-563000  ekin = 3.11505518852414 |  erot = 2.28057725990564 | epot = -22.791430640287 | etot = -17.3957981918572
-564000  ekin = 2.45343120006931 |  erot = 2.36321638506708 | epot = -22.75807077839 | etot = -17.9414231932536
-565000  ekin = 2.77835835502221 |  erot = 2.07073547186409 | epot = -22.7486053888412 | etot = -17.8995115619549
-566000  ekin = 2.43655641927934 |  erot = 2.19832280178868 | epot = -22.7227654505166 | etot = -18.0878862294486
-567000  ekin = 2.71233133108494 |  erot = 2.01281091173405 | epot = -22.8839744455115 | etot = -18.1588322026925
-568000  ekin = 3.12450796157708 |  erot = 1.93520150351061 | epot = -22.9625972279254 | etot = -17.9028877628377
-569000  ekin = 3.72714267701977 |  erot = 2.06562452789051 | epot = -22.9814174117752 | etot = -17.1886502068649
-570000  ekin = 2.68808623045676 |  erot = 2.36042122391805 | epot = -22.998959026692 | etot = -17.9504515723172
-571000  ekin = 1.97223467321356 |  erot = 2.85558181274648 | epot = -22.9369001315648 | etot = -18.1090836456047
-572000  ekin = 2.4182049732123 |  erot = 2.40910077907643 | epot = -22.934930836907 | etot = -18.1076250846182
-573000  ekin = 1.76702714285012 |  erot = 2.31739567602694 | epot = -22.9768902017483 | etot = -18.8924673828712
-574000  ekin = 2.08740259214111 |  erot = 2.59288012722136 | epot = -23.0518321557917 | etot = -18.3715494364293
-575000  ekin = 2.34020490338786 |  erot = 2.78500973557001 | epot = -23.106579446946 | etot = -17.9813648079881
-576000  ekin = 2.15506609467459 |  erot = 3.3045287538029 | epot = -23.1521162771299 | etot = -17.6925214286524
-577000  ekin = 2.45698150895878 |  erot = 2.31876672704204 | epot = -23.1781917242715 | etot = -18.4024434882707
-578000  ekin = 2.59353106592521 |  erot = 2.33790294336519 | epot = -23.2101395643707 | etot = -18.2787055550803
-579000  ekin = 2.58102015460712 |  erot = 1.71748063175117 | epot = -23.1865014452815 | etot = -18.8880006589232
-580000  ekin = 2.30361750578347 |  erot = 2.87410564379621 | epot = -23.2045008793077 | etot = -18.026777729728
-581000  ekin = 2.45915247103344 |  erot = 2.59640238490727 | epot = -23.1882783600354 | etot = -18.1327235040947
-582000  ekin = 2.33801590725494 |  erot = 3.19256035650617 | epot = -23.2501410058056 | etot = -17.7195647420445
-583000  ekin = 1.95982078382855 |  erot = 2.81944051586213 | epot = -23.4085593869414 | etot = -18.6292980872508
-584000  ekin = 2.00358327245437 |  erot = 1.7126727026301 | epot = -23.4960310960901 | etot = -19.7797751210056
-585000  ekin = 2.28859150562676 |  erot = 2.06309046911262 | epot = -23.5306230166998 | etot = -19.1789410419604
-586000  ekin = 2.21858454582016 |  erot = 1.97776854350186 | epot = -23.4873397268816 | etot = -19.2909866375596
-587000  ekin = 3.70065233550663 |  erot = 1.82187748311298 | epot = -23.4652388428899 | etot = -17.9427090242702
-588000  ekin = 3.49447328534893 |  erot = 2.31981981591506 | epot = -23.3985567739262 | etot = -17.5842636726622
-589000  ekin = 2.66144502802388 |  erot = 3.02756546370717 | epot = -23.2783756079917 | etot = -17.5893651162607
-590000  ekin = 1.52141257336428 |  erot = 2.09874614600563 | epot = -23.1290158071881 | etot = -19.5088570878182
-591000  ekin = 1.82897193042274 |  erot = 1.75592223095374 | epot = -23.0622736076073 | etot = -19.4773794462309
-592000  ekin = 2.49491276892191 |  erot = 2.5482988197852 | epot = -23.054885494985 | etot = -18.0116739062779
-593000  ekin = 2.36845716276159 |  erot = 1.78503341410575 | epot = -23.005264310194 | etot = -18.8517737333267
-594000  ekin = 2.07907010887474 |  erot = 2.14563658430187 | epot = -22.9611396232755 | etot = -18.7364329300989
-595000  ekin = 2.62736231723874 |  erot = 2.0397582574453 | epot = -22.9495489717352 | etot = -18.2824283970512
-596000  ekin = 2.58985967531625 |  erot = 2.12449830164849 | epot = -22.9908505579803 | etot = -18.2764925810155
-597000  ekin = 3.02540042664856 |  erot = 3.14256707367048 | epot = -22.9740991012936 | etot = -16.8061316009746
-598000  ekin = 3.44397104083287 |  erot = 2.8605790839857 | epot = -23.0035411551228 | etot = -16.6989910303042
-599000  ekin = 2.13932500926498 |  erot = 3.49187029024979 | epot = -22.9657391359988 | etot = -17.334543836484
-600000  ekin = 2.19758597945326 |  erot = 2.49610822362376 | epot = -22.9452235009931 | etot = -18.2515292979161
-601000  ekin = 2.80918982916752 |  erot = 2.81768433603376 | epot = -22.8970508934525 | etot = -17.2701767282513
-602000  ekin = 2.30031523379463 |  erot = 2.40907304500534 | epot = -22.8523950981499 | etot = -18.1430068193499
-603000  ekin = 1.91335501396421 |  erot = 1.99518053980753 | epot = -22.7884152302358 | etot = -18.879879676464
-604000  ekin = 2.5976715095492 |  erot = 3.14351403383687 | epot = -22.7430641975849 | etot = -17.0018786541988
-605000  ekin = 2.63203298717972 |  erot = 2.07906613894389 | epot = -22.7307949909783 | etot = -18.0196958648547
-606000  ekin = 2.94678399289781 |  erot = 2.03982213630799 | epot = -22.6555302524726 | etot = -17.6689241232668
-607000  ekin = 2.85272606479019 |  erot = 2.36693467257681 | epot = -22.6318548820144 | etot = -17.4121941446474
-608000  ekin = 3.6642968125636 |  erot = 2.46706737589234 | epot = -22.5724662590778 | etot = -16.4411020706219
-609000  ekin = 2.69343886620625 |  erot = 2.25873504143679 | epot = -22.6007364465805 | etot = -17.6485625389374
-610000  ekin = 2.99904616523658 |  erot = 2.13621966615343 | epot = -22.5973658485054 | etot = -17.4621000171154
-611000  ekin = 3.86832985948944 |  erot = 2.12096644577641 | epot = -22.5702925425382 | etot = -16.5809962372724
-612000  ekin = 2.88515301824618 |  erot = 2.45910554524357 | epot = -22.4848584522585 | etot = -17.1405998887688
-613000  ekin = 2.9367425327116 |  erot = 2.14436169371533 | epot = -22.465526703267 | etot = -17.3844224768401
-614000  ekin = 2.79116462876301 |  erot = 2.024409539648 | epot = -22.5207406301148 | etot = -17.7051664617038
-615000  ekin = 2.29338048298908 |  erot = 2.38828872470982 | epot = -22.6082782403584 | etot = -17.9266090326595
-616000  ekin = 1.78195169789474 |  erot = 2.45334803626968 | epot = -22.6887534547644 | etot = -18.4534537206
-617000  ekin = 2.57505808534158 |  erot = 2.55345758187858 | epot = -22.701463839496 | etot = -17.5729481722758
-618000  ekin = 2.29561379442387 |  erot = 2.68043259355499 | epot = -22.629958627306 | etot = -17.6539122393272
-619000  ekin = 1.94323313590202 |  erot = 2.00964911157699 | epot = -22.56819110474 | etot = -18.6153088572609
-620000  ekin = 2.92263589097657 |  erot = 2.15657756066215 | epot = -22.6264664894927 | etot = -17.547253037854
-621000  ekin = 2.90437881656455 |  erot = 1.70649555848315 | epot = -22.665419447573 | etot = -18.0545450725253
-622000  ekin = 2.03426149564846 |  erot = 2.51826459248401 | epot = -22.6086250578043 | etot = -18.0560989696718
-623000  ekin = 1.98348786592096 |  erot = 3.08484972830227 | epot = -22.6234743341759 | etot = -17.5551367399527
-624000  ekin = 2.08463083558977 |  erot = 2.64004606903047 | epot = -22.6266529328942 | etot = -17.901976028274
-625000  ekin = 2.52963490334089 |  erot = 2.37033264022622 | epot = -22.6750436783156 | etot = -17.7750761347485
-626000  ekin = 2.73147680333726 |  erot = 2.07051651598004 | epot = -22.7272383647964 | etot = -17.9252450454791
-627000  ekin = 2.23447399123207 |  erot = 2.35288557052269 | epot = -22.7136740507756 | etot = -18.1263144890208
-628000  ekin = 2.28933754695897 |  erot = 2.29676268895054 | epot = -22.6176528573237 | etot = -18.0315526214142
-629000  ekin = 2.5355466362136 |  erot = 1.92082543033528 | epot = -22.5693331526924 | etot = -18.1129610861435
-630000  ekin = 3.11700824717166 |  erot = 2.51611049765935 | epot = -22.5144695759915 | etot = -16.8813508311605
-631000  ekin = 2.38844807455604 |  erot = 3.31601650504458 | epot = -22.5190998334878 | etot = -16.8146352538871
-632000  ekin = 2.59939587493746 |  erot = 2.51496212358955 | epot = -22.4711049664696 | etot = -17.3567469679426
-633000  ekin = 2.45338619933597 |  erot = 1.89874016257143 | epot = -22.4394257686937 | etot = -18.0872994067863
-634000  ekin = 2.23819111967047 |  erot = 1.98305652730466 | epot = -22.3433365860708 | etot = -18.1220889390957
-635000  ekin = 2.22438000857702 |  erot = 1.95893208021227 | epot = -22.2877959440852 | etot = -18.1044838552959
-636000  ekin = 2.26938644192167 |  erot = 2.77816773779856 | epot = -22.304696935737 | etot = -17.2571427560168
-637000  ekin = 1.97799147515645 |  erot = 2.59610837639352 | epot = -22.3353238115758 | etot = -17.7612239600258
-638000  ekin = 2.54901279963355 |  erot = 3.14232301833368 | epot = -22.3113570318407 | etot = -16.6200212138734
-639000  ekin = 2.38194254982011 |  erot = 2.49468098011844 | epot = -22.2696251856514 | etot = -17.3930016557128
-640000  ekin = 2.07438054408915 |  erot = 2.20336226777045 | epot = -22.1673693230788 | etot = -17.8896265112192
-641000  ekin = 2.49150296422893 |  erot = 3.53882164550033 | epot = -22.047323387435 | etot = -16.0169987777057
-642000  ekin = 3.37964058409635 |  erot = 2.18458831029801 | epot = -21.9324522713976 | etot = -16.3682233770032
-643000  ekin = 2.80862431007863 |  erot = 2.40815089193716 | epot = -21.8726014240441 | etot = -16.6558262220283
-644000  ekin = 2.952235016065 |  erot = 1.92776262379328 | epot = -21.826057423183 | etot = -16.9460597833247
-645000  ekin = 4.10488984334312 |  erot = 1.89062109330214 | epot = -21.7981661301139 | etot = -15.8026551934687
-646000  ekin = 2.50234872105284 |  erot = 2.00205075040523 | epot = -21.7221642434957 | etot = -17.2177647720377
-647000  ekin = 2.52267281239589 |  erot = 2.19481558810105 | epot = -21.7438885460027 | etot = -17.0264001455058
-648000  ekin = 2.99344241657584 |  erot = 2.11139263207284 | epot = -21.7373240000025 | etot = -16.6324889513538
-649000  ekin = 2.55027365085816 |  erot = 3.20350991793738 | epot = -21.7192481424448 | etot = -15.9654645736493
-650000  ekin = 3.75163896052813 |  erot = 2.44189212282279 | epot = -21.6756681314987 | etot = -15.4821370481478
-651000  ekin = 3.29740056237165 |  erot = 2.36780448747275 | epot = -21.5372361691658 | etot = -15.8720311193214
-652000  ekin = 2.54645886055823 |  erot = 2.99097829596978 | epot = -21.4549655298412 | etot = -15.9175283733132
-653000  ekin = 2.88682688109756 |  erot = 2.53633970608342 | epot = -21.4696471597398 | etot = -16.0464805725588
-654000  ekin = 2.28614085804932 |  erot = 2.12026601708473 | epot = -21.5642684321318 | etot = -17.1578615569978
-655000  ekin = 2.20709609517087 |  erot = 2.10729950549551 | epot = -21.5349466292622 | etot = -17.2205510285959
-656000  ekin = 2.40310876229413 |  erot = 2.09663823500903 | epot = -21.5631924595209 | etot = -17.0634454622178
-657000  ekin = 2.7886551346751 |  erot = 2.19608839827219 | epot = -21.794507747247 | etot = -16.8097642142998
-658000  ekin = 3.1025713807162 |  erot = 2.59154293692773 | epot = -21.96675599421 | etot = -16.2726416765661
-659000  ekin = 2.88891106020275 |  erot = 3.47010878893494 | epot = -22.0542552611187 | etot = -15.695235411981
-660000  ekin = 2.90074521854052 |  erot = 1.62850743298554 | epot = -22.1003034196589 | etot = -17.5710507681328
-661000  ekin = 3.26666543815737 |  erot = 1.86223225384175 | epot = -22.202664217118 | etot = -17.0737665251189
-662000  ekin = 3.1558491019044 |  erot = 2.16868634291728 | epot = -22.3049478747805 | etot = -16.9804124299588
-663000  ekin = 1.94349853674083 |  erot = 2.45687952722591 | epot = -22.3908978754178 | etot = -17.990519811451
-664000  ekin = 1.45445820960401 |  erot = 1.37641815749115 | epot = -22.5088813854798 | etot = -19.6780050183846
-665000  ekin = 1.57568561901953 |  erot = 2.30379312359823 | epot = -22.5957949572927 | etot = -18.7163162146749
-666000  ekin = 2.46162449261636 |  erot = 1.76978614573263 | epot = -22.7431602236664 | etot = -18.5117495853174
-667000  ekin = 2.82410423268351 |  erot = 2.3383666365949 | epot = -22.9350563238978 | etot = -17.7725854546194
-668000  ekin = 2.73717686116191 |  erot = 3.18779777915035 | epot = -23.0188768131827 | etot = -17.0939021728704
-669000  ekin = 3.41035672635339 |  erot = 2.45479601777612 | epot = -23.0718232403886 | etot = -17.2066704962591
-670000  ekin = 2.54649164859505 |  erot = 1.99520979169172 | epot = -23.0246775830826 | etot = -18.4829761427959
-671000  ekin = 2.3802025684166 |  erot = 3.00742736998541 | epot = -23.0023479116088 | etot = -17.6147179732068
-672000  ekin = 3.0126952152146 |  erot = 2.55297219144565 | epot = -22.9947723733502 | etot = -17.4291049666899
-673000  ekin = 3.39486270740071 |  erot = 2.3808700262033 | epot = -22.9033457919095 | etot = -17.1276130583054
-674000  ekin = 3.13698489626099 |  erot = 2.10609113054063 | epot = -22.8089270617647 | etot = -17.5658510349631
-675000  ekin = 2.32294130821675 |  erot = 1.5285851482073 | epot = -22.6840603385672 | etot = -18.8325338821432
-676000  ekin = 2.43564726401376 |  erot = 2.26860623636408 | epot = -22.6133446272028 | etot = -17.909091126825
-677000  ekin = 2.75162757613842 |  erot = 1.94219014743457 | epot = -22.7039380847023 | etot = -18.0101203611293
-678000  ekin = 2.86321973687601 |  erot = 1.66387788364136 | epot = -22.7223510604726 | etot = -18.1952534399553
-679000  ekin = 2.35079208772869 |  erot = 2.70386328048641 | epot = -22.7977445343495 | etot = -17.7430891661344
-680000  ekin = 2.48449675729004 |  erot = 2.90645575582477 | epot = -22.8559375688936 | etot = -17.4649850557788
-681000  ekin = 1.91581136662333 |  erot = 2.58179603882022 | epot = -22.7891325966099 | etot = -18.2915251911664
-682000  ekin = 2.10466427353705 |  erot = 2.69470735868807 | epot = -22.6959043279182 | etot = -17.896532695693
-683000  ekin = 2.34504535409021 |  erot = 2.11592035700791 | epot = -22.5718670441909 | etot = -18.1109013330928
-684000  ekin = 2.87198876498958 |  erot = 2.65732173958706 | epot = -22.4986977268025 | etot = -16.9693872222258
-685000  ekin = 3.03375238110975 |  erot = 2.18190577381518 | epot = -22.4634189289575 | etot = -17.2477607740326
-686000  ekin = 2.46248931777656 |  erot = 2.43025710170918 | epot = -22.4079029677658 | etot = -17.5151565482801
-687000  ekin = 2.74662486817896 |  erot = 1.79609152562411 | epot = -22.3360381567114 | etot = -17.7933217629083
-688000  ekin = 1.81703718003042 |  erot = 2.06511603415635 | epot = -22.3083758541198 | etot = -18.426222639933
-689000  ekin = 2.84202633430564 |  erot = 1.92033962884777 | epot = -22.3752571185822 | etot = -17.6128911554288
-690000  ekin = 2.07525448405017 |  erot = 2.46342632176817 | epot = -22.4633535431152 | etot = -17.9246727372969
-691000  ekin = 2.12558517800138 |  erot = 2.52961097164 | epot = -22.483426266766 | etot = -17.8282301171246
-692000  ekin = 2.86720433292881 |  erot = 2.65102150657025 | epot = -22.4003374064863 | etot = -16.8821115669873
-693000  ekin = 2.30143055084864 |  erot = 2.52290946383361 | epot = -22.2859681228792 | etot = -17.4616281081969
-694000  ekin = 2.88400701080875 |  erot = 2.34320802755437 | epot = -22.206318584282 | etot = -16.9791035459189
-695000  ekin = 2.93184722112895 |  erot = 2.22933507376834 | epot = -22.2348177906806 | etot = -17.0736354957833
-696000  ekin = 2.63173546326796 |  erot = 2.34275369570833 | epot = -22.274597219839 | etot = -17.3001080608627
-697000  ekin = 1.87084079501972 |  erot = 1.78050094908734 | epot = -22.2730387150935 | etot = -18.6216969709865
-698000  ekin = 2.19791428580687 |  erot = 2.82883581756349 | epot = -22.2819378523405 | etot = -17.2551877489701
-699000  ekin = 2.34279295545267 |  erot = 2.07514436344563 | epot = -22.2061425261575 | etot = -17.7882052072592
-700000  ekin = 2.576803119019 |  erot = 2.32167543064962 | epot = -22.1658685747825 | etot = -17.2673900251139
-701000  ekin = 2.9943865807539 |  erot = 1.89982533986206 | epot = -22.2191193266439 | etot = -17.324907406028
-702000  ekin = 2.68548464757459 |  erot = 2.65050744453208 | epot = -22.2547415922757 | etot = -16.918749500169
-703000  ekin = 2.01996957402024 |  erot = 2.04032822241737 | epot = -22.3253693056515 | etot = -18.2650715092139
-704000  ekin = 1.58871069317829 |  erot = 1.64014270467762 | epot = -22.3617232281452 | etot = -19.1328698302893
-705000  ekin = 2.3089415754982 |  erot = 1.90252913035993 | epot = -22.4307958564623 | etot = -18.2193251506042
-706000  ekin = 2.61729186445574 |  erot = 3.21879868039103 | epot = -22.5603358780911 | etot = -16.7242453332443
-707000  ekin = 2.60797107906866 |  erot = 2.31455039977396 | epot = -22.7102471053997 | etot = -17.7877256265571
-708000  ekin = 1.81633850341999 |  erot = 2.3482257566942 | epot = -22.841408787855 | etot = -18.6768445277408
-709000  ekin = 1.83541322105378 |  erot = 2.51792380003796 | epot = -23.0137235815795 | etot = -18.6603865604878
-710000  ekin = 2.2142058326246 |  erot = 1.92378721690473 | epot = -23.1433453130909 | etot = -19.0053522635615
-711000  ekin = 2.06744054454467 |  erot = 2.3981170935319 | epot = -23.1532717948855 | etot = -18.687714156809
-712000  ekin = 2.1727947270635 |  erot = 1.75362175342097 | epot = -23.0479262273955 | etot = -19.121509746911
-713000  ekin = 2.87118830138474 |  erot = 1.54943993787555 | epot = -22.8430575230906 | etot = -18.4224292838303
-714000  ekin = 2.0107946674397 |  erot = 1.87510988392751 | epot = -22.9212969433221 | etot = -19.0353923919549
-715000  ekin = 2.4992182958927 |  erot = 1.91934008289236 | epot = -22.9679126658062 | etot = -18.5493542870211
-716000  ekin = 2.94666510633353 |  erot = 2.18714442405523 | epot = -23.033997097429 | etot = -17.9001875670402
-717000  ekin = 3.07404079722085 |  erot = 2.46628262765133 | epot = -23.1869721551174 | etot = -17.6466487302452
-718000  ekin = 3.47060078371109 |  erot = 2.28206620506093 | epot = -23.2524492340768 | etot = -17.4997822453048
-719000  ekin = 4.08343792096552 |  erot = 3.10429377075217 | epot = -23.2448292181926 | etot = -16.0570975264749
-720000  ekin = 2.52774819763971 |  erot = 1.92867508904585 | epot = -23.1435084559682 | etot = -18.6870851692826
-721000  ekin = 2.58294244811584 |  erot = 2.0383053178033 | epot = -23.0601633758883 | etot = -18.4389156099691
-722000  ekin = 1.9445888545086 |  erot = 2.32008660802523 | epot = -22.9811929404572 | etot = -18.7165174779234
-723000  ekin = 2.41998340576259 |  erot = 2.12369728979369 | epot = -23.0570939793876 | etot = -18.5134132838314
-724000  ekin = 1.90406371300861 |  erot = 1.97533505769876 | epot = -23.1267629042383 | etot = -19.247364133531
-725000  ekin = 2.14287056473422 |  erot = 2.79289687450022 | epot = -23.1695632046138 | etot = -18.2337957653794
-726000  ekin = 2.26423317099721 |  erot = 2.55343019202652 | epot = -23.2432909083709 | etot = -18.4256275453472
-727000  ekin = 1.69816397656716 |  erot = 2.64011919415556 | epot = -23.298837689321 | etot = -18.9605545185982
-728000  ekin = 2.23000862561934 |  erot = 3.58521470578671 | epot = -23.3528245832467 | etot = -17.5376012518407
-729000  ekin = 2.70076566380343 |  erot = 1.73367306410751 | epot = -23.3971276122796 | etot = -18.9626888843686
-730000  ekin = 2.54818673802759 |  erot = 2.77394958410256 | epot = -23.3988686964744 | etot = -18.0767323743443
-731000  ekin = 2.69782550956093 |  erot = 2.04855826523075 | epot = -23.4310969813891 | etot = -18.6847132065974
-732000  ekin = 2.79613002753752 |  erot = 1.87867430486715 | epot = -23.4885161441653 | etot = -18.8137118117607
-733000  ekin = 2.20346728125046 |  erot = 2.64365594749975 | epot = -23.5261309431819 | etot = -18.6790077144317
-734000  ekin = 1.69780111261443 |  erot = 2.30917909560787 | epot = -23.5188046470475 | etot = -19.5118244388252
-735000  ekin = 2.18402736165936 |  erot = 2.72051620230871 | epot = -23.4712689506938 | etot = -18.5667253867257
-736000  ekin = 2.26138696009404 |  erot = 1.17083930058803 | epot = -23.4348107178754 | etot = -20.0025844571934
-737000  ekin = 2.22219419044796 |  erot = 3.14114682990362 | epot = -23.3869288757725 | etot = -18.0235878554209
-738000  ekin = 1.75464981631084 |  erot = 2.28485941478058 | epot = -23.2709893028052 | etot = -19.2314800717138
-739000  ekin = 1.41806378584362 |  erot = 2.16714034112821 | epot = -23.2213775300889 | etot = -19.636173403117
-740000  ekin = 1.90901017596351 |  erot = 2.27102763422491 | epot = -23.1829198366046 | etot = -19.0028820264162
-741000  ekin = 1.9930994487751 |  erot = 2.73523269523399 | epot = -23.1169670577824 | etot = -18.3886349137733
-742000  ekin = 1.99876411117685 |  erot = 1.89882876917754 | epot = -23.0300825800851 | etot = -19.1324896997307
-743000  ekin = 1.96472814667687 |  erot = 2.79504722629174 | epot = -22.8990488521609 | etot = -18.1392734791923
-744000  ekin = 2.02442646092311 |  erot = 2.35044838626024 | epot = -22.8186526150799 | etot = -18.4437777678966
-745000  ekin = 1.65344231988822 |  erot = 1.87919095141018 | epot = -22.7624827109091 | etot = -19.2298494396107
-746000  ekin = 2.1034668185472 |  erot = 2.03078530569663 | epot = -22.743454277698 | etot = -18.6092021534542
-747000  ekin = 3.06690414848489 |  erot = 1.6754029786949 | epot = -22.7625979159322 | etot = -18.0202907887524
-748000  ekin = 3.06965414483401 |  erot = 1.86014593098643 | epot = -22.8118567150739 | etot = -17.8820566392535
-749000  ekin = 2.53718696167217 |  erot = 2.02710579059033 | epot = -22.8431046011969 | etot = -18.2788118489344
-750000  ekin = 2.75657354808099 |  erot = 2.34953156046291 | epot = -22.9548205390759 | etot = -17.848715430532
-751000  ekin = 2.52290020835147 |  erot = 2.34873763599977 | epot = -23.0238691402084 | etot = -18.1522312958572
-752000  ekin = 2.47222247869325 |  erot = 1.68679846444683 | epot = -22.9958559112491 | etot = -18.8368349681091
-753000  ekin = 2.48263277172423 |  erot = 1.54669382815742 | epot = -23.0858212396418 | etot = -19.0564946397602
-754000  ekin = 2.54806257410878 |  erot = 2.26636466676163 | epot = -23.1896472696842 | etot = -18.3752200288138
-755000  ekin = 1.53168409517921 |  erot = 2.22665478278013 | epot = -23.2059118234918 | etot = -19.4475729455324
-756000  ekin = 2.10751715527953 |  erot = 2.40525774326678 | epot = -23.114150245375 | etot = -18.6013753468287
-757000  ekin = 2.93395895491028 |  erot = 2.05821177584909 | epot = -23.0783355599275 | etot = -18.0861648291682
-758000  ekin = 2.38307945406232 |  erot = 2.50598165375058 | epot = -22.9691152621287 | etot = -18.0800541543158
-759000  ekin = 2.60292884338835 |  erot = 2.36916677072548 | epot = -22.7987274767845 | etot = -17.8266318626707
-760000  ekin = 3.2284318196987 |  erot = 2.73822716520638 | epot = -22.6756147646272 | etot = -16.7089557797221
-761000  ekin = 3.41868727786494 |  erot = 1.68975765213408 | epot = -22.5638952547581 | etot = -17.4554503247591
-762000  ekin = 3.43033946346107 |  erot = 2.5283975140253 | epot = -22.3549032489322 | etot = -16.3961662714458
-763000  ekin = 2.65773094814485 |  erot = 1.83975133975562 | epot = -22.234833339183 | etot = -17.7373510512825
-764000  ekin = 2.3815484472129 |  erot = 2.70684992442147 | epot = -22.0890752688231 | etot = -17.0006768971887
-765000  ekin = 2.23212803588897 |  erot = 1.94868597739427 | epot = -21.9918715237933 | etot = -17.81105751051
-766000  ekin = 2.49097891886066 |  erot = 1.96764603993156 | epot = -21.8443436680801 | etot = -17.3857187092879
-767000  ekin = 2.3457921497675 |  erot = 2.64636009163513 | epot = -21.7634962034012 | etot = -16.7713439619986
-768000  ekin = 1.87671147825106 |  erot = 2.05549869178485 | epot = -21.7324638416528 | etot = -17.8002536716169
-769000  ekin = 3.05058687860239 |  erot = 2.66104171022372 | epot = -21.66792195987 | etot = -15.9562933710439
-770000  ekin = 2.44115683640633 |  erot = 1.97554932479751 | epot = -21.6448820664751 | etot = -17.2281759052712
-771000  ekin = 2.23687464004429 |  erot = 2.55040970708789 | epot = -21.5811924169692 | etot = -16.793908069837
-772000  ekin = 2.76529680592008 |  erot = 1.97873499811185 | epot = -21.6543448952384 | etot = -16.9103130912064
-773000  ekin = 2.14632888240094 |  erot = 2.41330587525514 | epot = -21.7728828090228 | etot = -17.2132480513667
-774000  ekin = 2.19848545803079 |  erot = 1.9765131024719 | epot = -21.8398858604883 | etot = -17.6648872999856
-775000  ekin = 2.52300137989083 |  erot = 2.80935365273515 | epot = -22.0219985274259 | etot = -16.6896434947999
-776000  ekin = 3.15842485269274 |  erot = 2.47066157093645 | epot = -22.183029096161 | etot = -16.5539426725319
-777000  ekin = 1.91784338934576 |  erot = 1.76045300517081 | epot = -22.2259652888115 | etot = -18.547668894295
-778000  ekin = 2.93738066043324 |  erot = 2.29457842490289 | epot = -22.2339481852394 | etot = -17.0019890999032
-779000  ekin = 3.09847206114319 |  erot = 2.0455771700605 | epot = -22.240438366259 | etot = -17.0963891350553
-780000  ekin = 2.86127568397807 |  erot = 3.12055135138658 | epot = -22.1865692766137 | etot = -16.204742241249
-781000  ekin = 2.36069914420785 |  erot = 3.53186431088487 | epot = -22.1210563364352 | etot = -16.2284928813425
-782000  ekin = 2.31592690319261 |  erot = 2.85730598644035 | epot = -22.0302855151548 | etot = -16.8570526255218
-783000  ekin = 1.86647729944746 |  erot = 3.03450246093099 | epot = -21.886014367949 | etot = -16.9850346075705
-784000  ekin = 2.04055627573201 |  erot = 2.26047908607293 | epot = -21.7534271639393 | etot = -17.4523918021343
-785000  ekin = 2.02248469828703 |  erot = 2.13950421850547 | epot = -21.6318967501918 | etot = -17.4699078333993
-786000  ekin = 2.34211746551602 |  erot = 2.34838133643265 | epot = -21.5890308210084 | etot = -16.8985320190598
-787000  ekin = 2.74971447554938 |  erot = 2.24123553296042 | epot = -21.5192132515563 | etot = -16.5282632430465
-788000  ekin = 2.14142056672039 |  erot = 2.27008574684965 | epot = -21.4982362621714 | etot = -17.0867299486013
-789000  ekin = 1.98580913341303 |  erot = 2.00702444041791 | epot = -21.5235331659838 | etot = -17.5306995921529
-790000  ekin = 1.68578263083924 |  erot = 1.43485602862151 | epot = -21.6440081593601 | etot = -18.5233694998993
-791000  ekin = 2.13583938840528 |  erot = 2.5373009545894 | epot = -21.7916440698418 | etot = -17.1185037268471
-792000  ekin = 1.71937483898028 |  erot = 2.19563804216011 | epot = -21.8794946709408 | etot = -17.9644817898004
-793000  ekin = 3.15868943755338 |  erot = 1.94575875708421 | epot = -22.0398145404617 | etot = -16.9353663458242
-794000  ekin = 2.45478602538954 |  erot = 3.00825554959563 | epot = -22.0843165283013 | etot = -16.6212749533161
-795000  ekin = 2.87760320917193 |  erot = 3.06920266633565 | epot = -22.1595628991904 | etot = -16.2127570236829
-796000  ekin = 2.29816690595058 |  erot = 1.61510864654315 | epot = -22.1869705548184 | etot = -18.2736950023247
-797000  ekin = 2.1901525606721 |  erot = 3.65734446008353 | epot = -22.1432608090644 | etot = -16.2957637883088
-798000  ekin = 2.12018787925578 |  erot = 2.92822258455555 | epot = -22.1311312789224 | etot = -17.0827208151111
-799000  ekin = 2.49416140154829 |  erot = 2.73328283280216 | epot = -22.0825726051882 | etot = -16.8551283708378
-800000  ekin = 2.18932007838552 |  erot = 2.97640731559393 | epot = -21.979362152191 | etot = -16.8136347582115
-801000  ekin = 2.58827112124838 |  erot = 2.7440442483726 | epot = -21.9108490336924 | etot = -16.5785336640714
-802000  ekin = 3.07870342348167 |  erot = 2.87961505564287 | epot = -21.822560433681 | etot = -15.8642419545565
-803000  ekin = 2.2398624368064 |  erot = 2.50525058807596 | epot = -21.72759408181 | etot = -16.9824810569277
-804000  ekin = 2.91885860068426 |  erot = 1.57889040451428 | epot = -21.6896376725624 | etot = -17.1918886673638
-805000  ekin = 2.68277363980193 |  erot = 3.05527868915738 | epot = -21.6710764398127 | etot = -15.9330241108534
-806000  ekin = 2.77769607049014 |  erot = 2.1888727690908 | epot = -21.6314833902337 | etot = -16.6649145506527
-807000  ekin = 2.12673239079668 |  erot = 2.86003407600806 | epot = -21.7295924017744 | etot = -16.7428259349697
-808000  ekin = 1.89599614774678 |  erot = 2.29237053227662 | epot = -21.7511361510417 | etot = -17.5627694710183
-809000  ekin = 1.96405066221971 |  erot = 1.92110393348368 | epot = -21.7075506883706 | etot = -17.8223960926672
-810000  ekin = 2.01518137594275 |  erot = 2.60119247286596 | epot = -21.6788385874729 | etot = -17.0624647386642
-811000  ekin = 2.31084800889289 |  erot = 1.75270367309064 | epot = -21.6837819033719 | etot = -17.6202302213883
-812000  ekin = 2.5770103100209 |  erot = 2.34932304073588 | epot = -21.7246716033188 | etot = -16.798338252562
-813000  ekin = 2.87706904926076 |  erot = 2.35686610624154 | epot = -21.8375922236049 | etot = -16.6036570681026
-814000  ekin = 2.89908405023866 |  erot = 2.31423299883226 | epot = -21.8379261473901 | etot = -16.6246090983192
-815000  ekin = 2.54050064212256 |  erot = 2.82732568868829 | epot = -21.6068952707049 | etot = -16.2390689398941
-816000  ekin = 2.17040404256387 |  erot = 2.53711088209172 | epot = -21.5560322071983 | etot = -16.8485172825427
-817000  ekin = 1.7842696071831 |  erot = 2.67810959410576 | epot = -21.8738878035325 | etot = -17.4115086022437
-818000  ekin = 2.29659398017838 |  erot = 2.63718862373664 | epot = -22.164277271391 | etot = -17.230494667476
-819000  ekin = 2.15801167884062 |  erot = 2.62095572928877 | epot = -22.1816109590116 | etot = -17.4026435508822
-820000  ekin = 1.94384548213955 |  erot = 2.28597987799275 | epot = -22.0986187375022 | etot = -17.8687933773699
-821000  ekin = 2.10513194007576 |  erot = 2.38698175569219 | epot = -22.1146754444785 | etot = -17.6225617487105
-822000  ekin = 2.24819716786441 |  erot = 2.15258805680875 | epot = -22.0539472940486 | etot = -17.6531620693754
-823000  ekin = 2.26584952085583 |  erot = 2.60619852526611 | epot = -22.0924201800579 | etot = -17.220372133936
-824000  ekin = 1.65187935478514 |  erot = 1.48703119037228 | epot = -22.1682955997986 | etot = -19.0293850546412
-825000  ekin = 1.60213094818648 |  erot = 1.98592524368393 | epot = -22.1687104063708 | etot = -18.5806542145004
-826000  ekin = 1.97430720107255 |  erot = 2.19175014677159 | epot = -22.1061881978655 | etot = -17.9401308500213
-827000  ekin = 2.1793755983405 |  erot = 2.44975419075935 | epot = -21.9704586607304 | etot = -17.3413288716305
-828000  ekin = 1.90399088418588 |  erot = 2.72532994798816 | epot = -21.9585923270583 | etot = -17.3292714948842
-829000  ekin = 2.06478103068884 |  erot = 2.9658303540259 | epot = -21.9849402038682 | etot = -16.9543288191534
-830000  ekin = 1.98920675238979 |  erot = 2.15331250444996 | epot = -22.0339146439702 | etot = -17.8913953871305
-831000  ekin = 2.33567462674689 |  erot = 2.36888807413497 | epot = -22.1271573756461 | etot = -17.4225946747643
-832000  ekin = 2.0119470999192 |  erot = 1.94769143293625 | epot = -22.2038482709588 | etot = -18.2442097381034
-833000  ekin = 2.26025933495881 |  erot = 2.16012558191462 | epot = -22.2882501045414 | etot = -17.867865187668
-834000  ekin = 2.11529426445865 |  erot = 1.52405523315358 | epot = -22.3075608649826 | etot = -18.6682113673703
-835000  ekin = 2.8992075090551 |  erot = 2.73801081751029 | epot = -22.3942491248321 | etot = -16.7570307982667
-836000  ekin = 3.33069528982658 |  erot = 2.4277126780786 | epot = -22.4321737300744 | etot = -16.6737657621692
-837000  ekin = 2.74831774333782 |  erot = 2.31991750378628 | epot = -22.4290234552872 | etot = -17.3607882081631
-838000  ekin = 3.13714871682188 |  erot = 3.21601751721777 | epot = -22.4642383906451 | etot = -16.1110721566054
-839000  ekin = 2.73358272751807 |  erot = 2.60144488190506 | epot = -22.4062682687368 | etot = -17.0712406593137
-840000  ekin = 2.96121930874637 |  erot = 1.42725942278118 | epot = -22.3293755621294 | etot = -17.9408968306018
-841000  ekin = 2.95134811170866 |  erot = 2.67666861874608 | epot = -22.2936348151224 | etot = -16.6656180846677
-842000  ekin = 2.15783928636401 |  erot = 2.30287195796693 | epot = -22.2978011147172 | etot = -17.8370898703863
-843000  ekin = 2.84565152669617 |  erot = 2.0510801477514 | epot = -22.3162908719779 | etot = -17.4195591975303
-844000  ekin = 2.99645803669157 |  erot = 1.50433298006521 | epot = -22.3768320579304 | etot = -17.8760410411736
-845000  ekin = 3.20248025697125 |  erot = 2.27246140825564 | epot = -22.3985708422076 | etot = -16.9236291769807
-846000  ekin = 3.35773945734322 |  erot = 2.54074745551552 | epot = -22.4144833015876 | etot = -16.5159963887289
-847000  ekin = 2.17779203733109 |  erot = 2.73817581188461 | epot = -22.3524825149514 | etot = -17.4365146657357
-848000  ekin = 2.51627348417144 |  erot = 2.81170686694717 | epot = -22.2066307862469 | etot = -16.8786504351283
-849000  ekin = 1.99679455190557 |  erot = 2.56855846773092 | epot = -22.0763062134929 | etot = -17.5109531938564
-850000  ekin = 2.05799123916876 |  erot = 1.80888056240785 | epot = -22.0665032506706 | etot = -18.1996314490939
-851000  ekin = 2.0888979376792 |  erot = 1.86172181790289 | epot = -22.0629711763889 | etot = -18.1123514208068
-852000  ekin = 1.68990805178902 |  erot = 1.42763535981882 | epot = -22.002100112701 | etot = -18.8845567010931
-853000  ekin = 1.99310886654811 |  erot = 3.05226969048292 | epot = -22.0306903552278 | etot = -16.9853117981968
-854000  ekin = 2.98378700534986 |  erot = 2.2310274524054 | epot = -22.1115820238811 | etot = -16.8967675661258
-855000  ekin = 2.17087415585277 |  erot = 2.8378147226879 | epot = -22.1115106395971 | etot = -17.1028217610564
-856000  ekin = 2.42228475387308 |  erot = 1.53328604594478 | epot = -22.0841888628209 | etot = -18.128618063003
-857000  ekin = 2.50431566526894 |  erot = 2.80498769176516 | epot = -21.9881235267534 | etot = -16.6788201697193
-858000  ekin = 2.17333686672378 |  erot = 2.8259111550717 | epot = -21.9093201368614 | etot = -16.9100721150659
-859000  ekin = 2.29930070497243 |  erot = 2.32417368939061 | epot = -21.8849849636104 | etot = -17.2615105692473
-860000  ekin = 1.99153024057672 |  erot = 1.94674638600151 | epot = -21.8998709373217 | etot = -17.9615943107434
-861000  ekin = 2.69177523559624 |  erot = 2.23997750036373 | epot = -21.8915522194994 | etot = -16.9597994835394
-862000  ekin = 2.86117050047984 |  erot = 2.41530060322761 | epot = -21.876687883023 | etot = -16.6002167793156
-863000  ekin = 2.59841547044276 |  erot = 3.3501705008543 | epot = -21.8162649771437 | etot = -15.8676790058467
-864000  ekin = 2.92496272611018 |  erot = 2.30350236144453 | epot = -21.7820358973268 | etot = -16.5535708097721
-865000  ekin = 1.94718216128952 |  erot = 2.16572180916633 | epot = -21.7000823492195 | etot = -17.5871783787636
-866000  ekin = 1.99006127871689 |  erot = 1.65011901234952 | epot = -21.6190182409268 | etot = -17.9788379498604
-867000  ekin = 1.76250718110787 |  erot = 3.37958608370307 | epot = -21.5401486584561 | etot = -16.3980553936452
-868000  ekin = 1.845623450314 |  erot = 2.78812196028616 | epot = -21.5771917352235 | etot = -16.9434463246234
-869000  ekin = 2.39300849969205 |  erot = 2.38301618173176 | epot = -21.6710790825578 | etot = -16.895054401134
-870000  ekin = 1.91899243212541 |  erot = 3.22222440717393 | epot = -21.6734733803871 | etot = -16.5322565410878
-871000  ekin = 3.10255827845531 |  erot = 2.95454268850896 | epot = -21.5913249106744 | etot = -15.5342239437101
-872000  ekin = 2.94582883077842 |  erot = 1.38261935263093 | epot = -21.4597055547833 | etot = -17.1312573713739
-873000  ekin = 2.72830997927423 |  erot = 2.23223699637274 | epot = -21.3657566950046 | etot = -16.4052097193577
-874000  ekin = 2.41464704842015 |  erot = 2.10351476791496 | epot = -21.2635161734954 | etot = -16.7453543571603
-875000  ekin = 2.99468455803482 |  erot = 2.72761242382524 | epot = -21.2488881289381 | etot = -15.526591147078
-876000  ekin = 2.13382009818493 |  erot = 2.23152059294678 | epot = -21.2388603913311 | etot = -16.8735197001994
-877000  ekin = 1.839391763993 |  erot = 1.607279977226 | epot = -21.2015948102408 | etot = -17.7549230690218
-878000  ekin = 2.01267175782178 |  erot = 2.73109796378376 | epot = -21.2125253160263 | etot = -16.4687555944208
-879000  ekin = 1.42911941081343 |  erot = 2.17371661448622 | epot = -21.1345316334464 | etot = -17.5316956081468
-880000  ekin = 2.10605339224633 |  erot = 2.5884751778913 | epot = -21.0787246891645 | etot = -16.3841961190269
-881000  ekin = 1.54924791070118 |  erot = 2.0068513915418 | epot = -21.1356465207066 | etot = -17.5795472184637
-882000  ekin = 2.199643157135 |  erot = 2.65509097106007 | epot = -21.2389026935677 | etot = -16.3841685653726
-883000  ekin = 2.20850404171077 |  erot = 2.22833605977577 | epot = -21.3067394383395 | etot = -16.869899336853
-884000  ekin = 2.76978562647275 |  erot = 2.10395845939756 | epot = -21.3429618615585 | etot = -16.4692177756882
-885000  ekin = 1.93339807672781 |  erot = 1.77156241344967 | epot = -21.3858074096933 | etot = -17.6808469195158
-886000  ekin = 2.00408769971894 |  erot = 3.10736267931439 | epot = -21.3935346347812 | etot = -16.2820842557479
-887000  ekin = 1.96987943750801 |  erot = 2.82035886899744 | epot = -21.3967073105593 | etot = -16.6064690040538
-888000  ekin = 1.91464371566411 |  erot = 2.33371232948867 | epot = -21.4767119016419 | etot = -17.2283558564891
-889000  ekin = 1.88227414130201 |  erot = 2.45915914930408 | epot = -21.5790392436829 | etot = -17.2376059530768
-890000  ekin = 1.84515176532447 |  erot = 2.24992378831499 | epot = -21.6747594004542 | etot = -17.5796838468148
-891000  ekin = 2.6016566869706 |  erot = 2.34500453305753 | epot = -21.8016735536793 | etot = -16.8550123336512
-892000  ekin = 2.71287751886859 |  erot = 2.69544224573131 | epot = -21.9063749565585 | etot = -16.4980551919586
-893000  ekin = 2.17862714611329 |  erot = 2.98452123742221 | epot = -21.9155556335137 | etot = -16.7524072499782
-894000  ekin = 2.52079948361477 |  erot = 2.46355933674925 | epot = -21.915110079455 | etot = -16.930751259091
-895000  ekin = 2.53566097944338 |  erot = 2.4513045444294 | epot = -21.947786087834 | etot = -16.9608205639612
-896000  ekin = 1.84455393639213 |  erot = 2.77499090684945 | epot = -21.9167554809878 | etot = -17.2972106377463
-897000  ekin = 2.38519326880694 |  erot = 2.019802873173 | epot = -21.8644918203993 | etot = -17.4594956784193
-898000  ekin = 2.14354914407572 |  erot = 1.89196669459414 | epot = -21.7953104274974 | etot = -17.7597945888276
-899000  ekin = 2.65485657727374 |  erot = 2.3237456003819 | epot = -21.6964754705568 | etot = -16.7178732929012
-900000  ekin = 2.1437154528087 |  erot = 2.28119066740275 | epot = -21.6934954112434 | etot = -17.2685892910319
-901000  ekin = 1.93965814946881 |  erot = 1.81495571440908 | epot = -21.7369092433376 | etot = -17.9822953794597
-902000  ekin = 2.60993957981555 |  erot = 2.50321386623391 | epot = -21.6842517568354 | etot = -16.571098310786
-903000  ekin = 1.87484955546757 |  erot = 2.17008893987962 | epot = -21.6383913984978 | etot = -17.5934529031506
-904000  ekin = 1.87454064845764 |  erot = 2.32484081519398 | epot = -21.5866637125315 | etot = -17.3872822488799
-905000  ekin = 2.31407473814844 |  erot = 2.15094868542391 | epot = -21.5154415841816 | etot = -17.0504181606093
-906000  ekin = 2.49583383758853 |  erot = 2.25091096848461 | epot = -21.5170853902294 | etot = -16.7703405841563
-907000  ekin = 4.19798796104344 |  erot = 2.5030532322807 | epot = -21.5976736513859 | etot = -14.8966324580618
-908000  ekin = 3.26730891548756 |  erot = 2.11222217905481 | epot = -21.7526644402476 | etot = -16.3731333457052
-909000  ekin = 2.64106561110374 |  erot = 1.92197432194202 | epot = -21.8748043207924 | etot = -17.3117643877467
-910000  ekin = 2.61805562731904 |  erot = 2.90737422678703 | epot = -21.9709470207745 | etot = -16.4455171666685
-911000  ekin = 2.62012718860141 |  erot = 4.35318528241844 | epot = -22.0282478750366 | etot = -15.0549354040167
-912000  ekin = 3.07628909273118 |  erot = 3.69371809788395 | epot = -22.0511180009901 | etot = -15.281110810375
-913000  ekin = 2.82956898268831 |  erot = 2.17078429141201 | epot = -22.0149543706266 | etot = -17.0146010965263
-914000  ekin = 2.16386655780066 |  erot = 1.22303673036133 | epot = -21.9243495493208 | etot = -18.5374462611589
-915000  ekin = 1.59447095066509 |  erot = 2.95966391292002 | epot = -21.8264580452026 | etot = -17.2723231816175
-916000  ekin = 2.58365539107523 |  erot = 3.75147270955029 | epot = -21.8922962938608 | etot = -15.5571681932352
-917000  ekin = 3.01643029206973 |  erot = 2.88035639021004 | epot = -21.9150526568514 | etot = -16.0182659745717
-918000  ekin = 2.89929776900147 |  erot = 2.64137394041291 | epot = -21.9078998623094 | etot = -16.367228152895
-919000  ekin = 3.20476671865012 |  erot = 2.76036957969153 | epot = -21.8878055443404 | etot = -15.9226692459988
-920000  ekin = 2.28949350558683 |  erot = 2.38558870046816 | epot = -21.8659406759967 | etot = -17.1908584699418
-921000  ekin = 2.39158312157105 |  erot = 2.44959700788167 | epot = -21.8638974869225 | etot = -17.0227173574697
-922000  ekin = 2.30678787768012 |  erot = 2.42145678067298 | epot = -21.8218369909645 | etot = -17.0935923326114
-923000  ekin = 2.49697778842282 |  erot = 2.66565493744118 | epot = -21.8078634464733 | etot = -16.6452307206093
-924000  ekin = 1.55676047489501 |  erot = 2.97115254541007 | epot = -21.7829722234117 | etot = -17.2550592031067
-925000  ekin = 1.86603413909288 |  erot = 1.96274861601779 | epot = -21.7288604040749 | etot = -17.9000776489642
-926000  ekin = 1.36993364395821 |  erot = 2.11749584641399 | epot = -21.7083442855147 | etot = -18.2209147951426
-927000  ekin = 2.55718977538496 |  erot = 2.08109095048881 | epot = -21.7242353526192 | etot = -17.0859546267455
-928000  ekin = 2.0974272910786 |  erot = 2.73922911267236 | epot = -21.7673808868819 | etot = -16.9307244831309
-929000  ekin = 1.85550591174834 |  erot = 1.84990976935039 | epot = -21.8639426090857 | etot = -18.158526927987
-930000  ekin = 1.99594723517184 |  erot = 2.09151231016387 | epot = -21.8461015073053 | etot = -17.7586419619696
-931000  ekin = 2.45331651079283 |  erot = 1.86703658018613 | epot = -21.7382799817762 | etot = -17.4179268907972
-932000  ekin = 2.76909250526759 |  erot = 2.34990175754269 | epot = -21.7639792890094 | etot = -16.6449850261991
-933000  ekin = 3.04747366335481 |  erot = 2.52740756503515 | epot = -21.6783727845496 | etot = -16.1034915561597
-934000  ekin = 2.93463275640818 |  erot = 2.48893095891026 | epot = -21.5784996926914 | etot = -16.1549359773729
-935000  ekin = 2.77799347567549 |  erot = 2.1392935841225 | epot = -21.5334239467005 | etot = -16.6161368869025
-936000  ekin = 2.96529953690398 |  erot = 2.07095365726714 | epot = -21.5249249864244 | etot = -16.4886717922533
-937000  ekin = 3.0485053770175 |  erot = 2.32432162998051 | epot = -21.4386642161072 | etot = -16.0658372091092
-938000  ekin = 2.9926262850536 |  erot = 2.35224559307843 | epot = -21.3457080466208 | etot = -16.0008361684887
-939000  ekin = 2.61238181353703 |  erot = 2.26780356837292 | epot = -21.3079422537804 | etot = -16.4277568718705
-940000  ekin = 2.65930112044942 |  erot = 2.75497479722395 | epot = -21.2170493356504 | etot = -15.802773417977
-941000  ekin = 2.27574261339217 |  erot = 2.61419196501686 | epot = -21.1297657597673 | etot = -16.2398311813583
-942000  ekin = 1.89172011891055 |  erot = 2.82029488513784 | epot = -21.0410099256114 | etot = -16.328994921563
-943000  ekin = 2.47643464476757 |  erot = 2.34737109151876 | epot = -21.046668772798 | etot = -16.2228630365117
-944000  ekin = 2.13883995897326 |  erot = 1.92577316206138 | epot = -21.0114219746514 | etot = -16.9468088536167
-945000  ekin = 2.57768697869113 |  erot = 2.21470136124069 | epot = -21.0634624131725 | etot = -16.2710740732407
-946000  ekin = 2.36420709243625 |  erot = 2.89647330776424 | epot = -21.088814693033 | etot = -15.8281342928325
-947000  ekin = 2.07104171538467 |  erot = 1.86575631327232 | epot = -21.1004860950452 | etot = -17.1636880663882
-948000  ekin = 1.85532958802997 |  erot = 1.36952834086551 | epot = -21.1364231315616 | etot = -17.9115652026661
-949000  ekin = 1.76206591178366 |  erot = 2.31737328558629 | epot = -21.1463744779337 | etot = -17.0669352805638
-950000  ekin = 1.72021033353108 |  erot = 2.24191394295309 | epot = -21.1376324866856 | etot = -17.1755082102014
-951000  ekin = 1.96140007830504 |  erot = 2.32248863487758 | epot = -21.1955927656813 | etot = -16.9117040524987
-952000  ekin = 2.93256201500608 |  erot = 2.74550490827503 | epot = -21.234781024541 | etot = -15.5567141012599
-953000  ekin = 2.95031285986317 |  erot = 2.39822873263993 | epot = -21.252609183133 | etot = -15.9040675906299
-954000  ekin = 3.09579074538114 |  erot = 1.98159252445734 | epot = -21.1641538136742 | etot = -16.0867705438357
-955000  ekin = 3.59360323486038 |  erot = 2.06789679071821 | epot = -21.0522880782498 | etot = -15.3907880526712
-956000  ekin = 2.97416074498497 |  erot = 3.66953591785751 | epot = -20.9097603766373 | etot = -14.2660637137948
-957000  ekin = 3.03140562067951 |  erot = 2.66078083760708 | epot = -20.741905867784 | etot = -15.0497194094974
-958000  ekin = 2.68913434704072 |  erot = 2.94057112873834 | epot = -20.5488384129041 | etot = -14.9191329371251
-959000  ekin = 1.93264217407773 |  erot = 2.45198406257092 | epot = -20.468781161493 | etot = -16.0841549248444
-960000  ekin = 1.49632279167952 |  erot = 3.13346348599987 | epot = -20.4844974178568 | etot = -15.8547111401774
-961000  ekin = 1.96353429663481 |  erot = 2.07553358516994 | epot = -20.4805590123497 | etot = -16.441491130545
-962000  ekin = 2.02830196392007 |  erot = 1.88908496389356 | epot = -20.5374211599971 | etot = -16.6200342321835
-963000  ekin = 1.80829526034561 |  erot = 2.46258345726267 | epot = -20.5841835730967 | etot = -16.3133048554884
-964000  ekin = 2.79449124937198 |  erot = 2.42527551362846 | epot = -20.623880544448 | etot = -15.4041137814476
-965000  ekin = 2.53493670506137 |  erot = 2.27804362684503 | epot = -20.6549300812151 | etot = -15.8419497493087
-966000  ekin = 2.0920817650402 |  erot = 2.27478990703181 | epot = -20.704473904241 | etot = -16.337602232169
-967000  ekin = 1.55562260797661 |  erot = 3.55543363172458 | epot = -20.739375276301 | etot = -15.6283190365998
-968000  ekin = 1.93439891222236 |  erot = 2.37295903815892 | epot = -20.7189229543385 | etot = -16.4115650039572
-969000  ekin = 2.16199728898303 |  erot = 2.4601205252494 | epot = -20.6747113173023 | etot = -16.0525935030699
-970000  ekin = 1.84926216722517 |  erot = 2.96951777569267 | epot = -20.6011599981509 | etot = -15.7823800552331
-971000  ekin = 1.93656411083027 |  erot = 3.08724923997924 | epot = -20.5835250734812 | etot = -15.5597117226717
-972000  ekin = 1.90452783927713 |  erot = 2.5823076678316 | epot = -20.5782905980209 | etot = -16.0914550909122
-973000  ekin = 2.1922712122506 |  erot = 2.92686386394502 | epot = -20.5868173702649 | etot = -15.4676822940693
-974000  ekin = 2.53094641465528 |  erot = 2.69271305556795 | epot = -20.5382547781502 | etot = -15.314595307927
-975000  ekin = 3.41187201669925 |  erot = 2.32917219553093 | epot = -20.5109803919917 | etot = -14.7699361797616
-976000  ekin = 2.88156114272554 |  erot = 3.10474521611246 | epot = -20.5158119249461 | etot = -14.5295055661081
-977000  ekin = 2.73962881168093 |  erot = 2.50884169958543 | epot = -20.4964590297999 | etot = -15.2479885185336
-978000  ekin = 1.79682802545478 |  erot = 2.06924041504343 | epot = -20.4730821934977 | etot = -16.6070137529995
-979000  ekin = 1.86521389998383 |  erot = 2.22151626929011 | epot = -20.4069392895634 | etot = -16.3202091202894
-980000  ekin = 1.92383169177414 |  erot = 1.56425965548877 | epot = -20.3533353734708 | etot = -16.8652440262079
-981000  ekin = 1.55110199282939 |  erot = 2.05381225133935 | epot = -20.3970890782076 | etot = -16.7921748340389
-982000  ekin = 1.85559395816058 |  erot = 1.96991369841493 | epot = -20.499354149896 | etot = -16.6738464933205
-983000  ekin = 2.75061857015333 |  erot = 1.7944840218308 | epot = -20.5241519929378 | etot = -15.9790494009537
-984000  ekin = 3.65069712553537 |  erot = 2.64237329124733 | epot = -20.6374699142712 | etot = -14.3443994974885
-985000  ekin = 2.9563732193106 |  erot = 2.18846412126773 | epot = -20.8122975273334 | etot = -15.6674601867551
-986000  ekin = 2.87072902054599 |  erot = 2.18810434250119 | epot = -20.9390290724605 | etot = -15.8801957094134
-987000  ekin = 3.37463328642758 |  erot = 2.5371366667467 | epot = -21.0098323012658 | etot = -15.0980623480916
-988000  ekin = 3.45107854450338 |  erot = 3.23625536313169 | epot = -21.0554260480417 | etot = -14.3680921404067
-989000  ekin = 2.83591404363756 |  erot = 2.20564156324817 | epot = -21.19499265416 | etot = -16.1534370472743
-990000  ekin = 2.79864389348437 |  erot = 1.83178426663539 | epot = -21.1880268304373 | etot = -16.5575986703175
-991000  ekin = 3.14781925181036 |  erot = 3.2078247180891 | epot = -21.1115234865128 | etot = -14.7558795166133
-992000  ekin = 3.30033725309946 |  erot = 2.62749912694387 | epot = -21.0030296251662 | etot = -15.0751932451229
-993000  ekin = 3.07374297249949 |  erot = 2.22697230616356 | epot = -20.9385586572609 | etot = -15.6378433785979
-994000  ekin = 3.21461776403449 |  erot = 2.80599707993708 | epot = -20.8790524582442 | etot = -14.8584376142727
-995000  ekin = 3.25071478747345 |  erot = 1.73415439498321 | epot = -20.8037804714002 | etot = -15.8189112889436
-996000  ekin = 3.07999632962569 |  erot = 3.18107550500824 | epot = -20.7805295335828 | etot = -14.5194576989488
-997000  ekin = 2.97118118001025 |  erot = 3.14046656474894 | epot = -20.7334885248756 | etot = -14.6218407801164
-998000  ekin = 3.09169861594907 |  erot = 1.99060706981745 | epot = -20.6553134096535 | etot = -15.573007723887
-999000  ekin = 2.07498130576584 |  erot = 2.75045972766921 | epot = -20.616091526295 | etot = -15.79065049286
-1000000  ekin = 2.07851119592057 |  erot = 2.11869313853035 | epot = -20.4539417072875 | etot = -16.2567373728366
- 1000000  0.092378275   -1.3359709  0.057599499   -1.1484644 2.8477973e-05 
-Loop time of 38.201 on 1 procs for 1000000 steps with 16 atoms
-
-Performance: 22617.237 tau/day, 26177.358 timesteps/s
-98.6% CPU use with 1 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 27.344     | 27.344     | 27.344     |   0.0 | 71.58
-Bond    | 0.88043    | 0.88043    | 0.88043    |   0.0 |  2.30
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 0.2073     | 0.2073     | 0.2073     |   0.0 |  0.54
-Output  | 7e-06      | 7e-06      | 7e-06      |   0.0 |  0.00
-Modify  | 9.4379     | 9.4379     | 9.4379     |   0.0 | 24.71
-Other   |            | 0.331      |            |       |  0.87
-
-Nlocal:    16 ave 16 max 16 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Nghost:    0 ave 0 max 0 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Neighs:    88 ave 88 max 88 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-
-Total # of neighbors = 88
-Ave neighs/atom = 5.5
-Ave special neighs/atom = 3.75
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:38
diff --git a/examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.4 b/examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.4
deleted file mode 100644
index 3010570379..0000000000
--- a/examples/USER/cgdna/examples/oxDNA/duplex2/log.18Jun19.duplex2.g++.4
+++ /dev/null
@@ -1,1167 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000189 secs
-  read_data CPU = 0.003505 secs
-
-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
-
-# 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 0.6 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 0.6 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
-
-#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 = 1.92828
-  ghost atom cutoff = 1.92828
-  binsize = 0.964142, bins = 42 42 42
-  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
-Per MPI rank memory allocation (min/avg/max) = 7.466 | 7.648 | 7.83 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 = 2.127459870274 | epot = -23.7545354032947 | etot = -19.7202708938335
-15000  ekin = 2.40428667481004 |  erot = 2.06172433796653 | epot = -23.6726347642127 | etot = -19.2066237514361
-16000  ekin = 2.7510166356243 |  erot = 1.18896277635345 | epot = -23.5745121257654 | etot = -19.6345327137876
-17000  ekin = 2.44090826892662 |  erot = 2.38166706806442 | epot = -23.5888433865641 | etot = -18.766268049573
-18000  ekin = 2.16977970545217 |  erot = 2.46915729098831 | epot = -23.6023194416344 | etot = -18.9633824451939
-19000  ekin = 2.19378610033861 |  erot = 2.45183819484608 | epot = -23.5449084745393 | etot = -18.8992841793546
-20000  ekin = 2.07734013817241 |  erot = 1.81448496219961 | epot = -23.5782673056894 | etot = -19.6864422053173
-21000  ekin = 2.27781532351243 |  erot = 2.76369118136087 | epot = -23.5986545956161 | etot = -18.5571480907428
-22000  ekin = 2.69375785791379 |  erot = 1.86436952967315 | epot = -23.5521083325077 | etot = -18.9939809449208
-23000  ekin = 1.99952884103097 |  erot = 2.28032953163858 | epot = -23.4448504933921 | etot = -19.1649921207226
-24000  ekin = 2.19993258930349 |  erot = 2.97916455146846 | epot = -23.365299008021 | etot = -18.1862018672491
-25000  ekin = 2.28089469652686 |  erot = 2.97627567077201 | epot = -23.2873526827526 | etot = -18.0301823154537
-26000  ekin = 1.99390998801618 |  erot = 2.79250495479073 | 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 = 3.11357086039976 | epot = -23.0617618407572 | etot = -17.6679525404769
-35000  ekin = 2.88795920533174 |  erot = 1.81662227096288 | epot = -23.1342233361349 | etot = -18.4296418598403
-36000  ekin = 2.40018487148211 |  erot = 2.59182059399979 | epot = -23.2153198761915 | etot = -18.2233144107096
-37000  ekin = 2.22699211630433 |  erot = 1.73889017332476 | epot = -23.2291614908027 | etot = -19.2632792011736
-38000  ekin = 2.13593461964592 |  erot = 3.07590136326317 | epot = -23.1607724763685 | etot = -17.9489364934594
-39000  ekin = 2.08839393640823 |  erot = 2.80471150509565 | epot = -23.1352878747759 | etot = -18.242182433272
-40000  ekin = 2.94982054413846 |  erot = 2.19484102372242 | epot = -23.1842229043853 | etot = -18.0395613365244
-41000  ekin = 2.47855373480178 |  erot = 3.46795094832273 | epot = -23.1698888629099 | etot = -17.2233841797854
-42000  ekin = 2.57225931171306 |  erot = 3.11160980977123 | epot = -23.0914425999525 | etot = -17.4075734784682
-43000  ekin = 2.16695829201326 |  erot = 2.67063324875933 | epot = -22.9841690345739 | etot = -18.1465774938013
-44000  ekin = 2.3251045436594 |  erot = 3.31069456451417 | epot = -22.9099977707014 | etot = -17.2741986625278
-45000  ekin = 1.8593572517472 |  erot = 3.48256913429863 | epot = -22.7853293556222 | etot = -17.4434029695763
-46000  ekin = 2.59906260222482 |  erot = 2.2320785378511 | epot = -22.67184319375 | etot = -17.8407020536741
-47000  ekin = 1.9041935097682 |  erot = 3.39352467596442 | epot = -22.5624536061979 | etot = -17.2647354204653
-48000  ekin = 2.46191536162938 |  erot = 2.50024189038396 | epot = -22.5888330081063 | etot = -17.626675756093
-49000  ekin = 3.18008619674965 |  erot = 2.18329398142911 | epot = -22.6110647388653 | etot = -17.2476845606865
-50000  ekin = 2.92380640638808 |  erot = 1.5483538313346 | epot = -22.6682279672282 | etot = -18.1960677295055
-51000  ekin = 2.86729503225236 |  erot = 2.67529217516738 | epot = -22.6748886664557 | etot = -17.132301459036
-52000  ekin = 2.30283827457731 |  erot = 1.82645474029553 | epot = -22.6607030819086 | etot = -18.5314100670358
-53000  ekin = 3.18697616339313 |  erot = 1.67211265049679 | epot = -22.7158951183044 | etot = -17.8568063044145
-54000  ekin = 2.63274995193146 |  erot = 1.96664130685844 | epot = -22.7877787224364 | etot = -18.1883874636465
-55000  ekin = 3.18311630681888 |  erot = 2.85127254864952 | epot = -22.8390589862477 | etot = -16.8046701307793
-56000  ekin = 2.55275960671527 |  erot = 3.05720384772627 | epot = -22.8187750450683 | etot = -17.2088115906267
-57000  ekin = 2.43682051944963 |  erot = 3.45782031837861 | epot = -22.7770565571277 | etot = -16.8824157192995
-58000  ekin = 1.93888380963701 |  erot = 2.51321017005842 | epot = -22.7135987564736 | etot = -18.2615047767781
-59000  ekin = 2.5584899615086 |  erot = 3.52166542523796 | epot = -22.6623202639297 | etot = -16.5821648771831
-60000  ekin = 2.80661395039301 |  erot = 2.89055248290059 | 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 = 2.65627195091608 |  erot = 2.46107949280746 | epot = -22.3986334001314 | etot = -17.2812819564079
-64000  ekin = 2.12379240032878 |  erot = 2.79203441675508 | epot = -22.3495990435982 | etot = -17.4337722265143
-65000  ekin = 1.86782238979936 |  erot = 2.70277079938775 | epot = -22.3710220966341 | etot = -17.800428907447
-66000  ekin = 2.74983103317414 |  erot = 1.93532287297328 | epot = -22.3642892005435 | etot = -17.6791352943961
-67000  ekin = 2.51092055125345 |  erot = 2.46618624666164 | epot = -22.3997780561407 | etot = -17.4226712582257
-68000  ekin = 2.95469759114172 |  erot = 1.97026833535316 | epot = -22.465077041847 | etot = -17.5401111153521
-69000  ekin = 2.60179538487173 |  erot = 2.27022574694886 | epot = -22.4013876082186 | etot = -17.529366476398
-70000  ekin = 2.38624525335423 |  erot = 2.82124637267728 | epot = -22.3329612644329 | etot = -17.1254696384013
-71000  ekin = 2.62641919853461 |  erot = 2.89332429923839 | epot = -22.3324946257813 | etot = -16.8127511280083
-72000  ekin = 2.93199679301318 |  erot = 2.83600213853038 | epot = -22.4418753486332 | etot = -16.6738764170897
-73000  ekin = 2.20521324648382 |  erot = 3.0506384171445 | epot = -22.5078076718832 | etot = -17.2519560082549
-74000  ekin = 2.16594519672766 |  erot = 2.82993872672918 | epot = -22.5187768617569 | etot = -17.5228929383001
-75000  ekin = 1.52753824412461 |  erot = 1.91758574309003 | epot = -22.6434864113427 | etot = -19.198362424128
-76000  ekin = 1.89477517532868 |  erot = 2.83145375092217 | epot = -22.7507099037207 | etot = -18.0244809774699
-77000  ekin = 2.84722966394523 |  erot = 3.20523918524771 | epot = -22.8263123696514 | etot = -16.7738435204585
-78000  ekin = 2.44900478430451 |  erot = 2.80964787966682 | epot = -22.8119237303111 | etot = -17.5532710663397
-79000  ekin = 2.16549328835506 |  erot = 1.67531288307153 | epot = -22.8278994273521 | etot = -18.9870932559255
-80000  ekin = 2.38929173610466 |  erot = 2.58355997375491 | epot = -22.7453472674483 | etot = -17.7724955575887
-81000  ekin = 2.74182188148999 |  erot = 1.92580771183151 | epot = -22.6872721828913 | etot = -18.0196425895698
-82000  ekin = 1.90254633515813 |  erot = 1.70958501101745 | 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 = -22.4457225556767 | etot = -18.3295663221553
-88000  ekin = 1.7511616822056 |  erot = 2.36434608342924 | epot = -22.4232555875236 | etot = -18.3077478218887
-89000  ekin = 1.85498863251071 |  erot = 3.29466014836527 | epot = -22.4615925106509 | etot = -17.3119437297749
-90000  ekin = 2.22730928223451 |  erot = 2.36761183779185 | epot = -22.5498488806969 | etot = -17.9549277606706
-91000  ekin = 2.40026068010467 |  erot = 3.1312454261103 | epot = -22.5445138059197 | etot = -17.0130076997047
-92000  ekin = 2.69184894487886 |  erot = 3.01111638487596 | epot = -22.5488335054242 | etot = -16.8458681756693
-93000  ekin = 3.04452081584098 |  erot = 3.0289315825034 | epot = -22.4857514998612 | etot = -16.4122991015169
-94000  ekin = 3.21054020599498 |  erot = 1.87554208928457 | epot = -22.58235617796 | etot = -17.4962738826805
-95000  ekin = 3.49164555041805 |  erot = 2.89107259754101 | epot = -22.651746211573 | etot = -16.2690280636139
-96000  ekin = 2.8961145983777 |  erot = 2.38403691628048 | epot = -22.6376886129393 | etot = -17.3575370982811
-97000  ekin = 1.94001816357315 |  erot = 2.09603205774619 | epot = -22.6212143095229 | etot = -18.5851640882036
-98000  ekin = 2.21812472183551 |  erot = 3.66512951907029 | epot = -22.5400207863669 | etot = -16.6567665454611
-99000  ekin = 1.96304801418099 |  erot = 2.78092002528644 | epot = -22.4500077741119 | etot = -17.7060397346444
-100000  ekin = 1.78146596589238 |  erot = 2.66087063973067 | epot = -22.3806285021859 | etot = -17.9382918965629
-101000  ekin = 2.13576431486591 |  erot = 2.39189697670582 | epot = -22.3671198416411 | etot = -17.8394585500694
-102000  ekin = 1.54265458925823 |  erot = 2.31301627489861 | epot = -22.3596033820568 | etot = -18.5039325179
-103000  ekin = 1.6493299781162 |  erot = 2.82700146777614 | epot = -22.4044472055819 | etot = -17.9281157596895
-104000  ekin = 1.88425130865015 |  erot = 3.36695629589132 | epot = -22.4614117565727 | etot = -17.2102041520312
-105000  ekin = 2.0873628063424 |  erot = 1.99902589912497 | epot = -22.4857870795246 | etot = -18.3993983740572
-106000  ekin = 2.85192200005481 |  erot = 1.96124421177818 | epot = -22.4885148263279 | etot = -17.6753486144949
-107000  ekin = 2.27699301124082 |  erot = 1.54572940373457 | epot = -22.4328687856414 | etot = -18.610146370666
-108000  ekin = 2.43341212242248 |  erot = 1.7101452395327 | epot = -22.4750159709763 | etot = -18.3314586090212
-109000  ekin = 2.3240302459673 |  erot = 2.92730273400661 | epot = -22.4544447404649 | etot = -17.203111760491
-110000  ekin = 2.75939007795593 |  erot = 2.3726124845783 | epot = -22.4066316113363 | etot = -17.2746290488021
-111000  ekin = 2.30202775259985 |  erot = 2.09098171366697 | epot = -22.340628179725 | etot = -17.9476187134581
-112000  ekin = 2.89672803093986 |  erot = 1.84536318388285 | epot = -22.189229344937 | etot = -17.4471381301143
-113000  ekin = 2.802868120203 |  erot = 1.68317583122193 | epot = -22.1739192926257 | etot = -17.6878753412008
-114000  ekin = 3.41134331362353 |  erot = 2.66279011393036 | epot = -22.2993892060878 | etot = -16.2252557785339
-115000  ekin = 3.04096848543598 |  erot = 1.72164164793761 | epot = -22.3101669297006 | etot = -17.547556796327
-116000  ekin = 3.18249263106367 |  erot = 3.21872780579631 | epot = -22.3766120310369 | etot = -15.975391594177
-117000  ekin = 3.04033644338918 |  erot = 2.4163277414929 | epot = -22.3406101341932 | etot = -16.8839459493111
-118000  ekin = 3.2297663279461 |  erot = 1.46870208555873 | epot = -22.262910646297 | etot = -17.5644422327922
-119000  ekin = 2.35815331598994 |  erot = 3.07464675916892 | epot = -22.21629705762 | etot = -16.7834969824611
-120000  ekin = 1.93901604028919 |  erot = 2.21087803685818 | epot = -22.1596747789505 | etot = -18.0097807018031
-121000  ekin = 1.94791988346889 |  erot = 3.06697908719322 | epot = -22.1473490758084 | etot = -17.1324501051462
-122000  ekin = 1.69642311218451 |  erot = 1.71065948591522 | epot = -22.235021693017 | etot = -18.8279390949172
-123000  ekin = 1.74537927001903 |  erot = 2.31042772730644 | epot = -22.3250546948603 | etot = -18.2692476975348
-124000  ekin = 2.74229806685692 |  erot = 1.94346011848795 | epot = -22.3376426377462 | etot = -17.6518844524013
-125000  ekin = 2.77628031613761 |  erot = 1.95737420539167 | epot = -22.3561899601979 | etot = -17.6225354386686
-126000  ekin = 2.05898577806786 |  erot = 1.47493157618749 | 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 = 2.38745668871875 | epot = -22.3622404512641 | etot = -17.4570651527346
-130000  ekin = 1.60778116741171 |  erot = 2.81983062254802 | epot = -22.3043401463426 | etot = -17.8767283563829
-131000  ekin = 2.27966529707091 |  erot = 2.29465997580789 | epot = -22.1860056729234 | etot = -17.6116804000446
-132000  ekin = 2.94605151024306 |  erot = 2.34727265039698 | epot = -22.1004107829512 | etot = -16.8070866223112
-133000  ekin = 2.00184520718143 |  erot = 2.13597622566089 | epot = -22.0860804435183 | etot = -17.948259010676
-134000  ekin = 1.54536260297594 |  erot = 2.86019181856985 | epot = -22.0324797134652 | etot = -17.6269252919194
-135000  ekin = 1.7899169229158 |  erot = 2.40585579784188 | epot = -22.0564792277569 | etot = -17.8607065069992
-136000  ekin = 1.63315069688348 |  erot = 2.13968964990471 | epot = -22.0645410751455 | etot = -18.2917007283573
-137000  ekin = 2.36475220491125 |  erot = 1.93075105476848 | epot = -22.101884847306 | etot = -17.8063815876262
-138000  ekin = 2.9554682114977 |  erot = 1.58329215843879 | epot = -22.158920719349 | etot = -17.6201603494125
-139000  ekin = 3.18559985564368 |  erot = 2.24978247982886 | epot = -22.2766713145625 | etot = -16.84128897909
-140000  ekin = 2.25331500051846 |  erot = 3.04264261269698 | epot = -22.4413209794807 | etot = -17.1453633662653
-141000  ekin = 1.8939664036255 |  erot = 3.12730191483887 | epot = -22.6943708703895 | etot = -17.6731025519251
-142000  ekin = 2.48698722341786 |  erot = 2.50204475841097 | epot = -22.8022645411412 | etot = -17.8132325593124
-143000  ekin = 2.39031114354901 |  erot = 2.72027514737474 | epot = -22.7789363640121 | etot = -17.6683500730884
-144000  ekin = 1.93009742932803 |  erot = 2.68112648713777 | epot = -22.6600942975092 | etot = -18.0488703810434
-145000  ekin = 1.81543048110687 |  erot = 1.73927524532866 | epot = -22.6290694904769 | etot = -19.0743637640413
-146000  ekin = 2.4125202126428 |  erot = 2.0856902293417 | epot = -22.560764077018 | etot = -18.0625536350335
-147000  ekin = 1.44642974398304 |  erot = 1.86921415702345 | epot = -22.4437745695725 | etot = -19.128130668566
-148000  ekin = 1.94224767107089 |  erot = 2.57935525538892 | epot = -22.4110987100046 | etot = -17.8894957835448
-149000  ekin = 2.03195649040454 |  erot = 3.31786202502786 | epot = -22.312227106758 | etot = -16.9624085913256
-150000  ekin = 2.47792894576431 |  erot = 2.68612874200302 | epot = -22.1392843642772 | etot = -16.9752266765099
-151000  ekin = 2.75692645092955 |  erot = 1.88122565848133 | epot = -21.9329416416722 | etot = -17.2947895322613
-152000  ekin = 2.7753834344323 |  erot = 1.78115734250796 | epot = -21.745072490984 | etot = -17.1885317140438
-153000  ekin = 3.09316888168833 |  erot = 1.80744228044955 | epot = -21.6451473427313 | etot = -16.7445361805934
-154000  ekin = 2.31433640945477 |  erot = 2.19304386678896 | epot = -21.5946356595636 | etot = -17.0872553833199
-155000  ekin = 1.94169881401553 |  erot = 2.67959698479411 | epot = -21.6941053409436 | etot = -17.0728095421339
-156000  ekin = 2.69151609119638 |  erot = 2.25048211983205 | epot = -21.7610571974251 | etot = -16.8190589863966
-157000  ekin = 3.89507004263776 |  erot = 2.74501587672577 | epot = -21.8157728797742 | etot = -15.1756869604107
-158000  ekin = 2.88173407476086 |  erot = 2.69702262693026 | epot = -21.8854957137509 | etot = -16.3067390120597
-159000  ekin = 3.15173323195919 |  erot = 2.61743473710129 | epot = -21.8245251626835 | etot = -16.055357193623
-160000  ekin = 2.54983562435716 |  erot = 3.26037467643908 | epot = -21.8527884226329 | etot = -16.0425781218366
-161000  ekin = 2.47569624391789 |  erot = 2.44418416527208 | epot = -21.7973550812186 | etot = -16.8774746720287
-162000  ekin = 2.9422872213738 |  erot = 2.59784970938383 | epot = -21.7813251561028 | etot = -16.2411882253452
-163000  ekin = 3.25812805712343 |  erot = 2.2523933100784 | epot = -21.820089307521 | etot = -16.3095679403192
-164000  ekin = 3.52786799143084 |  erot = 2.22392713421413 | epot = -21.7646946348872 | etot = -16.0128995092422
-165000  ekin = 2.47839548873417 |  erot = 2.58744140761171 | epot = -21.679095294504 | etot = -16.6132583981582
-166000  ekin = 2.14435847552791 |  erot = 3.04732688845808 | epot = -21.6219995979976 | etot = -16.4303142340116
-167000  ekin = 2.77664659649902 |  erot = 2.89037999868329 | epot = -21.5339928834654 | etot = -15.8669662882831
-168000  ekin = 1.74464407802389 |  erot = 2.78052653338967 | epot = -21.4288999288374 | etot = -16.9037293174239
-169000  ekin = 1.80689129093329 |  erot = 2.46391033708927 | epot = -21.4128285618694 | etot = -17.1420269338468
-170000  ekin = 1.6949814594151 |  erot = 2.88911238881154 | epot = -21.4319269866203 | etot = -16.8478331383937
-171000  ekin = 2.15326316196645 |  erot = 1.61346547801869 | epot = -21.2861470779283 | etot = -17.5194184379432
-172000  ekin = 1.67904916339532 |  erot = 2.36509147316375 | epot = -21.1250864759441 | etot = -17.080945839385
-173000  ekin = 2.05349972960735 |  erot = 2.1886466510775 | epot = -21.0744450592631 | etot = -16.8322986785782
-174000  ekin = 2.49402795941962 |  erot = 3.10392317000879 | epot = -20.9332609664624 | etot = -15.335309837034
-175000  ekin = 2.60611029063986 |  erot = 2.90993176119182 | epot = -20.8533230180668 | etot = -15.3372809662352
-176000  ekin = 2.14535974511637 |  erot = 2.67710511021539 | epot = -20.8508037764829 | etot = -16.0283389211511
-177000  ekin = 2.82654664242577 |  erot = 2.80647819657321 | epot = -20.9303681620826 | etot = -15.2973433230836
-178000  ekin = 3.17006270723388 |  erot = 1.88204403688962 | epot = -21.0665744865168 | etot = -16.0144677423933
-179000  ekin = 2.33834827123178 |  erot = 2.84870047825869 | epot = -21.1082901606943 | etot = -15.9212414112039
-180000  ekin = 2.39362550925045 |  erot = 2.94575326168227 | epot = -21.1089731290028 | etot = -15.7695943580701
-181000  ekin = 2.78703231260152 |  erot = 3.29998898392537 | epot = -21.0761138110654 | etot = -14.9890925145385
-182000  ekin = 3.02338391239199 |  erot = 2.32533107462881 | epot = -21.0444377426861 | etot = -15.6957227556653
-183000  ekin = 2.44126401356994 |  erot = 2.19853056632819 | epot = -20.8846280234405 | etot = -16.2448334435424
-184000  ekin = 2.56448211253962 |  erot = 2.77267067014066 | epot = -20.6657911214549 | etot = -15.3286383387746
-185000  ekin = 2.16427057092672 |  erot = 1.95880146934286 | epot = -20.5647658775173 | etot = -16.4416938372477
-186000  ekin = 2.06536030915311 |  erot = 3.14593463137772 | epot = -20.4537584304771 | etot = -15.2424634899463
-187000  ekin = 2.43846121057803 |  erot = 1.93593042270703 | epot = -20.4775765627296 | etot = -16.1031849294445
-188000  ekin = 2.28827356508696 |  erot = 2.89699235589217 | epot = -20.6028880527163 | etot = -15.4176221317372
-189000  ekin = 1.67206333515898 |  erot = 3.05807378739729 | epot = -20.6184572736204 | etot = -15.8883201510642
-190000  ekin = 1.96995062226968 |  erot = 2.94301967439401 | epot = -20.6150380630742 | etot = -15.7020677664105
-191000  ekin = 2.31558303301195 |  erot = 2.65062200614568 | epot = -20.5845049099943 | etot = -15.6182998708367
-192000  ekin = 3.58105122568799 |  erot = 2.89866835149675 | epot = -20.555036456006 | etot = -14.0753168788213
-193000  ekin = 2.69738971383614 |  erot = 3.08390984677749 | epot = -20.5718609412494 | etot = -14.7905613806358
-194000  ekin = 2.65963556416735 |  erot = 2.28486501061268 | epot = -20.4488832942326 | etot = -15.5043827194526
-195000  ekin = 1.85289053427901 |  erot = 2.65318671222087 | epot = -20.3816844231208 | etot = -15.8756071766209
-196000  ekin = 2.28257181147918 |  erot = 2.31175601065462 | epot = -20.4051132325268 | etot = -15.810785410393
-197000  ekin = 2.49770460330585 |  erot = 2.55587879440511 | epot = -20.4716020539923 | etot = -15.4180186562814
-198000  ekin = 2.01700960777427 |  erot = 1.51922008609382 | epot = -20.4907970823156 | etot = -16.9545673884475
-199000  ekin = 1.50027537520987 |  erot = 2.19604462463446 | epot = -20.5138434458212 | etot = -16.8175234459769
-200000  ekin = 1.64850512926723 |  erot = 2.4596633548257 | epot = -20.4934420686449 | etot = -16.385273584552
-201000  ekin = 2.62997533994907 |  erot = 2.61637339049483 | epot = -20.5569645618355 | etot = -15.3106158313916
-202000  ekin = 2.3089517547524 |  erot = 2.5565329388766 | epot = -20.6262537118088 | etot = -15.7607690181798
-203000  ekin = 1.64768887888551 |  erot = 2.11556417528285 | epot = -20.6617888215465 | etot = -16.8985357673782
-204000  ekin = 2.01924097320136 |  erot = 1.97748949636931 | epot = -20.7002685556682 | etot = -16.7035380860975
-205000  ekin = 2.97656554045711 |  erot = 3.25408007971553 | epot = -20.9425038008424 | etot = -14.7118581806698
-206000  ekin = 2.56613069661945 |  erot = 2.21624244224461 | epot = -21.0621833598182 | etot = -16.2798102209542
-207000  ekin = 3.44850636848559 |  erot = 2.48816050856267 | epot = -21.2038849430867 | etot = -15.2672180660384
-208000  ekin = 2.54208934028226 |  erot = 2.22605232144502 | epot = -21.3476404533667 | etot = -16.5794987916394
-209000  ekin = 3.84151461096732 |  erot = 2.16534559513903 | epot = -21.4932373455843 | etot = -15.486377139478
-210000  ekin = 3.06873591712904 |  erot = 2.24760815652574 | epot = -21.6427793540355 | etot = -16.3264352803807
-211000  ekin = 1.64176280869923 |  erot = 2.17721976802011 | epot = -21.8130439048272 | etot = -17.9940613281078
-212000  ekin = 2.5985934050661 |  erot = 2.41520703335869 | epot = -21.9964648294563 | etot = -16.9826643910315
-213000  ekin = 2.51136104390039 |  erot = 1.99503544560738 | epot = -22.161492842604 | etot = -17.6550963530962
-214000  ekin = 2.77089845962619 |  erot = 3.17247228684199 | epot = -22.208715104286 | etot = -16.2653443578179
-215000  ekin = 2.53408528186206 |  erot = 1.84963848601798 | 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 = 2.41974828067303 | epot = -22.2447049583244 | etot = -17.385593735012
-219000  ekin = 2.30221269367205 |  erot = 2.65120674162376 | epot = -22.2807164841742 | etot = -17.3272970488784
-220000  ekin = 1.70065256620687 |  erot = 2.34758543213915 | epot = -22.2809933538228 | etot = -18.2327553554768
-221000  ekin = 2.09298237125575 |  erot = 2.47886481595909 | 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 = 2.93869915115497 | epot = -22.1425986650605 | etot = -16.6080629425798
-225000  ekin = 3.29351563254165 |  erot = 2.8433953581414 | epot = -22.12757310355 | etot = -15.9906621128669
-226000  ekin = 3.03135339447922 |  erot = 2.08293143143602 | epot = -22.15283624886 | etot = -17.0385514229448
-227000  ekin = 2.50176282992082 |  erot = 3.15084128846394 | epot = -22.2250438959744 | etot = -16.5724397775897
-228000  ekin = 2.32013498351673 |  erot = 2.67554406359439 | epot = -22.3177515383563 | etot = -17.3220724912452
-229000  ekin = 2.89545450975319 |  erot = 2.90735055857068 | epot = -22.4361496683348 | etot = -16.6333446000109
-230000  ekin = 2.28321229485933 |  erot = 3.48420465632866 | epot = -22.548785995051 | etot = -16.781369043863
-231000  ekin = 2.0778632375453 |  erot = 3.10673973696436 | epot = -22.5896609633152 | etot = -17.4050579888055
-232000  ekin = 2.1202374109541 |  erot = 1.98747810033065 | epot = -22.5738924334392 | etot = -18.4661769221544
-233000  ekin = 2.33571877855589 |  erot = 2.83585090202738 | epot = -22.5402065195541 | etot = -17.3686368389708
-234000  ekin = 2.10578223747154 |  erot = 2.07381218733635 | epot = -22.5507693150833 | etot = -18.3711748902754
-235000  ekin = 2.44321041214394 |  erot = 2.80846352304318 | epot = -22.5606929563186 | etot = -17.3090190211315
-236000  ekin = 2.93630791731799 |  erot = 3.0631591853173 | epot = -22.4860653874722 | etot = -16.4865982848369
-237000  ekin = 3.21264879506079 |  erot = 3.26866508478298 | epot = -22.3683553437862 | etot = -15.8870414639424
-238000  ekin = 2.46595539123277 |  erot = 2.32502019506664 | epot = -22.3144456769666 | etot = -17.5234700906672
-239000  ekin = 2.10325864915823 |  erot = 2.47631139904042 | epot = -22.3011392921811 | etot = -17.7215692439825
-240000  ekin = 1.77270999777839 |  erot = 2.60141429112664 | epot = -22.2344206081543 | etot = -17.8602963192493
-241000  ekin = 1.94952922244078 |  erot = 1.39715216866764 | epot = -22.2207225048761 | etot = -18.8740411137677
-242000  ekin = 3.05687991591411 |  erot = 2.00862394928705 | epot = -22.2213200390944 | etot = -17.1558161738932
-243000  ekin = 2.86735711945299 |  erot = 1.79948118674678 | epot = -22.2697610280427 | etot = -17.6029227218429
-244000  ekin = 2.00525854269389 |  erot = 2.36445341214555 | epot = -22.2726788994494 | etot = -17.90296694461
-245000  ekin = 2.28011102404838 |  erot = 2.787005205328 | epot = -22.2995433574618 | etot = -17.2324271280854
-246000  ekin = 2.06819738789813 |  erot = 2.24624952782285 | epot = -22.2551680110138 | etot = -17.9407210952928
-247000  ekin = 1.69964711256213 |  erot = 3.22260619239827 | epot = -22.1916408256116 | etot = -17.2693875206512
-248000  ekin = 1.92997585194759 |  erot = 3.61155944514373 | epot = -22.0096484177853 | etot = -16.4681131206939
-249000  ekin = 2.16278530892653 |  erot = 3.27771891456709 | epot = -21.8856058980727 | etot = -16.4451016745791
-250000  ekin = 2.32204054211024 |  erot = 2.46317574116847 | epot = -21.8028762710592 | etot = -17.0176599877804
-251000  ekin = 1.23768964067254 |  erot = 2.24150533762101 | epot = -21.763065707404 | etot = -18.2838707291104
-252000  ekin = 1.79818833522214 |  erot = 2.12556386664128 | epot = -21.7586349357285 | etot = -17.8348827338651
-253000  ekin = 2.12809689846393 |  erot = 2.59685639208402 | epot = -21.7226495687758 | etot = -16.9976962782278
-254000  ekin = 2.46813261968532 |  erot = 2.00391812662869 | epot = -21.7113918037362 | etot = -17.2393410574222
-255000  ekin = 2.3156672908729 |  erot = 2.03619058028117 | epot = -21.7265453183257 | etot = -17.3746874471716
-256000  ekin = 2.87223929491326 |  erot = 2.61790933826624 | epot = -21.659332511914 | etot = -16.1691838787345
-257000  ekin = 2.85756762932927 |  erot = 2.081746739162 | epot = -21.6161821054731 | etot = -16.6768677369819
-258000  ekin = 2.06111021157734 |  erot = 2.32748664972428 | epot = -21.5132485706727 | etot = -17.124651709371
-259000  ekin = 2.23305784057759 |  erot = 2.88843859953735 | epot = -21.5040039667855 | etot = -16.3825075266705
-260000  ekin = 2.49862397932476 |  erot = 2.38336885848389 | epot = -21.488210637319 | etot = -16.6062177995103
-261000  ekin = 2.09280296934734 |  erot = 2.39632540029205 | epot = -21.4325331777953 | etot = -16.9434048081559
-262000  ekin = 2.33576913564289 |  erot = 2.67273419354397 | epot = -21.3832241450035 | etot = -16.3747208158166
-263000  ekin = 2.20536189489354 |  erot = 2.71530627040565 | epot = -21.4329409070981 | etot = -16.5122727417989
-264000  ekin = 2.2858247573423 |  erot = 2.76839346219664 | epot = -21.39310844316 | etot = -16.338890223621
-265000  ekin = 1.70928536820409 |  erot = 1.79395423442894 | epot = -21.2682341921474 | etot = -17.7649945895144
-266000  ekin = 2.48721735474525 |  erot = 2.08745460533224 | epot = -21.1746995817337 | etot = -16.6000276216562
-267000  ekin = 2.69283567987773 |  erot = 2.10301910407211 | epot = -21.1705161290062 | etot = -16.3746613450564
-268000  ekin = 3.00000233743719 |  erot = 2.80954585635721 | epot = -21.164752112651 | etot = -15.3552039188566
-269000  ekin = 3.50713810468527 |  erot = 2.35763817348003 | epot = -21.1537110688984 | etot = -15.2889347907331
-270000  ekin = 3.50686942248863 |  erot = 1.86462765875888 | epot = -21.1925508822801 | etot = -15.8210538010326
-271000  ekin = 3.57026082273992 |  erot = 2.08172467795384 | epot = -21.2775817182941 | etot = -15.6255962176003
-272000  ekin = 2.4484752533773 |  erot = 3.08466485039761 | epot = -21.3619851902072 | etot = -15.8288450864322
-273000  ekin = 2.39748176307241 |  erot = 3.13355050446718 | epot = -21.4386234252579 | etot = -15.9075911577183
-274000  ekin = 2.48208144431863 |  erot = 2.00552494041967 | epot = -21.4476232953882 | etot = -16.9600169106499
-275000  ekin = 2.48721081149369 |  erot = 3.05413598233603 | epot = -21.4713984309062 | etot = -15.9300516370765
-276000  ekin = 2.82709589676966 |  erot = 2.88384306577856 | epot = -21.4434590118161 | etot = -15.7325200492679
-277000  ekin = 2.23479555963313 |  erot = 2.20310851955638 | epot = -21.3883073251199 | etot = -16.9504032459304
-278000  ekin = 2.81418916407429 |  erot = 3.24537052192613 | epot = -21.3155364074003 | etot = -15.2559767213999
-279000  ekin = 2.57366525203699 |  erot = 1.81705578305929 | epot = -21.2862101233851 | etot = -16.8954890882888
-280000  ekin = 2.41063464320149 |  erot = 1.76282693004731 | epot = -21.2549625280961 | etot = -17.0815009548473
-281000  ekin = 2.58126226070487 |  erot = 2.29258221702166 | epot = -21.306394928225 | etot = -16.4325504504985
-282000  ekin = 3.02016903398222 |  erot = 2.43094523890341 | epot = -21.4340900724633 | etot = -15.9829757995777
-283000  ekin = 2.59269149790331 |  erot = 2.11330689541033 | epot = -21.6296517079942 | etot = -16.9236533146806
-284000  ekin = 2.51704243107537 |  erot = 3.13156683036761 | epot = -21.7452694753527 | etot = -16.0966602139097
-285000  ekin = 2.4236537221525 |  erot = 1.77228258125507 | epot = -21.8557019037769 | etot = -17.6597656003693
-286000  ekin = 1.9446719552166 |  erot = 2.0366097411672 | epot = -21.901435736722 | etot = -17.9201540403382
-287000  ekin = 2.56319670376172 |  erot = 2.60867050510166 | epot = -21.90675099349 | etot = -16.7348837846266
-288000  ekin = 2.19574207425738 |  erot = 1.69805542160023 | epot = -21.8143855675961 | etot = -17.9205880717385
-289000  ekin = 2.35326278833027 |  erot = 1.65840109676146 | epot = -21.6976038565284 | etot = -17.6859399714367
-290000  ekin = 2.3519456177505 |  erot = 1.99444238353744 | epot = -21.6551012116075 | etot = -17.3087132103195
-291000  ekin = 1.48585281531715 |  erot = 2.66475825861554 | epot = -21.56036793472 | etot = -17.4097568607873
-292000  ekin = 2.10739944756451 |  erot = 2.42809824662638 | epot = -21.4451596117638 | etot = -16.9096619175729
-293000  ekin = 2.11618090223716 |  erot = 1.86694554151198 | epot = -21.3593625692767 | etot = -17.3762361255276
-294000  ekin = 2.06078090566332 |  erot = 2.13941873359476 | epot = -21.2326233100941 | etot = -17.032423670836
-295000  ekin = 2.11467178034793 |  erot = 2.3267343667518 | epot = -21.1123588667461 | etot = -16.6709527196464
-296000  ekin = 1.53087058859331 |  erot = 2.94008409149153 | epot = -21.2112197533848 | etot = -16.7402650732999
-297000  ekin = 2.52732986791196 |  erot = 2.18380855337858 | epot = -21.1955190508786 | etot = -16.4843806295881
-298000  ekin = 1.89033945823196 |  erot = 2.02521913176001 | epot = -21.2593750718296 | etot = -17.3438164818376
-299000  ekin = 1.87142873048436 |  erot = 1.66404563221549 | epot = -21.2919162310488 | etot = -17.7564418683489
-300000  ekin = 2.23872615546788 |  erot = 1.50807257618897 | epot = -21.3339204593826 | etot = -17.5871217277258
-301000  ekin = 1.99965506724558 |  erot = 2.00145094516844 | epot = -21.4707589194325 | etot = -17.4696529070184
-302000  ekin = 1.76370349732521 |  erot = 2.23787708901487 | epot = -21.5675275978257 | etot = -17.5659470114856
-303000  ekin = 2.69610887251788 |  erot = 1.6995722142974 | epot = -21.5563765448092 | etot = -17.1606954579939
-304000  ekin = 2.55447143501921 |  erot = 2.02060813090349 | epot = -21.5692327321341 | etot = -16.9941531662114
-305000  ekin = 2.38230604232717 |  erot = 2.31489374428114 | epot = -21.5335950166329 | etot = -16.8363952300246
-306000  ekin = 2.07785475765118 |  erot = 2.4523066068597 | epot = -21.4550895345847 | etot = -16.9249281700738
-307000  ekin = 3.17130424567278 |  erot = 3.29574614566806 | epot = -21.4151535289883 | etot = -14.9481031376474
-308000  ekin = 3.40959217051674 |  erot = 2.68389483402973 | epot = -21.4778643688409 | etot = -15.3843773642944
-309000  ekin = 2.36068264180093 |  erot = 2.91715332823342 | epot = -21.5794336507741 | etot = -16.3015976807398
-310000  ekin = 2.4995235722922 |  erot = 2.36028950896138 | epot = -21.5982142524176 | etot = -16.738401171164
-311000  ekin = 2.53288726180906 |  erot = 2.29596940545851 | epot = -21.6418553661547 | etot = -16.8129986988871
-312000  ekin = 2.05123272208704 |  erot = 2.92023923411834 | epot = -21.7377547517075 | etot = -16.7662827955022
-313000  ekin = 1.80834719374888 |  erot = 2.29357283142125 | epot = -21.7993116362532 | etot = -17.6973916110831
-314000  ekin = 2.30684015099018 |  erot = 2.20859462712272 | epot = -21.8029398081388 | etot = -17.2875050300259
-315000  ekin = 1.86413924486173 |  erot = 2.14748794238475 | epot = -21.8550418960799 | etot = -17.8434147088335
-316000  ekin = 2.20558056533516 |  erot = 3.03447287931582 | epot = -21.8868412075709 | etot = -16.6467877629199
-317000  ekin = 2.47820931125479 |  erot = 3.56870099099487 | epot = -21.9902146748519 | etot = -15.9433043726022
-318000  ekin = 2.36582343801679 |  erot = 3.01887804681552 | epot = -22.1178732891163 | etot = -16.733171804284
-319000  ekin = 2.40464629760758 |  erot = 3.15910789488741 | epot = -22.2289401281565 | etot = -16.6651859356615
-320000  ekin = 1.80206494109346 |  erot = 2.83527990295434 | epot = -22.3120263401861 | etot = -17.6746814961383
-321000  ekin = 2.91146951948762 |  erot = 2.25772268449837 | epot = -22.3029455835947 | etot = -17.1337533796087
-322000  ekin = 2.8226351296685 |  erot = 2.67950826833977 | epot = -22.3041650189947 | etot = -16.8020216209865
-323000  ekin = 2.067323568424 |  erot = 2.319752847753 | epot = -22.3338840353559 | etot = -17.9468076191789
-324000  ekin = 2.6012747278288 |  erot = 2.58351861537749 | epot = -22.3215168526944 | etot = -17.1367235094881
-325000  ekin = 3.45560055552843 |  erot = 2.50162515355505 | epot = -22.1825527777624 | etot = -16.2253270686789
-326000  ekin = 3.51422890604519 |  erot = 2.84426061018012 | epot = -22.0201095272525 | etot = -15.6616200110272
-327000  ekin = 2.63551490316295 |  erot = 2.20570805472231 | epot = -21.9384479867007 | etot = -17.0972250288154
-328000  ekin = 1.8043914440792 |  erot = 2.37599512200968 | epot = -21.861980397642 | etot = -17.6815938315531
-329000  ekin = 2.15766181563134 |  erot = 2.45286496267961 | epot = -21.8518523862112 | etot = -17.2413256079002
-330000  ekin = 1.8483425992464 |  erot = 2.03367429366601 | epot = -21.768409525242 | etot = -17.8863926323296
-331000  ekin = 2.3531484336258 |  erot = 1.80165819621476 | epot = -21.7197009414848 | etot = -17.5648943116443
-332000  ekin = 1.67855936307207 |  erot = 2.5334121965131 | epot = -21.7336434355881 | etot = -17.5216718760029
-333000  ekin = 1.60376334688456 |  erot = 2.14058675025446 | epot = -21.835637958395 | etot = -18.091287861256
-334000  ekin = 2.26551990081779 |  erot = 2.62486254825415 | epot = -21.8794971078471 | etot = -16.9891146587751
-335000  ekin = 2.91208137486081 |  erot = 3.11052870452009 | epot = -21.9161692767172 | etot = -15.8935591973363
-336000  ekin = 2.73132973682385 |  erot = 2.56213100489412 | epot = -21.8312488568505 | etot = -16.5377881151325
-337000  ekin = 3.15411918141902 |  erot = 3.87512819831194 | epot = -21.9061152574783 | etot = -14.8768678777473
-338000  ekin = 2.33141760424507 |  erot = 2.13211945089677 | epot = -21.913746111238 | etot = -17.4502090560962
-339000  ekin = 1.71915361945719 |  erot = 2.31270220754042 | epot = -21.904207477372 | etot = -17.8723516503744
-340000  ekin = 1.62199393011804 |  erot = 3.16990972384471 | epot = -21.8898233676232 | etot = -17.0979197136604
-341000  ekin = 1.71588704296646 |  erot = 3.17642860992459 | epot = -21.8345558128149 | etot = -16.9422401599239
-342000  ekin = 1.82178091247658 |  erot = 2.58875985611024 | epot = -21.7161502950573 | etot = -17.3056095264705
-343000  ekin = 3.08559255942693 |  erot = 2.94813449265471 | epot = -21.7030445300997 | etot = -15.669317478018
-344000  ekin = 2.95985387154984 |  erot = 3.1154751585035 | epot = -21.6815483295521 | etot = -15.6062192994987
-345000  ekin = 2.33428072266864 |  erot = 2.88044431283017 | epot = -21.6567075042343 | etot = -16.4419824687355
-346000  ekin = 2.02077664062698 |  erot = 3.45936833964707 | epot = -21.5877268821218 | etot = -16.1075819018478
-347000  ekin = 2.34924784800441 |  erot = 1.93056350805623 | epot = -21.4896151766055 | etot = -17.2098038205448
-348000  ekin = 2.79839267202794 |  erot = 2.79408776517963 | epot = -21.4682057474678 | etot = -15.8757253102602
-349000  ekin = 2.33820470114614 |  erot = 3.12966318670513 | epot = -21.5603039389198 | etot = -16.0924360510685
-350000  ekin = 2.22383234890832 |  erot = 2.38886870388011 | epot = -21.5375784703117 | etot = -16.9248774175233
-351000  ekin = 2.33329735253339 |  erot = 2.84447430695179 | epot = -21.5078106306152 | etot = -16.33003897113
-352000  ekin = 2.74923373919408 |  erot = 2.76796181793625 | epot = -21.5537134920816 | etot = -16.0365179349512
-353000  ekin = 1.76111836153717 |  erot = 2.12255592617518 | epot = -21.5037017999955 | etot = -17.6200275122832
-354000  ekin = 2.29967358188085 |  erot = 2.37615363620183 | epot = -21.559257977819 | etot = -16.8834307597364
-355000  ekin = 2.32956787601564 |  erot = 2.41406261152025 | epot = -21.5311925684016 | etot = -16.7875620808657
-356000  ekin = 2.99536507165417 |  erot = 3.0133786789017 | epot = -21.461213826164 | etot = -15.4524700756081
-357000  ekin = 1.79487551861702 |  erot = 2.14781775756832 | epot = -21.4425100027869 | etot = -17.4998167266016
-358000  ekin = 2.06856992699964 |  erot = 1.9158505155371 | epot = -21.4597512525557 | etot = -17.475330810019
-359000  ekin = 2.03457633089973 |  erot = 2.13725650388114 | epot = -21.434584367242 | etot = -17.2627515324611
-360000  ekin = 2.64289898809605 |  erot = 2.45722294398598 | epot = -21.3798303659973 | etot = -16.2797084339152
-361000  ekin = 2.44681633772951 |  erot = 2.40323525392197 | epot = -21.4535746870958 | etot = -16.6035230954443
-362000  ekin = 2.27284400709389 |  erot = 2.04866562998477 | epot = -21.4444048899961 | etot = -17.1228952529175
-363000  ekin = 3.23945885057604 |  erot = 1.79247859381387 | epot = -21.4992698914106 | etot = -16.4673324470207
-364000  ekin = 3.01124200487831 |  erot = 2.16495867321708 | epot = -21.5330648567406 | etot = -16.3568641786452
-365000  ekin = 2.51472285580867 |  erot = 2.29864111879035 | epot = -21.6252096459669 | etot = -16.8118456713679
-366000  ekin = 2.59356655410022 |  erot = 2.21031948632573 | epot = -21.6397726115723 | etot = -16.8358865711464
-367000  ekin = 2.23422490605626 |  erot = 1.85375489374336 | epot = -21.7036464131406 | etot = -17.615666613341
-368000  ekin = 2.47747707853682 |  erot = 2.36511710555106 | epot = -21.7442459693683 | etot = -16.9016517852804
-369000  ekin = 2.03854183495619 |  erot = 2.80790943599038 | epot = -21.829546112742 | etot = -16.9830948417954
-370000  ekin = 2.08495509326204 |  erot = 2.15717784784087 | epot = -21.8579547558588 | etot = -17.6158218147559
-371000  ekin = 2.1649158804987 |  erot = 2.10731342711637 | epot = -21.750730287247 | etot = -17.4785009796319
-372000  ekin = 1.83416420958724 |  erot = 1.90082367490453 | epot = -21.6784224725519 | etot = -17.9434345880602
-373000  ekin = 1.97176482573297 |  erot = 1.77796007890949 | epot = -21.6393712386778 | etot = -17.8896463340354
-374000  ekin = 2.89940710658305 |  erot = 1.91194262525378 | epot = -21.5337545453636 | etot = -16.7224048135267
-375000  ekin = 2.32339676163341 |  erot = 1.92362318361284 | epot = -21.4217091025191 | 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 = 2.54156262207207 | epot = -21.3122380587448 | etot = -16.3871602961057
-379000  ekin = 2.08457212928958 |  erot = 2.11819645676889 | epot = -21.2663127721437 | etot = -17.0635441860853
-380000  ekin = 2.62168026009058 |  erot = 2.36576073073357 | epot = -21.2469701231192 | etot = -16.259529132295
-381000  ekin = 2.42554871977308 |  erot = 2.21588725182519 | epot = -21.2594018196931 | etot = -16.6179658480948
-382000  ekin = 2.04454090532126 |  erot = 3.35199327879852 | epot = -21.3507561156204 | etot = -15.9542219315006
-383000  ekin = 2.57756769789846 |  erot = 1.58356833947095 | epot = -21.4206473136967 | etot = -17.2595112763272
-384000  ekin = 2.32411392435712 |  erot = 2.07034159075996 | epot = -21.425401700327 | etot = -17.03094618521
-385000  ekin = 1.93815279071873 |  erot = 3.29970374476252 | epot = -21.4993838182002 | etot = -16.2615272827189
-386000  ekin = 2.10645704249442 |  erot = 2.94380940917572 | epot = -21.5050572923383 | etot = -16.4547908406681
-387000  ekin = 2.28625118399721 |  erot = 2.404880226949 | epot = -21.4350466670762 | etot = -16.74391525613
-388000  ekin = 2.84183807689895 |  erot = 2.72440789072405 | epot = -21.448767296848 | etot = -15.882521329225
-389000  ekin = 3.39750799106372 |  erot = 3.08194517695386 | epot = -21.6559630447603 | etot = -15.1765098767427
-390000  ekin = 2.82211920760115 |  erot = 2.04880343622589 | epot = -21.7229608878358 | etot = -16.8520382440088
-391000  ekin = 2.25113345866117 |  erot = 2.45876014532077 | epot = -21.7793475672488 | etot = -17.0694539632668
-392000  ekin = 2.6777973992177 |  erot = 2.75278604715789 | epot = -21.9200377033298 | etot = -16.4894542569542
-393000  ekin = 2.07336639249413 |  erot = 1.66102921524042 | epot = -22.0500496423094 | etot = -18.3156540345748
-394000  ekin = 2.1138614951422 |  erot = 2.4065490584156 | epot = -22.0647062581752 | etot = -17.5442957046174
-395000  ekin = 2.46967791557607 |  erot = 2.46187607744978 | epot = -22.0113006362931 | etot = -17.0797466432672
-396000  ekin = 3.17858061422168 |  erot = 1.60030928107608 | epot = -21.9570022338792 | etot = -17.1781123385814
-397000  ekin = 2.37483507726776 |  erot = 2.17387816921976 | epot = -21.8769234701935 | etot = -17.3282102237059
-398000  ekin = 2.29815779154461 |  erot = 2.2014862703049 | epot = -21.8293641014529 | etot = -17.3297200396034
-399000  ekin = 2.66620669497936 |  erot = 2.78316441348845 | epot = -21.7420307764657 | etot = -16.2926596679979
-400000  ekin = 1.8196142363994 |  erot = 2.77573291920477 | epot = -21.7225828560707 | etot = -17.1272357004666
-401000  ekin = 2.39347596566753 |  erot = 3.11237720134102 | epot = -21.7632198127751 | etot = -16.2573666457665
-402000  ekin = 4.01379092525261 |  erot = 3.58756310879361 | epot = -21.6952307126456 | etot = -14.0938766785994
-403000  ekin = 3.64238723358271 |  erot = 3.44210139074533 | epot = -21.6932224157202 | etot = -14.6087337913922
-404000  ekin = 2.52116102522202 |  erot = 2.99286839639893 | epot = -21.7395466120138 | etot = -16.2255171903929
-405000  ekin = 2.80514548558626 |  erot = 3.09807228440149 | epot = -21.809681120553 | etot = -15.9064633505653
-406000  ekin = 2.32696376764902 |  erot = 2.03572639782902 | epot = -21.9111381639248 | etot = -17.5484479984468
-407000  ekin = 2.33504128016395 |  erot = 1.91320949168965 | epot = -21.9359478399848 | etot = -17.6876970681312
-408000  ekin = 1.90942025822265 |  erot = 2.20375631379574 | epot = -21.9849314014528 | etot = -17.8717548294344
-409000  ekin = 1.98818542800297 |  erot = 1.95540808206523 | epot = -22.0378349759701 | etot = -18.0942414659019
-410000  ekin = 1.59823476401333 |  erot = 1.91272967852491 | epot = -22.0830507565096 | etot = -18.5720863139714
-411000  ekin = 1.87320182179615 |  erot = 2.46575148951076 | epot = -22.1911106440468 | etot = -17.8521573327399
-412000  ekin = 2.51909186028136 |  erot = 2.65534868642724 | epot = -22.281680067606 | etot = -17.1072395208974
-413000  ekin = 2.80929435327118 |  erot = 3.19888285052217 | epot = -22.1907679968741 | etot = -16.1825907930808
-414000  ekin = 2.79014519733558 |  erot = 2.7251519541093 | epot = -22.144863024243 | etot = -16.6295658727981
-415000  ekin = 2.46789019087319 |  erot = 2.24891720770208 | epot = -22.1977268949425 | etot = -17.4809194963672
-416000  ekin = 3.30766536008866 |  erot = 1.55878918639505 | epot = -22.1694878213559 | etot = -17.3030332748722
-417000  ekin = 3.95074944679108 |  erot = 2.44780201516577 | epot = -22.1018895242095 | etot = -15.7033380622526
-418000  ekin = 2.77340936693415 |  erot = 2.68993840817536 | epot = -21.977327562767 | etot = -16.5139797876575
-419000  ekin = 2.38275203991917 |  erot = 2.97769109273478 | epot = -21.9010102007429 | etot = -16.5405670680889
-420000  ekin = 1.80397709765343 |  erot = 1.82715488758969 | epot = -21.8849019003165 | etot = -18.2537699150734
-421000  ekin = 1.35294173647286 |  erot = 1.7746327595132 | epot = -21.8324727162455 | etot = -18.7048982202595
-422000  ekin = 1.39101035408781 |  erot = 2.74626781088313 | epot = -21.8922044238521 | etot = -17.7549262588811
-423000  ekin = 1.58313118355036 |  erot = 3.0798858727609 | epot = -21.9303489156376 | etot = -17.2673318593263
-424000  ekin = 2.38308976422853 |  erot = 2.0290563283423 | epot = -22.0003513420112 | etot = -17.5882052494403
-425000  ekin = 2.32292982636642 |  erot = 2.54472792699355 | epot = -22.0461884305753 | etot = -17.1785306772154
-426000  ekin = 2.07274921207622 |  erot = 3.12068562025985 | epot = -21.9899604929779 | etot = -16.7965256606419
-427000  ekin = 2.16499158921497 |  erot = 2.43609860560844 | epot = -21.883756502818 | etot = -17.2826663079946
-428000  ekin = 1.81001230881454 |  erot = 1.6518491031194 | epot = -21.8651168729134 | etot = -18.4032554609795
-429000  ekin = 1.67080799563552 |  erot = 2.55829004033943 | epot = -21.823203822061 | etot = -17.5941057860861
-430000  ekin = 2.68658781224627 |  erot = 2.8591925337156 | epot = -21.8545360487503 | etot = -16.3087557027885
-431000  ekin = 2.77334901985549 |  erot = 1.57746917070686 | epot = -21.8360353910944 | etot = -17.485217200532
-432000  ekin = 2.50244674166436 |  erot = 1.60779258881598 | epot = -21.7381087453319 | etot = -17.6278694148516
-433000  ekin = 1.85649371322473 |  erot = 2.4917335891794 | epot = -21.7919912827364 | etot = -17.4437639803323
-434000  ekin = 2.89302367450635 |  erot = 2.7989004560269 | epot = -21.923157505168 | etot = -16.2312333746348
-435000  ekin = 3.67647442700572 |  erot = 1.38588132381276 | epot = -22.1019777057281 | etot = -17.0396219549097
-436000  ekin = 3.05510329104703 |  erot = 2.00142902882896 | epot = -22.1034257027066 | etot = -17.0468933828306
-437000  ekin = 3.2334117289381 |  erot = 1.78346855436481 | epot = -22.1137020887251 | etot = -17.0968218054222
-438000  ekin = 2.86378458795303 |  erot = 1.84588842157479 | epot = -22.072414124752 | etot = -17.3627411152242
-439000  ekin = 2.41407153953135 |  erot = 2.70066632790346 | epot = -22.0535011599236 | etot = -16.9387632924888
-440000  ekin = 2.22110309163132 |  erot = 3.0167468581899 | epot = -22.0773629228072 | etot = -16.839512972986
-441000  ekin = 2.8952003347941 |  erot = 2.87911130379518 | epot = -22.2098492363511 | etot = -16.4355375977618
-442000  ekin = 2.05598301233622 |  erot = 1.73562369066667 | epot = -22.2689079268812 | etot = -18.4773012238783
-443000  ekin = 1.86650631344267 |  erot = 2.00816178040311 | epot = -22.3072964279925 | etot = -18.4326283341467
-444000  ekin = 2.06088560705618 |  erot = 2.15265011198712 | epot = -22.3186686701219 | etot = -18.1051329510786
-445000  ekin = 2.10029110633057 |  erot = 2.2800331405132 | epot = -22.3739249314238 | etot = -17.9936006845801
-446000  ekin = 2.42121462246176 |  erot = 2.85365097104764 | epot = -22.4030820729314 | etot = -17.128216479422
-447000  ekin = 2.19905370994782 |  erot = 2.98216231903379 | epot = -22.4760062523442 | etot = -17.2947902233625
-448000  ekin = 2.35344530580996 |  erot = 2.94496431571713 | epot = -22.4927466941727 | etot = -17.1943370726456
-449000  ekin = 2.39032460069844 |  erot = 2.92889137252356 | epot = -22.5027878081879 | etot = -17.1835718349659
-450000  ekin = 1.87543018481826 |  erot = 1.69603328668916 | epot = -22.4562462785528 | etot = -18.8847828070454
-451000  ekin = 2.01850498861611 |  erot = 1.92812989993404 | epot = -22.4817672986218 | etot = -18.5351324100716
-452000  ekin = 1.36652609658347 |  erot = 1.87105620810406 | epot = -22.4501755877893 | etot = -19.2125932831018
-453000  ekin = 2.0599225820261 |  erot = 2.56027964608567 | epot = -22.2765869721545 | etot = -17.6563847440428
-454000  ekin = 1.47421749728914 |  erot = 2.19120144206327 | epot = -22.1381671023588 | etot = -18.4727481630064
-455000  ekin = 1.65550022307771 |  erot = 2.72165814308168 | epot = -21.9904394751434 | etot = -17.613281108984
-456000  ekin = 2.34827062603187 |  erot = 2.00722438151074 | epot = -21.9105114729144 | etot = -17.5550164653718
-457000  ekin = 2.01338249991754 |  erot = 2.37170378033695 | epot = -21.8819790372449 | etot = -17.4968927569904
-458000  ekin = 1.72815421955305 |  erot = 2.26329746701056 | epot = -21.9116044050661 | etot = -17.9201527185024
-459000  ekin = 2.48347398227002 |  erot = 2.32376196929941 | epot = -21.9949404038568 | etot = -17.1877044522874
-460000  ekin = 2.18770854699575 |  erot = 2.00081662918322 | epot = -21.9585322440375 | etot = -17.7700070678586
-461000  ekin = 2.27716435663744 |  erot = 2.9019565626907 | epot = -21.8877682177659 | etot = -16.7086472984378
-462000  ekin = 2.61244889701715 |  erot = 1.79757533309513 | epot = -21.9143949779912 | etot = -17.5043707478789
-463000  ekin = 2.55684814656524 |  erot = 3.31200610027657 | epot = -21.8497749242034 | etot = -15.9809206773616
-464000  ekin = 2.15312235839157 |  erot = 2.38947690136822 | epot = -21.7825241097983 | etot = -17.2399248500385
-465000  ekin = 2.5257577253008 |  erot = 3.61331808321477 | epot = -21.70727052519 | etot = -15.5681947166744
-466000  ekin = 1.97943618964772 |  erot = 2.88688528337621 | epot = -21.7222514097774 | etot = -16.8559299367535
-467000  ekin = 1.62882257493983 |  erot = 2.60892282315519 | epot = -21.8080861041928 | etot = -17.5703407060978
-468000  ekin = 1.09823854644375 |  erot = 3.35073251937299 | epot = -21.8523811012329 | etot = -17.4034100354162
-469000  ekin = 1.70229597385131 |  erot = 2.7588984072639 | epot = -21.8665756757502 | etot = -17.405381294635
-470000  ekin = 1.85844768422772 |  erot = 2.8706546217625 | epot = -21.9036130079376 | etot = -17.1745107019474
-471000  ekin = 2.74399539924327 |  erot = 2.34943354955083 | epot = -21.9543989717239 | etot = -16.8609700229298
-472000  ekin = 2.7182617922689 |  erot = 2.13581917182001 | epot = -22.0449294707038 | etot = -17.1908485066149
-473000  ekin = 2.29380642077304 |  erot = 2.07595163501546 | epot = -22.0706135180041 | etot = -17.7008554622156
-474000  ekin = 2.22690782122656 |  erot = 2.1647059901395 | epot = -22.0704871162386 | etot = -17.6788733048726
-475000  ekin = 2.4978679533329 |  erot = 2.09510196885223 | epot = -22.0509742163569 | etot = -17.4580042941718
-476000  ekin = 2.20264299239668 |  erot = 1.76757923556403 | epot = -21.9427521555982 | etot = -17.9725299276375
-477000  ekin = 2.45872237399503 |  erot = 2.38426997478539 | epot = -21.9051474088983 | etot = -17.0621550601178
-478000  ekin = 1.89905964030889 |  erot = 2.04864356713722 | epot = -21.9114508304737 | etot = -17.9637476230276
-479000  ekin = 2.27133902137491 |  erot = 3.08755197682257 | epot = -21.8872829373266 | etot = -16.5283919391291
-480000  ekin = 1.67015605151468 |  erot = 2.76560365045837 | epot = -21.8968158425889 | etot = -17.4610561406158
-481000  ekin = 1.81882995680354 |  erot = 2.94136105971067 | epot = -21.8571304925407 | etot = -17.0969394760265
-482000  ekin = 2.15305069632653 |  erot = 2.07327897823918 | epot = -21.8152992914385 | etot = -17.5889696168728
-483000  ekin = 1.50004535981758 |  erot = 1.99364343935404 | epot = -21.7843644990947 | etot = -18.2906756999231
-484000  ekin = 1.85234844255529 |  erot = 2.34000231202781 | epot = -21.8614293841666 | etot = -17.6690786295835
-485000  ekin = 1.64682178328831 |  erot = 2.50437862576679 | epot = -21.8969405008956 | etot = -17.7457400918405
-486000  ekin = 1.86104257115938 |  erot = 2.15995925522771 | epot = -21.8879397421696 | etot = -17.8669379157825
-487000  ekin = 2.34639026339217 |  erot = 3.11622773972825 | epot = -21.9707194220382 | etot = -16.5081014189178
-488000  ekin = 2.27484994031488 |  erot = 3.28147617368226 | epot = -21.9426475486812 | etot = -16.3863214346841
-489000  ekin = 2.38811933287365 |  erot = 2.56070014238266 | epot = -21.8600861168089 | etot = -16.9112666415526
-490000  ekin = 2.12976254880773 |  erot = 3.54525746010289 | epot = -21.7617637919249 | etot = -16.0867437830143
-491000  ekin = 2.20850764560417 |  erot = 2.48919239454317 | epot = -21.6468680069132 | etot = -16.9491679667658
-492000  ekin = 2.43957739853024 |  erot = 2.76323186690378 | epot = -21.6230951653168 | etot = -16.4202858998828
-493000  ekin = 1.79391622496105 |  erot = 2.29052518470042 | epot = -21.6945975278841 | etot = -17.6101561182226
-494000  ekin = 2.11542949642227 |  erot = 3.01313865872481 | epot = -21.7637004472039 | etot = -16.6351322920568
-495000  ekin = 2.1568591957283 |  erot = 2.49005677705245 | epot = -21.8783556810053 | etot = -17.2314397082246
-496000  ekin = 2.06037552826019 |  erot = 2.60698629104699 | epot = -21.9276220332962 | etot = -17.260260213989
-497000  ekin = 2.52228141248763 |  erot = 1.710130192768 | epot = -21.8769629373864 | etot = -17.6445513321307
-498000  ekin = 2.15394500805411 |  erot = 1.78777085700022 | epot = -21.8243748366056 | etot = -17.8826589715513
-499000  ekin = 3.01296343053108 |  erot = 1.73934813146708 | epot = -21.8392632680439 | etot = -17.0869517060458
-500000  ekin = 2.76642119718551 |  erot = 2.50182215373002 | epot = -21.830671988603 | etot = -16.5624286376875
-501000  ekin = 2.69367571720338 |  erot = 2.99042817784739 | epot = -21.7039103667138 | etot = -16.0198064716631
-502000  ekin = 1.91666556639459 |  erot = 3.89815239299714 | epot = -21.5845300715443 | etot = -15.7697121121525
-503000  ekin = 1.80513448090424 |  erot = 2.94463129244922 | epot = -21.408846856306 | etot = -16.6590810829525
-504000  ekin = 1.70082883689617 |  erot = 3.04312463877848 | epot = -21.3315058298563 | etot = -16.5875523541817
-505000  ekin = 2.75953000022913 |  erot = 2.14635942194519 | epot = -21.3525103549444 | etot = -16.4466209327701
-506000  ekin = 2.29728093923375 |  erot = 2.04403144683579 | epot = -21.3794572010067 | etot = -17.0381448149372
-507000  ekin = 3.17636857959624 |  erot = 2.42164349794529 | epot = -21.4731108320934 | etot = -15.8750987545519
-508000  ekin = 2.53590109429522 |  erot = 2.52790695399208 | epot = -21.6300410847596 | etot = -16.5662330364723
-509000  ekin = 2.12748393236722 |  erot = 2.83071060777933 | epot = -21.7781347526393 | etot = -16.8199402124927
-510000  ekin = 2.16138023827908 |  erot = 1.44739524871434 | epot = -21.8661383228762 | etot = -18.2573628358828
-511000  ekin = 2.5432337386743 |  erot = 2.77108674378182 | epot = -21.9670096484361 | etot = -16.65268916598
-512000  ekin = 2.32820226144235 |  erot = 2.8042493163404 | epot = -22.0177071813425 | etot = -16.8852556035598
-513000  ekin = 2.47700215188743 |  erot = 2.17127792631492 | epot = -22.0110285387343 | etot = -17.3627484605319
-514000  ekin = 2.76651136580707 |  erot = 2.55680467976047 | epot = -22.0909970005814 | etot = -16.7676809550138
-515000  ekin = 2.5202331965388 |  erot = 1.82499891391154 | epot = -22.1712715169565 | etot = -17.8260394065062
-516000  ekin = 2.81741012640848 |  erot = 2.22255273815334 | epot = -22.2621950124766 | etot = -17.2222321479148
-517000  ekin = 2.03287831599844 |  erot = 2.04932227860395 | epot = -22.2794486174447 | etot = -18.1972480228423
-518000  ekin = 2.18753527424292 |  erot = 2.76011341951323 | epot = -22.2667176836093 | etot = -17.3190689898532
-519000  ekin = 2.23127004412533 |  erot = 2.23036422155453 | epot = -22.3641437250361 | etot = -17.9025094593562
-520000  ekin = 1.88835704965194 |  erot = 2.20137678015021 | epot = -22.4547788180201 | etot = -18.365044988218
-521000  ekin = 2.57911594310157 |  erot = 1.87216207270883 | epot = -22.6071563154982 | etot = -18.1558782996878
-522000  ekin = 3.47551915105823 |  erot = 1.7762374523623 | epot = -22.6852629490162 | etot = -17.4335063455956
-523000  ekin = 2.84545293485784 |  erot = 2.47507537559667 | epot = -22.727728352182 | etot = -17.4072000417275
-524000  ekin = 2.40278895519472 |  erot = 2.37529684497552 | epot = -22.6643160930411 | etot = -17.8862302928709
-525000  ekin = 1.59507033575009 |  erot = 2.61508341973268 | epot = -22.5633164974795 | etot = -18.3531627419968
-526000  ekin = 1.67007684014044 |  erot = 1.59545284095808 | epot = -22.511319978416 | etot = -19.2457902973175
-527000  ekin = 2.19667533945247 |  erot = 1.93330231246752 | epot = -22.4181345854017 | etot = -18.2881569334817
-528000  ekin = 2.6386695788743 |  erot = 2.84200507572115 | epot = -22.4271496272375 | etot = -16.946474972642
-529000  ekin = 2.71685924097597 |  erot = 3.01195511036354 | epot = -22.4607209136928 | etot = -16.7319065623533
-530000  ekin = 2.59646038482582 |  erot = 2.1317692819235 | epot = -22.3209630404852 | etot = -17.5927333737358
-531000  ekin = 2.96818211550215 |  erot = 2.35836906019033 | epot = -22.2240561584028 | etot = -16.8975049827103
-532000  ekin = 2.54400448114086 |  erot = 2.32266423688292 | epot = -22.2383323718678 | etot = -17.3716636538441
-533000  ekin = 2.47235456553948 |  erot = 2.96337386592411 | epot = -22.2434312615742 | etot = -16.8077028301106
-534000  ekin = 2.104894788263 |  erot = 2.03894640697441 | epot = -22.2624131617689 | etot = -18.1185719665315
-535000  ekin = 3.76811893478762 |  erot = 2.64694643296526 | epot = -22.2342741399369 | etot = -15.819208772184
-536000  ekin = 2.78932048770646 |  erot = 1.95046774407585 | epot = -22.1710588414062 | etot = -17.4312706096239
-537000  ekin = 2.84547413963846 |  erot = 2.6235440651257 | epot = -22.0792539675812 | etot = -16.610235762817
-538000  ekin = 2.67615418297317 |  erot = 2.08962546790895 | epot = -21.9560559397441 | etot = -17.190276288862
-539000  ekin = 2.73041224389434 |  erot = 2.35761678189143 | epot = -22.0360310245606 | etot = -16.9480019987748
-540000  ekin = 2.45513520817505 |  erot = 2.4980712479617 | epot = -22.1997448500024 | etot = -17.2465383938656
-541000  ekin = 3.48268229748523 |  erot = 2.77797330372245 | epot = -22.2939060084685 | etot = -16.0332504072608
-542000  ekin = 2.48960436886327 |  erot = 2.87332479229809 | epot = -22.3004887690915 | etot = -16.9375596079301
-543000  ekin = 2.34699181381528 |  erot = 2.86167842257193 | epot = -22.3027783678197 | etot = -17.0941081314325
-544000  ekin = 2.22918134297116 |  erot = 1.4682792461716 | epot = -22.2757921511235 | etot = -18.5783315619807
-545000  ekin = 2.45393652663684 |  erot = 2.14178562937392 | epot = -22.2696521197313 | etot = -17.6739299637206
-546000  ekin = 1.98434977645849 |  erot = 2.24144093113159 | epot = -22.232171992891 | etot = -18.0063812853009
-547000  ekin = 2.56230350196472 |  erot = 1.8957462591202 | epot = -22.2013923967025 | etot = -17.7433426356176
-548000  ekin = 1.72907614338158 |  erot = 1.64127030305735 | epot = -22.1897325934373 | etot = -18.8193861469984
-549000  ekin = 1.95696682165776 |  erot = 2.64539988943055 | epot = -22.3281210018679 | etot = -17.7257542907796
-550000  ekin = 1.80672944936439 |  erot = 1.58554489058937 | epot = -22.4379557312283 | etot = -19.0456813912745
-551000  ekin = 2.19785864069661 |  erot = 2.26344341600386 | epot = -22.4944444264338 | etot = -18.0331423697333
-552000  ekin = 2.074442528674 |  erot = 2.49246441473273 | epot = -22.5313734934249 | etot = -17.9644665500182
-553000  ekin = 2.94841939583913 |  erot = 2.1230978630074 | epot = -22.5870982488507 | etot = -17.5155809900042
-554000  ekin = 2.86687820100223 |  erot = 1.9428729838172 | epot = -22.755332978123 | etot = -17.9455817933036
-555000  ekin = 2.43102414091851 |  erot = 2.28708167460996 | epot = -22.8409516497233 | etot = -18.1228458341949
-556000  ekin = 2.31020008885682 |  erot = 2.55815314755913 | epot = -22.8777743355338 | etot = -18.0094210991179
-557000  ekin = 2.81359485404958 |  erot = 1.42586137655665 | epot = -22.93912738 | etot = -18.6996711493938
-558000  ekin = 2.7970970853355 |  erot = 1.99545051650404 | epot = -22.9823826800611 | etot = -18.1898350782216
-559000  ekin = 3.34842854089643 |  erot = 2.30939572175805 | epot = -23.0558646505447 | etot = -17.3980403878902
-560000  ekin = 3.12583165184862 |  erot = 2.33613566970363 | epot = -23.0537007225862 | etot = -17.591733401034
-561000  ekin = 2.9127609673679 |  erot = 2.07459481236913 | epot = -22.982260765434 | etot = -17.994904985697
-562000  ekin = 3.33017095598494 |  erot = 2.52215992853225 | epot = -22.8889363116257 | etot = -17.0366054271086
-563000  ekin = 2.70200701416854 |  erot = 1.64770113379199 | epot = -22.8712722594835 | etot = -18.521564111523
-564000  ekin = 2.82953631474813 |  erot = 2.52900560163798 | epot = -22.8387855460795 | etot = -17.4802436296934
-565000  ekin = 2.67999888917708 |  erot = 2.05091800967453 | epot = -22.7937507048715 | etot = -18.0628338060199
-566000  ekin = 2.32986557500305 |  erot = 2.16379904557213 | epot = -22.8028233873669 | etot = -18.3091587667917
-567000  ekin = 1.92319601586312 |  erot = 2.83258522428556 | epot = -22.7588270107033 | etot = -18.0030457705546
-568000  ekin = 2.1767237164987 |  erot = 2.23391201707386 | epot = -22.7857243432792 | etot = -18.3750886097066
-569000  ekin = 2.44197408396629 |  erot = 2.6515953630557 | epot = -22.7197314796374 | etot = -17.6261620326154
-570000  ekin = 2.43177406209051 |  erot = 1.89764945519458 | epot = -22.6963472615904 | etot = -18.3669237443054
-571000  ekin = 2.86160521289847 |  erot = 2.96804382024775 | epot = -22.6961835038031 | etot = -16.8665344706569
-572000  ekin = 1.92662919536387 |  erot = 3.79135909534691 | epot = -22.6587081618987 | etot = -16.940719871188
-573000  ekin = 2.40137439242946 |  erot = 2.29982613356341 | epot = -22.6365074046858 | etot = -17.935306878693
-574000  ekin = 1.68882589350908 |  erot = 2.3209740449249 | epot = -22.6783832960445 | etot = -18.6685833576105
-575000  ekin = 1.85490665091732 |  erot = 1.8564080891142 | epot = -22.7444448136904 | etot = -19.0331300736588
-576000  ekin = 3.24775679594035 |  erot = 2.9556926821431 | epot = -22.6991990620437 | etot = -16.4957495839603
-577000  ekin = 2.89423151645282 |  erot = 2.87486712706735 | epot = -22.628436560802 | etot = -16.8593379172818
-578000  ekin = 2.4046091667757 |  erot = 2.78216711024699 | epot = -22.4348874817265 | etot = -17.2481112047039
-579000  ekin = 2.40580528046576 |  erot = 1.9955781448253 | epot = -22.288913673667 | etot = -17.887530248376
-580000  ekin = 2.69817090358906 |  erot = 1.94741864170502 | epot = -22.1754486864787 | etot = -17.5298591411846
-581000  ekin = 2.06309668646281 |  erot = 2.97621367011722 | epot = -22.0670098600828 | etot = -17.0276995035027
-582000  ekin = 2.33869527454826 |  erot = 3.07898324506955 | epot = -21.9478320300713 | etot = -16.5301535104535
-583000  ekin = 2.23428959741495 |  erot = 2.68476693088864 | epot = -21.837983720672 | etot = -16.9189271923684
-584000  ekin = 2.94321016295282 |  erot = 2.59995039730549 | epot = -21.7517635625832 | etot = -16.2086030023248
-585000  ekin = 2.36063475490835 |  erot = 2.49112677628938 | epot = -21.7173359488816 | etot = -16.8655744176839
-586000  ekin = 3.56583702163525 |  erot = 2.02487858259688 | epot = -21.7707868137138 | etot = -16.1800712094817
-587000  ekin = 3.53727585853243 |  erot = 1.9725893265202 | epot = -21.7665121756112 | etot = -16.2566469905585
-588000  ekin = 2.82339556293757 |  erot = 1.59340504807046 | epot = -21.7545319340972 | etot = -17.3377313230892
-589000  ekin = 2.31627310139818 |  erot = 2.20582604523299 | epot = -21.8199173705563 | etot = -17.2978182239252
-590000  ekin = 2.57616671531331 |  erot = 1.72768273328208 | epot = -21.8427138199642 | etot = -17.5388643713688
-591000  ekin = 1.91473306171853 |  erot = 3.80604384238379 | epot = -21.9351393124187 | etot = -16.2143624083164
-592000  ekin = 2.11222958764659 |  erot = 2.84208333850205 | epot = -21.9639458839076 | etot = -17.0096329577589
-593000  ekin = 1.66462149590471 |  erot = 2.46217253451014 | epot = -21.9921445323971 | etot = -17.8653505019822
-594000  ekin = 1.86314045588476 |  erot = 2.37275936142268 | epot = -22.1149191228505 | etot = -17.879019305543
-595000  ekin = 1.6397125755004 |  erot = 2.1497024679856 | epot = -22.2960530768755 | etot = -18.5066380333895
-596000  ekin = 1.86247376576131 |  erot = 1.5693809542787 | epot = -22.4014957466218 | etot = -18.9696410265818
-597000  ekin = 2.210739014067 |  erot = 2.3087175693751 | epot = -22.4599242604733 | etot = -17.9404676770312
-598000  ekin = 1.8660134932493 |  erot = 3.02311727399809 | epot = -22.5165298316334 | etot = -17.627399064386
-599000  ekin = 2.86271635930755 |  erot = 2.19928854437227 | epot = -22.536599708025 | etot = -17.4745948043452
-600000  ekin = 2.65062163067179 |  erot = 2.14533898812782 | epot = -22.4620537969303 | etot = -17.6660931781307
-601000  ekin = 2.97018864875202 |  erot = 3.19824090103877 | epot = -22.3271949752462 | etot = -16.1587654254554
-602000  ekin = 2.93416893709001 |  erot = 2.68627449040958 | epot = -22.2245183728173 | etot = -16.6040749453177
-603000  ekin = 2.5987545006459 |  erot = 2.71301833029982 | epot = -22.1705323477201 | etot = -16.8587595167744
-604000  ekin = 1.79059859762797 |  erot = 2.11515305424796 | epot = -22.1931056020217 | etot = -18.2873539501458
-605000  ekin = 1.82914051863723 |  erot = 2.27656979248766 | epot = -22.2183915784731 | etot = -18.1126812673482
-606000  ekin = 2.33864125390345 |  erot = 2.204164937778 | epot = -22.1617656383863 | etot = -17.6189594467048
-607000  ekin = 2.72666217259876 |  erot = 2.97710334336218 | epot = -22.1572786906588 | etot = -16.4535131746978
-608000  ekin = 2.45226937954678 |  erot = 2.41232790919959 | epot = -22.1263051367364 | etot = -17.2617078479901
-609000  ekin = 1.91032127854288 |  erot = 2.62712516529567 | epot = -22.0127581830193 | etot = -17.4753117391807
-610000  ekin = 3.01319055031108 |  erot = 2.17098104720965 | epot = -21.930499629869 | etot = -16.7463280323483
-611000  ekin = 2.44410994437293 |  erot = 2.75159061185424 | epot = -21.9258193850468 | etot = -16.7301188288197
-612000  ekin = 2.50271115837174 |  erot = 2.16817640692169 | epot = -21.9676183236645 | etot = -17.2967307583711
-613000  ekin = 3.01842230632868 |  erot = 2.12784419676567 | epot = -22.0277467117807 | etot = -16.8814802086864
-614000  ekin = 2.25331711369829 |  erot = 2.99334048390158 | epot = -22.0701464667307 | etot = -16.8234888691309
-615000  ekin = 1.66376443031995 |  erot = 2.63613776051569 | epot = -21.9985978951916 | etot = -17.698695704356
-616000  ekin = 1.89454248699046 |  erot = 2.87318355169532 | epot = -22.0041678369046 | etot = -17.2364417982189
-617000  ekin = 2.14789714287838 |  erot = 2.51249074123957 | epot = -22.0251474680604 | etot = -17.3647595839425
-618000  ekin = 3.11174934178844 |  erot = 2.74374306269141 | epot = -21.980284295602 | etot = -16.1247918911221
-619000  ekin = 3.41036213968179 |  erot = 2.10616794159728 | epot = -21.9557959924962 | etot = -16.4392659112171
-620000  ekin = 4.28430989238205 |  erot = 2.19572475327593 | epot = -21.9033881020935 | etot = -15.4233534564355
-621000  ekin = 3.095687767491 |  erot = 2.55794040804605 | epot = -21.8286763731363 | etot = -16.1750481975993
-622000  ekin = 2.76030419206697 |  erot = 2.60754397958254 | epot = -21.7459002641757 | etot = -16.3780520925262
-623000  ekin = 2.87269212022169 |  erot = 2.90401311950186 | epot = -21.5853226709315 | etot = -15.8086174312079
-624000  ekin = 2.01889500087932 |  erot = 3.41825755609791 | epot = -21.4095311686242 | etot = -15.972378611647
-625000  ekin = 2.87966631754697 |  erot = 2.69115421564283 | epot = -21.2859406043045 | etot = -15.7151200711147
-626000  ekin = 2.56087279949319 |  erot = 2.15801254335177 | epot = -21.2329175358055 | etot = -16.5140321929606
-627000  ekin = 2.30197939613517 |  erot = 2.40176668957967 | epot = -21.2932794652839 | etot = -16.589533379569
-628000  ekin = 2.23988628353727 |  erot = 2.75332535542195 | epot = -21.4558642198861 | etot = -16.4626525809268
-629000  ekin = 2.20891060851904 |  erot = 1.97036896055006 | epot = -21.6109313731644 | etot = -17.4316518040953
-630000  ekin = 2.48711004105954 |  erot = 2.14055508379566 | epot = -21.6286281269545 | etot = -17.0009630020993
-631000  ekin = 2.05035510102044 |  erot = 1.78519131042561 | epot = -21.633635046353 | etot = -17.798088634907
-632000  ekin = 1.65439924450982 |  erot = 3.28310987077496 | epot = -21.6999899301469 | etot = -16.7624808148621
-633000  ekin = 2.34657988531209 |  erot = 2.34109631044869 | epot = -21.8317647703271 | etot = -17.1440885745664
-634000  ekin = 2.31570267703931 |  erot = 2.471293173825 | epot = -21.8814211467029 | etot = -17.0944252958386
-635000  ekin = 1.99068848818427 |  erot = 3.35493927676214 | epot = -21.9111632351734 | etot = -16.565535470227
-636000  ekin = 2.5015676385862 |  erot = 2.48847742334419 | epot = -21.8752689055209 | etot = -16.8852238435905
-637000  ekin = 2.76558055064046 |  erot = 2.80410341825293 | epot = -21.7874464522772 | etot = -16.2177624833838
-638000  ekin = 2.45488734924466 |  erot = 2.81516363335622 | epot = -21.897362338598 | etot = -16.6273113559971
-639000  ekin = 1.89221088715375 |  erot = 2.13319565970052 | epot = -21.932098303477 | etot = -17.9066917566227
-640000  ekin = 2.12173400886946 |  erot = 3.32302167857403 | epot = -21.8808288554836 | etot = -16.4360731680401
-641000  ekin = 2.09554541112562 |  erot = 2.23098450754968 | epot = -21.9203390995502 | etot = -17.5938091808749
-642000  ekin = 2.28696138506763 |  erot = 2.67378976619349 | epot = -21.9723604262128 | etot = -17.0116092749517
-643000  ekin = 2.74450005384908 |  erot = 2.20403941809548 | epot = -21.9235240791533 | etot = -16.9749846072088
-644000  ekin = 2.87909523138453 |  erot = 3.40688779630214 | epot = -21.9417833997402 | etot = -15.6558003720535
-645000  ekin = 2.38284095628021 |  erot = 2.10846397463902 | epot = -21.8306349073152 | etot = -17.339329976396
-646000  ekin = 2.68568471833193 |  erot = 1.8085210536706 | epot = -21.6853054888873 | etot = -17.1910997168848
-647000  ekin = 2.44462012552757 |  erot = 2.00446720103467 | epot = -21.4974635292911 | etot = -17.0483762027288
-648000  ekin = 2.22150753159449 |  erot = 1.69679185313772 | epot = -21.5947311257684 | etot = -17.6764317410362
-649000  ekin = 2.55943952639507 |  erot = 1.77203724563615 | epot = -22.016770390185 | etot = -17.6852936181538
-650000  ekin = 2.7234725572106 |  erot = 2.20418229003755 | epot = -22.1594214535889 | etot = -17.2317666063407
-651000  ekin = 2.25383373914402 |  erot = 3.26326768595798 | epot = -22.2274805933885 | etot = -16.7103791682865
-652000  ekin = 2.35810253390822 |  erot = 2.29591208392313 | epot = -22.2332195197311 | etot = -17.5792049018997
-653000  ekin = 2.06421004499471 |  erot = 2.1417184547457 | epot = -22.2265612208312 | etot = -18.0206327210908
-654000  ekin = 2.30460304373657 |  erot = 1.85567946278894 | epot = -22.2521914868228 | etot = -18.0919089802973
-655000  ekin = 2.11188824015111 |  erot = 1.79072614414006 | epot = -22.2262193909715 | etot = -18.3236050066803
-656000  ekin = 2.44561836830367 |  erot = 2.32567811025775 | epot = -22.1872376286341 | etot = -17.4159411500727
-657000  ekin = 2.45751083141108 |  erot = 2.86439216413734 | epot = -22.1805503246548 | etot = -16.8586473291064
-658000  ekin = 2.49955432693124 |  erot = 2.85472680235227 | epot = -22.1390040132353 | etot = -16.7847228839518
-659000  ekin = 3.37980090980363 |  erot = 2.77552992994233 | epot = -21.9898923341708 | etot = -15.8345614944249
-660000  ekin = 2.6941462621918 |  erot = 1.99094454704574 | epot = -21.839770569098 | etot = -17.1546797598605
-661000  ekin = 2.21049176877594 |  erot = 2.52393650500608 | epot = -21.6857326790217 | etot = -16.9513044052397
-662000  ekin = 2.06962867519899 |  erot = 2.53976085175021 | epot = -21.6239147287108 | etot = -17.0145252017616
-663000  ekin = 2.27770295544224 |  erot = 2.30124717941155 | epot = -21.5870186127932 | etot = -17.0080684779394
-664000  ekin = 2.39061717453214 |  erot = 1.87616423363735 | epot = -21.4930500427881 | etot = -17.2262686346187
-665000  ekin = 2.66924405123179 |  erot = 2.29240983153227 | epot = -21.4402310096658 | etot = -16.4785771269017
-666000  ekin = 1.66318176263893 |  erot = 2.30827907651666 | epot = -21.3477804932103 | etot = -17.3763196540548
-667000  ekin = 1.65573830146343 |  erot = 2.8261361193353 | epot = -21.2651811028886 | etot = -16.7833066820899
-668000  ekin = 2.50126196238916 |  erot = 3.29062396521939 | epot = -21.1310768281354 | etot = -15.3391909005269
-669000  ekin = 1.61008562219097 |  erot = 2.65727107854378 | epot = -21.0513800034042 | etot = -16.7840233026694
-670000  ekin = 2.21851826153844 |  erot = 2.60770568109394 | epot = -20.9727942140714 | etot = -16.146570271439
-671000  ekin = 2.25905318343359 |  erot = 2.15965495575029 | epot = -20.920836534986 | etot = -16.5021283958021
-672000  ekin = 1.93426342346647 |  erot = 1.65365047668441 | epot = -20.8333028169839 | etot = -17.245388916833
-673000  ekin = 1.880896686753 |  erot = 2.07483128120029 | epot = -20.79952620348 | etot = -16.8437982355267
-674000  ekin = 2.06783468057301 |  erot = 2.16234064938726 | epot = -20.8176950919606 | etot = -16.5875197620003
-675000  ekin = 2.03952283590142 |  erot = 2.48129689359269 | epot = -20.8297865902612 | etot = -16.3089668607671
-676000  ekin = 2.44687523374789 |  erot = 2.77932995735251 | epot = -20.8513819036485 | etot = -15.6251767125481
-677000  ekin = 2.18851088067448 |  erot = 2.6192892566419 | epot = -20.8589021998565 | etot = -16.0511020625401
-678000  ekin = 2.13451298865477 |  erot = 2.78742961560772 | epot = -20.7380850837789 | etot = -15.8161424795164
-679000  ekin = 2.15556981522704 |  erot = 2.17593910434841 | epot = -20.629255081746 | etot = -16.2977461621706
-680000  ekin = 2.0771745141444 |  erot = 2.68436897198806 | epot = -20.6512705044545 | etot = -15.889727018322
-681000  ekin = 2.16836766753576 |  erot = 1.82666294843077 | epot = -20.7392652191906 | etot = -16.744234603224
-682000  ekin = 3.01810965188601 |  erot = 2.39774897550361 | epot = -20.7185667085479 | etot = -15.3027080811583
-683000  ekin = 2.84169666492797 |  erot = 2.09885122074905 | epot = -20.7261705834808 | etot = -15.7856226978037
-684000  ekin = 1.9625035286937 |  erot = 2.99543980855394 | epot = -20.7697045673731 | etot = -15.8117612301254
-685000  ekin = 1.50086016290167 |  erot = 2.04478648729578 | epot = -20.7788952528481 | etot = -17.2332486026506
-686000  ekin = 2.3009298353038 |  erot = 2.55442118756325 | epot = -20.7673358731011 | etot = -15.9119848502341
-687000  ekin = 1.86053862979306 |  erot = 2.84846934037481 | epot = -20.7009117540898 | etot = -15.9919037839219
-688000  ekin = 2.56859020075852 |  erot = 2.23263295871676 | epot = -20.6563366249257 | etot = -15.8551134654504
-689000  ekin = 2.7493014170063 |  erot = 2.68327386026116 | epot = -20.8092642099637 | etot = -15.3766889326963
-690000  ekin = 2.67477310841297 |  erot = 2.52397256899153 | epot = -21.0730303416649 | etot = -15.8742846642604
-691000  ekin = 2.28465281003006 |  erot = 2.52273866559282 | epot = -21.2401157605126 | etot = -16.4327242848897
-692000  ekin = 2.42087744380444 |  erot = 3.24812320332686 | epot = -21.2665776826931 | etot = -15.5975770355618
-693000  ekin = 2.37642605279041 |  erot = 2.99546830568891 | epot = -21.3330277418611 | etot = -15.9611333833818
-694000  ekin = 2.69750178365984 |  erot = 2.53085866970816 | epot = -21.521485598392 | etot = -16.293125145024
-695000  ekin = 2.49230316198816 |  erot = 1.18105864485318 | epot = -21.6959912399269 | etot = -18.0226294330856
-696000  ekin = 1.86075498586631 |  erot = 1.46501529683133 | epot = -21.6808441671222 | etot = -18.3550738844245
-697000  ekin = 2.40460770445908 |  erot = 2.10461647488794 | epot = -21.7143559347048 | etot = -17.2051317553578
-698000  ekin = 2.32098148261586 |  erot = 1.91506962097515 | epot = -21.7787361369849 | etot = -17.5426850333939
-699000  ekin = 2.44943497732062 |  erot = 2.56143482106644 | epot = -21.7638026578475 | etot = -16.7529328594605
-700000  ekin = 2.13119890669415 |  erot = 2.28802336161954 | epot = -21.6714710604343 | etot = -17.2522487921206
-701000  ekin = 2.15013169314239 |  erot = 2.18565847708907 | epot = -21.5488216255628 | etot = -17.2130314553313
-702000  ekin = 1.57482438035702 |  erot = 1.99931097090508 | epot = -21.5047640382371 | etot = -17.930628686975
-703000  ekin = 2.08829522236785 |  erot = 2.17557396869524 | epot = -21.5242713758434 | etot = -17.2604021847803
-704000  ekin = 2.82144699483839 |  erot = 1.94479401958833 | epot = -21.5462466947694 | etot = -16.7800056803427
-705000  ekin = 2.81019786745821 |  erot = 2.16662483548889 | epot = -21.497690476826 | etot = -16.5208677738789
-706000  ekin = 1.97639068263159 |  erot = 2.31468002405233 | epot = -21.494117475981 | etot = -17.2030467692971
-707000  ekin = 1.90740387464487 |  erot = 2.04436544372037 | epot = -21.5505486138142 | etot = -17.5987792954489
-708000  ekin = 2.4927128838246 |  erot = 2.15829540621563 | epot = -21.5728746117359 | etot = -16.9218663216957
-709000  ekin = 2.89296518644075 |  erot = 2.58120965850485 | epot = -21.6152997801578 | etot = -16.1411249352122
-710000  ekin = 2.18515172086139 |  erot = 2.27924743097097 | epot = -21.5865916502444 | etot = -17.122192498412
-711000  ekin = 2.31589231212299 |  erot = 1.40143925977899 | epot = -21.6089597508522 | etot = -17.8916281789502
-712000  ekin = 2.55835611026778 |  erot = 2.27281573655802 | epot = -21.7227687229586 | etot = -16.8915968761328
-713000  ekin = 1.95615391137192 |  erot = 2.3180685223896 | epot = -21.8059432402922 | etot = -17.5317208065307
-714000  ekin = 2.56238583099812 |  erot = 2.10850361056242 | epot = -21.8681675013087 | etot = -17.1972780597481
-715000  ekin = 2.42321114653449 |  erot = 3.74023135295615 | epot = -21.8498336266088 | etot = -15.6863911271181
-716000  ekin = 2.83316600532177 |  erot = 2.84850242081136 | epot = -21.7640231598546 | etot = -16.0823547337214
-717000  ekin = 3.45113934412558 |  erot = 3.20598462177201 | epot = -21.667790662391 | etot = -15.0106666964934
-718000  ekin = 3.10736232683018 |  erot = 3.94031338601797 | epot = -21.5629179727886 | etot = -14.5152422599405
-719000  ekin = 2.38564322644681 |  erot = 2.95089811755838 | epot = -21.5481188237003 | etot = -16.2115774796951
-720000  ekin = 2.22543420991222 |  erot = 3.14305432696276 | epot = -21.5381615962024 | etot = -16.1696730593274
-721000  ekin = 1.71709109813907 |  erot = 2.23939430363989 | epot = -21.4645851946691 | etot = -17.5080997928902
-722000  ekin = 1.93213958129581 |  erot = 2.81573218276728 | epot = -21.4896847080113 | etot = -16.7418129439482
-723000  ekin = 2.3814534534689 |  erot = 2.55666957995948 | epot = -21.4374887927968 | etot = -16.4993657593684
-724000  ekin = 1.74740284448188 |  erot = 2.4555617568904 | epot = -21.4125175551609 | etot = -17.2095529537886
-725000  ekin = 2.29233638352032 |  erot = 2.9526701477774 | epot = -21.4751392844086 | etot = -16.2301327531109
-726000  ekin = 1.63503646092182 |  erot = 2.30649262262117 | epot = -21.5156851039584 | etot = -17.5741560204154
-727000  ekin = 2.46705454176008 |  erot = 3.19802987014479 | epot = -21.5382715508196 | etot = -15.8731871389148
-728000  ekin = 2.21709576272191 |  erot = 2.16616227421244 | epot = -21.5244744557248 | etot = -17.1412164187904
-729000  ekin = 1.89396537247993 |  erot = 1.66596987620967 | epot = -21.5644109232526 | etot = -18.004475674563
-730000  ekin = 1.78155182892059 |  erot = 2.15399661961713 | epot = -21.5594738957829 | etot = -17.6239254472452
-731000  ekin = 2.16713092512296 |  erot = 2.96875570154118 | epot = -21.4952326145865 | etot = -16.3593459879223
-732000  ekin = 2.40927355189018 |  erot = 2.27189990077002 | epot = -21.3831563581627 | etot = -16.7019829055024
-733000  ekin = 3.04824198143784 |  erot = 2.57289903054807 | epot = -21.429005165309 | etot = -15.8078641533231
-734000  ekin = 2.36703883022855 |  erot = 2.04468815017469 | epot = -21.4926214065432 | etot = -17.0808944261399
-735000  ekin = 2.13292788677937 |  erot = 1.55097035487251 | epot = -21.5455592190822 | etot = -17.8616609774303
-736000  ekin = 2.13562110082196 |  erot = 3.45795834862287 | epot = -21.6515763333194 | etot = -16.0579968838746
-737000  ekin = 1.73550703692746 |  erot = 3.58781244645382 | epot = -21.6785680654269 | etot = -16.3552485820456
-738000  ekin = 2.01136680767019 |  erot = 2.50533140705366 | epot = -21.7068415263434 | etot = -17.1901433116196
-739000  ekin = 1.85122466968333 |  erot = 2.19323904324285 | epot = -21.7211705032462 | etot = -17.6767067903201
-740000  ekin = 2.84677298867337 |  erot = 2.79086338446698 | epot = -21.7460997683893 | etot = -16.108463395249
-741000  ekin = 2.47281769013274 |  erot = 2.90867674862121 | epot = -21.8038806031312 | etot = -16.4223861643772
-742000  ekin = 2.74212748781964 |  erot = 3.26601844940295 | epot = -21.9417105639309 | etot = -15.9335646267083
-743000  ekin = 2.23337436613032 |  erot = 3.20752099935254 | epot = -22.0769938861091 | etot = -16.6360985206262
-744000  ekin = 2.01007582963959 |  erot = 3.79208398827071 | epot = -22.1581491314472 | etot = -16.3559893135369
-745000  ekin = 3.14168435406402 |  erot = 2.32756039064277 | epot = -22.1552791709709 | etot = -16.6860344262642
-746000  ekin = 2.96147960587595 |  erot = 2.64919778641529 | epot = -22.131657657659 | etot = -16.5209802653678
-747000  ekin = 2.31713973406909 |  erot = 2.0538838502724 | epot = -22.1362115743712 | etot = -17.7651879900297
-748000  ekin = 2.36228107661837 |  erot = 2.41530550223615 | epot = -22.1703943251347 | etot = -17.3928077462802
-749000  ekin = 2.07006713072585 |  erot = 2.7743291960411 | epot = -22.1708421357978 | etot = -17.3264458090308
-750000  ekin = 1.65834656870048 |  erot = 2.38415657369843 | epot = -22.2465520170919 | etot = -18.204048874693
-751000  ekin = 1.79302728344389 |  erot = 2.827102160061 | epot = -22.3488339479635 | etot = -17.7287045044586
-752000  ekin = 1.35555517803007 |  erot = 1.46019783589209 | epot = -22.4342877547318 | etot = -19.6185347408096
-753000  ekin = 1.88586262445723 |  erot = 2.44014879801272 | epot = -22.3837690917336 | etot = -18.0577576692636
-754000  ekin = 1.74745498380874 |  erot = 2.73612011854199 | epot = -22.2852965474798 | etot = -17.8017214451291
-755000  ekin = 2.39590781949902 |  erot = 2.41019902787154 | epot = -22.2066358684386 | etot = -17.400529021068
-756000  ekin = 1.83745653598818 |  erot = 2.79024351605605 | epot = -22.133592240187 | etot = -17.5058921881428
-757000  ekin = 1.97281200687049 |  erot = 2.57792722235948 | epot = -22.0604464398181 | etot = -17.5097072105881
-758000  ekin = 1.18945619136922 |  erot = 2.72372183682492 | epot = -21.9899494795137 | etot = -18.0767714513196
-759000  ekin = 2.16230453116658 |  erot = 1.39722896511084 | epot = -22.0003304659983 | etot = -18.4407969697208
-760000  ekin = 2.57253050230035 |  erot = 2.33269711137819 | epot = -22.0357457302398 | etot = -17.1305181165612
-761000  ekin = 2.08545216810511 |  erot = 2.24940559703297 | epot = -22.1132097744113 | etot = -17.7783520092733
-762000  ekin = 2.13509249172209 |  erot = 1.66078369856518 | epot = -22.1380840935026 | etot = -18.3422079032154
-763000  ekin = 2.42851727622128 |  erot = 3.36016749294484 | epot = -22.2079173436287 | etot = -16.4192325744626
-764000  ekin = 2.84703530894743 |  erot = 2.79172375883345 | epot = -22.2143624032421 | etot = -16.5756033354612
-765000  ekin = 1.81325658345262 |  erot = 2.77448180912351 | epot = -22.1194010453623 | etot = -17.5316626527862
-766000  ekin = 2.64831101430988 |  erot = 2.3138164970859 | epot = -21.9919179324216 | etot = -17.0297904210258
-767000  ekin = 2.58949745571041 |  erot = 2.86718473216884 | epot = -21.9087370669524 | etot = -16.4520548790732
-768000  ekin = 1.86313167956692 |  erot = 2.78552244417217 | epot = -21.9381577980074 | etot = -17.2895036742683
-769000  ekin = 2.40162376419982 |  erot = 2.31402374045875 | epot = -22.0373843590672 | etot = -17.3217368544087
-770000  ekin = 2.49146487205159 |  erot = 3.23101926076328 | epot = -22.1439576198693 | etot = -16.4214734870544
-771000  ekin = 2.33226337742861 |  erot = 2.27787220200643 | epot = -22.1812213688414 | etot = -17.5710857894063
-772000  ekin = 2.28990016215835 |  erot = 2.99389364569332 | epot = -22.2765115340955 | etot = -16.9927177262439
-773000  ekin = 2.23002457595115 |  erot = 1.82240115552767 | epot = -22.3379686916384 | etot = -18.2855429601596
-774000  ekin = 2.82350297312971 |  erot = 2.21054815770298 | epot = -22.331524297742 | etot = -17.2974731669093
-775000  ekin = 1.82305982105504 |  erot = 1.87100336542221 | epot = -22.2729891281483 | etot = -18.578925941671
-776000  ekin = 1.39169167990077 |  erot = 3.16027505319296 | epot = -22.2459295451276 | etot = -17.6939628120339
-777000  ekin = 1.6265637770548 |  erot = 2.80881827044756 | epot = -22.1611617112313 | etot = -17.7257796637289
-778000  ekin = 1.49436478903862 |  erot = 2.24161236856226 | epot = -22.1732646444852 | etot = -18.4372874868843
-779000  ekin = 1.88107404119766 |  erot = 1.90732846459751 | epot = -22.2125828989308 | etot = -18.4241803931357
-780000  ekin = 1.70209634464211 |  erot = 2.30515299210351 | epot = -22.2800747799124 | etot = -18.2728254431668
-781000  ekin = 2.12615575710868 |  erot = 2.5606535839807 | epot = -22.3657963731658 | etot = -17.6789870320765
-782000  ekin = 2.60319344794517 |  erot = 1.9571688066736 | epot = -22.278889588664 | etot = -17.7185273340452
-783000  ekin = 2.19489638548848 |  erot = 2.9003350616753 | epot = -22.2004563501245 | etot = -17.1052249029607
-784000  ekin = 2.84914111009349 |  erot = 2.24051018422878 | epot = -22.2093010900996 | etot = -17.1196497957773
-785000  ekin = 3.14240765153577 |  erot = 2.92860772919915 | epot = -22.2500274240077 | etot = -16.1790120432728
-786000  ekin = 2.83372300736036 |  erot = 3.44593690351849 | epot = -22.2923595270367 | etot = -16.0126996161579
-787000  ekin = 2.41074903520556 |  erot = 3.01381650302092 | epot = -22.2329745868673 | etot = -16.8084090486408
-788000  ekin = 1.99557665602945 |  erot = 2.01600225895996 | epot = -22.1996915458458 | etot = -18.1881126308564
-789000  ekin = 2.46258971641133 |  erot = 2.27406771625316 | epot = -22.1314921413931 | etot = -17.3948347087286
-790000  ekin = 3.5794195002921 |  erot = 2.82440864812442 | epot = -22.0691321886934 | etot = -15.6653040402769
-791000  ekin = 3.1240271028451 |  erot = 2.42401718962737 | epot = -22.0808685046086 | etot = -16.5328242121361
-792000  ekin = 3.95429056548242 |  erot = 1.97241939137157 | epot = -22.0156932891881 | etot = -16.0889833323341
-793000  ekin = 2.26828416500901 |  erot = 2.58677202552917 | epot = -21.9219598803777 | etot = -17.0669036898395
-794000  ekin = 2.16106559150924 |  erot = 2.44310931274122 | epot = -21.7619518452423 | etot = -17.1577769409919
-795000  ekin = 1.62519700428841 |  erot = 2.41826691867446 | epot = -21.6012749849542 | etot = -17.5578110619913
-796000  ekin = 2.18377144801669 |  erot = 2.13093440679001 | epot = -21.4820337714693 | etot = -17.1673279166626
-797000  ekin = 1.81427862345353 |  erot = 1.99534051513419 | epot = -21.4739195915569 | etot = -17.6643004529692
-798000  ekin = 2.2201219513299 |  erot = 2.51363796316553 | epot = -21.5008270155092 | etot = -16.7670671010138
-799000  ekin = 1.88984581553595 |  erot = 2.87047971528298 | epot = -21.4708608053325 | etot = -16.7105352745136
-800000  ekin = 2.14235800297794 |  erot = 2.35196377273805 | epot = -21.3792596865246 | etot = -16.8849379108086
-801000  ekin = 1.84302686949433 |  erot = 1.65480855802629 | epot = -21.2211741734437 | etot = -17.7233387459231
-802000  ekin = 2.20305615004888 |  erot = 2.22355768328245 | epot = -21.1073599995259 | etot = -16.6807461661946
-803000  ekin = 2.64836814873033 |  erot = 1.90761871804858 | epot = -21.0752041885471 | etot = -16.5192173217682
-804000  ekin = 2.34495845479317 |  erot = 2.89112045330492 | epot = -21.0176734836814 | etot = -15.7815945755833
-805000  ekin = 1.79915640284781 |  erot = 2.71685844764875 | epot = -20.8858433761952 | etot = -16.3698285256987
-806000  ekin = 1.74992507845556 |  erot = 2.08517047523252 | epot = -20.8503301901419 | etot = -17.0152346364538
-807000  ekin = 1.57172452594494 |  erot = 1.70422569898767 | epot = -20.9092333967053 | etot = -17.6332831717727
-808000  ekin = 2.08106901002531 |  erot = 2.4036706521883 | epot = -20.9858691795981 | etot = -16.5011295173845
-809000  ekin = 2.61736488835992 |  erot = 1.51251405170843 | epot = -20.9790910298502 | etot = -16.8492120897819
-810000  ekin = 3.07344763503492 |  erot = 2.65428122600395 | epot = -20.896297890317 | etot = -15.1685690292781
-811000  ekin = 3.028899831017 |  erot = 3.61686315729187 | epot = -20.939661602879 | etot = -14.2938986145701
-812000  ekin = 2.13832655324419 |  erot = 2.7919099294265 | epot = -21.0260005012597 | etot = -16.095764018589
-813000  ekin = 2.19077235410927 |  erot = 3.16158040032406 | epot = -21.2169108164964 | etot = -15.8645580620631
-814000  ekin = 1.70775111413747 |  erot = 2.98436840501864 | epot = -21.3089511890131 | etot = -16.6168316698569
-815000  ekin = 2.14630779714624 |  erot = 2.27335416843263 | epot = -21.3099230783927 | etot = -16.8902611128138
-816000  ekin = 2.70331501775258 |  erot = 1.53093796189124 | epot = -21.3384418834226 | etot = -17.1041889037788
-817000  ekin = 2.55738086811903 |  erot = 2.58558173150041 | epot = -21.4691891608916 | etot = -16.3262265612722
-818000  ekin = 2.27829786328906 |  erot = 2.26089725682103 | epot = -21.5162183667694 | etot = -16.9770232466593
-819000  ekin = 2.10478260130361 |  erot = 3.02380855832961 | epot = -21.5292309310153 | etot = -16.4006397713821
-820000  ekin = 2.50608188233135 |  erot = 2.71783485224719 | epot = -21.5036816055507 | etot = -16.2797648709722
-821000  ekin = 2.62609848062629 |  erot = 2.55164634943844 | epot = -21.478766185164 | etot = -16.3010213550993
-822000  ekin = 3.63941681915299 |  erot = 2.20246894917129 | epot = -21.4688230156577 | etot = -15.6269372473334
-823000  ekin = 3.58953515450024 |  erot = 2.73556206545619 | epot = -21.4650227341943 | etot = -15.1399255142378
-824000  ekin = 4.11304720722591 |  erot = 3.2917459513548 | epot = -21.4062011377905 | etot = -14.0014079792098
-825000  ekin = 2.90620097853796 |  erot = 3.46409084826251 | epot = -21.2436944546109 | etot = -14.8734026278105
-826000  ekin = 1.72188438195169 |  erot = 1.97028277378148 | epot = -21.0473904580338 | etot = -17.3552233023007
-827000  ekin = 1.9124069409458 |  erot = 2.55760488338657 | epot = -20.9206700763425 | etot = -16.4506582520101
-828000  ekin = 2.38145056979363 |  erot = 2.55544957149182 | epot = -20.8204865756543 | etot = -15.8835864343689
-829000  ekin = 2.24733826946605 |  erot = 1.78474837345228 | epot = -20.7084449579388 | etot = -16.6763583150204
-830000  ekin = 2.52795893691035 |  erot = 2.34146724282711 | epot = -20.5883731027638 | etot = -15.7189469230264
-831000  ekin = 2.68310001004752 |  erot = 2.07407005901145 | epot = -20.4364451382899 | etot = -15.679275069231
-832000  ekin = 2.6732342426401 |  erot = 2.02167788192499 | epot = -20.3691783993746 | etot = -15.6742662748095
-833000  ekin = 2.55071664949192 |  erot = 2.59972899624767 | epot = -20.3036213925319 | etot = -15.1531757467923
-834000  ekin = 2.87089088359563 |  erot = 2.32463192225235 | epot = -20.2984653371648 | etot = -15.1029425313168
-835000  ekin = 2.77558903596269 |  erot = 2.73757154391999 | epot = -20.4022293845421 | etot = -14.8890688046595
-836000  ekin = 2.57713146919653 |  erot = 2.85322310545496 | epot = -20.5403137141641 | etot = -15.1099591395126
-837000  ekin = 1.78075406754283 |  erot = 1.97503243561096 | epot = -20.5889142070484 | etot = -16.8331277038946
-838000  ekin = 1.98032617531701 |  erot = 2.7982946707394 | epot = -20.6049667376349 | etot = -15.8263458915785
-839000  ekin = 2.0003179521848 |  erot = 2.70198331564815 | epot = -20.5921495833285 | etot = -15.8898483154955
-840000  ekin = 1.70031236242703 |  erot = 2.95685689490568 | epot = -20.6678372916037 | etot = -16.010668034271
-841000  ekin = 2.77705100359315 |  erot = 2.84742847205069 | epot = -20.7929304121763 | etot = -15.1684509365325
-842000  ekin = 2.54393458307436 |  erot = 2.87172695192627 | epot = -20.8173418291016 | etot = -15.401680294101
-843000  ekin = 2.00273625390939 |  erot = 2.63437491598434 | epot = -20.8053999188197 | etot = -16.1682887489259
-844000  ekin = 1.52900749569349 |  erot = 1.92882434140971 | epot = -20.8427655387949 | etot = -17.3849337016917
-845000  ekin = 2.27176799938834 |  erot = 2.308436365406 | epot = -20.9384881501645 | etot = -16.3582837853702
-846000  ekin = 2.06718804989496 |  erot = 2.33108662324981 | epot = -21.008503215967 | etot = -16.6102285428222
-847000  ekin = 2.457310325364 |  erot = 2.64112097293887 | epot = -20.9624761048838 | etot = -15.8640448065809
-848000  ekin = 2.13894899278459 |  erot = 1.46487099434192 | epot = -20.9909626022984 | etot = -17.3871426151719
-849000  ekin = 2.0007946308419 |  erot = 2.48568109050424 | epot = -20.9995492646628 | etot = -16.5130735433167
-850000  ekin = 2.54186297995285 |  erot = 2.66929613872204 | epot = -20.9906717645298 | etot = -15.7795126458549
-851000  ekin = 2.16443404123472 |  erot = 2.92830981454153 | epot = -20.9932718794597 | etot = -15.9005280236835
-852000  ekin = 2.48255398040851 |  erot = 2.46238001266592 | epot = -21.018749118108 | etot = -16.0738151250336
-853000  ekin = 2.41541467016921 |  erot = 2.97520224443385 | epot = -20.9598722543997 | etot = -15.5692553397966
-854000  ekin = 2.35150751079563 |  erot = 2.85453387569363 | epot = -20.8693696367608 | etot = -15.6633282502715
-855000  ekin = 2.36749640703667 |  erot = 2.0675340835823 | epot = -20.8980197782034 | etot = -16.4629892875844
-856000  ekin = 2.52164598863741 |  erot = 2.75265020302047 | epot = -20.800830948998 | etot = -15.5265347573401
-857000  ekin = 2.55862872070476 |  erot = 3.03030828592914 | epot = -20.6910887919773 | etot = -15.1021517853434
-858000  ekin = 3.12628251408762 |  erot = 2.1455460426107 | epot = -20.6394579492303 | etot = -15.367629392532
-859000  ekin = 2.91259413572113 |  erot = 2.23773675238284 | epot = -20.6611486479508 | etot = -15.5108177598468
-860000  ekin = 2.88318377110752 |  erot = 1.51972062646443 | epot = -20.6828066069552 | etot = -16.2799022093833
-861000  ekin = 2.33529167415754 |  erot = 2.85116617791259 | epot = -20.6796212139896 | etot = -15.4931633619195
-862000  ekin = 3.06091745354043 |  erot = 1.86960550588563 | epot = -20.7257485328209 | etot = -15.7952255733949
-863000  ekin = 2.88295223464283 |  erot = 1.77743902656171 | epot = -20.8340328987095 | etot = -16.173641637505
-864000  ekin = 2.95602292127633 |  erot = 2.6505641071531 | epot = -21.016295456145 | etot = -15.4097084277156
-865000  ekin = 3.3172549369506 |  erot = 2.24347319046513 | epot = -21.1441095096619 | etot = -15.5833813822461
-866000  ekin = 2.8446879555804 |  erot = 3.16802464112883 | epot = -21.2275167371632 | etot = -15.214804140454
-867000  ekin = 2.74149808612435 |  erot = 3.09628634794253 | epot = -21.2140642048229 | etot = -15.376279770756
-868000  ekin = 2.19141484864809 |  erot = 2.23765996064101 | epot = -21.1661691183494 | etot = -16.7370943090603
-869000  ekin = 2.92726848075923 |  erot = 2.49663936074752 | epot = -21.1109612585256 | etot = -15.6870534170189
-870000  ekin = 2.47986538741064 |  erot = 2.11907230969515 | epot = -21.0900293946685 | etot = -16.4910916975627
-871000  ekin = 2.18342640526418 |  erot = 2.37474045896628 | epot = -20.9804914418025 | etot = -16.422324577572
-872000  ekin = 1.52873571215978 |  erot = 2.08908078804674 | epot = -20.9343176993392 | etot = -17.3165011991327
-873000  ekin = 1.39281578471524 |  erot = 2.29034780878957 | epot = -21.0007866828842 | etot = -17.3176230893794
-874000  ekin = 1.40786554880768 |  erot = 2.77007970032348 | epot = -21.160084274243 | etot = -16.9821390251118
-875000  ekin = 1.18320018517441 |  erot = 2.7305884288351 | epot = -21.2959059488291 | etot = -17.3821173348196
-876000  ekin = 1.8300189393038 |  erot = 2.99586941144887 | epot = -21.3298635968753 | etot = -16.5039752461226
-877000  ekin = 2.38032906471076 |  erot = 2.03722695211227 | epot = -21.4152790752831 | etot = -16.99772305846
-878000  ekin = 2.1293851684127 |  erot = 1.75666654131943 | epot = -21.412657760354 | etot = -17.5266060506219
-879000  ekin = 2.23837299177368 |  erot = 2.71307243504657 | epot = -21.4006541150457 | etot = -16.4492086882254
-880000  ekin = 2.68032631557358 |  erot = 2.78439945590096 | epot = -21.4462782448912 | etot = -15.9815524734167
-881000  ekin = 2.86810525851389 |  erot = 2.35959915589952 | epot = -21.4314549447334 | etot = -16.20375053032
-882000  ekin = 2.33172283615115 |  erot = 2.17176020371467 | epot = -21.369535469283 | etot = -16.8660524294172
-883000  ekin = 2.36331150998289 |  erot = 1.97634374053966 | epot = -21.1748990104138 | etot = -16.8352437598913
-884000  ekin = 2.53782271833829 |  erot = 2.25243670168427 | epot = -21.0795767771653 | etot = -16.2893173571427
-885000  ekin = 2.86057103069745 |  erot = 2.27462544190307 | epot = -21.0782171958267 | etot = -15.9430207232262
-886000  ekin = 3.17034195996096 |  erot = 1.74832646729409 | epot = -21.1280719510453 | etot = -16.2094035237903
-887000  ekin = 2.66023408534638 |  erot = 2.49426802108016 | epot = -21.1909579488462 | etot = -16.0364558424197
-888000  ekin = 2.14156056158802 |  erot = 2.83065920295552 | epot = -21.2749898508176 | etot = -16.302770086274
-889000  ekin = 2.13776380125426 |  erot = 2.19994227158624 | epot = -21.1902576201104 | etot = -16.8525515472699
-890000  ekin = 1.76446650263826 |  erot = 2.97354753014624 | epot = -21.2518724314555 | etot = -16.513858398671
-891000  ekin = 1.64433607192947 |  erot = 2.28044235221045 | epot = -21.3759471910581 | etot = -17.4511687669181
-892000  ekin = 1.97381907006142 |  erot = 2.35969977765342 | epot = -21.5200869372681 | etot = -17.1865680895533
-893000  ekin = 1.77998159671209 |  erot = 1.83959134574388 | epot = -21.5960425863495 | etot = -17.9764696438935
-894000  ekin = 2.8098996128374 |  erot = 2.80337844303785 | epot = -21.6896955865519 | etot = -16.0764175306767
-895000  ekin = 2.03570642281182 |  erot = 2.73641442629084 | epot = -21.77632807541 | etot = -17.0042072263074
-896000  ekin = 1.6670401968188 |  erot = 2.55842313387756 | epot = -21.9079691828366 | etot = -17.6825058521403
-897000  ekin = 1.79364820755772 |  erot = 2.35937074837063 | epot = -22.0466195733302 | etot = -17.8936006174018
-898000  ekin = 1.84103348909591 |  erot = 2.4159698011209 | epot = -22.0792153246985 | etot = -17.8222120344817
-899000  ekin = 1.6644807831865 |  erot = 3.06295573986192 | epot = -22.0050930291629 | etot = -17.2776565061145
-900000  ekin = 2.15301263014261 |  erot = 2.62503812958044 | epot = -21.9769631774149 | etot = -17.1989124176918
-901000  ekin = 2.43323525076021 |  erot = 2.69661561775585 | epot = -22.0455467285607 | etot = -16.9156958600446
-902000  ekin = 2.57983518470479 |  erot = 2.40634661051271 | epot = -22.0504126836938 | etot = -17.0642308884763
-903000  ekin = 2.38804084084236 |  erot = 2.40369143268286 | epot = -22.0548572254258 | etot = -17.2631249519006
-904000  ekin = 1.9975679938241 |  erot = 3.15736733739655 | epot = -22.0783783499621 | etot = -16.9234430187414
-905000  ekin = 2.28042135995781 |  erot = 2.20746001153526 | epot = -22.092475444409 | etot = -17.604594072916
-906000  ekin = 2.49914497220395 |  erot = 1.67106173041057 | epot = -22.0649292741971 | etot = -17.8947225715826
-907000  ekin = 2.34170753461351 |  erot = 2.16830189815579 | epot = -21.9182395193391 | etot = -17.4082300865698
-908000  ekin = 2.83101675354561 |  erot = 2.39226452568031 | epot = -21.9393923471479 | etot = -16.7161110679219
-909000  ekin = 3.13519044247878 |  erot = 2.07053636961478 | epot = -22.044039894957 | etot = -16.8383130828634
-910000  ekin = 2.91492350277448 |  erot = 3.54269221448408 | epot = -22.1774209001616 | etot = -15.719805182903
-911000  ekin = 1.86299522014884 |  erot = 2.75425299355676 | epot = -22.2318842654016 | etot = -17.614636051696
-912000  ekin = 2.64270620869814 |  erot = 1.86916034984858 | epot = -22.2816929482531 | etot = -17.7698263897064
-913000  ekin = 2.45835259040075 |  erot = 2.03343540339216 | epot = -22.4051980318983 | etot = -17.9134100381054
-914000  ekin = 2.01630257583653 |  erot = 3.01931541129968 | epot = -22.505580829989 | etot = -17.4699628428528
-915000  ekin = 2.73550820750709 |  erot = 2.14051989379169 | epot = -22.5067223019054 | etot = -17.6306942006067
-916000  ekin = 2.38833694849903 |  erot = 3.26236542376325 | epot = -22.5299732656691 | etot = -16.8792708934068
-917000  ekin = 2.21211072529667 |  erot = 2.24425221182159 | epot = -22.5175498112378 | etot = -18.0611868741195
-918000  ekin = 2.11721632678553 |  erot = 2.05681940825278 | epot = -22.4485798442659 | etot = -18.2745441092275
-919000  ekin = 2.6606540164524 |  erot = 2.41853759346262 | epot = -22.4819256778217 | etot = -17.4027340679066
-920000  ekin = 3.26471044916532 |  erot = 2.75531911342505 | epot = -22.5858600689149 | etot = -16.5658305063245
-921000  ekin = 2.72028388628927 |  erot = 1.9696059637128 | epot = -22.639440275186 | etot = -17.949550425184
-922000  ekin = 1.43428549123066 |  erot = 1.52428475569853 | epot = -22.6914991306332 | etot = -19.732928883704
-923000  ekin = 1.67603986848274 |  erot = 1.86522020655464 | epot = -22.7510571233686 | etot = -19.2097970483313
-924000  ekin = 2.15000311118185 |  erot = 1.53327070095755 | epot = -22.722341324193 | etot = -19.0390675120536
-925000  ekin = 2.27769316315993 |  erot = 1.3558291477729 | epot = -22.6317669747038 | etot = -18.9982446637709
-926000  ekin = 2.0037075380337 |  erot = 2.07123237010034 | epot = -22.5811533157097 | etot = -18.5062134075756
-927000  ekin = 2.5163142824884 |  erot = 1.98711239136866 | epot = -22.6957752134474 | etot = -18.1923485395904
-928000  ekin = 2.57502157703452 |  erot = 2.51449316644151 | epot = -22.8486668477058 | etot = -17.7591521042298
-929000  ekin = 2.66015175923782 |  erot = 1.82991995656989 | epot = -22.8894816710891 | etot = -18.3994099552814
-930000  ekin = 2.41758548277495 |  erot = 2.00977019739402 | epot = -22.9023129289068 | etot = -18.4749572487378
-931000  ekin = 3.01936517399357 |  erot = 2.11115283295647 | epot = -22.8598478032752 | etot = -17.7293297963252
-932000  ekin = 2.34904883629147 |  erot = 1.87134929534042 | epot = -22.900230384769 | etot = -18.6798322531371
-933000  ekin = 2.16775611540091 |  erot = 2.83796264813669 | epot = -22.9075292968864 | etot = -17.9018105333488
-934000  ekin = 2.17428610858913 |  erot = 2.11891276299501 | epot = -22.9275911153101 | etot = -18.634392243726
-935000  ekin = 2.35380058127247 |  erot = 2.22719757040085 | epot = -22.9178791070039 | etot = -18.3368809553306
-936000  ekin = 2.29398857252167 |  erot = 2.52122883801967 | epot = -23.0254587453496 | etot = -18.2102413348082
-937000  ekin = 2.32405492839276 |  erot = 2.82571975062453 | epot = -23.1134869099967 | etot = -17.9637122309794
-938000  ekin = 2.46190818228192 |  erot = 1.99586541720566 | epot = -23.1690855883853 | etot = -18.7113119888978
-939000  ekin = 2.99494633358444 |  erot = 2.1120057997909 | epot = -23.1621265982256 | etot = -18.0551744648503
-940000  ekin = 3.76773061527755 |  erot = 2.67954167018356 | epot = -23.1020260319689 | etot = -16.6547537465078
-941000  ekin = 3.15108874053801 |  erot = 2.26610050109568 | epot = -23.0042404655517 | etot = -17.587051223918
-942000  ekin = 3.50311245643907 |  erot = 1.88373602143018 | epot = -22.9671180112669 | etot = -17.5802695333976
-943000  ekin = 3.82043792465856 |  erot = 2.71285823250348 | epot = -22.9404059827705 | etot = -16.4071098256085
-944000  ekin = 2.68278476017665 |  erot = 2.75585489458161 | epot = -22.919058077481 | etot = -17.4804184227228
-945000  ekin = 2.55880828345198 |  erot = 2.02741981318914 | epot = -22.8232630911495 | etot = -18.2370349945083
-946000  ekin = 2.47548691870273 |  erot = 1.66864059361738 | epot = -22.6586979544826 | etot = -18.5145704421625
-947000  ekin = 2.41867478100658 |  erot = 1.99274780926995 | epot = -22.5542133657 | etot = -18.1427907754235
-948000  ekin = 3.54970439277899 |  erot = 2.57756240201333 | epot = -22.4104376157296 | etot = -16.2831708209373
-949000  ekin = 2.98589976166071 |  erot = 2.44208964275302 | epot = -22.1971411230011 | etot = -16.7691517185873
-950000  ekin = 1.82147308870195 |  erot = 3.05083899379338 | epot = -22.0435130221227 | etot = -17.1712009396274
-951000  ekin = 2.20031505253436 |  erot = 2.38004890424644 | epot = -22.0174402075992 | etot = -17.4370762508184
-952000  ekin = 2.14165422682636 |  erot = 1.67045420750585 | epot = -21.9875031647927 | etot = -18.1753947304605
-953000  ekin = 2.2983346942831 |  erot = 1.97349532600851 | epot = -21.9532851584681 | etot = -17.6814551381765
-954000  ekin = 1.48835290094507 |  erot = 3.35692451991831 | epot = -21.8812774176255 | etot = -17.0359999967621
-955000  ekin = 1.87513794155827 |  erot = 2.65898918540887 | epot = -21.7919528937348 | etot = -17.2578257667677
-956000  ekin = 1.6947359470094 |  erot = 2.15427252360414 | epot = -21.7268035908356 | etot = -17.877795120222
-957000  ekin = 1.75579814865835 |  erot = 1.63901039608816 | epot = -21.700727032202 | etot = -18.3059184874555
-958000  ekin = 1.59869777656518 |  erot = 2.20104985114387 | epot = -21.7023937250484 | etot = -17.9026460973393
-959000  ekin = 2.58438881562724 |  erot = 2.4897790743314 | epot = -21.7153511733982 | etot = -16.6411832834396
-960000  ekin = 2.53916903929276 |  erot = 2.05995138561213 | epot = -21.7134163297425 | etot = -17.1142959048376
-961000  ekin = 2.28282707786747 |  erot = 2.18347157951504 | epot = -21.7152390799838 | etot = -17.2489404226013
-962000  ekin = 1.65520100959905 |  erot = 3.51416445242775 | epot = -21.7329558565076 | etot = -16.5635903944808
-963000  ekin = 1.99568689924178 |  erot = 1.50126173817713 | epot = -21.6847527677603 | etot = -18.1878041303413
-964000  ekin = 2.18616111169191 |  erot = 2.27601428306196 | epot = -21.621271673579 | etot = -17.1590962788252
-965000  ekin = 2.12688674785305 |  erot = 2.31141713690626 | epot = -21.6018715374842 | etot = -17.1635676527249
-966000  ekin = 3.18043989665769 |  erot = 3.42455452205085 | epot = -21.638305203769 | etot = -15.0333107850605
-967000  ekin = 3.07300409154252 |  erot = 2.17511749698304 | epot = -21.5951488445701 | etot = -16.3470272560445
-968000  ekin = 2.08663150655529 |  erot = 2.13997027735021 | epot = -21.5232721871232 | etot = -17.2966704032177
-969000  ekin = 2.26951411936363 |  erot = 2.21822796004341 | epot = -21.4611553284775 | etot = -16.9734132490705
-970000  ekin = 2.49167396599781 |  erot = 2.62083774678039 | epot = -21.4077353682587 | etot = -16.2952236554805
-971000  ekin = 2.497450596106 |  erot = 2.64553775005007 | epot = -21.3712924820092 | etot = -16.2283041358532
-972000  ekin = 3.2069302084461 |  erot = 2.4701129448845 | epot = -21.3144344371103 | etot = -15.6373912837797
-973000  ekin = 3.35935448087941 |  erot = 2.62917582888825 | epot = -21.2433830591837 | etot = -15.254852749416
-974000  ekin = 2.71069552226069 |  erot = 2.13944446989067 | epot = -21.1404268855179 | etot = -16.2902868933666
-975000  ekin = 1.81165819781674 |  erot = 2.10218924092727 | epot = -21.0499905566304 | etot = -17.1361431178864
-976000  ekin = 2.36984742020937 |  erot = 1.38488988265325 | epot = -20.9803229653515 | etot = -17.2255856624889
-977000  ekin = 2.83728662155799 |  erot = 3.02976542728586 | epot = -21.086860961914 | etot = -15.2198089130701
-978000  ekin = 3.14169266917128 |  erot = 3.0279981203262 | epot = -21.1408187166748 | etot = -14.9711279271773
-979000  ekin = 3.63725915757345 |  erot = 2.47075910077982 | epot = -21.0348329782418 | etot = -14.9268147198885
-980000  ekin = 3.42622785415583 |  erot = 3.24164435781272 | epot = -20.9604411583362 | etot = -14.2925689463677
-981000  ekin = 2.9282364939793 |  erot = 2.44516658563954 | epot = -20.999389015838 | etot = -15.6259859362192
-982000  ekin = 2.0455891107008 |  erot = 2.21302288881361 | epot = -21.0172581853275 | etot = -16.7586461858131
-983000  ekin = 2.56053983213181 |  erot = 1.98406283304104 | epot = -21.0054554868711 | etot = -16.4608528216982
-984000  ekin = 2.31455025377678 |  erot = 2.58584391470351 | epot = -21.0528748947299 | etot = -16.1524807262496
-985000  ekin = 2.31703817263368 |  erot = 2.99965025262552 | epot = -21.1270579315131 | etot = -15.8103695062539
-986000  ekin = 2.05103854432386 |  erot = 2.1535155091137 | epot = -21.2182405597612 | etot = -17.0136865063236
-987000  ekin = 2.41899263793244 |  erot = 1.58416150281503 | epot = -21.1906087726859 | etot = -17.1874546319384
-988000  ekin = 2.75135283132848 |  erot = 2.70498731016258 | epot = -21.09026978368 | etot = -15.633929642189
-989000  ekin = 2.29408577956131 |  erot = 2.85656205344493 | epot = -21.0178170251465 | etot = -15.8671691921403
-990000  ekin = 2.23414139649767 |  erot = 2.58987928207187 | epot = -20.9412338597721 | etot = -16.1172131812026
-991000  ekin = 2.20140095465642 |  erot = 2.53421928109187 | epot = -20.8284298905317 | etot = -16.0928096547834
-992000  ekin = 1.73516341340694 |  erot = 2.49726908126814 | epot = -20.8981414535471 | etot = -16.665708958872
-993000  ekin = 1.38883779880922 |  erot = 1.96818984395137 | epot = -20.9939445972527 | etot = -17.6369169544921
-994000  ekin = 1.48978908674571 |  erot = 2.95636513336706 | epot = -21.0608370227912 | etot = -16.6146828026784
-995000  ekin = 2.31404204513712 |  erot = 1.67482961392509 | epot = -21.1264761824825 | etot = -17.1376045234203
-996000  ekin = 2.89776504847011 |  erot = 2.85063328331353 | epot = -21.0879631716189 | etot = -15.3395648398353
-997000  ekin = 3.12980664910277 |  erot = 2.14994147346883 | epot = -21.0789162715404 | etot = -15.7991681489688
-998000  ekin = 2.21592279552962 |  erot = 3.03017611615784 | epot = -20.9989402817529 | etot = -15.7528413700654
-999000  ekin = 2.60947995309596 |  erot = 1.73829419308785 | epot = -20.9136108602423 | etot = -16.5658367140585
-1000000  ekin = 2.32269547490306 |  erot = 2.87794942105203 | epot = -20.9071852604882 | etot = -15.7065403645331
- 1000000   0.10323091    -1.356822  0.050122912   -1.1615306 0.00013791576 
-Loop time of 52.0267 on 4 procs for 1000000 steps with 16 atoms
-
-Performance: 16606.850 tau/day, 19220.892 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    | 0.92946    | 16.932     | 31.787     | 338.2 | 32.55
-Bond    | 0.12904    | 0.54878    | 0.89134    |  46.8 |  1.05
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 4.2008     | 5.1678     | 6.1197     |  36.6 |  9.93
-Output  | 2.1e-05    | 3.15e-05   | 3.6e-05    |   0.0 |  0.00
-Modify  | 0.32128    | 3.4221     | 6.4024     | 143.6 |  6.58
-Other   |            | 25.96      |            |       | 49.89
-
-Nlocal:    4 ave 8 max 0 min
-Histogram: 1 1 0 0 0 0 0 0 1 1
-Nghost:    9 ave 10 max 8 min
-Histogram: 1 0 0 0 0 2 0 0 0 1
-Neighs:    34.5 ave 67 max 0 min
-Histogram: 1 1 0 0 0 0 0 0 0 2
-
-Total # of neighbors = 138
-Ave neighs/atom = 8.625
-Ave special neighs/atom = 3.75
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:52
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.1 b/examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.1
deleted file mode 100644
index a699d8726d..0000000000
--- a/examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.1
+++ /dev/null
@@ -1,1172 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000102 secs
-  read_data CPU = 0.002436 secs
-
-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 oxdna2/fene
-bond_coeff * 2.0 0.25 0.7564
-
-# 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     seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.6 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 0.6 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
-
-#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 = 2.6274
-  ghost atom cutoff = 2.6274
-  binsize = 1.3137, 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
-Per MPI rank memory allocation (min/avg/max) = 3.023 | 3.023 | 3.023 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
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-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
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-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
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-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
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-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
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-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
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-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
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-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
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-331000  ekin = 0.304195517643728 |  erot = 0.484439927615862 | epot = -15.4061494803532 | etot = -14.6175140350936
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-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
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-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
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-342000  ekin = 0.404646174019828 |  erot = 0.455385967573506 | epot = -15.4775461765844 | etot = -14.617514034991
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-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
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-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
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-353000  ekin = 0.245153509655857 |  erot = 0.605705335206491 | epot = -15.4683728798634 | etot = -14.617514035001
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-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
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-359000  ekin = 0.221770268741646 |  erot = 0.604273418958276 | epot = -15.443557722588 | etot = -14.6175140348881
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-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
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-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
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-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
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-398000  ekin = 0.250862154070766 |  erot = 0.491439914329229 | epot = -15.3598161036022 | etot = -14.6175140352022
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-405000  ekin = 0.278857975737129 |  erot = 0.719246574878154 | epot = -15.6156185859915 | etot = -14.6175140353763
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-440000  ekin = 0.434927659014138 |  erot = 0.308973010492868 | epot = -15.3614147045135 | etot = -14.6175140350065
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-443000  ekin = 0.377694362715545 |  erot = 0.319179725729324 | epot = -15.314388123361 | etot = -14.6175140349161
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-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
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-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
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-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
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-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
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-570000  ekin = 0.269583567607364 |  erot = 0.546150320474836 | epot = -15.4332479230362 | etot = -14.617514034954
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-572000  ekin = 0.276116495687091 |  erot = 0.569316321634121 | epot = -15.4629468522959 | etot = -14.6175140349747
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-574000  ekin = 0.290574483947443 |  erot = 0.58103049076154 | epot = -15.4891190097262 | etot = -14.6175140350172
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-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
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-580000  ekin = 0.351854361646192 |  erot = 0.557326170820746 | epot = -15.5266945675209 | etot = -14.617514035054
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-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
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-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
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-594000  ekin = 0.430768094953839 |  erot = 0.356614269836478 | epot = -15.4048963997596 | etot = -14.6175140349693
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-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
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-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
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-684000  ekin = 0.112958164258869 |  erot = 0.381423459018597 | epot = -15.1118956580574 | etot = -14.6175140347799
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-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
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-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
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-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
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-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
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-720000  ekin = 0.353703497403049 |  erot = 0.655019233384572 | epot = -15.6262367660863 | etot = -14.6175140352987
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-723000  ekin = 0.365803989072306 |  erot = 0.643193727890481 | epot = -15.6265117521426 | etot = -14.6175140351798
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-729000  ekin = 0.302780724957378 |  erot = 0.619758691690217 | epot = -15.5400534514572 | etot = -14.6175140348096
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-738000  ekin = 0.188451200585547 |  erot = 0.684300102137718 | epot = -15.4902653375453 | etot = -14.6175140348221
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-740000  ekin = 0.188021068410451 |  erot = 0.693554915034906 | epot = -15.4990900183625 | etot = -14.6175140349172
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-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 20.4903 on 1 procs for 1000000 steps with 10 atoms
-
-Performance: 42166.322 tau/day, 48803.614 timesteps/s
-98.3% CPU use with 1 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 16.542     | 16.542     | 16.542     |   0.0 | 80.73
-Bond    | 0.62224    | 0.62224    | 0.62224    |   0.0 |  3.04
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 0.21974    | 0.21974    | 0.21974    |   0.0 |  1.07
-Output  | 7e-06      | 7e-06      | 7e-06      |   0.0 |  0.00
-Modify  | 2.7798     | 2.7798     | 2.7798     |   0.0 | 13.57
-Other   |            | 0.3269     |            |       |  1.60
-
-Nlocal:    10 ave 10 max 10 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Nghost:    0 ave 0 max 0 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Neighs:    45 ave 45 max 45 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-
-Total # of neighbors = 45
-Ave neighs/atom = 4.5
-Ave special neighs/atom = 3.6
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:20
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.4 b/examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.4
deleted file mode 100644
index 9856a9c95b..0000000000
--- a/examples/USER/cgdna/examples/oxDNA2/duplex1/log.18Jun19.duplex1.g++.4
+++ /dev/null
@@ -1,1172 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000196 secs
-  read_data CPU = 0.003266 secs
-
-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 oxdna2/fene
-bond_coeff * 2.0 0.25 0.7564
-
-# 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     seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.6 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 0.6 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
-
-#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 = 2.6274
-  ghost atom cutoff = 2.6274
-  binsize = 1.3137, 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
-Per MPI rank memory allocation (min/avg/max) = 7.652 | 7.834 | 8.016 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
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-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
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-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
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-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
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-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
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-169000  ekin = 0.246079081489486 |  erot = 0.482926967022081 | epot = -15.3465200833369 | etot = -14.6175140348253
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-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
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-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
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-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
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-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
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-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
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-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
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-252000  ekin = 0.201630699423836 |  erot = 0.384307951122289 | epot = -15.2034526853611 | etot = -14.617514034815
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-260000  ekin = 0.312883750215128 |  erot = 0.237045600991386 | epot = -15.1674433858462 | etot = -14.6175140346397
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-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
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-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
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-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
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-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
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-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
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-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
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-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
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-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
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-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
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-322000  ekin = 0.141309963686786 |  erot = 0.493483840953745 | epot = -15.2523078396115 | etot = -14.617514034971
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-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
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-329000  ekin = 0.252245305622037 |  erot = 0.503209396460715 | epot = -15.372968737129 | etot = -14.6175140350463
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-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
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-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
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-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
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-389000  ekin = 0.128237001096924 |  erot = 0.183188026636153 | epot = -14.9289390621345 | etot = -14.6175140344014
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-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
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-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
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-411000  ekin = 0.242720888553515 |  erot = 0.74080910391814 | epot = -15.6010440276324 | etot = -14.6175140351607
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-416000  ekin = 0.227838940778005 |  erot = 0.65270826110506 | epot = -15.4980612367768 | etot = -14.6175140348937
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-425000  ekin = 0.344144594922978 |  erot = 0.444869796713037 | epot = -15.4065284264654 | etot = -14.6175140348294
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-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
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-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
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-438000  ekin = 0.465707830234525 |  erot = 0.308296241622533 | epot = -15.3915181069269 | etot = -14.6175140350699
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-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
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-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
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-454000  ekin = 0.239716691076083 |  erot = 0.39400413186188 | epot = -15.2512348578882 | etot = -14.6175140349502
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-457000  ekin = 0.228459014431981 |  erot = 0.40850770951526 | epot = -15.2544807589758 | etot = -14.6175140350286
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-472000  ekin = 0.188707621222025 |  erot = 0.365373993438314 | epot = -15.1715956493842 | etot = -14.6175140347239
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-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
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-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
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-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
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-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
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-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
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-684000  ekin = 0.112958164259223 |  erot = 0.38142345901904 | epot = -15.1118956580582 | etot = -14.61751403478
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-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
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-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
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-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
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-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
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-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 28.9854 on 4 procs for 1000000 steps with 10 atoms
-
-Performance: 29808.075 tau/day, 34500.086 timesteps/s
-96.6% CPU use with 4 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 0.85571    | 9.8341     | 18.111     | 228.8 | 33.93
-Bond    | 0.12393    | 0.38078    | 0.62324    |  32.7 |  1.31
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 2.795      | 3.6269     | 4.4228     |  30.4 | 12.51
-Output  | 1.8e-05    | 2.575e-05  | 2.9e-05    |   0.0 |  0.00
-Modify  | 0.24721    | 1.1083     | 1.9206     |  64.1 |  3.82
-Other   |            | 14.04      |            |       | 48.42
-
-Nlocal:    2.5 ave 5 max 0 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-Nghost:    7.5 ave 10 max 5 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-Neighs:    18.5 ave 35 max 0 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-
-Total # of neighbors = 74
-Ave neighs/atom = 7.4
-Ave special neighs/atom = 3.6
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:28
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.1 b/examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.1
deleted file mode 100644
index e4478a8942..0000000000
--- a/examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.1
+++ /dev/null
@@ -1,1173 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000103 secs
-  read_data CPU = 0.00215 secs
-
-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 oxdna2/fene
-bond_coeff * 2.0 0.25 0.7564
-
-# 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     seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.6 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 0.6 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
-
-#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 = 2.6274
-  ghost atom cutoff = 2.6274
-  binsize = 1.3137, 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
-Per MPI rank memory allocation (min/avg/max) = 3.025 | 3.025 | 3.025 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 = 2.72073389273301 |  erot = 1.81206134758344 | epot = -21.8246886433981 | etot = -17.2918934030816
-129000  ekin = 2.76648233159587 |  erot = 2.90133130407443 | epot = -21.9103698595755 | etot = -16.2425562239052
-130000  ekin = 3.26919771496399 |  erot = 2.56804213542044 | epot = -22.0468205769693 | etot = -16.2095807265849
-131000  ekin = 2.65797021501453 |  erot = 2.51912811588696 | epot = -22.1046945041584 | etot = -16.9275961732569
-132000  ekin = 2.60615175826329 |  erot = 3.39821871959342 | epot = -22.1393658191679 | etot = -16.1349953413112
-133000  ekin = 2.01702653257964 |  erot = 2.88164356754679 | epot = -22.1083395633022 | etot = -17.2096694631758
-134000  ekin = 1.62732528940444 |  erot = 1.66916296573806 | epot = -22.0617984863721 | etot = -18.7653102312296
-135000  ekin = 2.44472224525446 |  erot = 2.12100291286044 | epot = -22.0290071826116 | etot = -17.4632820244967
-136000  ekin = 2.29361895961086 |  erot = 3.04813516280966 | epot = -21.9240579822781 | etot = -16.5823038598575
-137000  ekin = 2.71943103843212 |  erot = 2.46250134466529 | epot = -21.759346222065 | etot = -16.5774138389676
-138000  ekin = 3.29026615453928 |  erot = 1.74005246857097 | epot = -21.7424803627639 | etot = -16.7121617396537
-139000  ekin = 2.76078280183931 |  erot = 1.72093988964439 | epot = -21.8915740702781 | etot = -17.4098513787944
-140000  ekin = 2.72717929836212 |  erot = 2.46093572161851 | epot = -21.9730696792527 | etot = -16.784954659272
-141000  ekin = 2.79178566984556 |  erot = 2.45152416051809 | epot = -21.9760531770405 | etot = -16.7327433466769
-142000  ekin = 3.51808959230238 |  erot = 3.47662361887462 | epot = -21.9144706671159 | etot = -14.9197574559389
-143000  ekin = 2.56674276565954 |  erot = 2.02320192154355 | epot = -21.887847774869 | etot = -17.2979030876659
-144000  ekin = 3.71876753045239 |  erot = 3.03518010984555 | epot = -21.8693810552709 | etot = -15.115433414973
-145000  ekin = 3.61067898932004 |  erot = 2.70461629179152 | epot = -21.7768865247848 | etot = -15.4615912436733
-146000  ekin = 3.85672431702576 |  erot = 2.48360222237068 | epot = -21.7383083831155 | etot = -15.3979818437191
-147000  ekin = 3.26264642879795 |  erot = 2.07790943830875 | epot = -21.612808589745 | etot = -16.2722527226383
-148000  ekin = 2.49411629896921 |  erot = 1.64570933977901 | epot = -21.3601881264357 | etot = -17.2203624876875
-149000  ekin = 2.73353556199719 |  erot = 2.27529903215971 | epot = -21.180923940444 | etot = -16.1720893462871
-150000  ekin = 2.6282457385967 |  erot = 2.90058901460194 | epot = -21.0864924194498 | etot = -15.5576576662512
-151000  ekin = 2.07954165316093 |  erot = 2.1164125590575 | epot = -20.9951076802445 | etot = -16.7991534680261
-152000  ekin = 2.41868973763601 |  erot = 2.60413735099777 | epot = -20.8520585412647 | etot = -15.8292314526309
-153000  ekin = 2.12569822788918 |  erot = 2.25674944787518 | epot = -20.8874716791535 | etot = -16.5050240033891
-154000  ekin = 2.34486280100484 |  erot = 2.61050919353092 | epot = -20.9924730886396 | etot = -16.0371010941038
-155000  ekin = 2.06912274657395 |  erot = 3.0299583491991 | epot = -21.0207700832301 | etot = -15.921688987457
-156000  ekin = 2.03235057930374 |  erot = 3.18386486882217 | epot = -20.8574059636368 | etot = -15.6411905155109
-157000  ekin = 2.3579061324469 |  erot = 1.91132393217369 | epot = -20.8256173876826 | etot = -16.556387323062
-158000  ekin = 2.17332819176356 |  erot = 2.47832446500284 | epot = -20.9206749462161 | etot = -16.2690222894497
-159000  ekin = 2.87139796431922 |  erot = 2.29125458595932 | epot = -21.0425793637301 | etot = -15.8799268134516
-160000  ekin = 2.19495281512895 |  erot = 2.37206762182712 | epot = -21.12868212155 | etot = -16.5616616845939
-161000  ekin = 2.13209841436583 |  erot = 2.44149028746738 | epot = -21.2267263358883 | etot = -16.6531376340551
-162000  ekin = 1.75046056470489 |  erot = 2.66847316377717 | epot = -21.2792984888785 | etot = -16.8603647603965
-163000  ekin = 2.22203312194875 |  erot = 2.03600602857084 | epot = -21.4244626156303 | etot = -17.1664234651107
-164000  ekin = 2.74926161019501 |  erot = 1.42936965542836 | epot = -21.5631783920293 | etot = -17.384547126406
-165000  ekin = 2.66465183950737 |  erot = 2.28908630196103 | epot = -21.572272285795 | etot = -16.6185341443266
-166000  ekin = 3.29267065001881 |  erot = 2.38564084157004 | epot = -21.5039232020267 | etot = -15.8256117104378
-167000  ekin = 3.03664818915841 |  erot = 2.03669674074452 | epot = -21.5747204885882 | etot = -16.5013755586853
-168000  ekin = 3.16556842965113 |  erot = 1.85206282714724 | epot = -21.6223493129218 | etot = -16.6047180561234
-169000  ekin = 2.24511985727904 |  erot = 2.66889068764969 | epot = -21.5368970033532 | etot = -16.6228864584245
-170000  ekin = 2.43734116474603 |  erot = 2.49716986363814 | epot = -21.3912465276853 | etot = -16.4567354993011
-171000  ekin = 1.90620260936893 |  erot = 2.39687883544744 | epot = -21.3008997539566 | etot = -16.9978183091402
-172000  ekin = 2.87444998880216 |  erot = 3.21713663160875 | epot = -21.2616188758685 | etot = -15.1700322554576
-173000  ekin = 2.74942738368889 |  erot = 2.14120450530294 | epot = -21.2850360200821 | etot = -16.3944041310903
-174000  ekin = 2.4529377396394 |  erot = 2.23261644076142 | epot = -21.3299047479428 | etot = -16.644350567542
-175000  ekin = 2.84864650053625 |  erot = 2.37733794803682 | epot = -21.2943230039461 | etot = -16.068338555373
-176000  ekin = 2.13647755199109 |  erot = 1.89602819204849 | epot = -21.3605335602015 | etot = -17.3280278161619
-177000  ekin = 2.57740970525463 |  erot = 2.74252419383388 | epot = -21.3306809364134 | etot = -16.0107470373249
-178000  ekin = 1.83680522170069 |  erot = 2.5856914127028 | epot = -21.2632846497336 | etot = -16.8407880153301
-179000  ekin = 2.51484018139121 |  erot = 2.38459479892641 | epot = -21.325303559771 | etot = -16.4258685794534
-180000  ekin = 1.88523508330591 |  erot = 2.46381998482447 | epot = -21.4811020579528 | etot = -17.1320469898224
-181000  ekin = 1.75689043588625 |  erot = 3.04324017089631 | epot = -21.474228259015 | etot = -16.6740976522324
-182000  ekin = 1.56534231241504 |  erot = 2.04864866727399 | epot = -21.4129540971941 | etot = -17.798963117505
-183000  ekin = 2.00287899563344 |  erot = 2.82515065812734 | epot = -21.49258719815 | etot = -16.6645575443892
-184000  ekin = 2.68544625765532 |  erot = 2.43626281495748 | epot = -21.6103862218356 | etot = -16.4886771492228
-185000  ekin = 2.99891111533195 |  erot = 3.19602779235331 | epot = -21.6822175762628 | etot = -15.4872786685775
-186000  ekin = 3.18195376963592 |  erot = 2.43765957688182 | epot = -21.7117512273523 | etot = -16.0921378808346
-187000  ekin = 2.64722090162018 |  erot = 3.43145857630564 | epot = -21.6694156065006 | etot = -15.5907361285748
-188000  ekin = 2.8593721905413 |  erot = 3.05764002667605 | epot = -21.6129263142805 | etot = -15.6959140970631
-189000  ekin = 2.64258352431382 |  erot = 1.81957536948003 | epot = -21.5503774009301 | etot = -17.0882185071363
-190000  ekin = 2.2190608435254 |  erot = 1.84740673329965 | epot = -21.5105703637082 | etot = -17.4441027868831
-191000  ekin = 2.27442549063464 |  erot = 2.06581774328105 | epot = -21.4485511972947 | etot = -17.108307963379
-192000  ekin = 2.27419285809427 |  erot = 3.10822480468651 | epot = -21.4844439428341 | etot = -16.1020262800533
-193000  ekin = 1.95256612457884 |  erot = 1.88944690058107 | epot = -21.4719648319093 | etot = -17.6299518067494
-194000  ekin = 2.46290863552507 |  erot = 2.02714246570739 | epot = -21.3483686370757 | etot = -16.8583175358433
-195000  ekin = 3.12615833704228 |  erot = 2.09882827884293 | epot = -21.2854694780647 | etot = -16.0604828621794
-196000  ekin = 2.70126861243405 |  erot = 2.51307250710585 | epot = -21.2052184052664 | etot = -15.9908772857265
-197000  ekin = 2.55113347479427 |  erot = 2.07490331769114 | epot = -21.0379488001649 | etot = -16.4119120076795
-198000  ekin = 2.7091171175815 |  erot = 1.79542986755821 | epot = -21.0311079948236 | etot = -16.5265610096839
-199000  ekin = 2.57086088527333 |  erot = 2.33194065149168 | epot = -21.0448935828999 | etot = -16.1420920461349
-200000  ekin = 2.89149033048946 |  erot = 1.42165157230865 | epot = -21.03770919399 | etot = -16.7245672911919
-201000  ekin = 2.68304721320748 |  erot = 1.55647352804279 | epot = -21.0368254418007 | etot = -16.7973047005504
-202000  ekin = 2.2656487707054 |  erot = 2.24246330836477 | epot = -20.9783437689148 | etot = -16.4702316898446
-203000  ekin = 2.11263799464235 |  erot = 2.0311722239375 | epot = -20.9045528293636 | etot = -16.7607426107837
-204000  ekin = 2.10289033168206 |  erot = 1.89431766090034 | epot = -20.917707897003 | etot = -16.9204999044206
-205000  ekin = 1.32594040742044 |  erot = 2.12787440210413 | epot = -20.9650467335179 | etot = -17.5112319239933
-206000  ekin = 1.37942510627947 |  erot = 2.255876437166 | epot = -20.9344799697865 | etot = -17.299178426341
-207000  ekin = 1.89707208497052 |  erot = 1.80792832329628 | epot = -21.0372131039119 | etot = -17.3322126956451
-208000  ekin = 1.82394216235567 |  erot = 3.24636401083921 | epot = -21.2905133091558 | etot = -16.2202071359609
-209000  ekin = 2.80235035495642 |  erot = 2.34817422826193 | epot = -21.4119988544966 | etot = -16.2614742712782
-210000  ekin = 3.17268831077415 |  erot = 3.11920168004874 | epot = -21.4880486169942 | etot = -15.1961586261713
-211000  ekin = 2.46911290485391 |  erot = 2.09583435351186 | epot = -21.6131156278285 | etot = -17.0481683694628
-212000  ekin = 2.36983963899524 |  erot = 1.93490727968814 | epot = -21.6916906588951 | etot = -17.3869437402117
-213000  ekin = 1.90089387455099 |  erot = 2.5187405361218 | epot = -21.7688631446424 | etot = -17.3492287339696
-214000  ekin = 1.97453946438608 |  erot = 2.49804990679736 | epot = -21.7968032544022 | etot = -17.3242138832188
-215000  ekin = 1.97170537707849 |  erot = 3.1720109210939 | epot = -21.7980499435109 | etot = -16.6543336453385
-216000  ekin = 1.89064429395263 |  erot = 1.88113651267029 | epot = -21.7625464985643 | etot = -17.9907656919414
-217000  ekin = 2.0626433286583 |  erot = 1.95286476791462 | epot = -21.8181895344454 | etot = -17.8026814378725
-218000  ekin = 2.31967181974704 |  erot = 1.6896622434335 | epot = -21.7699992955268 | etot = -17.7606652323462
-219000  ekin = 2.46739391618502 |  erot = 2.20775453602831 | epot = -21.776978875084 | etot = -17.1018304228706
-220000  ekin = 1.73785505731585 |  erot = 3.0372433480804 | epot = -21.7321393101048 | etot = -16.9570409047086
-221000  ekin = 1.778697043089 |  erot = 2.7846909329313 | epot = -21.7425830987872 | etot = -17.1791951227669
-222000  ekin = 2.62634865011186 |  erot = 2.86077326472522 | epot = -21.7007933593054 | etot = -16.2136714444683
-223000  ekin = 3.04431297723215 |  erot = 1.94008328047868 | epot = -21.7188465939138 | etot = -16.734450336203
-224000  ekin = 2.71939424183677 |  erot = 2.42480251627533 | epot = -21.6866518782312 | etot = -16.5424551201191
-225000  ekin = 2.02593449761365 |  erot = 3.37613250979673 | epot = -21.6919775986917 | etot = -16.2899105912813
-226000  ekin = 2.36496088602628 |  erot = 2.39060577783945 | epot = -21.7612411053054 | etot = -17.0056744414397
-227000  ekin = 2.73527371921374 |  erot = 2.63040468048003 | epot = -21.8235720454426 | etot = -16.4578936457488
-228000  ekin = 2.09009153610323 |  erot = 2.26861924367323 | epot = -21.8859446312141 | etot = -17.5272338514377
-229000  ekin = 1.80131280326501 |  erot = 1.7963110804324 | epot = -21.9677974652423 | etot = -18.3701735815449
-230000  ekin = 2.77436270232913 |  erot = 2.22792046726092 | epot = -21.9902739646399 | etot = -16.9879907950498
-231000  ekin = 3.15789416871844 |  erot = 2.77494856675301 | epot = -21.9771750398138 | etot = -16.0443323043424
-232000  ekin = 1.86920525086143 |  erot = 1.70617009970185 | epot = -22.0127465263534 | etot = -18.4373711757901
-233000  ekin = 1.75915660001321 |  erot = 1.56505378532405 | epot = -21.9936912811375 | etot = -18.6694808958002
-234000  ekin = 2.33631680564953 |  erot = 2.05523369254154 | epot = -21.9151391633044 | etot = -17.5235886651133
-235000  ekin = 1.95729755108493 |  erot = 2.52297007842176 | epot = -21.8622583087295 | etot = -17.3819906792228
-236000  ekin = 2.26174488772854 |  erot = 1.90926942275389 | epot = -21.8776848863915 | etot = -17.7066705759091
-237000  ekin = 2.48859859508474 |  erot = 2.6489237604941 | epot = -21.9479801146397 | etot = -16.8104577590608
-238000  ekin = 2.21074117955686 |  erot = 2.74245988956904 | epot = -22.0027094279364 | etot = -17.0495083588105
-239000  ekin = 2.72897236706913 |  erot = 2.49153579775713 | epot = -22.0211522435864 | etot = -16.8006440787602
-240000  ekin = 3.10410575629688 |  erot = 2.19185039149975 | epot = -21.9285399490843 | etot = -16.6325838012877
-241000  ekin = 3.04659381738443 |  erot = 2.65407823399251 | epot = -21.8553999209703 | etot = -16.1547278695933
-242000  ekin = 2.22634814860329 |  erot = 2.33710119371497 | epot = -21.778295180705 | etot = -17.2148458383868
-243000  ekin = 1.53739989500925 |  erot = 2.804422651144 | epot = -21.7210994015014 | etot = -17.3792768553481
-244000  ekin = 1.91594160283678 |  erot = 2.43897673315061 | epot = -21.6239948430905 | etot = -17.2690765071031
-245000  ekin = 1.9573212108497 |  erot = 2.60792757585164 | epot = -21.4969890421964 | etot = -16.931740255495
-246000  ekin = 2.07155268659352 |  erot = 2.40712847472271 | epot = -21.4555802858827 | etot = -16.9768991245664
-247000  ekin = 1.55687592357629 |  erot = 2.27937051296287 | epot = -21.415801560854 | etot = -17.5795551243148
-248000  ekin = 1.83815644169539 |  erot = 2.56757546633135 | epot = -21.4396063392852 | etot = -17.0338744312585
-249000  ekin = 1.79880701831597 |  erot = 2.0439839568354 | epot = -21.5116552123395 | etot = -17.6688642371882
-250000  ekin = 1.6819474109243 |  erot = 3.39458382990459 | epot = -21.5432862054069 | etot = -16.466754964578
-251000  ekin = 2.13148829031636 |  erot = 3.25959517865089 | epot = -21.5335137503413 | etot = -16.142430281374
-252000  ekin = 2.05395839402013 |  erot = 2.53819950912971 | epot = -21.5603119938518 | etot = -16.9681540907019
-253000  ekin = 1.65837982841157 |  erot = 3.21084156386521 | epot = -21.5856483774528 | etot = -16.716426985176
-254000  ekin = 2.32607189562296 |  erot = 3.10904441141191 | epot = -21.5835562113995 | etot = -16.1484399043647
-255000  ekin = 2.50516183463011 |  erot = 2.76806754476897 | epot = -21.5622650070292 | etot = -16.2890356276301
-256000  ekin = 1.97348594928106 |  erot = 2.62554900973971 | epot = -21.5549569513865 | etot = -16.9559219923657
-257000  ekin = 2.23010268129159 |  erot = 3.26394503338319 | epot = -21.5756937773404 | etot = -16.0816460626656
-258000  ekin = 2.0447966409083 |  erot = 1.84671550533958 | epot = -21.6926265414806 | etot = -17.8011143952327
-259000  ekin = 2.87403716266236 |  erot = 2.7890686554313 | epot = -21.799948240906 | etot = -16.1368424228124
-260000  ekin = 2.90780294403218 |  erot = 2.19263097772001 | epot = -21.8560884935551 | etot = -16.7556545718029
-261000  ekin = 2.76828016335186 |  erot = 2.34066383431491 | epot = -21.904753347489 | etot = -16.7958093498223
-262000  ekin = 3.52268021990509 |  erot = 1.77075610541266 | epot = -21.923252751046 | etot = -16.6298164257282
-263000  ekin = 3.08420493567484 |  erot = 2.42539400967894 | epot = -21.8573813915989 | etot = -16.3477824462451
-264000  ekin = 2.24745015945595 |  erot = 2.03541588430139 | epot = -21.8692313889178 | etot = -17.5863653451605
-265000  ekin = 1.92522220276231 |  erot = 2.5003676829468 | epot = -21.7418152763709 | etot = -17.3162253906618
-266000  ekin = 2.39641107663208 |  erot = 3.25288398956727 | epot = -21.6961161037834 | etot = -16.046821037584
-267000  ekin = 1.71111784450077 |  erot = 2.23671058890166 | epot = -21.6618183077995 | etot = -17.7139898743971
-268000  ekin = 2.10089423119538 |  erot = 3.22434301936133 | epot = -21.6199098144813 | etot = -16.2946725639246
-269000  ekin = 1.9625053447265 |  erot = 2.78709438989466 | epot = -21.512378343547 | etot = -16.7627786089258
-270000  ekin = 2.11347862898579 |  erot = 2.66955708081142 | epot = -21.4131997021519 | etot = -16.6301639923547
-271000  ekin = 2.18755627878071 |  erot = 3.10635949745237 | epot = -21.231195119641 | etot = -15.9372793434079
-272000  ekin = 2.53142755489725 |  erot = 2.28018838604503 | epot = -21.0716416692008 | etot = -16.2600257282585
-273000  ekin = 1.9364743445402 |  erot = 1.99261296885892 | epot = -21.007557675667 | etot = -17.0784703622679
-274000  ekin = 1.91013630831847 |  erot = 2.2120127665723 | epot = -21.0477834541013 | etot = -16.9256343792105
-275000  ekin = 1.79273258693701 |  erot = 3.10050032804429 | epot = -21.0858519409205 | etot = -16.1926190259392
-276000  ekin = 3.35719138398128 |  erot = 2.41111345420191 | epot = -21.0304226706007 | etot = -15.2621178324176
-277000  ekin = 2.41774397151369 |  erot = 1.50719443697989 | epot = -20.9759671563228 | etot = -17.0510287478292
-278000  ekin = 2.53951758510302 |  erot = 2.14756601555722 | epot = -20.9653070148297 | etot = -16.2782234141694
-279000  ekin = 1.90856122527452 |  erot = 2.38982437581387 | epot = -20.9745429336076 | etot = -16.6761573325192
-280000  ekin = 2.37131544290542 |  erot = 3.59489996493466 | epot = -20.85613421052 | etot = -14.8899188026799
-281000  ekin = 1.76889591811704 |  erot = 1.7951894912658 | epot = -20.9289254822807 | etot = -17.3648400728979
-282000  ekin = 2.27070827347114 |  erot = 3.05009551199377 | epot = -20.8916515658568 | etot = -15.5708477803919
-283000  ekin = 2.18685960365006 |  erot = 2.20812220616949 | epot = -20.8474969045899 | etot = -16.4525150947704
-284000  ekin = 1.91940159973892 |  erot = 2.20890146173499 | epot = -20.8751887573221 | etot = -16.7468856958482
-285000  ekin = 3.15509933694634 |  erot = 1.80738796351619 | epot = -21.0554892608396 | etot = -16.0930019603771
-286000  ekin = 3.87415003559708 |  erot = 1.83530883692693 | epot = -21.2366462656484 | etot = -15.5271873931244
-287000  ekin = 3.65191681280166 |  erot = 2.913547855761 | epot = -21.3085830740657 | etot = -14.7431184055031
-288000  ekin = 3.25566521528532 |  erot = 1.61409275051713 | epot = -21.3016538192157 | etot = -16.4318958534132
-289000  ekin = 2.57277357969492 |  erot = 2.7865509468974 | epot = -21.2753452951968 | etot = -15.9160207686044
-290000  ekin = 2.70842209282674 |  erot = 2.41918512811132 | epot = -21.2877903800065 | etot = -16.1601831590685
-291000  ekin = 2.06014704473036 |  erot = 2.36104758138505 | epot = -21.2845199368975 | etot = -16.8633253107821
-292000  ekin = 2.28556270655109 |  erot = 2.04929815389926 | epot = -21.3435089189608 | etot = -17.0086480585104
-293000  ekin = 2.24999256733429 |  erot = 2.35234276421049 | epot = -21.4532864362272 | etot = -16.8509511046824
-294000  ekin = 2.93128079968628 |  erot = 2.88901294012339 | epot = -21.5344832077337 | etot = -15.7141894679241
-295000  ekin = 2.66786158124138 |  erot = 2.29144551421467 | epot = -21.6972562684637 | etot = -16.7379491730076
-296000  ekin = 2.20703931624838 |  erot = 2.91798090137806 | epot = -21.7499994740518 | etot = -16.6249792564254
-297000  ekin = 2.17711857895463 |  erot = 3.3139407196584 | epot = -21.7438418246471 | etot = -16.2527825260341
-298000  ekin = 2.91263821701566 |  erot = 2.35687557807243 | epot = -21.7003108484957 | etot = -16.4307970534076
-299000  ekin = 3.16765240032233 |  erot = 2.23927360570976 | epot = -21.8111744518828 | etot = -16.4042484458507
-300000  ekin = 3.29571242152463 |  erot = 1.38932168050636 | epot = -21.8854995787115 | etot = -17.2004654766805
-301000  ekin = 2.38336849338668 |  erot = 3.30873138065989 | epot = -21.9040100279112 | etot = -16.2119101538647
-302000  ekin = 2.92546415072637 |  erot = 3.247691767578 | epot = -21.8700812142841 | etot = -15.6969252959798
-303000  ekin = 2.4103373416559 |  erot = 2.62018947425678 | epot = -21.8591741279587 | etot = -16.828647312046
-304000  ekin = 2.22974120288231 |  erot = 2.69525972032883 | epot = -21.7977946057185 | etot = -16.8727936825074
-305000  ekin = 2.37900884029014 |  erot = 2.39016080950149 | epot = -21.7722637572341 | etot = -17.0030941074424
-306000  ekin = 1.9446171443063 |  erot = 2.89927908625624 | epot = -21.772518921465 | etot = -16.9286226909024
-307000  ekin = 2.51296678773709 |  erot = 2.07871985749639 | epot = -21.7145354205816 | etot = -17.1228487753482
-308000  ekin = 2.81300442192371 |  erot = 2.63068774502107 | epot = -21.7059595575782 | etot = -16.2622673906334
-309000  ekin = 2.33295752921531 |  erot = 2.12114847477695 | epot = -21.6789859227475 | etot = -17.2248799187552
-310000  ekin = 2.52283407385729 |  erot = 3.21577684610766 | epot = -21.6977338722704 | etot = -15.9591229523054
-311000  ekin = 2.34905401714491 |  erot = 3.03961744974846 | epot = -21.7112095513776 | etot = -16.3225380844842
-312000  ekin = 1.82668239636477 |  erot = 3.25882975871633 | epot = -21.5839087054203 | etot = -16.4983965503392
-313000  ekin = 1.63596397844578 |  erot = 2.08106491982899 | epot = -21.6088054377576 | etot = -17.8917765394829
-314000  ekin = 2.27268061655198 |  erot = 2.56861774872119 | epot = -21.622333325343 | etot = -16.7810349600698
-315000  ekin = 2.53123691731374 |  erot = 2.1324731770604 | epot = -21.7018350864597 | etot = -17.0381249920856
-316000  ekin = 1.99511026234591 |  erot = 1.80085053236165 | epot = -21.7165753862862 | etot = -17.9206145915787
-317000  ekin = 2.11342130166581 |  erot = 2.00931752224566 | epot = -21.7049091699378 | etot = -17.5821703460263
-318000  ekin = 2.29657040201996 |  erot = 1.9218952520588 | epot = -21.6732020643863 | etot = -17.4547364103076
-319000  ekin = 1.98100978177984 |  erot = 1.68241530251755 | epot = -21.5700337503682 | etot = -17.9066086660708
-320000  ekin = 2.46277902525288 |  erot = 3.0707129249839 | epot = -21.5118277867106 | etot = -15.9783358364738
-321000  ekin = 1.8533722862421 |  erot = 2.67441728470359 | epot = -21.5413634192757 | etot = -17.01357384833
-322000  ekin = 1.94543884879318 |  erot = 3.3613066315754 | epot = -21.4649757180038 | etot = -16.1582302376352
-323000  ekin = 1.92582236335168 |  erot = 2.08582462630249 | epot = -21.5020070864549 | etot = -17.4903600968007
-324000  ekin = 2.21385975174577 |  erot = 2.45972054558752 | epot = -21.6040339423077 | etot = -16.9304536449744
-325000  ekin = 2.71973574551436 |  erot = 2.37172075216282 | epot = -21.7154750081878 | etot = -16.6240185105106
-326000  ekin = 1.88834012476607 |  erot = 1.92160793718507 | epot = -21.7697066104337 | etot = -17.9597585484825
-327000  ekin = 3.03100650626309 |  erot = 1.66914039489952 | epot = -21.8474776692767 | etot = -17.1473307681141
-328000  ekin = 2.74123304387623 |  erot = 1.9170666048058 | epot = -21.8856206551572 | etot = -17.2273210064752
-329000  ekin = 2.94158338898171 |  erot = 3.13997083102765 | epot = -21.9406516192959 | etot = -15.8590973992865
-330000  ekin = 2.91669398329971 |  erot = 2.01301123001111 | epot = -21.9369752911326 | etot = -17.0072700778218
-331000  ekin = 2.28417665381006 |  erot = 2.04960167200569 | epot = -21.927160006304 | etot = -17.5933816804883
-332000  ekin = 2.4148148688836 |  erot = 3.18178691603942 | epot = -21.9797962539673 | etot = -16.3831944690443
-333000  ekin = 2.45630818257634 |  erot = 2.70954264697347 | epot = -22.0834375892948 | etot = -16.917586759745
-334000  ekin = 2.37347521855933 |  erot = 2.99534828037212 | epot = -22.119902754337 | etot = -16.7510792554055
-335000  ekin = 2.11274250313861 |  erot = 3.56585847378427 | epot = -22.1620352555629 | etot = -16.48343427864
-336000  ekin = 2.63429420241716 |  erot = 2.12841745309053 | epot = -22.1384285356293 | etot = -17.3757168801216
-337000  ekin = 2.74014146566976 |  erot = 2.73588205536329 | epot = -22.1194416289215 | etot = -16.6434181078884
-338000  ekin = 1.84480508690214 |  erot = 2.23455733552335 | epot = -22.1965093971539 | etot = -18.1171469747284
-339000  ekin = 1.56183988387053 |  erot = 2.489100411134 | epot = -22.2396203002948 | etot = -18.1886800052903
-340000  ekin = 1.46409027371678 |  erot = 4.0512372950447 | epot = -22.1584645354502 | etot = -16.6431369666887
-341000  ekin = 1.68589245970878 |  erot = 2.79353148184118 | epot = -22.1393063295445 | etot = -17.6598823879945
-342000  ekin = 1.9632055547669 |  erot = 2.74455536956775 | epot = -22.2008946996018 | etot = -17.4931337752671
-343000  ekin = 2.66782090058793 |  erot = 3.18156117072004 | epot = -22.2922370675599 | etot = -16.4428549962519
-344000  ekin = 1.78878469299216 |  erot = 2.18063379585249 | epot = -22.3229742728833 | etot = -18.3535557840387
-345000  ekin = 1.540972096623 |  erot = 1.85836807653953 | epot = -22.3669594635967 | etot = -18.9676192904341
-346000  ekin = 1.69306131915114 |  erot = 1.80797582028411 | epot = -22.3312791976866 | etot = -18.8302420582514
-347000  ekin = 1.37617258934979 |  erot = 2.61616357123582 | epot = -22.3534264320593 | etot = -18.3610902714737
-348000  ekin = 2.13829045790164 |  erot = 2.85908731375532 | epot = -22.3464198630052 | etot = -17.3490420913483
-349000  ekin = 1.82945196641201 |  erot = 1.97678849263654 | epot = -22.3619223728943 | etot = -18.5556819138458
-350000  ekin = 1.78944470920989 |  erot = 2.50950790539659 | epot = -22.3467767277336 | etot = -18.0478241131271
-351000  ekin = 1.68749587286921 |  erot = 2.81742906170281 | epot = -22.4171372510498 | etot = -17.9122123164778
-352000  ekin = 2.77021178817643 |  erot = 2.15256178979697 | epot = -22.5877268787862 | etot = -17.6649533008128
-353000  ekin = 3.5651579503159 |  erot = 1.46627940614144 | epot = -22.6396840781933 | etot = -17.608246721736
-354000  ekin = 3.44763260550689 |  erot = 2.25092776011915 | epot = -22.5553143373262 | etot = -16.8567539717001
-355000  ekin = 2.03402845200418 |  erot = 2.90906782343746 | epot = -22.5137132330461 | etot = -17.5706169576044
-356000  ekin = 2.10644486273696 |  erot = 3.31938387624324 | epot = -22.5442634045104 | etot = -17.1184346655302
-357000  ekin = 2.76535001946383 |  erot = 2.50873330135166 | epot = -22.52215971412 | etot = -17.2480763933045
-358000  ekin = 2.53751054023787 |  erot = 2.26477084741189 | epot = -22.5103746530379 | etot = -17.7080932653881
-359000  ekin = 3.23570364771486 |  erot = 2.52813698122051 | epot = -22.6019986378314 | etot = -16.838158008896
-360000  ekin = 2.59175576606819 |  erot = 1.97223576668381 | epot = -22.6470028729806 | etot = -18.0830113402286
-361000  ekin = 2.61182361704566 |  erot = 2.50385714239847 | epot = -22.6927829246934 | etot = -17.5771021652493
-362000  ekin = 2.38475515872101 |  erot = 3.84233912950958 | epot = -22.6454854809905 | etot = -16.4183911927599
-363000  ekin = 2.88487115582968 |  erot = 1.98709532428838 | epot = -22.5316518293815 | etot = -17.6596853492635
-364000  ekin = 2.24456282663807 |  erot = 1.87857741688963 | epot = -22.4065988337859 | etot = -18.2834585902582
-365000  ekin = 2.04295690198209 |  erot = 2.81008642631349 | epot = -22.2314366274422 | etot = -17.3783932991466
-366000  ekin = 2.266544192376 |  erot = 1.95642386899595 | epot = -22.1933765521819 | etot = -17.97040849081
-367000  ekin = 2.81580114465084 |  erot = 2.51878026336671 | epot = -22.2503978612043 | etot = -16.9158164531867
-368000  ekin = 2.81616947616975 |  erot = 2.18673959088794 | epot = -22.3700662776457 | etot = -17.367157210588
-369000  ekin = 2.31685128708704 |  erot = 2.8485166214536 | epot = -22.4347113127671 | etot = -17.2693434042264
-370000  ekin = 2.66633369096824 |  erot = 2.10373843245294 | epot = -22.5097473869516 | etot = -17.7396752635304
-371000  ekin = 2.19554700980946 |  erot = 3.61136788339347 | epot = -22.5751109079912 | etot = -16.7681960147883
-372000  ekin = 1.77355024694411 |  erot = 3.42422008956619 | epot = -22.6682235461143 | etot = -17.470453209604
-373000  ekin = 2.14882393689494 |  erot = 2.79102164241389 | epot = -22.7183823639386 | etot = -17.7785367846297
-374000  ekin = 2.69471790401649 |  erot = 3.57888941010137 | epot = -22.8644350080836 | etot = -16.5908276939657
-375000  ekin = 2.40588229328688 |  erot = 2.98559431132055 | epot = -22.9231560989464 | etot = -17.5316794943389
-376000  ekin = 3.36525975858234 |  erot = 3.24749522030667 | epot = -22.9448546765658 | etot = -16.3320996976767
-377000  ekin = 3.1898535090454 |  erot = 2.65440981370779 | epot = -22.8890189773608 | etot = -17.0447556546076
-378000  ekin = 1.54661929765086 |  erot = 2.66304115784623 | epot = -22.8894135140088 | etot = -18.6797530585117
-379000  ekin = 1.93848939303329 |  erot = 2.54534330055222 | epot = -22.9081180555037 | etot = -18.4242853619182
-380000  ekin = 2.66258042260528 |  erot = 2.88895789126712 | epot = -22.9376621442708 | etot = -17.3861238303984
-381000  ekin = 2.95374671041029 |  erot = 2.1769850563328 | epot = -22.9816080577256 | etot = -17.8508762909825
-382000  ekin = 2.58850292280408 |  erot = 2.01885613358327 | epot = -22.9279053853416 | etot = -18.3205463289542
-383000  ekin = 2.01542491830335 |  erot = 2.50444856286716 | epot = -22.9509700194999 | etot = -18.4310965383294
-384000  ekin = 2.10088918623931 |  erot = 2.19861971638621 | epot = -22.9637245689725 | etot = -18.664215666347
-385000  ekin = 1.91381637067085 |  erot = 1.63023926713733 | epot = -22.9798616984434 | etot = -19.4358060606352
-386000  ekin = 1.55997375471681 |  erot = 1.35864886272388 | epot = -23.026401230456 | etot = -20.1077786130153
-387000  ekin = 2.21265030198491 |  erot = 1.7501227932087 | epot = -23.0266356759123 | etot = -19.0638625807187
-388000  ekin = 1.98732621523102 |  erot = 1.96003045102707 | epot = -22.9343684877508 | etot = -18.9870118214927
-389000  ekin = 2.5418388293764 |  erot = 2.33933777400626 | epot = -22.9288764120935 | etot = -18.0476998087109
-390000  ekin = 2.07840415144685 |  erot = 1.88714080084969 | epot = -22.8368099519711 | etot = -18.8712649996745
-391000  ekin = 1.85201287716429 |  erot = 2.41309749069991 | epot = -22.8035614550317 | etot = -18.5384510871675
-392000  ekin = 2.19897450334475 |  erot = 2.90002030847564 | epot = -22.8026053664846 | etot = -17.7036105546642
-393000  ekin = 2.15250422129825 |  erot = 3.1954140871906 | epot = -22.8935871868038 | etot = -17.5456688783149
-394000  ekin = 1.99220043003136 |  erot = 2.14720550675182 | epot = -22.8839525821639 | etot = -18.7445466453807
-395000  ekin = 2.03384825587122 |  erot = 2.5026704188622 | epot = -22.9355340107645 | etot = -18.3990153360311
-396000  ekin = 2.14388612805494 |  erot = 1.95887569078926 | epot = -23.0314147787906 | etot = -18.9286529599464
-397000  ekin = 2.39817268086959 |  erot = 1.65198489715495 | epot = -23.1381610188687 | etot = -19.0880034408442
-398000  ekin = 3.5848529329223 |  erot = 2.5137795193631 | epot = -23.2493671328086 | etot = -17.1507346805232
-399000  ekin = 2.65690410152896 |  erot = 1.78815540583896 | epot = -23.3551071826471 | etot = -18.9100476752792
-400000  ekin = 2.5116972230557 |  erot = 2.10904464709597 | epot = -23.4242760069967 | etot = -18.803534136845
-401000  ekin = 2.05111703519218 |  erot = 2.15375363886755 | epot = -23.4796569613041 | etot = -19.2747862872443
-402000  ekin = 2.43372934314587 |  erot = 2.11260100954187 | epot = -23.4682554876931 | etot = -18.9219251350053
-403000  ekin = 2.53598880596584 |  erot = 2.81278076880176 | epot = -23.5378775828587 | etot = -18.1891080080911
-404000  ekin = 2.18194702425602 |  erot = 2.63711249102604 | epot = -23.6244518702206 | etot = -18.8053923549385
-405000  ekin = 2.45121967393562 |  erot = 2.40500763090291 | epot = -23.6357713162683 | etot = -18.7795440114298
-406000  ekin = 2.21958671378093 |  erot = 2.24922226746756 | epot = -23.6553601287 | etot = -19.1865511474515
-407000  ekin = 1.98564574231222 |  erot = 2.77863717556005 | epot = -23.5607032705187 | etot = -18.7964203526464
-408000  ekin = 2.57646591315375 |  erot = 2.58095218000659 | epot = -23.4398366413677 | etot = -18.2824185482073
-409000  ekin = 2.36945583486912 |  erot = 2.25935935813466 | epot = -23.3294611001761 | etot = -18.7006459071724
-410000  ekin = 2.02254604345491 |  erot = 1.96483214055515 | epot = -23.3122760741247 | etot = -19.3248978901146
-411000  ekin = 1.87895167522371 |  erot = 2.65152784802951 | epot = -23.2919254735047 | etot = -18.7614459502515
-412000  ekin = 1.99369299492691 |  erot = 2.68971636909523 | epot = -23.2559513781021 | etot = -18.57254201408
-413000  ekin = 2.38900558877156 |  erot = 2.64564764432049 | epot = -23.2013938450539 | etot = -18.1667406119618
-414000  ekin = 2.42764300748033 |  erot = 1.75174590229272 | epot = -23.1266922276306 | etot = -18.9473033178576
-415000  ekin = 2.76414124953308 |  erot = 2.44215852210494 | epot = -23.1817305186064 | etot = -17.9754307469683
-416000  ekin = 2.08280868301927 |  erot = 2.76578542751831 | epot = -23.1905832299196 | etot = -18.341989119382
-417000  ekin = 1.99968890800012 |  erot = 1.95787693284286 | epot = -23.194417716001 | etot = -19.236851875158
-418000  ekin = 2.38298881868294 |  erot = 2.55898711987873 | epot = -23.1586352965619 | etot = -18.2166593580002
-419000  ekin = 2.9839633883085 |  erot = 2.57065203496089 | epot = -23.0544780894577 | etot = -17.4998626661883
-420000  ekin = 2.60178854557762 |  erot = 2.46052060802045 | epot = -22.9622762729971 | etot = -17.899967119399
-421000  ekin = 2.51720276737396 |  erot = 1.77804167911051 | epot = -22.9515897224038 | etot = -18.6563452759193
-422000  ekin = 2.7320348139792 |  erot = 1.67298118116889 | epot = -22.9404137463627 | etot = -18.5353977512146
-423000  ekin = 2.13282380031375 |  erot = 2.54987675813572 | epot = -22.8157706530705 | etot = -18.133070094621
-424000  ekin = 1.90610672595356 |  erot = 2.31894231724673 | epot = -22.7787002443962 | etot = -18.553651201196
-425000  ekin = 2.37366400687573 |  erot = 1.95578603620107 | epot = -22.7873996262579 | etot = -18.4579495831811
-426000  ekin = 2.23502410344739 |  erot = 2.60951465135819 | epot = -22.8069525247999 | etot = -17.9624137699943
-427000  ekin = 1.88572309905852 |  erot = 2.12675775194484 | epot = -22.973782602072 | etot = -18.9613017510686
-428000  ekin = 1.93180562731872 |  erot = 2.45432362930894 | epot = -23.1062681387344 | etot = -18.7201388821067
-429000  ekin = 1.72618205037519 |  erot = 2.1638575670951 | epot = -23.1203764425356 | etot = -19.2303368250654
-430000  ekin = 2.31236502680075 |  erot = 2.14057167953237 | epot = -23.127316365141 | etot = -18.6743796588079
-431000  ekin = 2.45859340033276 |  erot = 2.41557475448707 | epot = -23.137683007962 | etot = -18.2635148531422
-432000  ekin = 2.80043339920945 |  erot = 2.19140888866301 | epot = -23.1459051340744 | etot = -18.1540628462019
-433000  ekin = 2.2038223816989 |  erot = 1.62239062651454 | epot = -23.1902054552061 | etot = -19.3639924469927
-434000  ekin = 2.59117398719482 |  erot = 2.35262979682601 | epot = -23.2174180769097 | etot = -18.2736142928889
-435000  ekin = 2.29283868462832 |  erot = 2.54026007379789 | epot = -23.1968654207439 | etot = -18.3637666623176
-436000  ekin = 2.43256920688117 |  erot = 2.74968424233253 | epot = -23.2466230085986 | etot = -18.0643695593849
-437000  ekin = 1.64425125112848 |  erot = 3.23329270267647 | epot = -23.2380191669749 | etot = -18.3604752131699
-438000  ekin = 1.56124620606823 |  erot = 2.60252333491232 | epot = -23.1341667906033 | etot = -18.9703972496228
-439000  ekin = 2.30501653948793 |  erot = 1.93890022921162 | epot = -23.14170715719 | etot = -18.8977903884904
-440000  ekin = 2.52023257151789 |  erot = 3.04669715760005 | epot = -23.2021590525686 | etot = -17.6352293234507
-441000  ekin = 2.79903748157629 |  erot = 2.54578114158762 | epot = -23.1760357267403 | etot = -17.8312171035764
-442000  ekin = 2.93503932875119 |  erot = 2.87674150367343 | epot = -23.1192988997858 | etot = -17.3075180673612
-443000  ekin = 1.96853850230447 |  erot = 1.76444304280728 | epot = -23.0474504745021 | etot = -19.3144689293904
-444000  ekin = 2.00740903163919 |  erot = 2.25338146232896 | epot = -22.9768126386128 | etot = -18.7160221446446
-445000  ekin = 2.22543241532629 |  erot = 2.06325853122729 | epot = -22.8128736901554 | etot = -18.5241827436018
-446000  ekin = 2.44497213168066 |  erot = 2.37296472072563 | epot = -22.7182187420116 | etot = -17.9002818896053
-447000  ekin = 2.27682912672612 |  erot = 2.40590062157627 | epot = -22.73821768508 | etot = -18.0554879367776
-448000  ekin = 2.17717815648414 |  erot = 1.94002353369628 | epot = -22.8515885285926 | etot = -18.7343868384122
-449000  ekin = 2.21957974285234 |  erot = 2.34288028472299 | epot = -22.9413256171992 | etot = -18.3788655896239
-450000  ekin = 2.75054329798646 |  erot = 1.97942707751151 | epot = -22.8960066852305 | etot = -18.1660363097325
-451000  ekin = 2.21127283509867 |  erot = 2.13383865709095 | epot = -22.93012845553 | etot = -18.5850169633403
-452000  ekin = 2.54342208027875 |  erot = 2.35725031977164 | epot = -22.9678192920236 | etot = -18.0671468919732
-453000  ekin = 2.22826691368246 |  erot = 1.78505555998555 | epot = -22.9525856519538 | etot = -18.9392631782858
-454000  ekin = 2.43963081757063 |  erot = 2.59545869820689 | epot = -22.8816014548474 | etot = -17.8465119390699
-455000  ekin = 2.04579285921012 |  erot = 2.79600798010941 | epot = -22.6671256943706 | etot = -17.8253248550511
-456000  ekin = 2.02054568037702 |  erot = 2.5142933737518 | epot = -22.4807651427491 | etot = -17.9459260886202
-457000  ekin = 2.62427297855768 |  erot = 2.43881475758852 | epot = -22.3628471473124 | etot = -17.2997594111662
-458000  ekin = 2.00982157063058 |  erot = 1.99237218757745 | epot = -22.2563036448067 | etot = -18.2541098865987
-459000  ekin = 1.75248702434071 |  erot = 2.49686008961238 | epot = -22.2467888503062 | etot = -17.9974417363531
-460000  ekin = 1.91910131837566 |  erot = 2.07619395094217 | epot = -22.2400567481829 | etot = -18.2447614788651
-461000  ekin = 1.56844353839394 |  erot = 1.28973659789019 | epot = -22.2093526564538 | etot = -19.3511725201697
-462000  ekin = 2.45174884293064 |  erot = 1.36031689293857 | epot = -22.3089787954009 | etot = -18.4969130595317
-463000  ekin = 2.64349839520108 |  erot = 2.07831354185085 | epot = -22.4300376076151 | etot = -17.7082256705631
-464000  ekin = 2.67299819724031 |  erot = 3.73615881795558 | epot = -22.554470130186 | etot = -16.1453131149901
-465000  ekin = 1.95390361110071 |  erot = 2.23920710641231 | epot = -22.7384686297881 | etot = -18.545357912275
-466000  ekin = 2.13348556167989 |  erot = 2.96280610170109 | epot = -22.8443072066537 | etot = -17.7480155432727
-467000  ekin = 2.46613760277875 |  erot = 2.11616591175904 | epot = -23.0265043956358 | etot = -18.444200881098
-468000  ekin = 1.99036864211387 |  erot = 1.62858187482038 | epot = -23.0961237334908 | etot = -19.4771732165565
-469000  ekin = 2.49659836745282 |  erot = 2.63661728128629 | epot = -23.1411267023576 | etot = -18.0079110536185
-470000  ekin = 2.92199371715687 |  erot = 3.21712399422296 | epot = -23.1457817109815 | etot = -17.0066639996017
-471000  ekin = 2.36477645073574 |  erot = 1.72314859686431 | epot = -23.1045733261495 | etot = -19.0166482785494
-472000  ekin = 2.18519498855062 |  erot = 2.00240720258206 | epot = -23.072627104452 | etot = -18.8850249133193
-473000  ekin = 2.3714321613692 |  erot = 2.86124663404655 | epot = -23.0328429128019 | etot = -17.8001641173862
-474000  ekin = 2.1857949588469 |  erot = 2.60051446256873 | epot = -22.9136735669303 | etot = -18.1273641455147
-475000  ekin = 2.39661135768768 |  erot = 2.01358694537797 | epot = -22.813046501162 | etot = -18.4028481980963
-476000  ekin = 2.10676579065005 |  erot = 2.60327856915634 | epot = -22.8119267991277 | etot = -18.1018824393213
-477000  ekin = 2.53295314095718 |  erot = 3.55510942450984 | epot = -22.7955031957515 | etot = -16.7074406302845
-478000  ekin = 2.40630114318287 |  erot = 2.73236241457618 | epot = -22.7034337758127 | etot = -17.5647702180536
-479000  ekin = 1.27745698905519 |  erot = 2.99245403250463 | epot = -22.6605920931777 | etot = -18.3906810716179
-480000  ekin = 1.82390564518045 |  erot = 2.13920354248295 | epot = -22.6299626931083 | etot = -18.6668535054449
-481000  ekin = 2.3880478628611 |  erot = 3.18399864702822 | epot = -22.6553769169915 | etot = -17.0833304071022
-482000  ekin = 3.20116727691415 |  erot = 2.41976760575225 | epot = -22.6125762236254 | etot = -16.991641340959
-483000  ekin = 3.03846588981692 |  erot = 2.48627946336888 | epot = -22.5774232520165 | etot = -17.0526778988307
-484000  ekin = 2.70181776439228 |  erot = 2.52677846233176 | epot = -22.6070502809988 | etot = -17.3784540542748
-485000  ekin = 3.27224317472663 |  erot = 2.42431335826243 | epot = -22.5997277235211 | etot = -16.9031711905321
-486000  ekin = 1.96596043103987 |  erot = 1.75891125021975 | epot = -22.642547970919 | etot = -18.9176762896594
-487000  ekin = 2.6234378417876 |  erot = 2.50755895035553 | epot = -22.7339556642929 | etot = -17.6029588721497
-488000  ekin = 1.75208074499658 |  erot = 2.6448687233026 | epot = -22.7917400975639 | etot = -18.3947906292648
-489000  ekin = 2.08733298303259 |  erot = 2.9523180967106 | epot = -22.881879447047 | etot = -17.8422283673038
-490000  ekin = 2.30760030156363 |  erot = 2.33161319100248 | epot = -22.8847649865187 | etot = -18.2455514939526
-491000  ekin = 2.48196214295004 |  erot = 2.59523958504393 | epot = -22.8776771178079 | etot = -17.800475389814
-492000  ekin = 3.28209206383218 |  erot = 2.1852502939697 | epot = -22.8577625078557 | etot = -17.3904201500538
-493000  ekin = 3.37967323337949 |  erot = 2.35355143859173 | epot = -22.8047552632571 | etot = -17.0715305912858
-494000  ekin = 3.57464120696614 |  erot = 2.24853455202993 | epot = -22.8042956353342 | etot = -16.9811198763381
-495000  ekin = 2.5052992174061 |  erot = 2.15850924694968 | epot = -22.7996067752132 | etot = -18.1357983108574
-496000  ekin = 1.95429188426678 |  erot = 3.5825937389492 | epot = -22.837298805698 | etot = -17.3004131824821
-497000  ekin = 2.22186292996358 |  erot = 2.46502235984734 | epot = -22.8432554612651 | etot = -18.1563701714542
-498000  ekin = 1.72648192614392 |  erot = 2.39641281876546 | epot = -22.7792810810776 | etot = -18.6563863361682
-499000  ekin = 2.44591165293457 |  erot = 2.82720242160824 | epot = -22.7953427712295 | etot = -17.5222286966867
-500000  ekin = 2.7851302139546 |  erot = 2.23270136622152 | epot = -22.8991185931508 | etot = -17.8812870129746
-501000  ekin = 2.99439211318652 |  erot = 1.97783069072832 | epot = -22.9279475016441 | etot = -17.9557246977292
-502000  ekin = 2.9862206030979 |  erot = 1.79973926744011 | epot = -22.956155459855 | etot = -18.170195589317
-503000  ekin = 2.51500932637374 |  erot = 2.88863666961797 | epot = -22.9858023469845 | etot = -17.5821563509928
-504000  ekin = 2.84387999289216 |  erot = 2.69340549636984 | epot = -22.9170131486245 | etot = -17.3797276593625
-505000  ekin = 2.95569075243612 |  erot = 2.602585876956 | epot = -22.9907249028698 | etot = -17.4324482734777
-506000  ekin = 2.19812159740513 |  erot = 1.96718410179931 | epot = -23.0318373952185 | etot = -18.8665316960141
-507000  ekin = 2.26250501037088 |  erot = 2.70461320689487 | epot = -22.9974394720575 | etot = -18.0303212547917
-508000  ekin = 2.63634784309456 |  erot = 2.05036585895923 | epot = -23.0090804345496 | etot = -18.3223667324958
-509000  ekin = 2.94151668821484 |  erot = 2.91160221114196 | epot = -23.0621014211554 | etot = -17.2089825217986
-510000  ekin = 2.26258273420884 |  erot = 2.8155823326395 | epot = -23.1767418648115 | etot = -18.0985767979631
-511000  ekin = 2.89871784417207 |  erot = 2.15651428734314 | epot = -23.2992796007865 | etot = -18.2440474692713
-512000  ekin = 2.18241701331153 |  erot = 2.32471024525139 | epot = -23.3744961479659 | etot = -18.867368889403
-513000  ekin = 1.69086971293502 |  erot = 2.8783745660792 | epot = -23.3843289700052 | etot = -18.8150846909909
-514000  ekin = 1.72546832120935 |  erot = 2.33325616873572 | epot = -23.3798363194193 | etot = -19.3211118294743
-515000  ekin = 1.99840202228396 |  erot = 1.80255577214453 | epot = -23.3747953532199 | etot = -19.5738375587914
-516000  ekin = 3.02853898966319 |  erot = 1.54004582498168 | epot = -23.3386782444955 | etot = -18.7700934298506
-517000  ekin = 2.46344499126943 |  erot = 2.11388687673044 | epot = -23.3135548350045 | etot = -18.7362229670046
-518000  ekin = 2.0362169291028 |  erot = 2.51796163147274 | epot = -23.2504637438686 | etot = -18.6962851832931
-519000  ekin = 1.58660977959654 |  erot = 1.63211831489779 | epot = -23.2081782818072 | etot = -19.9894501873129
-520000  ekin = 2.16318611090781 |  erot = 1.89658879288914 | epot = -23.2096974204855 | etot = -19.1499225166885
-521000  ekin = 1.97684804456375 |  erot = 2.08731550434085 | epot = -23.2527315496486 | etot = -19.188568000744
-522000  ekin = 2.69827007409924 |  erot = 2.19560826391663 | epot = -23.3133573112007 | etot = -18.4194789731848
-523000  ekin = 2.2478363305578 |  erot = 1.67442261891177 | epot = -23.3604551637841 | etot = -19.4381962143146
-524000  ekin = 2.34895041229461 |  erot = 2.10078601700867 | epot = -23.381233923661 | etot = -18.9314974943577
-525000  ekin = 2.13155817393156 |  erot = 2.07239357304026 | epot = -23.4395046885398 | etot = -19.235552941568
-526000  ekin = 2.50234900291801 |  erot = 2.25431525777582 | epot = -23.4988198653879 | etot = -18.7421556046941
-527000  ekin = 3.03511403104629 |  erot = 1.80504692374136 | epot = -23.5562539149297 | etot = -18.7160929601421
-528000  ekin = 2.56074044727573 |  erot = 2.54331285469023 | epot = -23.5735936308822 | etot = -18.4695403289162
-529000  ekin = 2.37500349152887 |  erot = 1.93006279746846 | epot = -23.5580125050353 | etot = -19.252946216038
-530000  ekin = 3.34194424343389 |  erot = 3.41373524710891 | epot = -23.4507267657596 | etot = -16.6950472752168
-531000  ekin = 2.42341072166937 |  erot = 2.35978455298084 | epot = -23.1501712562452 | etot = -18.366975981595
-532000  ekin = 2.58886764526949 |  erot = 1.86996947608086 | epot = -23.1663546344342 | etot = -18.7075175130839
-533000  ekin = 2.18022742299593 |  erot = 2.16045486833456 | epot = -23.380637574335 | etot = -19.0399552830045
-534000  ekin = 2.34791679374047 |  erot = 2.03855517230123 | epot = -23.463831563993 | etot = -19.0773595979513
-535000  ekin = 2.37817813408508 |  erot = 2.07397219148902 | epot = -23.4832900392636 | etot = -19.0311397136895
-536000  ekin = 2.46210672665338 |  erot = 1.8947790016655 | epot = -23.4672059982835 | etot = -19.1103202699646
-537000  ekin = 1.71186030024847 |  erot = 2.1344462698512 | epot = -23.5555571897054 | etot = -19.7092506196057
-538000  ekin = 2.16671541009104 |  erot = 2.76559932728314 | epot = -23.6609154290595 | etot = -18.7286006916853
-539000  ekin = 2.16621132370208 |  erot = 2.29104148484627 | epot = -23.7377569804062 | etot = -19.2805041718579
-540000  ekin = 2.37610335621453 |  erot = 1.63780764528448 | epot = -23.7325177726622 | etot = -19.7186067711632
-541000  ekin = 2.61201541528826 |  erot = 2.52498155703037 | epot = -23.6623419839272 | etot = -18.5253450116085
-542000  ekin = 2.72898292667725 |  erot = 2.10989431729706 | epot = -23.7000798212983 | etot = -18.861202577324
-543000  ekin = 2.72070152721044 |  erot = 1.85641764017256 | epot = -23.6069628280622 | etot = -19.0298436606792
-544000  ekin = 2.11779438939827 |  erot = 1.50576740930398 | epot = -23.5826778503359 | etot = -19.9591160516337
-545000  ekin = 1.70778076743634 |  erot = 2.56995673058895 | epot = -23.583343914622 | etot = -19.3056064165967
-546000  ekin = 2.3805758278215 |  erot = 1.86648142267507 | epot = -23.6114100683877 | etot = -19.3643528178911
-547000  ekin = 2.45245186799104 |  erot = 2.45758854207408 | epot = -23.6611856045782 | etot = -18.7511451945131
-548000  ekin = 2.39042546399151 |  erot = 2.39603897463391 | epot = -23.6735607421256 | etot = -18.8870963035002
-549000  ekin = 2.59234094316699 |  erot = 2.03286284306236 | epot = -23.6646331709071 | etot = -19.0394293846778
-550000  ekin = 1.99320521419403 |  erot = 1.84894458030441 | epot = -23.6669378249973 | etot = -19.8247880304988
-551000  ekin = 2.44898809443739 |  erot = 2.0219242208942 | epot = -23.6235443659669 | etot = -19.1526320506353
-552000  ekin = 2.69502802037877 |  erot = 1.40870700355959 | epot = -23.4610294466586 | etot = -19.3572944227202
-553000  ekin = 1.76133393557171 |  erot = 2.61023484195893 | epot = -23.254624102607 | etot = -18.8830553250764
-554000  ekin = 2.30411800065654 |  erot = 2.33064249173903 | epot = -23.2181242479504 | etot = -18.5833637555548
-555000  ekin = 3.27047384641377 |  erot = 1.6422371773255 | epot = -23.1973795659522 | etot = -18.2846685422129
-556000  ekin = 2.90314776795354 |  erot = 2.59897046564306 | epot = -23.1460736374982 | etot = -17.6439554039016
-557000  ekin = 2.91673821282758 |  erot = 3.16411852075219 | epot = -23.1459806883625 | etot = -17.0651239547827
-558000  ekin = 2.82902946234823 |  erot = 2.71147602500681 | epot = -23.1195640745749 | etot = -17.5790585872199
-559000  ekin = 2.44501247164481 |  erot = 3.2946921444891 | epot = -23.1638653139107 | etot = -17.4241606977768
-560000  ekin = 2.31903153876872 |  erot = 2.34794389762528 | epot = -23.1221343768987 | etot = -18.4551589405047
-561000  ekin = 2.04778211145284 |  erot = 2.88230317636058 | epot = -23.0254469759625 | etot = -18.0953616881491
-562000  ekin = 2.23097749779459 |  erot = 3.71637560430596 | epot = -22.8954878936692 | etot = -16.9481347915687
-563000  ekin = 3.13589796296721 |  erot = 2.30360204009239 | epot = -22.9672461823823 | etot = -17.5277461793227
-564000  ekin = 2.43468506100309 |  erot = 2.37780089042927 | epot = -22.9400399192094 | etot = -18.127553967777
-565000  ekin = 2.74707381978168 |  erot = 2.07635638038451 | epot = -22.9404100305402 | etot = -18.116979830374
-566000  ekin = 2.4222424655432 |  erot = 2.23675573588529 | epot = -22.964317030412 | etot = -18.3053188289835
-567000  ekin = 2.66075150820169 |  erot = 2.00813116398473 | epot = -23.0598382212572 | etot = -18.3909555490708
-568000  ekin = 3.04180913535304 |  erot = 1.98452490185762 | epot = -23.1129541055894 | etot = -18.0866200683787
-569000  ekin = 3.57499094364799 |  erot = 2.06992850387417 | epot = -23.117960007112 | etot = -17.4730405595898
-570000  ekin = 2.66020768003306 |  erot = 2.34012507933247 | epot = -23.1339632056245 | etot = -18.133630446259
-571000  ekin = 1.94924082891001 |  erot = 2.84220462440654 | epot = -23.0609933320748 | etot = -18.2695478787583
-572000  ekin = 2.41536650984725 |  erot = 2.40871845587551 | epot = -23.0560879925718 | etot = -18.232003026849
-573000  ekin = 1.75696177901838 |  erot = 2.31680084915611 | epot = -23.107424588529 | etot = -19.0336619603545
-574000  ekin = 2.1071071848933 |  erot = 2.59270710144433 | epot = -23.1966129698341 | etot = -18.4967986834965
-575000  ekin = 2.37668274547159 |  erot = 2.79832262601946 | epot = -23.2697902014998 | etot = -18.0947848300088
-576000  ekin = 2.17648663043414 |  erot = 3.28534323951364 | epot = -23.3035961850707 | etot = -17.8417663151229
-577000  ekin = 2.48653402473871 |  erot = 2.29382004189646 | epot = -23.3348256872303 | etot = -18.5544716205951
-578000  ekin = 2.63497646120015 |  erot = 2.38541222697017 | epot = -23.3938829535157 | etot = -18.3734942653454
-579000  ekin = 2.68807604490538 |  erot = 1.70832449354964 | epot = -23.3711370904455 | etot = -18.9747365519905
-580000  ekin = 2.35405412912148 |  erot = 2.8553242408976 | epot = -23.3804498064804 | etot = -18.1710714364613
-581000  ekin = 2.45622900796811 |  erot = 2.60461398742566 | epot = -23.3507481421638 | etot = -18.28990514677
-582000  ekin = 2.33821855888559 |  erot = 3.20610340688907 | epot = -23.4193095100182 | etot = -17.8749875442436
-583000  ekin = 1.96183085357235 |  erot = 2.81826367270291 | epot = -23.5872275727996 | etot = -18.8071330465243
-584000  ekin = 2.00096559581716 |  erot = 1.71662185522173 | epot = -23.6766993596687 | etot = -19.9591119086298
-585000  ekin = 2.2650842350347 |  erot = 2.08204874292297 | epot = -23.7234738719865 | etot = -19.3763408940288
-586000  ekin = 2.20207640113325 |  erot = 1.96861811478536 | epot = -23.6859240119471 | etot = -19.5152294960285
-587000  ekin = 3.67938790357027 |  erot = 1.82484412869377 | epot = -23.6634672548209 | etot = -18.1592352225569
-588000  ekin = 3.48089636122829 |  erot = 2.30691916064612 | epot = -23.5643712718911 | etot = -17.7765557500167
-589000  ekin = 2.63030533099327 |  erot = 2.9702466869305 | epot = -23.3767694123201 | etot = -17.7762173943963
-590000  ekin = 1.60813837628253 |  erot = 2.03263132264272 | epot = -23.1946522249358 | etot = -19.5538825260106
-591000  ekin = 1.81653381805571 |  erot = 1.75591263591366 | epot = -23.1302877005862 | etot = -19.5578412466168
-592000  ekin = 2.57247249135485 |  erot = 2.59257155085885 | epot = -23.1533569826366 | etot = -17.9883129404229
-593000  ekin = 2.43678836763256 |  erot = 1.78797409267748 | epot = -23.1035527853187 | etot = -18.8787903250087
-594000  ekin = 2.12126425466624 |  erot = 2.16319102375819 | epot = -23.0537965790237 | etot = -18.7693413005993
-595000  ekin = 2.61494655403376 |  erot = 2.04015446622256 | epot = -23.041588630948 | etot = -18.3864876106917
-596000  ekin = 2.58385979830463 |  erot = 2.125984026295 | epot = -23.0987578414776 | etot = -18.388914016878
-597000  ekin = 3.0356528884646 |  erot = 3.13920569000609 | epot = -23.0959220060406 | etot = -16.92106342757
-598000  ekin = 3.448018111133 |  erot = 2.86438132305443 | epot = -23.1524961324829 | etot = -16.8400966982954
-599000  ekin = 2.14568317629689 |  erot = 3.49762367929462 | epot = -23.1236320419091 | etot = -17.4803251863176
-600000  ekin = 2.20856388598401 |  erot = 2.50873295237986 | epot = -23.1229244675557 | etot = -18.4056276291918
-601000  ekin = 2.82305805419651 |  erot = 2.82785171484619 | epot = -23.093817009667 | etot = -17.4429072406243
-602000  ekin = 2.33756515640057 |  erot = 2.3814563165261 | epot = -23.0592036595801 | etot = -18.3401821866535
-603000  ekin = 1.93163217766375 |  erot = 1.95544716703194 | epot = -22.941151667404 | etot = -19.0540723227083
-604000  ekin = 2.67918576808855 |  erot = 3.14415640026539 | epot = -22.9119901406973 | etot = -17.0886479723434
-605000  ekin = 2.72017891571417 |  erot = 2.06410352610178 | epot = -22.9250944568005 | etot = -18.1408120149845
-606000  ekin = 2.99653903957879 |  erot = 2.03201724640129 | epot = -22.8426486789921 | etot = -17.814092393012
-607000  ekin = 2.88290327274547 |  erot = 2.37629823895312 | epot = -22.8265624505584 | etot = -17.5673609388598
-608000  ekin = 3.6564890765792 |  erot = 2.46096427245297 | epot = -22.7637531347954 | etot = -16.6462997857633
-609000  ekin = 2.67772613172483 |  erot = 2.28052588350936 | epot = -22.784032519386 | etot = -17.8257805041518
-610000  ekin = 2.96660977711584 |  erot = 2.13935236193287 | epot = -22.7753012812081 | etot = -17.6693391421594
-611000  ekin = 3.84936812341098 |  erot = 2.13515328821562 | epot = -22.7555358965927 | etot = -16.7710144849661
-612000  ekin = 2.85991416578252 |  erot = 2.46799936153364 | epot = -22.6670923038619 | etot = -17.3391787765458
-613000  ekin = 2.93458428860956 |  erot = 2.15612272200133 | epot = -22.6620509726505 | etot = -17.5713439620396
-614000  ekin = 2.80109550846435 |  erot = 2.03413630963325 | epot = -22.735929073337 | etot = -17.9006972552394
-615000  ekin = 2.29275572188425 |  erot = 2.37295436060996 | epot = -22.8265717932651 | etot = -18.1608617107709
-616000  ekin = 1.78880182339297 |  erot = 2.46512387757483 | epot = -22.9181914142038 | etot = -18.664265713236
-617000  ekin = 2.58548247747108 |  erot = 2.53734413400793 | epot = -22.9371325341202 | etot = -17.8143059226412
-618000  ekin = 2.31891017470357 |  erot = 2.68587322473765 | epot = -22.8737927646705 | etot = -17.8690093652293
-619000  ekin = 1.95260275466613 |  erot = 2.00546202293513 | epot = -22.8346556656307 | etot = -18.8765908880295
-620000  ekin = 2.9312355259843 |  erot = 2.17154966265513 | epot = -22.9093263040915 | etot = -17.806541115452
-621000  ekin = 2.92251791603671 |  erot = 1.69365790820559 | epot = -22.9491849521548 | etot = -18.3330091279125
-622000  ekin = 2.04583493083921 |  erot = 2.52347309118728 | epot = -22.8885087146283 | etot = -18.3192006926018
-623000  ekin = 1.97949309574552 |  erot = 3.07796024634624 | epot = -22.899088756596 | etot = -17.8416354145043
-624000  ekin = 2.09648243468335 |  erot = 2.65430331108241 | epot = -22.914733999871 | etot = -18.1639482541052
-625000  ekin = 2.53179488470072 |  erot = 2.36095144458489 | epot = -22.9722766139489 | etot = -18.0795302846633
-626000  ekin = 2.71471201325311 |  erot = 2.038002303651 | epot = -23.0006194176227 | etot = -18.2479051007186
-627000  ekin = 2.22374294193216 |  erot = 2.35282114621755 | epot = -22.9588355159151 | etot = -18.3822714277654
-628000  ekin = 2.28003968408293 |  erot = 2.28859673286464 | epot = -22.8537881524811 | etot = -18.2851517355335
-629000  ekin = 2.52123014813329 |  erot = 1.89624895610832 | epot = -22.7908976494591 | etot = -18.3734185452175
-630000  ekin = 3.09551469183927 |  erot = 2.51634259883875 | epot = -22.7156574639271 | etot = -17.1038001732491
-631000  ekin = 2.38491234780997 |  erot = 3.31746706623938 | epot = -22.7274824388449 | etot = -17.0251030247955
-632000  ekin = 2.58509546960735 |  erot = 2.52764681234154 | epot = -22.6801845001954 | etot = -17.5674422182465
-633000  ekin = 2.43450196234921 |  erot = 1.9074646477535 | epot = -22.6545806388637 | etot = -18.312614028761
-634000  ekin = 2.22577935817066 |  erot = 2.00781737526926 | epot = -22.5723806994747 | etot = -18.3387839660348
-635000  ekin = 2.21833116743445 |  erot = 1.98256884900851 | epot = -22.5422908112103 | etot = -18.3413907947673
-636000  ekin = 2.25207449335774 |  erot = 2.77890466668274 | epot = -22.5736742647701 | etot = -17.5426951047296
-637000  ekin = 1.94359576469155 |  erot = 2.6121109986752 | epot = -22.6035657643129 | etot = -18.0478590009461
-638000  ekin = 2.53947002676468 |  erot = 3.14006412371943 | epot = -22.5826147275244 | etot = -16.9030805770402
-639000  ekin = 2.37745481188141 |  erot = 2.49540365345358 | epot = -22.5449630195302 | etot = -17.6721045541952
-640000  ekin = 2.08212454926531 |  erot = 2.21940536991445 | epot = -22.453303862966 | etot = -18.1517739437862
-641000  ekin = 2.47971433110368 |  erot = 3.55852071727848 | epot = -22.3500233136602 | etot = -16.3117882652781
-642000  ekin = 3.38958957156561 |  erot = 2.18184701440171 | epot = -22.2389727056174 | etot = -16.6675361196501
-643000  ekin = 2.84881174665207 |  erot = 2.413254877821 | epot = -22.1927147648616 | etot = -16.9306481403886
-644000  ekin = 2.9788163296922 |  erot = 1.93799042516405 | epot = -22.1764728944767 | etot = -17.2596661396204
-645000  ekin = 4.12550859701587 |  erot = 1.89960014649319 | epot = -22.1706973334318 | etot = -16.1455885899228
-646000  ekin = 2.52696357860359 |  erot = 2.00637360005821 | epot = -22.1102258356952 | etot = -17.5768886570333
-647000  ekin = 2.55512268942677 |  erot = 2.20922204555245 | epot = -22.1538572894812 | etot = -17.389512554502
-648000  ekin = 3.02957533574521 |  erot = 2.11325139659861 | epot = -22.1575349215939 | etot = -17.0147081892501
-649000  ekin = 2.58453912449214 |  erot = 3.20631221677863 | epot = -22.1339073532352 | etot = -16.3430560119644
-650000  ekin = 3.77204744414227 |  erot = 2.43066777037188 | epot = -22.0837500061792 | etot = -15.8810347916651
-651000  ekin = 3.31369677202991 |  erot = 2.36221103045568 | epot = -21.9243902112032 | etot = -16.2484824087176
-652000  ekin = 2.49262898649827 |  erot = 3.02155153905954 | epot = -21.7253342697997 | etot = -16.2111537442419
-653000  ekin = 2.82559687485827 |  erot = 2.53899564631137 | epot = -21.7211782659414 | etot = -16.3565857447718
-654000  ekin = 2.35170683287638 |  erot = 2.15925543988734 | epot = -21.9219546077978 | etot = -17.4109923350341
-655000  ekin = 2.2746913368331 |  erot = 2.12498780379593 | epot = -21.9020101665877 | etot = -17.5023310259586
-656000  ekin = 2.33856358324454 |  erot = 2.10525554685067 | epot = -21.9227166217961 | etot = -17.4788974917008
-657000  ekin = 2.74434355807405 |  erot = 2.19006149870653 | epot = -22.1368388094875 | etot = -17.2024337527069
-658000  ekin = 3.04721032533817 |  erot = 2.59752520159664 | epot = -22.2936626687419 | etot = -16.6489271418071
-659000  ekin = 2.86427564828999 |  erot = 3.42151988715138 | epot = -22.2986314842237 | etot = -16.0128359487823
-660000  ekin = 2.92506899234012 |  erot = 1.63381738879488 | epot = -22.3375917964994 | etot = -17.7787054153644
-661000  ekin = 3.22051797741487 |  erot = 1.86658559874782 | epot = -22.4692759662967 | etot = -17.382172390134
-662000  ekin = 3.06008561550976 |  erot = 2.20194497946945 | epot = -22.5616874184536 | etot = -17.2996568234744
-663000  ekin = 1.91383924631387 |  erot = 2.47155788641765 | epot = -22.6270449564058 | etot = -18.2416478236743
-664000  ekin = 1.43175220258741 |  erot = 1.36481827202384 | epot = -22.714938601816 | etot = -19.9183681272047
-665000  ekin = 1.55751729325324 |  erot = 2.30904543593978 | epot = -22.7903483651339 | etot = -18.9237856359409
-666000  ekin = 2.44554812999981 |  erot = 1.7728381640758 | epot = -22.9292683336281 | etot = -18.7108820395525
-667000  ekin = 2.81292959120154 |  erot = 2.33182461186713 | epot = -23.1152300896738 | etot = -17.9704758866051
-668000  ekin = 2.71701517852366 |  erot = 3.1927510370022 | epot = -23.1898047541379 | etot = -17.2800385386121
-669000  ekin = 3.4211844979108 |  erot = 2.4483988547294 | epot = -23.2367567149657 | etot = -17.3671733623255
-670000  ekin = 2.540272537006 |  erot = 1.98108817711494 | epot = -23.1773017073799 | etot = -18.655940993259
-671000  ekin = 2.38054183576284 |  erot = 2.98341127846263 | epot = -23.1403357669317 | etot = -17.7763826527062
-672000  ekin = 3.02714775234025 |  erot = 2.54429912094893 | epot = -23.1240813931427 | etot = -17.5526345198536
-673000  ekin = 3.42342714962536 |  erot = 2.36764796314287 | epot = -23.0365834633316 | etot = -17.2455083505634
-674000  ekin = 3.1787369792725 |  erot = 2.10003598211897 | epot = -22.9565366380298 | etot = -17.6777636766383
-675000  ekin = 2.35379506516488 |  erot = 1.53509045481238 | epot = -22.8504434741329 | etot = -18.9615579541557
-676000  ekin = 2.44888744246419 |  erot = 2.24653163842729 | epot = -22.7725645250621 | etot = -18.0771454441706
-677000  ekin = 2.75831894151647 |  erot = 1.93124166774781 | epot = -22.8527844251281 | etot = -18.1632238158638
-678000  ekin = 2.86751481243524 |  erot = 1.65310315497864 | epot = -22.8648869805436 | etot = -18.3442690131297
-679000  ekin = 2.34238342331609 |  erot = 2.69036620616395 | epot = -22.9330609670147 | etot = -17.9003113375347
-680000  ekin = 2.47092831167294 |  erot = 2.90821987338148 | epot = -22.9893989293305 | etot = -17.610250744276
-681000  ekin = 1.90592213851373 |  erot = 2.57738203916981 | epot = -22.9226803153478 | etot = -18.4393761376642
-682000  ekin = 2.11776015116235 |  erot = 2.69956516894844 | epot = -22.8385618600593 | etot = -18.0212365399485
-683000  ekin = 2.36569744411279 |  erot = 2.12377742206911 | epot = -22.7248964050232 | etot = -18.2354215388413
-684000  ekin = 2.87481829504096 |  erot = 2.65568540935019 | epot = -22.6557781340276 | etot = -17.1252744296364
-685000  ekin = 3.04590812681261 |  erot = 2.17384411148381 | epot = -22.6239841629455 | etot = -17.4042319246491
-686000  ekin = 2.45732454887051 |  erot = 2.42727693460545 | epot = -22.5554269158738 | etot = -17.6708254323979
-687000  ekin = 2.74615797772517 |  erot = 1.80419114366277 | epot = -22.4906419692597 | etot = -17.9402928478718
-688000  ekin = 1.7920739822545 |  erot = 2.04572898801195 | epot = -22.4080555397627 | etot = -18.5702525694962
-689000  ekin = 2.87658871003945 |  erot = 1.89509928788519 | epot = -22.4597913998897 | etot = -17.6881034019651
-690000  ekin = 2.12362847773645 |  erot = 2.42433705189552 | epot = -22.5737079170673 | etot = -18.0257423874353
-691000  ekin = 2.15963929746743 |  erot = 2.52975117929537 | epot = -22.5896382204305 | etot = -17.9002477436677
-692000  ekin = 2.88714768351631 |  erot = 2.65189982514091 | epot = -22.4796475018852 | etot = -16.9405999932279
-693000  ekin = 2.30934205113368 |  erot = 2.51896960835911 | epot = -22.3454093965687 | etot = -17.5170977370759
-694000  ekin = 2.90083400146798 |  erot = 2.34214046553658 | epot = -22.2620689836397 | etot = -17.0190945166351
-695000  ekin = 2.9577943585455 |  erot = 2.23887088042094 | epot = -22.303054593607 | etot = -17.1063893546405
-696000  ekin = 2.65803880066321 |  erot = 2.33953886943022 | epot = -22.3444459486844 | etot = -17.3468682785909
-697000  ekin = 1.89104688866877 |  erot = 1.78290264315477 | epot = -22.3519476787994 | etot = -18.6779981469758
-698000  ekin = 2.22763370474282 |  erot = 2.82521193129044 | epot = -22.374966668557 | etot = -17.3221210325237
-699000  ekin = 2.35357258316915 |  erot = 2.06864522211151 | epot = -22.302995332199 | etot = -17.8807775269184
-700000  ekin = 2.58206368687336 |  erot = 2.33093601350411 | epot = -22.2613878464485 | etot = -17.3483881460711
-701000  ekin = 2.99704307093403 |  erot = 1.89954183386767 | epot = -22.3232249760621 | etot = -17.4266400712604
-702000  ekin = 2.67512006336489 |  erot = 2.64729282748452 | epot = -22.3604874692709 | etot = -17.0380745784215
-703000  ekin = 2.02348242287829 |  erot = 2.03755058248806 | epot = -22.4348344343157 | etot = -18.3738014289493
-704000  ekin = 1.59657624705204 |  erot = 1.63613322855987 | epot = -22.4674717825454 | etot = -19.2347623069335
-705000  ekin = 2.34019771505867 |  erot = 1.91006554831154 | epot = -22.5441024225864 | etot = -18.2938391592161
-706000  ekin = 2.47926998793354 |  erot = 3.26999075651193 | epot = -22.5117539612542 | etot = -16.7624932168087
-707000  ekin = 2.38604341038216 |  erot = 2.41699636933021 | epot = -22.604009927914 | etot = -17.8009701482016
-708000  ekin = 1.68115636633466 |  erot = 2.34002138995268 | epot = -22.7466665621618 | etot = -18.7254888058744
-709000  ekin = 1.80992626994918 |  erot = 2.57911114058356 | epot = -23.0637398035031 | etot = -18.6747023929704
-710000  ekin = 2.07665974484992 |  erot = 1.83617776589231 | epot = -23.1977961917903 | etot = -19.2849586810481
-711000  ekin = 1.95352231029107 |  erot = 2.41454578486037 | epot = -23.2358193849337 | etot = -18.8677512897822
-712000  ekin = 2.13370686414587 |  erot = 1.78661700982467 | epot = -23.2645434465923 | etot = -19.3442195726217
-713000  ekin = 2.90695161716251 |  erot = 1.55091931636559 | epot = -23.1835772351912 | etot = -18.7257063016631
-714000  ekin = 2.06629801094757 |  erot = 1.86611085535956 | epot = -23.2239032864041 | etot = -19.2914944200969
-715000  ekin = 2.52903922778277 |  erot = 1.94261958015835 | epot = -23.1658397986034 | etot = -18.6941809906622
-716000  ekin = 3.03498992772823 |  erot = 2.21064066235538 | epot = -23.2216970852983 | etot = -17.9760664952147
-717000  ekin = 3.07971375394894 |  erot = 2.47094593918087 | epot = -23.3639588975855 | etot = -17.8132992044557
-718000  ekin = 3.49703192209654 |  erot = 2.27170758510088 | epot = -23.4199184473786 | etot = -17.6511789401811
-719000  ekin = 4.06139770605771 |  erot = 3.10418818480813 | epot = -23.4072026156126 | etot = -16.2416167247468
-720000  ekin = 2.49828440590245 |  erot = 1.90909738802778 | epot = -23.262316602338 | etot = -18.8549348084078
-721000  ekin = 2.57931762358207 |  erot = 1.98570897250437 | epot = -23.1440560046385 | etot = -18.579029408552
-722000  ekin = 2.01081836336836 |  erot = 2.2747167647488 | epot = -23.1040519922181 | etot = -18.8185168641009
-723000  ekin = 2.44097316114449 |  erot = 2.07630856281912 | epot = -23.1828606158314 | etot = -18.6655788918678
-724000  ekin = 1.90797367222605 |  erot = 1.93592443836535 | epot = -23.2376437089983 | etot = -19.3937455984069
-725000  ekin = 2.19373210936071 |  erot = 2.80513028222362 | epot = -23.2888134461385 | etot = -18.2899510545542
-726000  ekin = 2.2764864004673 |  erot = 2.54378150467671 | epot = -23.3354979947709 | etot = -18.5152300896268
-727000  ekin = 1.72219216954142 |  erot = 2.62563304726333 | epot = -23.3703740298761 | etot = -19.0225488130713
-728000  ekin = 2.25087046178847 |  erot = 3.59486012962608 | epot = -23.435416924773 | etot = -17.5896863333584
-729000  ekin = 2.68839033328484 |  erot = 1.72111131116557 | epot = -23.4784810452544 | etot = -19.0689794008039
-730000  ekin = 2.5329756962683 |  erot = 2.7666773813211 | epot = -23.4899025882625 | etot = -18.1902495106731
-731000  ekin = 2.6760609901083 |  erot = 2.04579712240261 | epot = -23.5241973416199 | etot = -18.802339229109
-732000  ekin = 2.77848516459028 |  erot = 1.88432734797838 | epot = -23.5774208145874 | etot = -18.9146083020187
-733000  ekin = 2.18895381088671 |  erot = 2.63471719118119 | epot = -23.6107634586383 | etot = -18.7870924565704
-734000  ekin = 1.69467760927658 |  erot = 2.30338410687055 | epot = -23.5936446347431 | etot = -19.595582918596
-735000  ekin = 2.17749689272956 |  erot = 2.71618098412724 | epot = -23.5330417303215 | etot = -18.6393638534647
-736000  ekin = 2.29375858428166 |  erot = 1.1740900723812 | epot = -23.503450790287 | etot = -20.0356021336242
-737000  ekin = 2.20827752624533 |  erot = 3.11531250945766 | epot = -23.4552023795231 | etot = -18.1316123438201
-738000  ekin = 1.72303720787712 |  erot = 2.28747842674015 | epot = -23.3309270174989 | etot = -19.3204113828816
-739000  ekin = 1.39492824364512 |  erot = 2.17488386602882 | epot = -23.28548996576 | etot = -19.7156778560861
-740000  ekin = 1.90426261774289 |  erot = 2.27825159935278 | epot = -23.2514184467463 | etot = -19.0689042296506
-741000  ekin = 2.02024508457136 |  erot = 2.72073546284876 | epot = -23.1876217096301 | etot = -18.4466411622099
-742000  ekin = 1.97487019042321 |  erot = 1.87541960482772 | epot = -23.0929182320365 | etot = -19.2426284367856
-743000  ekin = 1.96486238454688 |  erot = 2.76982785281128 | epot = -22.9318899502109 | etot = -18.1971997128528
-744000  ekin = 2.04909521933131 |  erot = 2.34373814592941 | epot = -22.8510525613065 | etot = -18.4582191960458
-745000  ekin = 1.66771130319646 |  erot = 1.87270341329448 | epot = -22.7977076876185 | etot = -19.2572929711276
-746000  ekin = 2.11650515037838 |  erot = 2.03542197982564 | epot = -22.7785820280378 | etot = -18.6266548978338
-747000  ekin = 3.07964448387158 |  erot = 1.66910106460583 | epot = -22.8037757029139 | etot = -18.0550301544365
-748000  ekin = 3.03811477337698 |  erot = 1.85631102018694 | epot = -22.8436239146773 | etot = -17.9491981211133
-749000  ekin = 2.53753852426481 |  erot = 2.01199117356573 | epot = -22.860297041716 | etot = -18.3107673438855
-750000  ekin = 2.77210902960465 |  erot = 2.32628560304478 | epot = -22.9528220918576 | etot = -17.8544274592082
-751000  ekin = 2.52040431872467 |  erot = 2.34903725042469 | epot = -23.0127359055533 | etot = -18.1432943364039
-752000  ekin = 2.46408285580806 |  erot = 1.68868786663082 | epot = -22.9901282704654 | etot = -18.8373575480265
-753000  ekin = 2.47364326188914 |  erot = 1.55776271670366 | epot = -23.1135680684223 | etot = -19.0821620898295
-754000  ekin = 2.5278916038673 |  erot = 2.29496804643662 | epot = -23.2403939606523 | etot = -18.4175343103483
-755000  ekin = 1.52934303772527 |  erot = 2.21322404979637 | epot = -23.262110017443 | etot = -19.5195429299214
-756000  ekin = 2.10423967353423 |  erot = 2.40303050505255 | epot = -23.1685739957517 | etot = -18.6613038171649
-757000  ekin = 2.92559629660516 |  erot = 2.0691293568206 | epot = -23.1502917576405 | etot = -18.1555661042147
-758000  ekin = 2.37300490719645 |  erot = 2.51363215153151 | epot = -23.0495756460038 | etot = -18.1629385872758
-759000  ekin = 2.6014595730178 |  erot = 2.39657042348208 | epot = -22.9025259489071 | etot = -17.9044959524072
-760000  ekin = 3.23086874355225 |  erot = 2.77072134903012 | epot = -22.8089299952235 | etot = -16.8073399026412
-761000  ekin = 3.41475369307092 |  erot = 1.70180532416599 | epot = -22.7404708369396 | etot = -17.6239118197027
-762000  ekin = 3.40874473404401 |  erot = 2.52147443954634 | epot = -22.5276669204419 | etot = -16.5974477468515
-763000  ekin = 2.64281892112082 |  erot = 1.82464895439093 | epot = -22.3890167593186 | etot = -17.9215488838069
-764000  ekin = 2.38098664175603 |  erot = 2.71455563654527 | epot = -22.2309521785191 | etot = -17.1354099002178
-765000  ekin = 2.24221473762586 |  erot = 1.94826539133556 | epot = -22.122583392123 | etot = -17.9321032631616
-766000  ekin = 2.50645584526003 |  erot = 1.96129579948818 | epot = -21.9857907119498 | etot = -17.5180390672015
-767000  ekin = 2.34028568638226 |  erot = 2.64592471376141 | epot = -21.9051815399867 | etot = -16.918971139843
-768000  ekin = 1.86752761821211 |  erot = 2.06138447840236 | epot = -21.8874171216963 | etot = -17.9585050250818
-769000  ekin = 3.03590459157853 |  erot = 2.66440802561784 | epot = -21.8247140853503 | etot = -16.124401468154
-770000  ekin = 2.42567220683552 |  erot = 1.97830158892933 | epot = -21.8110526122117 | etot = -17.4070788164468
-771000  ekin = 2.20056711884501 |  erot = 2.53255190976195 | epot = -21.7341162461991 | etot = -17.0009972175921
-772000  ekin = 2.75016173617492 |  erot = 1.98403019503999 | epot = -21.8164316952287 | etot = -17.0822397640138
-773000  ekin = 2.14723076845117 |  erot = 2.41512334908793 | epot = -21.9576017041203 | etot = -17.3952475865812
-774000  ekin = 2.20536023895281 |  erot = 1.98379412617599 | epot = -22.043759647449 | etot = -17.8546052823202
-775000  ekin = 2.53158393271132 |  erot = 2.8225938280108 | epot = -22.2469056379858 | etot = -16.8927278772637
-776000  ekin = 3.15988726149912 |  erot = 2.46223044860468 | epot = -22.4204382258798 | etot = -16.798320515776
-777000  ekin = 1.91542872566335 |  erot = 1.75408058586262 | epot = -22.4517075164596 | etot = -18.7821982049336
-778000  ekin = 2.94665474162607 |  erot = 2.31805831302194 | epot = -22.4632153304498 | etot = -17.1985022758018
-779000  ekin = 3.10970934270731 |  erot = 2.04446179405629 | epot = -22.4851490287702 | etot = -17.3309778920066
-780000  ekin = 2.85215832341045 |  erot = 3.13312086675091 | epot = -22.4501531708741 | etot = -16.4648739807127
-781000  ekin = 2.36733074493229 |  erot = 3.56399648845806 | epot = -22.4171363625471 | etot = -16.4858091291567
-782000  ekin = 2.32796510372074 |  erot = 2.86343667143255 | epot = -22.3438054250098 | etot = -17.1524036498565
-783000  ekin = 1.86439500745061 |  erot = 3.05233385447291 | epot = -22.2079509833896 | etot = -17.2912221214661
-784000  ekin = 2.05476588420882 |  erot = 2.29789997988689 | epot = -22.1006364427793 | etot = -17.7479705786836
-785000  ekin = 2.03879516593738 |  erot = 2.15052527915338 | epot = -22.0056061371158 | etot = -17.816285692025
-786000  ekin = 2.3752160296601 |  erot = 2.32156698168742 | epot = -21.9727988200248 | etot = -17.2760158086773
-787000  ekin = 2.76686314352376 |  erot = 2.23625261993099 | epot = -21.8969600931556 | etot = -16.8938443297008
-788000  ekin = 2.13318993659091 |  erot = 2.25162748275281 | epot = -21.8604178455632 | etot = -17.4756004262194
-789000  ekin = 1.98216852118508 |  erot = 1.98058785261598 | epot = -21.844134033761 | etot = -17.8813776599599
-790000  ekin = 1.67847851427146 |  erot = 1.42560334440858 | epot = -21.941301490604 | etot = -18.837219631924
-791000  ekin = 2.12689982203095 |  erot = 2.53200907087448 | epot = -22.0864434478656 | etot = -17.4275345549602
-792000  ekin = 1.72797703494859 |  erot = 2.22448376175168 | epot = -22.1854190028922 | etot = -18.2329582061919
-793000  ekin = 3.18409314211953 |  erot = 1.94056710411296 | epot = -22.3760603901177 | etot = -17.2514001438852
-794000  ekin = 2.49071782059139 |  erot = 3.01186430180266 | epot = -22.4315505782774 | etot = -16.9289684558833
-795000  ekin = 2.89844296027926 |  erot = 3.07659510288655 | epot = -22.5164404652995 | etot = -16.5414024021337
-796000  ekin = 2.32845268798927 |  erot = 1.62708270564126 | epot = -22.5660647482766 | etot = -18.6105293546461
-797000  ekin = 2.20766900620157 |  erot = 3.6597733457204 | epot = -22.5351911425215 | etot = -16.6677487905995
-798000  ekin = 2.12139450500735 |  erot = 2.94419809776829 | epot = -22.53586560158 | etot = -17.4702729988044
-799000  ekin = 2.48452434226029 |  erot = 2.7415786036137 | epot = -22.4941328101442 | etot = -17.2680298642702
-800000  ekin = 2.17521613585505 |  erot = 2.96480330538541 | epot = -22.3818079549674 | etot = -17.2417885137269
-801000  ekin = 2.54690065539559 |  erot = 2.74966931670846 | epot = -22.3008594124712 | etot = -17.0042894403671
-802000  ekin = 3.02823775407486 |  erot = 2.8915936784506 | epot = -22.2024149184001 | etot = -16.2825834858746
-803000  ekin = 2.21042161290743 |  erot = 2.51594019231142 | epot = -22.1069208353333 | etot = -17.3805590301145
-804000  ekin = 2.91061289296152 |  erot = 1.5830418961718 | epot = -22.0839512655924 | etot = -17.5902964764591
-805000  ekin = 2.67762522194669 |  erot = 3.06970455948968 | epot = -22.0793101970619 | etot = -16.3319804156255
-806000  ekin = 2.75979804034939 |  erot = 2.2176860954027 | epot = -22.0549669082474 | etot = -17.0774827724953
-807000  ekin = 2.11041519443391 |  erot = 2.83915265443807 | epot = -22.1073292774231 | etot = -17.1577614285511
-808000  ekin = 1.84392510139081 |  erot = 2.29797054411878 | epot = -22.0753255923415 | etot = -17.9334299468319
-809000  ekin = 1.93171652686567 |  erot = 1.94021167949754 | epot = -22.0668297694372 | etot = -18.194901563074
-810000  ekin = 1.97774334424761 |  erot = 2.6472977913531 | epot = -22.1020544833021 | etot = -17.4770133477014
-811000  ekin = 2.2417092413671 |  erot = 1.75505259459069 | epot = -22.1062654329495 | etot = -18.1095035969917
-812000  ekin = 2.49053159164605 |  erot = 2.33986799245713 | epot = -22.124141511127 | etot = -17.2937419270238
-813000  ekin = 3.01755249739549 |  erot = 2.24004680047387 | epot = -22.1167722656682 | etot = -16.8591729677989
-814000  ekin = 2.86045886242639 |  erot = 2.24119269343823 | epot = -22.1084535534804 | etot = -17.0068019976158
-815000  ekin = 2.57503557502156 |  erot = 2.76212054641368 | epot = -21.9950519676046 | etot = -16.6578958461694
-816000  ekin = 2.19961906931023 |  erot = 2.59194277056134 | epot = -22.0843443380244 | etot = -17.2927824981528
-817000  ekin = 1.75062364873707 |  erot = 2.66165019507354 | epot = -22.3739862599355 | etot = -17.9617124161249
-818000  ekin = 2.24809257416679 |  erot = 2.59026399650675 | epot = -22.5610524731389 | etot = -17.7226959024654
-819000  ekin = 2.12537334404071 |  erot = 2.59618311382673 | epot = -22.5606510650104 | etot = -17.839094607143
-820000  ekin = 1.93414650390356 |  erot = 2.29085663493509 | epot = -22.4839314706954 | etot = -18.2589283318568
-821000  ekin = 2.11382182469737 |  erot = 2.38685226676536 | epot = -22.47627897247 | etot = -17.9756048810073
-822000  ekin = 2.2613431095799 |  erot = 2.12056938305333 | epot = -22.370909843474 | etot = -17.9889973508408
-823000  ekin = 2.31560863750917 |  erot = 2.60350436456086 | epot = -22.4988996092736 | etot = -17.5797866072036
-824000  ekin = 1.73697879038959 |  erot = 1.5185057021212 | epot = -22.6200401147494 | etot = -19.3645556222386
-825000  ekin = 1.63614248894086 |  erot = 1.97731468932685 | epot = -22.6198150724223 | etot = -19.0063578941546
-826000  ekin = 2.00841233147246 |  erot = 2.17850248200248 | epot = -22.5466518143203 | etot = -18.3597370008454
-827000  ekin = 2.18457105279113 |  erot = 2.44711764942285 | epot = -22.4005870169979 | etot = -17.7688983147839
-828000  ekin = 1.91039404464085 |  erot = 2.73449242191012 | epot = -22.3948651441296 | etot = -17.7499786775786
-829000  ekin = 2.07228257188588 |  erot = 2.97134747466499 | epot = -22.4347910090961 | etot = -17.3911609625452
-830000  ekin = 1.99293621346915 |  erot = 2.15765133255911 | epot = -22.4843800017124 | etot = -18.3337924556842
-831000  ekin = 2.33241187954984 |  erot = 2.37634533076884 | epot = -22.5757045912718 | etot = -17.8669473809531
-832000  ekin = 2.02856108052035 |  erot = 1.94729581180225 | epot = -22.6670251626246 | etot = -18.691168270302
-833000  ekin = 2.28623411522758 |  erot = 2.15108044390973 | epot = -22.7566850878713 | etot = -18.319370528734
-834000  ekin = 2.12105013529711 |  erot = 1.5116778668129 | epot = -22.7735851481702 | etot = -19.1408571460602
-835000  ekin = 2.88531776933573 |  erot = 2.74027641398136 | epot = -22.8585330533172 | etot = -17.2329388700001
-836000  ekin = 3.32070208623905 |  erot = 2.42231134749978 | epot = -22.8959107751695 | etot = -17.1528973414306
-837000  ekin = 2.74149226799164 |  erot = 2.32127198719276 | epot = -22.8906677110002 | etot = -17.8279034558158
-838000  ekin = 3.13302338440878 |  erot = 3.19829232559053 | epot = -22.9166668544453 | etot = -16.585351144446
-839000  ekin = 2.73522885875602 |  erot = 2.61100294075548 | epot = -22.8499426413711 | etot = -17.5037108418596
-840000  ekin = 2.97139629828009 |  erot = 1.43157972743722 | epot = -22.7763904271576 | etot = -18.3734144014403
-841000  ekin = 2.9571795545775 |  erot = 2.67280681737836 | epot = -22.7408850128302 | etot = -17.1108986408743
-842000  ekin = 2.17222575948606 |  erot = 2.30478646820068 | epot = -22.7382440804492 | etot = -18.2612318527624
-843000  ekin = 2.83292824269634 |  erot = 2.04165126380544 | epot = -22.7426687858571 | etot = -17.8680892793554
-844000  ekin = 2.95938970875204 |  erot = 1.50198210425589 | epot = -22.783719790782 | etot = -18.3223479777741
-845000  ekin = 3.16076837184522 |  erot = 2.28216144351779 | epot = -22.7913524647186 | etot = -17.3484226493555
-846000  ekin = 3.3398977708405 |  erot = 2.53602189023877 | epot = -22.7943227793905 | etot = -16.9184031183113
-847000  ekin = 2.14145435242079 |  erot = 2.75036267291773 | epot = -22.7255800042885 | etot = -17.83376297895
-848000  ekin = 2.48912550447967 |  erot = 2.81875176956459 | epot = -22.5834297802211 | etot = -17.2755525061768
-849000  ekin = 1.98023552181666 |  erot = 2.5692134285068 | epot = -22.4587431120173 | etot = -17.9092941616939
-850000  ekin = 2.0475383789703 |  erot = 1.80627608629883 | epot = -22.442868440532 | etot = -18.5890539752628
-851000  ekin = 2.09704360250612 |  erot = 1.85768640504848 | epot = -22.4344168330881 | etot = -18.4796868255335
-852000  ekin = 1.70813487206096 |  erot = 1.42387059402563 | epot = -22.3764553852037 | etot = -19.2444499191171
-853000  ekin = 2.00140314580349 |  erot = 3.04689599134399 | epot = -22.4103147041128 | etot = -17.3620155669653
-854000  ekin = 3.02149896921022 |  erot = 2.22990677084323 | epot = -22.4965128093929 | etot = -17.2451070693394
-855000  ekin = 2.19607047478225 |  erot = 2.83672007906388 | epot = -22.5083573431917 | etot = -17.4755667893456
-856000  ekin = 2.44947669543341 |  erot = 1.52884872890501 | epot = -22.4898047833717 | etot = -18.5114793590332
-857000  ekin = 2.53345481305323 |  erot = 2.80399799726174 | epot = -22.39864736443 | etot = -17.061194554115
-858000  ekin = 2.20266598505728 |  erot = 2.82477658278041 | epot = -22.322749893257 | etot = -17.2953073254193
-859000  ekin = 2.30655855498922 |  erot = 2.31428920065484 | epot = -22.299458676259 | etot = -17.6786109206149
-860000  ekin = 1.99697183524065 |  erot = 1.95028062775308 | epot = -22.3156691349687 | etot = -18.3684166719749
-861000  ekin = 2.69687116915107 |  erot = 2.24433771449493 | epot = -22.3086232893581 | etot = -17.3674144057121
-862000  ekin = 2.86022987586877 |  erot = 2.41684736135787 | epot = -22.2874375572893 | etot = -17.0103603200626
-863000  ekin = 2.60871204568914 |  erot = 3.3557366458487 | epot = -22.2313024399491 | etot = -16.2668537484113
-864000  ekin = 2.90978326967391 |  erot = 2.29745178043259 | epot = -22.1985713670251 | etot = -16.9913363169186
-865000  ekin = 1.92892881804686 |  erot = 2.15731715168145 | epot = -22.0984656787339 | etot = -18.0122197090056
-866000  ekin = 1.96990768776308 |  erot = 1.64764578107637 | epot = -21.9980087709689 | etot = -18.3804553021294
-867000  ekin = 1.75218832670564 |  erot = 3.37220276943672 | epot = -21.9060579112704 | etot = -16.781666815128
-868000  ekin = 1.82818126605702 |  erot = 2.79449094294287 | epot = -21.9401796601767 | etot = -17.3175074511768
-869000  ekin = 2.38095838431442 |  erot = 2.38587739965205 | epot = -22.0329803939138 | etot = -17.2661446099473
-870000  ekin = 1.91334960398162 |  erot = 3.22058637313173 | epot = -22.0372634175766 | etot = -16.9033274404632
-871000  ekin = 3.11762256076551 |  erot = 2.95337521110721 | epot = -21.9585521021423 | etot = -15.8875543302696
-872000  ekin = 2.97995457097216 |  erot = 1.38589789821627 | epot = -21.8388140547637 | etot = -17.4729615855753
-873000  ekin = 2.75063242740213 |  erot = 2.24384409185972 | epot = -21.7621446383558 | etot = -16.767668119094
-874000  ekin = 2.42548187796032 |  erot = 2.11160399589529 | epot = -21.6726796153781 | etot = -17.1355937415225
-875000  ekin = 2.99029080863986 |  erot = 2.74119845235593 | epot = -21.6681717382462 | etot = -15.9366824772504
-876000  ekin = 2.13275197859305 |  erot = 2.233203194222 | epot = -21.6687594523732 | etot = -17.3028042795581
-877000  ekin = 1.83070162423874 |  erot = 1.6010526911626 | epot = -21.6263742280813 | etot = -18.19461991268
-878000  ekin = 2.01997494895548 |  erot = 2.72070409004295 | epot = -21.632105565574 | etot = -16.8914265265756
-879000  ekin = 1.43444833027133 |  erot = 2.17422677437648 | epot = -21.5501867528963 | etot = -17.9415116482485
-880000  ekin = 2.09181862571921 |  erot = 2.57771231025419 | epot = -21.4847603093162 | etot = -16.8152293733428
-881000  ekin = 1.54081572899847 |  erot = 1.98591498012594 | epot = -21.5197472943257 | etot = -17.9930165852013
-882000  ekin = 2.2061903789583 |  erot = 2.64808794630213 | epot = -21.6149395754995 | etot = -16.760661250239
-883000  ekin = 2.22398786469444 |  erot = 2.23146516226547 | epot = -21.6814015671086 | etot = -17.2259485401487
-884000  ekin = 2.78668802039765 |  erot = 2.10130089852047 | epot = -21.7272273228039 | etot = -16.8392384038858
-885000  ekin = 1.92361997638943 |  erot = 1.77572378933155 | epot = -21.7696517903878 | etot = -18.0703080246668
-886000  ekin = 1.99836032534883 |  erot = 3.11596676947403 | epot = -21.7879382713548 | etot = -16.673611176532
-887000  ekin = 1.98879909318866 |  erot = 2.81589132946027 | epot = -21.7923091863043 | etot = -16.9876187636554
-888000  ekin = 1.92041141945741 |  erot = 2.3252911526479 | epot = -21.8607011941373 | etot = -17.614998622032
-889000  ekin = 1.8806357075667 |  erot = 2.46119753007268 | epot = -21.9506056361693 | etot = -17.6087723985299
-890000  ekin = 1.86005551534237 |  erot = 2.25705356539098 | epot = -22.0523870894554 | etot = -17.9352780087221
-891000  ekin = 2.60384568426052 |  erot = 2.35330960558484 | epot = -22.1900620535717 | etot = -17.2329067637263
-892000  ekin = 2.68682478776143 |  erot = 2.69192226449536 | epot = -22.2913421142228 | etot = -16.9125950619661
-893000  ekin = 2.17360632388892 |  erot = 2.98553431183659 | epot = -22.2913111245685 | etot = -17.132170488843
-894000  ekin = 2.52600330506545 |  erot = 2.45861329518365 | epot = -22.2813523194117 | etot = -17.2967357191626
-895000  ekin = 2.51964265942842 |  erot = 2.458508768977 | epot = -22.3090530666537 | etot = -17.3309016382482
-896000  ekin = 1.83970949418621 |  erot = 2.7876698428861 | epot = -22.2816769795447 | etot = -17.6542976424724
-897000  ekin = 2.36177466310812 |  erot = 2.0208895092276 | epot = -22.2244555724411 | etot = -17.8417914001054
-898000  ekin = 2.11475930620727 |  erot = 1.90142689771282 | epot = -22.1399515435435 | etot = -18.1237653396234
-899000  ekin = 2.62628238826603 |  erot = 2.33607509693707 | epot = -22.040854543184 | etot = -17.0784970579809
-900000  ekin = 2.1134311489616 |  erot = 2.28923041198217 | epot = -22.042922147544 | etot = -17.6402605866003
-901000  ekin = 1.9156742929676 |  erot = 1.81441237665855 | epot = -22.0776682049659 | etot = -18.3475815353397
-902000  ekin = 2.56902181313363 |  erot = 2.49856756454338 | epot = -22.0065137105888 | etot = -16.9389243329118
-903000  ekin = 1.85774740371253 |  erot = 2.17490444163848 | epot = -21.9440961512363 | etot = -17.9114443058853
-904000  ekin = 1.86493397406833 |  erot = 2.32873873815716 | epot = -21.8931358584844 | etot = -17.6994631462589
-905000  ekin = 2.31979070947169 |  erot = 2.14360558294755 | epot = -21.824385320242 | etot = -17.3609890278228
-906000  ekin = 2.49844805906095 |  erot = 2.24842339845928 | epot = -21.8343155675942 | etot = -17.087444110074
-907000  ekin = 4.2050069684007 |  erot = 2.50213003512293 | epot = -21.926981437738 | etot = -15.2198444342144
-908000  ekin = 3.27384188266606 |  erot = 2.113986364986 | epot = -22.0851390841283 | etot = -16.6973108364762
-909000  ekin = 2.63126156907554 |  erot = 1.92589592890071 | epot = -22.2067426627273 | etot = -17.649585164751
-910000  ekin = 2.59247391196527 |  erot = 2.91530974700789 | epot = -22.3083595488238 | etot = -16.8005758898507
-911000  ekin = 2.58542931349158 |  erot = 4.35273181589072 | epot = -22.3703725466068 | etot = -15.4322114172245
-912000  ekin = 3.05788115941417 |  erot = 3.70629270837706 | epot = -22.3924331468687 | etot = -15.6282592790774
-913000  ekin = 2.82179099955174 |  erot = 2.17271040546975 | epot = -22.3592523787226 | etot = -17.3647509737011
-914000  ekin = 2.15502438011904 |  erot = 1.21668409626845 | epot = -22.2678100512732 | etot = -18.8961015748857
-915000  ekin = 1.59606663662058 |  erot = 2.96270026674799 | epot = -22.1740650061606 | etot = -17.615298102792
-916000  ekin = 2.59113116114426 |  erot = 3.74925276784446 | epot = -22.2376802645764 | etot = -15.8972963355877
-917000  ekin = 3.04931771481537 |  erot = 2.87183708314021 | epot = -22.2631766381559 | etot = -16.3420218402004
-918000  ekin = 2.92188996322642 |  erot = 2.63336986904281 | epot = -22.2586011448583 | etot = -16.7033413125891
-919000  ekin = 3.21078589975638 |  erot = 2.75946192406924 | epot = -22.2354679015341 | etot = -16.2652200777085
-920000  ekin = 2.28588196467068 |  erot = 2.37332214874002 | epot = -22.2033589800159 | etot = -17.5441548666052
-921000  ekin = 2.38962275209347 |  erot = 2.43661594631483 | epot = -22.1850468087942 | etot = -17.3588081103859
-922000  ekin = 2.30444121290069 |  erot = 2.41446680487179 | epot = -22.1364838134968 | etot = -17.4175757957243
-923000  ekin = 2.49328668364371 |  erot = 2.66692739305866 | epot = -22.1214525565084 | etot = -16.961238479806
-924000  ekin = 1.53749552443357 |  erot = 2.96826070169594 | epot = -22.0894201538095 | etot = -17.58366392768
-925000  ekin = 1.85840160112661 |  erot = 1.96300614534087 | epot = -22.0261080308484 | etot = -18.2047002843809
-926000  ekin = 1.36444139420093 |  erot = 2.1171911056521 | epot = -22.0105169062661 | etot = -18.5288844064131
-927000  ekin = 2.55080456695379 |  erot = 2.08771192494034 | epot = -22.0296775970306 | etot = -17.3911611051365
-928000  ekin = 2.08687563155734 |  erot = 2.73937352627042 | epot = -22.0655254209395 | etot = -17.2392762631117
-929000  ekin = 1.85842465674464 |  erot = 1.85229951899858 | epot = -22.161879510768 | etot = -18.4511553350248
-930000  ekin = 1.98312460976539 |  erot = 2.1107410982594 | epot = -22.14836282055 | etot = -18.0544971125252
-931000  ekin = 2.44403538776918 |  erot = 1.87099700190232 | epot = -22.0455015122594 | etot = -17.7304691225879
-932000  ekin = 2.7450847259232 |  erot = 2.34428750425033 | epot = -22.0610452671158 | etot = -16.9716730369423
-933000  ekin = 3.03611053551161 |  erot = 2.51768120120295 | epot = -21.9625013660046 | etot = -16.4087096292901
-934000  ekin = 2.94656859108538 |  erot = 2.48807299457996 | epot = -21.861427363924 | etot = -16.4267857782587
-935000  ekin = 2.79276097099932 |  erot = 2.14683659927043 | epot = -21.8273092000012 | etot = -16.8877116297315
-936000  ekin = 2.97178317336133 |  erot = 2.07585468409967 | epot = -21.8285263420326 | etot = -16.7808884845716
-937000  ekin = 3.04678623330025 |  erot = 2.3469475727902 | epot = -21.7540111620946 | etot = -16.3602773560041
-938000  ekin = 2.98751343731959 |  erot = 2.36094469095133 | epot = -21.6698990656412 | etot = -16.3214409373703
-939000  ekin = 2.58148991378899 |  erot = 2.28540307033942 | epot = -21.641624391377 | etot = -16.7747314072486
-940000  ekin = 2.64449140269543 |  erot = 2.76444805229845 | epot = -21.5519193090555 | etot = -16.1429798540616
-941000  ekin = 2.27119597888968 |  erot = 2.6047011226429 | epot = -21.4613787017959 | etot = -16.5854816002633
-942000  ekin = 1.87372343217533 |  erot = 2.80846718394805 | epot = -21.3627475231486 | etot = -16.6805569070252
-943000  ekin = 2.47144243861285 |  erot = 2.33780411758964 | epot = -21.3635196463293 | etot = -16.5542730901269
-944000  ekin = 2.13395812695593 |  erot = 1.92152946754219 | epot = -21.3250397924826 | etot = -17.2695521979844
-945000  ekin = 2.55906013749132 |  erot = 2.2064112111687 | epot = -21.3688330068161 | etot = -16.6033616581561
-946000  ekin = 2.36057360323902 |  erot = 2.87561909021941 | epot = -21.3642087487724 | etot = -16.128016055314
-947000  ekin = 2.0664007802554 |  erot = 1.8712733843037 | epot = -21.3615863875836 | etot = -17.4239122230245
-948000  ekin = 1.84827298766581 |  erot = 1.37746869479931 | epot = -21.4042186851624 | etot = -18.1784770026972
-949000  ekin = 1.76268582715986 |  erot = 2.31704980534492 | epot = -21.4240851264671 | etot = -17.3443494939624
-950000  ekin = 1.71596526195605 |  erot = 2.24238613701562 | epot = -21.4136184248624 | etot = -17.4552670258908
-951000  ekin = 1.97739431794919 |  erot = 2.32356723589743 | epot = -21.4746626443703 | etot = -17.1737010905236
-952000  ekin = 2.93969915889367 |  erot = 2.72641565709973 | epot = -21.5183559681327 | etot = -15.8522411521393
-953000  ekin = 2.94576770934606 |  erot = 2.38856498634115 | epot = -21.5141407104899 | etot = -16.1798080148027
-954000  ekin = 3.09120782928501 |  erot = 1.98547863545544 | epot = -21.4220978424351 | etot = -16.3454113776947
-955000  ekin = 3.57635302907509 |  erot = 2.07344226252239 | epot = -21.3055276294275 | etot = -15.65573233783
-956000  ekin = 2.96199697760255 |  erot = 3.68176573533001 | epot = -21.1569123839441 | etot = -14.5131496710115
-957000  ekin = 2.99343140156395 |  erot = 2.6641673976979 | epot = -20.9767503534011 | etot = -15.3191515541393
-958000  ekin = 2.66519710291016 |  erot = 2.94296730915348 | epot = -20.778322783175 | etot = -15.1701583711114
-959000  ekin = 1.92859078964251 |  erot = 2.44737003089627 | epot = -20.7022563699757 | etot = -16.3262955494369
-960000  ekin = 1.49451727360012 |  erot = 3.13583888779427 | epot = -20.7118848436939 | etot = -16.0815286822995
-961000  ekin = 1.95030797402212 |  erot = 2.08601754519332 | epot = -20.7116280307748 | etot = -16.6753025115593
-962000  ekin = 2.02519672504697 |  erot = 1.8993614904036 | epot = -20.7772856698007 | etot = -16.8527274543501
-963000  ekin = 1.81866098250674 |  erot = 2.47413067985077 | epot = -20.8446590259958 | etot = -16.5518673636383
-964000  ekin = 2.82274927013719 |  erot = 2.43518028535965 | epot = -20.9038261011269 | etot = -15.64589654563
-965000  ekin = 2.55107687208175 |  erot = 2.29878175210651 | epot = -20.9717669792334 | etot = -16.1219083550452
-966000  ekin = 2.1200913755337 |  erot = 2.2846988725502 | epot = -21.0606259488472 | etot = -16.6558357007633
-967000  ekin = 1.58229605946639 |  erot = 3.55757301639252 | epot = -21.1224849810159 | etot = -15.982615905157
-968000  ekin = 1.95011274740584 |  erot = 2.3752003899703 | epot = -21.1147445818894 | etot = -16.7894314445132
-969000  ekin = 2.19259033480515 |  erot = 2.45911844664679 | epot = -21.0841141670188 | etot = -16.4324053855669
-970000  ekin = 1.87048608890169 |  erot = 2.95646346755995 | epot = -21.0142741201673 | etot = -16.1873245637056
-971000  ekin = 1.950153162929 |  erot = 3.0717285905854 | epot = -20.9854323440231 | etot = -15.9635505905087
-972000  ekin = 1.93197938125398 |  erot = 2.56232300543577 | epot = -20.9700672251306 | etot = -16.4757648384409
-973000  ekin = 2.21536036218028 |  erot = 2.92680374210101 | epot = -20.9735070987956 | etot = -15.8313429945143
-974000  ekin = 2.53787477442507 |  erot = 2.68950390909793 | epot = -20.9249780227203 | etot = -15.6975993391973
-975000  ekin = 3.3832404833891 |  erot = 2.33888514036507 | epot = -20.8975294326534 | etot = -15.1754038088992
-976000  ekin = 2.84644457799265 |  erot = 3.11578234174529 | epot = -20.8919958508098 | etot = -14.9297689310719
-977000  ekin = 2.71728271399263 |  erot = 2.50842582300821 | epot = -20.8689034899506 | etot = -15.6431949529497
-978000  ekin = 1.79447160570111 |  erot = 2.0736426807417 | epot = -20.8420102217514 | etot = -16.9738959353086
-979000  ekin = 1.87121723303036 |  erot = 2.21930404593537 | epot = -20.7748213462523 | etot = -16.6843000672865
-980000  ekin = 1.92329753072694 |  erot = 1.58075512357095 | epot = -20.7449893755876 | etot = -17.2409367212897
-981000  ekin = 1.54378956643562 |  erot = 2.05667260838343 | epot = -20.8055475552994 | etot = -17.2050853804803
-982000  ekin = 1.84106018589786 |  erot = 1.96434982363189 | epot = -20.9115392638984 | etot = -17.1061292543687
-983000  ekin = 2.72419781781661 |  erot = 1.79041192395563 | epot = -20.935370561762 | etot = -16.4207608199898
-984000  ekin = 3.62592878226169 |  erot = 2.63360520982709 | epot = -21.0391300854773 | etot = -14.7795960933885
-985000  ekin = 2.94852029277516 |  erot = 2.17123324675229 | epot = -21.210668025134 | etot = -16.0909144856065
-986000  ekin = 2.87308205004233 |  erot = 2.17802315487852 | epot = -21.3375937115616 | etot = -16.2864885066408
-987000  ekin = 3.37012638403781 |  erot = 2.51985184465596 | epot = -21.4043627880157 | etot = -15.514384559322
-988000  ekin = 3.46870329025365 |  erot = 3.24288958557111 | epot = -21.4574256625201 | etot = -14.7458327866953
-989000  ekin = 2.84167714920458 |  erot = 2.20794124486355 | epot = -21.6063889534189 | etot = -16.5567705593508
-990000  ekin = 2.79616762915596 |  erot = 1.83962543905575 | epot = -21.6049428673847 | etot = -16.969149799173
-991000  ekin = 3.12376374867622 |  erot = 3.19217780569165 | epot = -21.5124272449002 | etot = -15.1964856905324
-992000  ekin = 3.28266282243327 |  erot = 2.63435990952508 | epot = -21.3973672594977 | etot = -15.4803445275393
-993000  ekin = 3.03845590773447 |  erot = 2.22451011589011 | epot = -21.3214832241627 | etot = -16.0585172005382
-994000  ekin = 3.17417330085466 |  erot = 2.79358287085479 | epot = -21.2400043434466 | etot = -15.2722481717371
-995000  ekin = 3.20646780888655 |  erot = 1.72565517852613 | epot = -21.1372155372729 | etot = -16.2050925498602
-996000  ekin = 3.05109485375234 |  erot = 3.18000631651671 | epot = -21.0952864235923 | etot = -14.8641852533233
-997000  ekin = 2.95625677593347 |  erot = 3.15916554858247 | epot = -21.058148007987 | etot = -14.942725683471
-998000  ekin = 3.06605914614908 |  erot = 1.97682176881012 | epot = -20.9834240684974 | etot = -15.9405431535382
-999000  ekin = 2.08919327368179 |  erot = 2.76364485800616 | epot = -20.9705413117635 | etot = -16.1177031800756
-1000000  ekin = 2.11761701334905 |  erot = 2.1409630347026 | epot = -20.9096627221725 | etot = -16.6510826741208
- 1000000  0.094116312   -1.3659956  0.059141691   -1.1745029 -3.0654283e-05 
-Loop time of 43.6978 on 1 procs for 1000000 steps with 16 atoms
-
-Performance: 19772.150 tau/day, 22884.433 timesteps/s
-98.6% CPU use with 1 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 32.769     | 32.769     | 32.769     |   0.0 | 74.99
-Bond    | 0.93071    | 0.93071    | 0.93071    |   0.0 |  2.13
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 0.19584    | 0.19584    | 0.19584    |   0.0 |  0.45
-Output  | 1e-05      | 1e-05      | 1e-05      |   0.0 |  0.00
-Modify  | 9.4507     | 9.4507     | 9.4507     |   0.0 | 21.63
-Other   |            | 0.3515     |            |       |  0.80
-
-Nlocal:    16 ave 16 max 16 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Nghost:    0 ave 0 max 0 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Neighs:    116 ave 116 max 116 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-
-Total # of neighbors = 116
-Ave neighs/atom = 7.25
-Ave special neighs/atom = 3.75
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:43
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.4 b/examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.4
deleted file mode 100644
index 8989bce5ef..0000000000
--- a/examples/USER/cgdna/examples/oxDNA2/duplex2/log.18Jun19.duplex2.g++.4
+++ /dev/null
@@ -1,1173 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000162 secs
-  read_data CPU = 0.002971 secs
-
-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 oxdna2/fene
-bond_coeff * 2.0 0.25 0.7564
-
-# 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     seqav ${T} 1.3523 2.6717 6.0 0.4 0.9 0.32 0.6 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 0.6 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
-
-#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 = 2.6274
-  ghost atom cutoff = 2.6274
-  binsize = 1.3137, 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
-Per MPI rank memory allocation (min/avg/max) = 7.777 | 7.959 | 8.142 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 = 1.80871194953159 |  erot = 1.84151089264678 | epot = -21.8596865313185 | etot = -18.2094636891401
-421000  ekin = 1.25971024821532 |  erot = 1.84154088985399 | epot = -21.8144945739243 | etot = -18.713243435855
-422000  ekin = 1.38801644153196 |  erot = 2.76287955544763 | epot = -21.9448046693442 | etot = -17.7939086723646
-423000  ekin = 1.61378102360038 |  erot = 3.08643589903684 | epot = -21.9876910184367 | etot = -17.2874740957995
-424000  ekin = 2.38187559636676 |  erot = 2.03497345340564 | epot = -22.0529622043822 | etot = -17.6361131546098
-425000  ekin = 2.30172600419957 |  erot = 2.56124787306544 | epot = -22.0909144547264 | etot = -17.2279405774613
-426000  ekin = 2.08135734353848 |  erot = 3.11029155110106 | epot = -22.0318884881515 | etot = -16.8402395935119
-427000  ekin = 2.14905284759742 |  erot = 2.44063059706749 | epot = -21.9221859408584 | etot = -17.3325024961935
-428000  ekin = 1.77884336055357 |  erot = 1.65616500997461 | epot = -21.9003025672496 | etot = -18.4652941967214
-429000  ekin = 1.64634843235491 |  erot = 2.54977814749917 | epot = -21.8505053104909 | etot = -17.6543787306368
-430000  ekin = 2.66566369380165 |  erot = 2.85826638798746 | epot = -21.8749831872768 | etot = -16.3510531054877
-431000  ekin = 2.77262842672213 |  erot = 1.57008239418362 | epot = -21.8682859290024 | etot = -17.5255751080967
-432000  ekin = 2.55459213758159 |  erot = 1.62943387255927 | epot = -21.8357562133881 | etot = -17.6517302032472
-433000  ekin = 1.99645419170627 |  erot = 2.46386731011038 | epot = -21.9426115259012 | etot = -17.4822900240846
-434000  ekin = 3.03855037499723 |  erot = 2.70114732868002 | epot = -22.0521183162706 | etot = -16.3124206125934
-435000  ekin = 3.56249359412514 |  erot = 1.3916907800745 | epot = -22.1907087359577 | etot = -17.236524361758
-436000  ekin = 2.9919519436941 |  erot = 2.00780906096746 | epot = -22.1944569501235 | etot = -17.194695945462
-437000  ekin = 3.22983002449305 |  erot = 1.78457838368284 | epot = -22.2079862630257 | etot = -17.1935778548498
-438000  ekin = 2.89357954274282 |  erot = 1.84712438388029 | epot = -22.1640149633625 | etot = -17.4233110367394
-439000  ekin = 2.43548109922482 |  erot = 2.69725667220989 | epot = -22.15552566419 | etot = -17.0227878927552
-440000  ekin = 2.2623759777343 |  erot = 3.0053291392984 | epot = -22.1911581748161 | etot = -16.9234530577834
-441000  ekin = 2.91169601545459 |  erot = 2.87109172357543 | epot = -22.3349024428918 | etot = -16.5521147038618
-442000  ekin = 2.09099397022228 |  erot = 1.73520313922453 | epot = -22.4051258365299 | etot = -18.5789287270831
-443000  ekin = 1.89190436364779 |  erot = 2.00338805773041 | epot = -22.4571595679749 | etot = -18.5618671465967
-444000  ekin = 2.07260612589383 |  erot = 2.15261859961606 | epot = -22.4762155543905 | etot = -18.2509908288806
-445000  ekin = 2.10794043544074 |  erot = 2.27849500108989 | epot = -22.5289113655649 | etot = -18.1424759290343
-446000  ekin = 2.43249129570082 |  erot = 2.85798785841701 | epot = -22.5578450371516 | etot = -17.2673658830337
-447000  ekin = 2.18427449291498 |  erot = 2.99487058702881 | epot = -22.633209665243 | etot = -17.4540645852992
-448000  ekin = 2.33125251154888 |  erot = 2.9537271150568 | epot = -22.6544934614541 | etot = -17.3695138348484
-449000  ekin = 2.34830834177129 |  erot = 2.93433423081578 | epot = -22.6524261630772 | etot = -17.3697835904901
-450000  ekin = 1.83059864091627 |  erot = 1.69583085832556 | epot = -22.5959718193007 | etot = -19.0695423200588
-451000  ekin = 1.97008420530444 |  erot = 1.93005789483906 | epot = -22.6042016377466 | etot = -18.7040595376031
-452000  ekin = 1.36031716300771 |  erot = 1.88416646481667 | epot = -22.5654500281941 | etot = -19.3209664003698
-453000  ekin = 2.08394677326601 |  erot = 2.55637003071468 | epot = -22.3996731437447 | etot = -17.759356339764
-454000  ekin = 1.46122132979162 |  erot = 2.1932504558799 | epot = -22.2559783518549 | etot = -18.6015065661834
-455000  ekin = 1.66159562683808 |  erot = 2.72214658377912 | epot = -22.1100881227337 | etot = -17.7263459121165
-456000  ekin = 2.35139002285135 |  erot = 1.99736695780608 | epot = -22.0265180206658 | etot = -17.6777610400084
-457000  ekin = 2.02337666353787 |  erot = 2.36288174917835 | epot = -21.9870419865869 | etot = -17.6007835738707
-458000  ekin = 1.74388716034853 |  erot = 2.25704341258625 | epot = -22.0124765184275 | etot = -18.0115459454927
-459000  ekin = 2.51302694941202 |  erot = 2.31610812350976 | epot = -22.0905335599533 | etot = -17.2613984870315
-460000  ekin = 2.20235980851235 |  erot = 2.00073208070752 | epot = -22.0624281815267 | etot = -17.8593362923069
-461000  ekin = 2.27697813860512 |  erot = 2.92153186175593 | epot = -22.0043780203814 | etot = -16.8058680200203
-462000  ekin = 2.61751250591993 |  erot = 1.79446367088042 | epot = -22.034566251344 | etot = -17.6225900745436
-463000  ekin = 2.59076396942114 |  erot = 3.29959067151568 | epot = -21.9680597931617 | etot = -16.0777051522249
-464000  ekin = 2.18897688760924 |  erot = 2.37342380725927 | epot = -21.9014176363544 | etot = -17.3390169414859
-465000  ekin = 2.55336811292171 |  erot = 3.60208553232432 | epot = -21.8218243406516 | etot = -15.6663706954055
-466000  ekin = 1.98087073364117 |  erot = 2.88377492118972 | epot = -21.8240279062597 | etot = -16.9593822514288
-467000  ekin = 1.63963444033068 |  erot = 2.61720118783829 | epot = -21.9072568806945 | etot = -17.6504212525255
-468000  ekin = 1.11353612829142 |  erot = 3.36362638075105 | epot = -21.9675488944805 | etot = -17.490386385438
-469000  ekin = 1.72228182007047 |  erot = 2.77659856111655 | epot = -21.9967286251288 | etot = -17.4978482439417
-470000  ekin = 1.86957223270987 |  erot = 2.88200736733016 | epot = -22.0532435258199 | etot = -17.3016639257798
-471000  ekin = 2.73889257490363 |  erot = 2.33805868565127 | epot = -22.1018048913227 | etot = -17.0248536307678
-472000  ekin = 2.69336835751318 |  erot = 2.14497398823592 | epot = -22.1783319655624 | etot = -17.3399896198133
-473000  ekin = 2.2834012228809 |  erot = 2.08779065134065 | epot = -22.2062566289287 | etot = -17.8350647547071
-474000  ekin = 2.23753393343421 |  erot = 2.18021358366907 | epot = -22.2186470965394 | etot = -17.8008995794361
-475000  ekin = 2.52144972759887 |  erot = 2.10742888877791 | epot = -22.2200376200674 | etot = -17.5911590036907
-476000  ekin = 2.21750839437398 |  erot = 1.76993465858266 | epot = -22.1228407781581 | etot = -18.1353977252014
-477000  ekin = 2.49639604606981 |  erot = 2.38997154938614 | epot = -22.0914213950017 | etot = -17.2050537995458
-478000  ekin = 1.92476411077776 |  erot = 2.05068061613981 | epot = -22.1165013146126 | etot = -18.141056587695
-479000  ekin = 2.27814065534966 |  erot = 3.09902158675158 | epot = -22.1039609371193 | etot = -16.726798695018
-480000  ekin = 1.67684718675217 |  erot = 2.75298455656157 | epot = -22.107572084908 | etot = -17.6777403415942
-481000  ekin = 1.82004035403442 |  erot = 2.94243611851488 | epot = -22.0570042571709 | etot = -17.2945277846216
-482000  ekin = 2.15620792762657 |  erot = 2.07225318674483 | epot = -22.0195504604851 | etot = -17.7910893461137
-483000  ekin = 1.49597937205778 |  erot = 1.99748154603235 | epot = -21.9846691787552 | etot = -18.4912082606651
-484000  ekin = 1.84801031899852 |  erot = 2.3383930614213 | epot = -22.057622803598 | etot = -17.8712194231781
-485000  ekin = 1.63994449952444 |  erot = 2.49474020960602 | epot = -22.0873319631203 | etot = -17.9526472539898
-486000  ekin = 1.86878710017944 |  erot = 2.15121977781065 | epot = -22.0738722433192 | etot = -18.0538653653291
-487000  ekin = 2.36575535267025 |  erot = 3.10125401276719 | epot = -22.1449283981519 | etot = -16.6779190327145
-488000  ekin = 2.28442246943194 |  erot = 3.25683393002513 | epot = -22.0988506325681 | etot = -16.557594233111
-489000  ekin = 2.42271484675 |  erot = 2.54542145912102 | epot = -22.0089541135478 | etot = -17.0408178076768
-490000  ekin = 2.15700463004959 |  erot = 3.54046810332719 | epot = -21.9046622319151 | etot = -16.2071894985383
-491000  ekin = 2.21877065503535 |  erot = 2.48745097433189 | epot = -21.7908019627883 | etot = -17.084580333421
-492000  ekin = 2.42517437413502 |  erot = 2.76311171529555 | epot = -21.7601749752715 | etot = -16.5718888858409
-493000  ekin = 1.78704503482097 |  erot = 2.27560531894265 | epot = -21.8193757259442 | etot = -17.7567253721806
-494000  ekin = 2.08676036701357 |  erot = 2.99995787427429 | epot = -21.8611051542237 | etot = -16.7743869129358
-495000  ekin = 2.13526814465422 |  erot = 2.49327519100043 | epot = -21.9512664264056 | etot = -17.322723090751
-496000  ekin = 2.04396376951351 |  erot = 2.616205394925 | epot = -21.9926597066748 | etot = -17.3324905422363
-497000  ekin = 2.5138400992253 |  erot = 1.7082513952147 | epot = -21.9316573881385 | etot = -17.7095658936985
-498000  ekin = 2.15599563393455 |  erot = 1.7954584756616 | epot = -21.8684844569259 | etot = -17.9170303473298
-499000  ekin = 3.01748439271979 |  erot = 1.75754764004202 | epot = -21.8933218662966 | etot = -17.1182898335348
-500000  ekin = 2.75260982901106 |  erot = 2.51842805388796 | epot = -21.8943946135574 | etot = -16.6233567306584
-501000  ekin = 2.67931288903133 |  erot = 3.01160406637169 | epot = -21.7750232065095 | etot = -16.0841062511065
-502000  ekin = 1.89360306182664 |  erot = 3.89791941021244 | epot = -21.6573468922303 | etot = -15.8658244201912
-503000  ekin = 1.79321931974651 |  erot = 2.94204976962205 | epot = -21.4684952360274 | etot = -16.7332261466588
-504000  ekin = 1.67757593959819 |  erot = 3.03667519772553 | epot = -21.3740498051044 | etot = -16.6597986677806
-505000  ekin = 2.71879314198246 |  erot = 2.13553052885653 | epot = -21.3748517524097 | etot = -16.5205280815707
-506000  ekin = 2.26416011641767 |  erot = 2.0398390357387 | epot = -21.3744734731022 | etot = -17.0704743209458
-507000  ekin = 3.1361217829786 |  erot = 2.43598082432092 | epot = -21.4637546760327 | etot = -15.8916520687332
-508000  ekin = 2.50986106907072 |  erot = 2.54739392181407 | epot = -21.6231060681634 | etot = -16.5658510772786
-509000  ekin = 2.11468804004737 |  erot = 2.82565642150503 | epot = -21.7737120459513 | etot = -16.8333675843989
-510000  ekin = 2.15001055304937 |  erot = 1.42727017491937 | epot = -21.8417870574445 | etot = -18.2645063294758
-511000  ekin = 2.52545394756595 |  erot = 2.75161712587392 | epot = -21.9086876613652 | etot = -16.6316165879253
-512000  ekin = 2.30866784309731 |  erot = 2.74554976662385 | epot = -21.9096028664776 | etot = -16.8553852567564
-513000  ekin = 2.48902345599678 |  erot = 2.14823762928075 | epot = -21.8729373600799 | etot = -17.2356762748023
-514000  ekin = 2.80071109914887 |  erot = 2.54489890263222 | epot = -22.0260959105663 | etot = -16.6804859087852
-515000  ekin = 2.54951114466539 |  erot = 1.81830545608794 | epot = -22.1182236024141 | etot = -17.7504070016608
-516000  ekin = 2.82429114749713 |  erot = 2.22223190254033 | epot = -22.2027443448738 | etot = -17.1562212948364
-517000  ekin = 2.0440652856654 |  erot = 2.05268379810237 | epot = -22.2270328001489 | etot = -18.1302837163811
-518000  ekin = 2.19098614618396 |  erot = 2.7523349010516 | epot = -22.2209877154936 | etot = -17.2776666682581
-519000  ekin = 2.24036502705842 |  erot = 2.22532553600967 | epot = -22.3180679614818 | etot = -17.8523773984137
-520000  ekin = 1.89058003919379 |  erot = 2.20041260684313 | epot = -22.4024099853452 | etot = -18.3114173393082
-521000  ekin = 2.59235690452872 |  erot = 1.87867658572832 | epot = -22.562076955749 | etot = -18.0910434654919
-522000  ekin = 3.47612340255834 |  erot = 1.7709131526267 | epot = -22.6560013672146 | etot = -17.4089648120295
-523000  ekin = 2.8697331156896 |  erot = 2.45931135481363 | epot = -22.7015468187877 | etot = -17.3725023482845
-524000  ekin = 2.43256318748704 |  erot = 2.35726786724124 | epot = -22.6382055947878 | etot = -17.8483745400596
-525000  ekin = 1.5862220801759 |  erot = 2.67712917770356 | epot = -22.6016118927226 | etot = -18.3382606348432
-526000  ekin = 1.68941966580457 |  erot = 1.5638733848976 | epot = -22.5489288531345 | etot = -19.2956358024323
-527000  ekin = 2.25322718958956 |  erot = 1.91908592764601 | epot = -22.4417549635527 | etot = -18.2694418463171
-528000  ekin = 2.66412422381676 |  erot = 2.81704928468163 | epot = -22.4249217233809 | etot = -16.9437482148825
-529000  ekin = 2.68379060052796 |  erot = 3.01205280488721 | epot = -22.4295574265689 | etot = -16.7337140211537
-530000  ekin = 2.58073227215729 |  erot = 2.12870295195894 | epot = -22.2883086480464 | etot = -17.5788734239302
-531000  ekin = 2.96770457160389 |  erot = 2.35391742452841 | epot = -22.1856711738739 | etot = -16.8640491777416
-532000  ekin = 2.56038964370913 |  erot = 2.30878740571672 | epot = -22.1997799918585 | etot = -17.3306029424327
-533000  ekin = 2.47143825522096 |  erot = 2.96338918263318 | epot = -22.2065233272061 | etot = -16.7716958893519
-534000  ekin = 2.10112886915673 |  erot = 2.06170735341251 | epot = -22.2366529232829 | etot = -18.0738167007137
-535000  ekin = 3.76894732289841 |  erot = 2.64646203076619 | epot = -22.2276744548843 | etot = -15.8122651012197
-536000  ekin = 2.7696162230836 |  erot = 1.95805234771211 | epot = -22.1654529173378 | etot = -17.4377843465421
-537000  ekin = 2.84154244437419 |  erot = 2.62704512023094 | epot = -22.0849688339382 | etot = -16.6163812693331
-538000  ekin = 2.68442563578381 |  erot = 2.11441739965432 | epot = -22.0125688846837 | etot = -17.2137258492456
-539000  ekin = 2.71421145807769 |  erot = 2.40915133591281 | epot = -22.1313332530722 | etot = -17.0079704590817
-540000  ekin = 2.43518407250594 |  erot = 2.49363815768251 | epot = -22.2749632551308 | etot = -17.3461410249423
-541000  ekin = 3.40444579850308 |  erot = 2.79359613706622 | epot = -22.3466180642397 | etot = -16.1485761286704
-542000  ekin = 2.43275262454037 |  erot = 2.8926712949891 | epot = -22.3556133688796 | etot = -17.0301894493501
-543000  ekin = 2.33375802900842 |  erot = 2.87822266703542 | epot = -22.354503031092 | etot = -17.1425223350481
-544000  ekin = 2.20372430185484 |  erot = 1.45976141003991 | epot = -22.3227611685585 | etot = -18.6592754566638
-545000  ekin = 2.44172510086271 |  erot = 2.14426798374485 | epot = -22.3064237448696 | etot = -17.720430660262
-546000  ekin = 1.97339115566054 |  erot = 2.22847557914697 | epot = -22.2636677476263 | etot = -18.0618010128188
-547000  ekin = 2.54002001617723 |  erot = 1.88945501268906 | epot = -22.2158143598027 | etot = -17.7863393309365
-548000  ekin = 1.68526456618955 |  erot = 1.65049155866197 | epot = -22.1214578510425 | etot = -18.785701726191
-549000  ekin = 1.87014690614356 |  erot = 2.68376307045224 | epot = -22.3040985050477 | etot = -17.7501885284519
-550000  ekin = 1.81229877740871 |  erot = 1.59166644509217 | epot = -22.4560870327802 | etot = -19.0521218102793
-551000  ekin = 2.18773128797504 |  erot = 2.27087388044657 | epot = -22.5158361799812 | etot = -18.0572310115596
-552000  ekin = 2.05249497087455 |  erot = 2.50761265901319 | epot = -22.5719393540102 | etot = -18.0118317241225
-553000  ekin = 2.95454924363313 |  erot = 2.14558063826841 | epot = -22.6616695566088 | etot = -17.5615396747072
-554000  ekin = 2.82907288726943 |  erot = 1.93583607418193 | epot = -22.8114472173086 | etot = -18.0465382558572
-555000  ekin = 2.39144194814065 |  erot = 2.2690346714923 | epot = -22.8607776699892 | etot = -18.2003010503562
-556000  ekin = 2.29377130416531 |  erot = 2.58082229477443 | epot = -22.9123559572369 | etot = -18.0377623582971
-557000  ekin = 2.83942594504113 |  erot = 1.46630323732685 | epot = -22.9955247836668 | etot = -18.6897956012988
-558000  ekin = 2.74466783679159 |  erot = 2.01704787654692 | epot = -23.0269943374553 | etot = -18.2652786241168
-559000  ekin = 3.32013685758138 |  erot = 2.33070588278053 | epot = -23.0724440783111 | etot = -17.4216013379492
-560000  ekin = 3.06575014862304 |  erot = 2.3240772361437 | epot = -23.058452120381 | etot = -17.6686247356143
-561000  ekin = 2.86678914129224 |  erot = 2.08494050984238 | epot = -22.9757329649367 | etot = -18.0240033138021
-562000  ekin = 3.27279507804287 |  erot = 2.51484206553918 | epot = -22.8763400547029 | etot = -17.0887029111208
-563000  ekin = 2.66038070150058 |  erot = 1.64116530766161 | epot = -22.8496252506975 | etot = -18.5480792415353
-564000  ekin = 2.80463843262516 |  erot = 2.5266606313835 | epot = -22.8040898690867 | etot = -17.4727908050781
-565000  ekin = 2.64623234011006 |  erot = 2.04560086917498 | epot = -22.7528472206811 | etot = -18.061014011396
-566000  ekin = 2.31861442156789 |  erot = 2.17941765713979 | epot = -22.7559143900141 | etot = -18.2578823113064
-567000  ekin = 1.93226018038665 |  erot = 2.82020539323088 | epot = -22.7113049006743 | etot = -17.9588393270567
-568000  ekin = 2.20139908423163 |  erot = 2.2173471641442 | epot = -22.7309883250972 | etot = -18.3122420767214
-569000  ekin = 2.47190977966691 |  erot = 2.65968832242268 | epot = -22.6724326928842 | etot = -17.5408345907946
-570000  ekin = 2.43697670060318 |  erot = 1.88669477532771 | epot = -22.6652860601546 | etot = -18.3416145842237
-571000  ekin = 2.89014026085716 |  erot = 2.95617526869999 | epot = -22.6585089246084 | etot = -16.8121933950513
-572000  ekin = 1.93596118948626 |  erot = 3.77290573984751 | epot = -22.617986049283 | etot = -16.9091191199493
-573000  ekin = 2.4045463471171 |  erot = 2.31316721466246 | epot = -22.5941857447927 | etot = -17.8764721830131
-574000  ekin = 1.69171540489496 |  erot = 2.32939319863948 | epot = -22.6485181547002 | etot = -18.6274095511658
-575000  ekin = 1.84147438222145 |  erot = 1.86451086977537 | epot = -22.7257563443532 | etot = -19.0197710923563
-576000  ekin = 3.22125710715105 |  erot = 2.95826776175095 | epot = -22.6735851458116 | etot = -16.4940602769096
-577000  ekin = 2.86653117003728 |  erot = 2.88010628292138 | epot = -22.6061554079341 | etot = -16.8595179549754
-578000  ekin = 2.38032268318987 |  erot = 2.76710196021751 | epot = -22.4015577816723 | etot = -17.2541331382649
-579000  ekin = 2.40088404436444 |  erot = 1.99411758494037 | epot = -22.2441807849414 | etot = -17.8491791556366
-580000  ekin = 2.62022193893445 |  erot = 1.97772953708398 | epot = -22.0981459564787 | etot = -17.5001944804602
-581000  ekin = 2.04609920382364 |  erot = 3.0202197191752 | epot = -21.9713515823037 | etot = -16.9050326593048
-582000  ekin = 2.17556767215606 |  erot = 3.10885810822424 | epot = -21.8451828402321 | etot = -16.5607570598518
-583000  ekin = 2.12792577884129 |  erot = 2.7142175246668 | epot = -21.8090540347999 | etot = -16.9669107312918
-584000  ekin = 2.99197492146328 |  erot = 2.6185428756741 | epot = -21.8014711662179 | etot = -16.1909533690805
-585000  ekin = 2.41600413666429 |  erot = 2.49968403996098 | epot = -21.7582079751419 | etot = -16.8425197985166
-586000  ekin = 3.57880609498067 |  erot = 1.99026777936244 | epot = -21.7793800190221 | etot = -16.210306144679
-587000  ekin = 3.53569318795882 |  erot = 1.96660845702856 | epot = -21.7574182658133 | etot = -16.255116620826
-588000  ekin = 2.80385841316338 |  erot = 1.58927534150911 | epot = -21.7290695763864 | etot = -17.3359358217139
-589000  ekin = 2.31178332958482 |  erot = 2.19605556561577 | epot = -21.7771889269559 | etot = -17.2693500317553
-590000  ekin = 2.57159955455667 |  erot = 1.71441305781987 | epot = -21.7801644206484 | etot = -17.4941518082718
-591000  ekin = 1.90027597697965 |  erot = 3.80794292513097 | epot = -21.8693595444135 | etot = -16.1611406423028
-592000  ekin = 2.10287592275467 |  erot = 2.85572724854609 | epot = -21.913245820329 | etot = -16.9546426490283
-593000  ekin = 1.6630679389305 |  erot = 2.45937970675131 | epot = -21.9499391362603 | etot = -17.8274914905785
-594000  ekin = 1.85147249869391 |  erot = 2.37596539021724 | epot = -22.0748010854883 | etot = -17.8473631965771
-595000  ekin = 1.62801913987931 |  erot = 2.13760745860405 | epot = -22.2650343535207 | etot = -18.4994077550374
-596000  ekin = 1.8507787756783 |  erot = 1.55277904845736 | epot = -22.3618759263936 | etot = -18.9583181022579
-597000  ekin = 2.21873580046471 |  erot = 2.31247364510899 | epot = -22.4218283315557 | etot = -17.890618885982
-598000  ekin = 1.87152940931079 |  erot = 3.02770945247868 | epot = -22.4928956008977 | etot = -17.5936567391082
-599000  ekin = 2.84160333456022 |  erot = 2.19202304201413 | epot = -22.5210806388342 | etot = -17.4874542622599
-600000  ekin = 2.63824255094171 |  erot = 2.13280883838531 | epot = -22.4361553764614 | etot = -17.6651039871344
-601000  ekin = 2.95991744971104 |  erot = 3.20891387142304 | epot = -22.3089419175364 | etot = -16.1401105964023
-602000  ekin = 2.94287171911394 |  erot = 2.6801544694314 | epot = -22.2205146380182 | etot = -16.5974884494729
-603000  ekin = 2.59651768027528 |  erot = 2.70994674634417 | epot = -22.1626040385702 | etot = -16.8561396119508
-604000  ekin = 1.79237423166219 |  erot = 2.11638057359598 | epot = -22.1934477586593 | etot = -18.2846929534011
-605000  ekin = 1.83068473031177 |  erot = 2.2795743818689 | epot = -22.2254684973409 | etot = -18.1152093851602
-606000  ekin = 2.3318585405123 |  erot = 2.19626289047853 | epot = -22.1692552740621 | etot = -17.6411338430713
-607000  ekin = 2.71184010988538 |  erot = 2.97108975720824 | epot = -22.1536579122904 | etot = -16.4707280451968
-608000  ekin = 2.42009843612052 |  erot = 2.41609650030392 | epot = -22.110570505977 | etot = -17.2743755695526
-609000  ekin = 1.88829617874732 |  erot = 2.63290748875975 | epot = -21.9999822454274 | etot = -17.4787785779203
-610000  ekin = 3.00361337450473 |  erot = 2.17709909276457 | epot = -21.9226199750059 | etot = -16.7419075077366
-611000  ekin = 2.45804405292799 |  erot = 2.74756316868512 | epot = -21.9190479764513 | etot = -16.7134407548382
-612000  ekin = 2.52217588638913 |  erot = 2.13391253924555 | epot = -21.9544188877756 | etot = -17.2983304621409
-613000  ekin = 3.03676008822021 |  erot = 2.11841016157454 | epot = -22.0017416346015 | etot = -16.8465713848068
-614000  ekin = 2.28555718180926 |  erot = 3.0054092802111 | epot = -22.0761965028491 | etot = -16.7852300408287
-615000  ekin = 1.68510287809685 |  erot = 2.62386193001633 | epot = -22.0327006368424 | etot = -17.7237358287293
-616000  ekin = 1.93880828018173 |  erot = 2.84237691352502 | epot = -22.0612297066235 | etot = -17.2800445129167
-617000  ekin = 2.16704933019324 |  erot = 2.51662857724103 | epot = -22.0595683849495 | etot = -17.3758904775152
-618000  ekin = 3.09933970351517 |  erot = 2.74545743402536 | epot = -22.0170483082271 | etot = -16.1722511706866
-619000  ekin = 3.43176670397203 |  erot = 2.12195823326365 | epot = -21.9875785418916 | etot = -16.4338536046559
-620000  ekin = 4.28780554984769 |  erot = 2.22709196760532 | epot = -21.9605251543896 | etot = -15.4456276369365
-621000  ekin = 3.08171244822519 |  erot = 2.57159564010567 | epot = -21.9025163812385 | etot = -16.2492082929076
-622000  ekin = 2.7316886075754 |  erot = 2.62820058118157 | epot = -21.8412338594045 | etot = -16.4813446706475
-623000  ekin = 2.85452079274903 |  erot = 2.89943500147414 | epot = -21.6852443941174 | etot = -15.9312885998942
-624000  ekin = 2.03273271064347 |  erot = 3.41737453659275 | epot = -21.5180611078538 | etot = -16.0679538606176
-625000  ekin = 2.93860287466086 |  erot = 2.6777302302364 | epot = -21.3855450802948 | etot = -15.7692119753975
-626000  ekin = 2.62772208534213 |  erot = 2.18165419852424 | epot = -21.3747765229082 | etot = -16.5654002390418
-627000  ekin = 2.31977818310487 |  erot = 2.39484209061113 | epot = -21.4372090577008 | etot = -16.7225887839848
-628000  ekin = 2.22183190227213 |  erot = 2.76412054255638 | epot = -21.5969078027883 | etot = -16.6109553579598
-629000  ekin = 2.21761787409423 |  erot = 1.98066149405245 | epot = -21.7578561859453 | etot = -17.5595768177986
-630000  ekin = 2.47350494176362 |  erot = 2.13931642231374 | epot = -21.7773766650218 | etot = -17.1645553009445
-631000  ekin = 2.05047278007876 |  erot = 1.79296462014617 | epot = -21.7869475538217 | etot = -17.9435101535968
-632000  ekin = 1.64845667747476 |  erot = 3.28396465847893 | epot = -21.8333012025329 | etot = -16.9008798665792
-633000  ekin = 2.3500132343185 |  erot = 2.3390975332878 | epot = -21.9539301797825 | etot = -17.2648194121762
-634000  ekin = 2.35704893279043 |  erot = 2.46483254513169 | epot = -22.0204072629832 | etot = -17.1985257850611
-635000  ekin = 1.98907577162676 |  erot = 3.37071781675284 | epot = -22.0690924871448 | etot = -16.7092988987652
-636000  ekin = 2.50984196335062 |  erot = 2.48688994533939 | epot = -22.0714906026256 | etot = -17.0747586939356
-637000  ekin = 2.77501317112847 |  erot = 2.80709332215511 | epot = -21.9923972278242 | etot = -16.4102907345407
-638000  ekin = 2.43799129572064 |  erot = 2.7900719850463 | epot = -22.0591413868446 | etot = -16.8310781060777
-639000  ekin = 1.88073995546173 |  erot = 2.09679843998312 | epot = -22.0499554202513 | etot = -18.0724170248065
-640000  ekin = 2.08188045172846 |  erot = 3.35894090591918 | epot = -21.9976614802368 | etot = -16.5568401225891
-641000  ekin = 2.09182367506332 |  erot = 2.24091541077085 | epot = -22.0969663672431 | etot = -17.7642272814089
-642000  ekin = 2.29630816296813 |  erot = 2.69496533496291 | epot = -22.1529742829376 | etot = -17.1617007850065
-643000  ekin = 2.73580847855276 |  erot = 2.20074971448877 | epot = -22.0965451673466 | etot = -17.1599869743051
-644000  ekin = 2.877547382531 |  erot = 3.41752705378106 | epot = -22.1314614085221 | etot = -15.8363869722101
-645000  ekin = 2.42917363330758 |  erot = 2.10617126422418 | epot = -22.0684179655268 | etot = -17.533073067995
-646000  ekin = 2.69471397724187 |  erot = 1.80009045225372 | epot = -21.8990804127739 | etot = -17.4042759832783
-647000  ekin = 2.47700110999565 |  erot = 1.99221351689819 | epot = -21.6986646197608 | etot = -17.229449992867
-648000  ekin = 2.27330015032657 |  erot = 1.67398094476719 | epot = -21.7984825454864 | etot = -17.8512014503927
-649000  ekin = 2.5628574039565 |  erot = 1.74923984575743 | epot = -22.1937498986979 | etot = -17.881652648984
-650000  ekin = 2.76035969172866 |  erot = 2.20984080080438 | epot = -22.3536470081185 | etot = -17.3834465155854
-651000  ekin = 2.262551545237 |  erot = 3.27496991661067 | epot = -22.4274148303114 | etot = -16.8898933684638
-652000  ekin = 2.3727982819665 |  erot = 2.29630046443082 | epot = -22.4456643066011 | etot = -17.7765655602038
-653000  ekin = 2.07651844100825 |  erot = 2.14699861111497 | epot = -22.4487464586908 | etot = -18.2252294065676
-654000  ekin = 2.31499263290336 |  erot = 1.84798657187726 | epot = -22.471548114837 | etot = -18.3085689100564
-655000  ekin = 2.12344600536595 |  erot = 1.79742316518918 | epot = -22.4407504825061 | etot = -18.519881311951
-656000  ekin = 2.44238672537433 |  erot = 2.33314467296101 | epot = -22.4050518721077 | etot = -17.6295204737724
-657000  ekin = 2.44684720738067 |  erot = 2.87010904355218 | epot = -22.3954429054341 | etot = -17.0784866545012
-658000  ekin = 2.49369435044193 |  erot = 2.86933833355583 | epot = -22.3577847118898 | etot = -16.9947520278921
-659000  ekin = 3.38707666874149 |  erot = 2.79117377884123 | epot = -22.2233688708269 | etot = -16.0451184232442
-660000  ekin = 2.69464750718905 |  erot = 1.98877163007961 | epot = -22.0868371976707 | etot = -17.403418060402
-661000  ekin = 2.2148438610813 |  erot = 2.52686187560576 | epot = -21.9324475602905 | etot = -17.1907418236035
-662000  ekin = 2.04483468145689 |  erot = 2.52786214958084 | epot = -21.8656118118386 | etot = -17.2929149808009
-663000  ekin = 2.25554994547888 |  erot = 2.29981193022507 | epot = -21.812115133329 | etot = -17.256753257625
-664000  ekin = 2.38378154392877 |  erot = 1.87242521142835 | epot = -21.7163692740767 | etot = -17.4601625187195
-665000  ekin = 2.64936843119576 |  erot = 2.2989986114753 | epot = -21.6597356727187 | etot = -16.7113686300476
-666000  ekin = 1.64494457505824 |  erot = 2.30638161556456 | epot = -21.5641898301393 | etot = -17.6128636395165
-667000  ekin = 1.65735220589392 |  erot = 2.82614341732318 | epot = -21.4751653585362 | etot = -16.9916697353191
-668000  ekin = 2.49844825113869 |  erot = 3.27950898400314 | epot = -21.3387145475146 | etot = -15.5607573123727
-669000  ekin = 1.61611201967415 |  erot = 2.67203522811057 | epot = -21.2655442255718 | etot = -16.9773969777871
-670000  ekin = 2.23077474650818 |  erot = 2.61363425835144 | epot = -21.2008892493679 | etot = -16.3564802445083
-671000  ekin = 2.26765830930916 |  erot = 2.16388121545907 | epot = -21.1515274648835 | etot = -16.7199879401153
-672000  ekin = 1.94916146819698 |  erot = 1.65479713709716 | epot = -21.0650678898704 | etot = -17.4611092845762
-673000  ekin = 1.92556066199439 |  erot = 2.07900172108796 | epot = -21.0394363569888 | etot = -17.0348739739065
-674000  ekin = 2.12432357869025 |  erot = 2.16781085660272 | epot = -21.0725830613714 | etot = -16.7804486260784
-675000  ekin = 2.06851819258986 |  erot = 2.48317287761026 | epot = -21.1036073609477 | etot = -16.5519162907476
-676000  ekin = 2.45484997181755 |  erot = 2.79183078710855 | epot = -21.1301283632782 | etot = -15.8834476043521
-677000  ekin = 2.20334154136532 |  erot = 2.62444584525113 | epot = -21.1495626618894 | etot = -16.321775275273
-678000  ekin = 2.1472401432145 |  erot = 2.79545747432262 | epot = -21.0405241444794 | etot = -16.0978265269423
-679000  ekin = 2.17033413623502 |  erot = 2.18513653140294 | epot = -20.9421185444833 | etot = -16.5866478768454
-680000  ekin = 2.0995303513191 |  erot = 2.68744418062154 | epot = -20.96987060062 | etot = -16.1828960686793
-681000  ekin = 2.18304447310098 |  erot = 1.84812119436561 | epot = -21.0743862151371 | etot = -17.0432205476705
-682000  ekin = 3.04278123794939 |  erot = 2.40409586716963 | epot = -21.0797568548333 | etot = -15.6328797497143
-683000  ekin = 2.86269023881706 |  erot = 2.09728443896194 | epot = -21.0991655055583 | etot = -16.1391908277793
-684000  ekin = 1.98767037715953 |  erot = 2.99591968828981 | epot = -21.1362036730577 | etot = -16.1526136076083
-685000  ekin = 1.57295457528713 |  erot = 2.03034771002018 | epot = -21.146987158564 | etot = -17.5436848732567
-686000  ekin = 2.37743960028747 |  erot = 2.54064910359146 | epot = -21.1479154694211 | etot = -16.2298267655421
-687000  ekin = 1.90905424981708 |  erot = 2.87649471802563 | epot = -21.1390488337729 | etot = -16.3534998659302
-688000  ekin = 2.6274055742777 |  erot = 2.25087525520177 | epot = -21.1259808926564 | etot = -16.2477000631769
-689000  ekin = 2.6802663035185 |  erot = 2.65264291183039 | epot = -21.2405393346747 | etot = -15.9076301193258
-690000  ekin = 2.56393304559926 |  erot = 2.48495065222978 | epot = -21.4016015121778 | etot = -16.3527178143488
-691000  ekin = 2.1927043501829 |  erot = 2.52704457861404 | epot = -21.506826556612 | etot = -16.787077627815
-692000  ekin = 2.34077396593209 |  erot = 3.24867065054243 | epot = -21.5176021816804 | etot = -15.9281575652059
-693000  ekin = 2.29029075483228 |  erot = 3.0057489559252 | epot = -21.5358866889499 | etot = -16.2398469781924
-694000  ekin = 2.65674046511192 |  erot = 2.58629868712489 | epot = -21.7490636357026 | etot = -16.5060244834658
-695000  ekin = 2.43126197328691 |  erot = 1.19706323700546 | epot = -21.9401398969726 | etot = -18.3118146866802
-696000  ekin = 1.81474808623754 |  erot = 1.46920096781106 | epot = -21.9089223337524 | etot = -18.6249732797038
-697000  ekin = 2.39476771383886 |  erot = 2.11183502257124 | epot = -21.9420332766104 | etot = -17.4354305402003
-698000  ekin = 2.35926337724266 |  erot = 1.92783320549514 | epot = -22.0277191263435 | etot = -17.7406225436058
-699000  ekin = 2.48176872675362 |  erot = 2.56000644090342 | epot = -22.0212596021869 | etot = -16.9794844345298
-700000  ekin = 2.14129959772679 |  erot = 2.29861037684922 | epot = -21.9318234409146 | etot = -17.4919134663386
-701000  ekin = 2.17049668499625 |  erot = 2.20225192400486 | epot = -21.8245513288874 | etot = -17.4518027198863
-702000  ekin = 1.5627527155292 |  erot = 2.01171151000641 | epot = -21.7865003044461 | etot = -18.2120360789105
-703000  ekin = 2.06065227779357 |  erot = 2.17329473717683 | epot = -21.8026608939335 | etot = -17.5687138789631
-704000  ekin = 2.81952809577903 |  erot = 1.94266087393333 | epot = -21.8212186788769 | etot = -17.0590297091645
-705000  ekin = 2.82050127519937 |  erot = 2.18154028834385 | epot = -21.7752102636878 | etot = -16.7731687001446
-706000  ekin = 1.98267828238497 |  erot = 2.32706466032389 | epot = -21.7893242385512 | etot = -17.4795812958423
-707000  ekin = 1.9119199256382 |  erot = 2.05897787647106 | epot = -21.8430722730707 | etot = -17.8721744709615
-708000  ekin = 2.5016490217549 |  erot = 2.18383615173375 | epot = -21.8544847432183 | etot = -17.1689995697297
-709000  ekin = 2.87304116461984 |  erot = 2.56843564623617 | epot = -21.904442472254 | etot = -16.462965661398
-710000  ekin = 2.19867234802447 |  erot = 2.26714812026436 | epot = -21.8819798989583 | etot = -17.4161594306695
-711000  ekin = 2.3389229861775 |  erot = 1.44633862250317 | epot = -21.9197827259336 | etot = -18.1345211172529
-712000  ekin = 2.57005480809076 |  erot = 2.28706559960511 | epot = -22.0346026838636 | etot = -17.1774822761678
-713000  ekin = 1.98393390580317 |  erot = 2.33525788511068 | epot = -22.1280127822608 | etot = -17.8088209913469
-714000  ekin = 2.59844561627729 |  erot = 2.10769412707773 | epot = -22.1916311346269 | etot = -17.4854913912719
-715000  ekin = 2.41851974197058 |  erot = 3.7488852557719 | epot = -22.1607861798611 | etot = -15.9933811821187
-716000  ekin = 2.8418023132582 |  erot = 2.85971600497616 | epot = -22.0686589684412 | etot = -16.3671406502068
-717000  ekin = 3.4484144493586 |  erot = 3.22605040091157 | epot = -21.9727882885698 | etot = -15.2983234382996
-718000  ekin = 3.10436184228427 |  erot = 3.94950630255782 | epot = -21.8709253031511 | etot = -14.817057158309
-719000  ekin = 2.37806574336789 |  erot = 2.95502686702168 | epot = -21.8563367317646 | etot = -16.523244121375
-720000  ekin = 2.2124258408194 |  erot = 3.13473166149202 | epot = -21.832964450767 | etot = -16.4858069484555
-721000  ekin = 1.6946894391771 |  erot = 2.23193742756367 | epot = -21.7424084526643 | etot = -17.8157815859235
-722000  ekin = 1.90287140868432 |  erot = 2.80483524098531 | epot = -21.7497487144859 | etot = -17.0420420648163
-723000  ekin = 2.36731223380046 |  erot = 2.56327951769445 | epot = -21.6831418267135 | etot = -16.7525500752186
-724000  ekin = 1.73555921199202 |  erot = 2.45238016332295 | epot = -21.6581802464112 | etot = -17.4702408710962
-725000  ekin = 2.29059437023039 |  erot = 2.94575894857246 | epot = -21.7174261464808 | etot = -16.481072827678
-726000  ekin = 1.63483147798521 |  erot = 2.30383185500799 | epot = -21.7564933587679 | etot = -17.8178300257747
-727000  ekin = 2.48240653489464 |  erot = 3.20354227059193 | epot = -21.7912108634863 | etot = -16.1052620579997
-728000  ekin = 2.22769215153326 |  erot = 2.1648907299462 | epot = -21.7890771091799 | etot = -17.3964942277004
-729000  ekin = 1.89768095869013 |  erot = 1.65721672588089 | epot = -21.828690265207 | etot = -18.273792580636
-730000  ekin = 1.81050835100381 |  erot = 2.15777747975243 | epot = -21.8264469741817 | etot = -17.8581611434255
-731000  ekin = 2.19898236908282 |  erot = 2.98408098832205 | epot = -21.78613179764 | etot = -16.6030684402352
-732000  ekin = 2.43355047343304 |  erot = 2.27170844305628 | epot = -21.6883863408736 | etot = -16.9831274243842
-733000  ekin = 3.07212273972684 |  erot = 2.56783751855608 | epot = -21.7364921079322 | etot = -16.0965318496493
-734000  ekin = 2.38307322516835 |  erot = 2.02726646964742 | epot = -21.7939757502944 | etot = -17.3836360554786
-735000  ekin = 2.14195880954704 |  erot = 1.55624807241878 | epot = -21.8426856981853 | etot = -18.1444788162195
-736000  ekin = 2.14667447582536 |  erot = 3.43698049451811 | epot = -21.9502105525335 | etot = -16.36655558219
-737000  ekin = 1.74866123585724 |  erot = 3.5826697540454 | epot = -21.968815658378 | etot = -16.6374846684753
-738000  ekin = 2.03996249374858 |  erot = 2.50844136963082 | epot = -22.0013918784186 | etot = -17.4529880150392
-739000  ekin = 1.85238190118677 |  erot = 2.20010970404146 | epot = -22.0186271684577 | etot = -17.9661355632295
-740000  ekin = 2.8386294530065 |  erot = 2.79090377324796 | epot = -22.0338814904879 | etot = -16.4043482642334
-741000  ekin = 2.46678702773208 |  erot = 2.91050038280044 | epot = -22.0853235069127 | etot = -16.7080360963801
-742000  ekin = 2.7152902937519 |  erot = 3.273956530725 | epot = -22.2140748190892 | etot = -16.2248279946123
-743000  ekin = 2.22536600879677 |  erot = 3.2117924712642 | epot = -22.3431375024118 | etot = -16.9059790223509
-744000  ekin = 2.01371736615449 |  erot = 3.7760139384218 | epot = -22.4261509869247 | etot = -16.6364196823485
-745000  ekin = 3.15730296333415 |  erot = 2.31558796250712 | epot = -22.4108926873302 | etot = -16.9380017614889
-746000  ekin = 2.9774013013854 |  erot = 2.63107362961469 | epot = -22.3694265664286 | etot = -16.7609516354285
-747000  ekin = 2.34209064832563 |  erot = 2.04683419375202 | epot = -22.3628627944521 | etot = -17.9739379523744
-748000  ekin = 2.37156256463875 |  erot = 2.40538773919509 | epot = -22.3979208424336 | etot = -17.6209705385998
-749000  ekin = 2.06136855553991 |  erot = 2.76585915349199 | epot = -22.3831536512816 | etot = -17.5559259422497
-750000  ekin = 1.64656775002689 |  erot = 2.38368935068671 | epot = -22.444703911786 | etot = -18.4144468110724
-751000  ekin = 1.78122844885826 |  erot = 2.81833836133587 | epot = -22.533438976529 | etot = -17.9338721663349
-752000  ekin = 1.34730592473948 |  erot = 1.45838401317446 | epot = -22.6090848823224 | etot = -19.8033949444084
-753000  ekin = 1.87571626319838 |  erot = 2.4535466519722 | epot = -22.5588053116254 | etot = -18.2295423964548
-754000  ekin = 1.7497031355263 |  erot = 2.74314075044427 | epot = -22.4698920344377 | etot = -17.9770481484671
-755000  ekin = 2.42081076696332 |  erot = 2.41217357398055 | epot = -22.3964223120253 | etot = -17.5634379710815
-756000  ekin = 1.85475003398 |  erot = 2.78259891044772 | epot = -22.3205962727121 | etot = -17.6832473282843
-757000  ekin = 1.97578050121357 |  erot = 2.51781218539581 | epot = -22.1263927786386 | etot = -17.6328000920292
-758000  ekin = 1.22826853890876 |  erot = 2.60763168332874 | epot = -21.9863700054334 | etot = -18.1504697831958
-759000  ekin = 2.21637457917735 |  erot = 1.43949125248239 | epot = -22.1514665432947 | etot = -18.495600711635
-760000  ekin = 2.68033406797323 |  erot = 2.41719679588396 | epot = -22.2590376675296 | etot = -17.1615068036724
-761000  ekin = 2.1753744063555 |  erot = 2.27171718649737 | epot = -22.3344047362676 | etot = -17.8873131434147
-762000  ekin = 2.18577068124737 |  erot = 1.66829735822053 | epot = -22.3621686129861 | etot = -18.5081005735182
-763000  ekin = 2.45478818575913 |  erot = 3.35299551820638 | epot = -22.4281249366375 | etot = -16.620341232672
-764000  ekin = 2.82872579097199 |  erot = 2.78775814269904 | epot = -22.4216595904294 | etot = -16.8051756567583
-765000  ekin = 1.82575545759014 |  erot = 2.7623896973924 | epot = -22.3222506299713 | etot = -17.7341054749887
-766000  ekin = 2.64667028577447 |  erot = 2.30816231818549 | epot = -22.1784504992491 | etot = -17.2236178952891
-767000  ekin = 2.5751886312018 |  erot = 2.85636091304187 | epot = -22.0829371218307 | etot = -16.651387577587
-768000  ekin = 1.86419535586237 |  erot = 2.77038508826208 | epot = -22.1032134089885 | etot = -17.4686329648641
-769000  ekin = 2.39682103653439 |  erot = 2.30725355924694 | epot = -22.1808553751715 | etot = -17.4767807793902
-770000  ekin = 2.47007838986712 |  erot = 3.23244425991329 | epot = -22.2845706013469 | etot = -16.5820479515665
-771000  ekin = 2.32978280625416 |  erot = 2.29082247939232 | epot = -22.3223780040389 | etot = -17.7017727183924
-772000  ekin = 2.26109456847871 |  erot = 3.00930315380545 | epot = -22.420252339108 | etot = -17.1498546168239
-773000  ekin = 2.23291379974972 |  erot = 1.81993150945886 | epot = -22.4876821856977 | etot = -18.4348368764892
-774000  ekin = 2.82112723374611 |  erot = 2.20399964233337 | epot = -22.478004597296 | etot = -17.4528777212165
-775000  ekin = 1.80765894464447 |  erot = 1.85918506821001 | epot = -22.4072882679054 | etot = -18.7404442550509
-776000  ekin = 1.40021367363829 |  erot = 3.15411215412014 | epot = -22.3650958887673 | etot = -17.8107700610088
-777000  ekin = 1.64184304615234 |  erot = 2.80565056199556 | epot = -22.2758630382018 | etot = -17.8283694300539
-778000  ekin = 1.48552010960747 |  erot = 2.23385655322065 | epot = -22.280627961357 | etot = -18.5612512985288
-779000  ekin = 1.8612416844269 |  erot = 1.89467011122749 | epot = -22.3098169150752 | etot = -18.5539051194208
-780000  ekin = 1.69992943470698 |  erot = 2.31253245347 | epot = -22.3678364729486 | etot = -18.3553745847716
-781000  ekin = 2.09952906112345 |  erot = 2.56012058482576 | epot = -22.4462778123775 | etot = -17.7866281664283
-782000  ekin = 2.5656681981454 |  erot = 1.9584872929859 | epot = -22.3478635193415 | etot = -17.8237080282102
-783000  ekin = 2.16529384416182 |  erot = 2.88344914114146 | epot = -22.2446053910143 | etot = -17.1958624057111
-784000  ekin = 2.82003342353258 |  erot = 2.22795791523759 | epot = -22.2211041777196 | etot = -17.1731128389495
-785000  ekin = 3.1175846654813 |  erot = 2.90935771938994 | epot = -22.2344563156641 | etot = -16.2075139307928
-786000  ekin = 2.80016717549673 |  erot = 3.42867564957491 | epot = -22.2496451559719 | etot = -16.0208023309003
-787000  ekin = 2.38498105317564 |  erot = 3.01080705704523 | epot = -22.1644901078413 | etot = -16.7687019976204
-788000  ekin = 1.98689482841944 |  erot = 2.00265266168408 | epot = -22.1102205855985 | etot = -18.120673095495
-789000  ekin = 2.4429381578802 |  erot = 2.28303571912852 | epot = -22.0438356575627 | etot = -17.317861780554
-790000  ekin = 3.54942607073523 |  erot = 2.80791853998027 | epot = -21.9672470303852 | etot = -15.6099024196697
-791000  ekin = 3.07978044254695 |  erot = 2.4184479370232 | epot = -21.9558944305006 | etot = -16.4576660509305
-792000  ekin = 3.91878473045569 |  erot = 1.9731825502165 | epot = -21.8851857762129 | etot = -15.9932184955407
-793000  ekin = 2.24379464034279 |  erot = 2.58359475602037 | epot = -21.774610681239 | etot = -16.9472212848759
-794000  ekin = 2.14799943871595 |  erot = 2.45378042225321 | epot = -21.6055963838422 | etot = -17.0038165228731
-795000  ekin = 1.62858645550717 |  erot = 2.41208539626204 | epot = -21.4428264365968 | etot = -17.4021545848276
-796000  ekin = 2.20626767900772 |  erot = 2.13905661758329 | epot = -21.3317362060421 | etot = -16.9864119094511
-797000  ekin = 1.82996184067328 |  erot = 1.99906119944911 | epot = -21.3393574083459 | etot = -17.5103343682236
-798000  ekin = 2.25667499558209 |  erot = 2.51245793531 | epot = -21.3768565865699 | etot = -16.6077236556778
-799000  ekin = 1.90911035219009 |  erot = 2.87369878279891 | epot = -21.3617435253194 | etot = -16.5789343903304
-800000  ekin = 2.1677625897713 |  erot = 2.34740172956008 | epot = -21.2761013083254 | etot = -16.7609369889941
-801000  ekin = 1.87638787205728 |  erot = 1.64434088909028 | epot = -21.119685062831 | etot = -17.5989563016834
-802000  ekin = 2.22686790237101 |  erot = 2.21112245128271 | epot = -21.0065136937552 | etot = -16.5685233401014
-803000  ekin = 2.68797844582697 |  erot = 1.9055042783616 | epot = -20.977533512373 | etot = -16.3840507881845
-804000  ekin = 2.34860603481643 |  erot = 2.89571698053518 | epot = -20.9203141084123 | etot = -15.6759910930607
-805000  ekin = 1.76197291834029 |  erot = 2.71253740465393 | epot = -20.7889998983483 | etot = -16.3144895753541
-806000  ekin = 1.7473508020381 |  erot = 2.06758975379032 | epot = -20.7361939926422 | etot = -16.9212534368137
-807000  ekin = 1.56935370454674 |  erot = 1.70438269927346 | epot = -20.7922156879383 | etot = -17.5184792841181
-808000  ekin = 2.10918656723178 |  erot = 2.39856508826456 | epot = -20.8730295437323 | etot = -16.3652778882359
-809000  ekin = 2.64218178293791 |  erot = 1.51718119689586 | epot = -20.8620425969582 | etot = -16.7026796171244
-810000  ekin = 3.0961523233869 |  erot = 2.66382304688042 | epot = -20.7945446198551 | etot = -15.0345692495878
-811000  ekin = 3.04477285154901 |  erot = 3.63336291459452 | epot = -20.8540215443024 | etot = -14.1758857781589
-812000  ekin = 2.15160716251188 |  erot = 2.79673763715996 | epot = -20.9409883926875 | etot = -15.9926435930157
-813000  ekin = 2.1868093512261 |  erot = 3.1736283575579 | epot = -21.1408022790474 | etot = -15.7803645702634
-814000  ekin = 1.7209257269681 |  erot = 2.995751260245 | epot = -21.2437075371712 | etot = -16.5270305499581
-815000  ekin = 2.15299829462668 |  erot = 2.27035656487164 | epot = -21.2458654890398 | etot = -16.8225106295415
-816000  ekin = 2.708122450654 |  erot = 1.52125307187336 | epot = -21.2616781989935 | etot = -17.0323026764662
-817000  ekin = 2.58901717437677 |  erot = 2.58536627670115 | epot = -21.3956545078514 | etot = -16.2212710567734
-818000  ekin = 2.27875756856437 |  erot = 2.24624264725757 | epot = -21.4318935062254 | etot = -16.9068932904035
-819000  ekin = 2.10656184615865 |  erot = 3.01130039050673 | epot = -21.4327594058408 | etot = -16.3148971691754
-820000  ekin = 2.45661353119087 |  erot = 2.7077529494413 | epot = -21.3798106611917 | etot = -16.2154441805595
-821000  ekin = 2.56789243532195 |  erot = 2.54922758508947 | epot = -21.3170915318809 | etot = -16.1999715114695
-822000  ekin = 3.57333066089329 |  erot = 2.21054956102185 | epot = -21.2861057645663 | etot = -15.5022255426512
-823000  ekin = 3.55383413213106 |  erot = 2.72435850620162 | epot = -21.2727846567927 | etot = -14.99459201846
-824000  ekin = 4.1160622349429 |  erot = 3.29139599112171 | epot = -21.2039659493683 | etot = -13.7965077233036
-825000  ekin = 2.91568774544338 |  erot = 3.47057612959321 | epot = -21.0618933558847 | etot = -14.6756294808481
-826000  ekin = 1.71667097443836 |  erot = 1.97830555981831 | epot = -20.8776766681461 | etot = -17.1827001338894
-827000  ekin = 1.87676981471836 |  erot = 2.56467088925009 | epot = -20.7862250182709 | etot = -16.3447843143025
-828000  ekin = 2.38071607948713 |  erot = 2.54624446499464 | epot = -20.7057379171108 | etot = -15.778777372629
-829000  ekin = 2.23087866970087 |  erot = 1.78456567522682 | epot = -20.6078136299299 | etot = -16.5923692850022
-830000  ekin = 2.54758016482261 |  erot = 2.32440405635605 | epot = -20.4881081818274 | etot = -15.6161239606488
-831000  ekin = 2.68445862644274 |  erot = 2.08263260479755 | epot = -20.3542193485845 | etot = -15.5871281173442
-832000  ekin = 2.63412360308726 |  erot = 2.01244922883234 | epot = -20.215817212176 | etot = -15.5692443802564
-833000  ekin = 2.52816532834198 |  erot = 2.59604450500368 | epot = -20.1546011863619 | etot = -15.0303913530162
-834000  ekin = 2.89178882882708 |  erot = 2.32656568068785 | epot = -20.154457994043 | etot = -14.9361034845281
-835000  ekin = 2.77377023733645 |  erot = 2.76167763911259 | epot = -20.2925945781538 | etot = -14.7571467017048
-836000  ekin = 2.5461758373878 |  erot = 2.86272526489883 | epot = -20.4572179712235 | etot = -15.0483168689368
-837000  ekin = 1.73852270651188 |  erot = 1.97943492340463 | epot = -20.5100877279363 | etot = -16.7921300980198
-838000  ekin = 1.97190789156808 |  erot = 2.79058337256635 | epot = -20.5305299708184 | etot = -15.7680387066839
-839000  ekin = 1.97773711155226 |  erot = 2.72413991034567 | epot = -20.5265807034224 | etot = -15.8247036815245
-840000  ekin = 1.7232963874871 |  erot = 2.96738113282628 | epot = -20.6321231069653 | etot = -15.9414455866519
-841000  ekin = 2.83071457484449 |  erot = 2.84941397463216 | epot = -20.7926258530586 | etot = -15.112497303582
-842000  ekin = 2.59731855411368 |  erot = 2.84178819703383 | epot = -20.8313063579289 | etot = -15.3921996067814
-843000  ekin = 2.04928376150596 |  erot = 2.6128843549826 | epot = -20.8099267672999 | etot = -16.1477586508114
-844000  ekin = 1.54583411960153 |  erot = 1.93893729147582 | epot = -20.8613105352918 | etot = -17.3765391242145
-845000  ekin = 2.313825406008 |  erot = 2.32466241883302 | epot = -20.9823282893206 | etot = -16.3438404644796
-846000  ekin = 2.08903634512998 |  erot = 2.31578856009952 | epot = -21.0646153757685 | etot = -16.659790470539
-847000  ekin = 2.4800137362118 |  erot = 2.63006614696695 | epot = -21.0262265568772 | etot = -15.9161466736984
-848000  ekin = 2.15184282735255 |  erot = 1.47311006297176 | epot = -21.0583979355086 | etot = -17.4334450451843
-849000  ekin = 2.01842760273387 |  erot = 2.48110730715332 | epot = -21.0805165806607 | etot = -16.5809816707735
-850000  ekin = 2.55741512224125 |  erot = 2.68263416508461 | epot = -21.0773082596903 | etot = -15.8372589723645
-851000  ekin = 2.18005669935449 |  erot = 2.93569398882535 | epot = -21.0924777064982 | etot = -15.9767270183184
-852000  ekin = 2.4696261459638 |  erot = 2.4702657660563 | epot = -21.121182921383 | etot = -16.1812910093629
-853000  ekin = 2.39950550338299 |  erot = 2.98750142132015 | epot = -21.0612995182632 | etot = -15.67429259356
-854000  ekin = 2.33465924490093 |  erot = 2.85274307519464 | epot = -20.968723969517 | etot = -15.7813216494214
-855000  ekin = 2.34227388182979 |  erot = 2.06894784165371 | epot = -20.9841257021182 | etot = -16.5729039786347
-856000  ekin = 2.50117711580693 |  erot = 2.74791206324422 | epot = -20.8738269143244 | etot = -15.6247377352733
-857000  ekin = 2.54090672086302 |  erot = 3.01990349760065 | epot = -20.7453092144205 | etot = -15.1844989959569
-858000  ekin = 3.06946696795817 |  erot = 2.15496603972173 | epot = -20.6851307548641 | etot = -15.4606977471842
-859000  ekin = 2.8502330341827 |  erot = 2.24419946408453 | epot = -20.6787263175177 | etot = -15.5842938192505
-860000  ekin = 2.81341243833324 |  erot = 1.5197461937082 | epot = -20.6783502445099 | etot = -16.3451916124685
-861000  ekin = 2.27419936469317 |  erot = 2.84736568193217 | epot = -20.6476685348769 | etot = -15.5261034882516
-862000  ekin = 2.99814535919906 |  erot = 1.87200304458178 | epot = -20.6714218686896 | etot = -15.8012734649088
-863000  ekin = 2.82320132781549 |  erot = 1.77959785908837 | epot = -20.7642045825074 | etot = -16.1614053956036
-864000  ekin = 2.91892607599648 |  erot = 2.64325528924267 | epot = -20.9317153856013 | etot = -15.3695340203621
-865000  ekin = 3.32989545880503 |  erot = 2.25510784979563 | epot = -21.0557741374338 | etot = -15.4707708288331
-866000  ekin = 2.85710406140164 |  erot = 3.16185395635697 | epot = -21.1425088224093 | etot = -15.1235508046507
-867000  ekin = 2.74742982523498 |  erot = 3.06773761977147 | epot = -21.134531707449 | etot = -15.3193642624426
-868000  ekin = 2.1948650568198 |  erot = 2.22458860510737 | epot = -21.0697126630058 | etot = -16.6502590010787
-869000  ekin = 2.92239964068215 |  erot = 2.50065925324415 | epot = -21.0149378764857 | etot = -15.5918789825594
-870000  ekin = 2.48931117933877 |  erot = 2.13038554226924 | epot = -20.9976655364141 | etot = -16.3779688148061
-871000  ekin = 2.19107246828585 |  erot = 2.37839051284131 | epot = -20.8765191273408 | etot = -16.3070561462136
-872000  ekin = 1.55081886521514 |  erot = 2.09762459684259 | epot = -20.8521940121747 | etot = -17.2037505501169
-873000  ekin = 1.3896067615701 |  erot = 2.27757856660909 | epot = -20.9255865429236 | etot = -17.2584012147444
-874000  ekin = 1.41282979514325 |  erot = 2.76881886831623 | epot = -21.0901483490343 | etot = -16.9084996855748
-875000  ekin = 1.18979270807644 |  erot = 2.71872907877545 | epot = -21.2270266717576 | etot = -17.3185048849058
-876000  ekin = 1.81100671707876 |  erot = 2.98963277694409 | epot = -21.2472610575188 | etot = -16.4466215634959
-877000  ekin = 2.36243541111364 |  erot = 2.03609143795483 | epot = -21.3277863705839 | etot = -16.9292595215154
-878000  ekin = 2.1245196182468 |  erot = 1.75451707226955 | epot = -21.3222506595257 | etot = -17.4432139690093
-879000  ekin = 2.2716997631568 |  erot = 2.70191568133046 | epot = -21.3119311913778 | etot = -16.3383157468906
-880000  ekin = 2.68326313012635 |  erot = 2.77340532358103 | epot = -21.3535728447366 | etot = -15.8969043910292
-881000  ekin = 2.87483307600208 |  erot = 2.33652901733377 | epot = -21.3292700652532 | etot = -16.1179079719173
-882000  ekin = 2.32758906799515 |  erot = 2.16795489269516 | epot = -21.2584233833351 | etot = -16.7628794226448
-883000  ekin = 2.35908631800798 |  erot = 1.97904048991531 | epot = -21.0655746410777 | etot = -16.7274478331544
-884000  ekin = 2.52269362644082 |  erot = 2.25025361307445 | epot = -20.9641879640375 | etot = -16.1912407245222
-885000  ekin = 2.8471189843883 |  erot = 2.26506458535077 | epot = -20.9641383727441 | etot = -15.8519548030051
-886000  ekin = 3.18322288605135 |  erot = 1.73470875511279 | epot = -21.0012427194847 | etot = -16.0833110783206
-887000  ekin = 2.68813414464725 |  erot = 2.50204216522368 | epot = -21.067976555709 | etot = -15.8778002458381
-888000  ekin = 2.15187544250473 |  erot = 2.83221089603913 | epot = -21.17639007923 | etot = -16.1923037406862
-889000  ekin = 2.16956995574787 |  erot = 2.20198656261183 | epot = -21.1017572530618 | etot = -16.7302007347021
-890000  ekin = 1.78556825977743 |  erot = 2.98410700070926 | epot = -21.186208638226 | etot = -16.4165333777393
-891000  ekin = 1.64917016933854 |  erot = 2.27750403923458 | epot = -21.3189640243096 | etot = -17.3922898157365
-892000  ekin = 1.96583947510742 |  erot = 2.36271973263346 | epot = -21.4596361006042 | etot = -17.1310768928633
-893000  ekin = 1.79314340564254 |  erot = 1.8411107489992 | epot = -21.5470179462123 | etot = -17.9127637915705
-894000  ekin = 2.81442382935654 |  erot = 2.80759818283316 | epot = -21.6538835081476 | etot = -16.0318614959579
-895000  ekin = 2.0070369904664 |  erot = 2.75374249882318 | epot = -21.7499760057857 | etot = -16.9891965164961
-896000  ekin = 1.6507008342202 |  erot = 2.56296228195539 | epot = -21.8927812332095 | etot = -17.6791181170339
-897000  ekin = 1.78139405234358 |  erot = 2.35356223356246 | epot = -22.0286409132692 | etot = -17.8936846273632
-898000  ekin = 1.85207490030026 |  erot = 2.3928555728648 | epot = -22.0495390022753 | etot = -17.8046085291102
-899000  ekin = 1.66216066819287 |  erot = 3.04222938639382 | epot = -21.9579747350567 | etot = -17.25358468047
-900000  ekin = 2.15165827067079 |  erot = 2.62356927804175 | epot = -21.9156104880732 | etot = -17.1403829393607
-901000  ekin = 2.41248642142908 |  erot = 2.69714418093217 | epot = -21.9837417963999 | etot = -16.8741111940386
-902000  ekin = 2.57545214239909 |  erot = 2.40635843208183 | epot = -21.996436412966 | etot = -17.0146258384851
-903000  ekin = 2.40335601179059 |  erot = 2.4057541752901 | epot = -22.0230111828253 | etot = -17.2139009957446
-904000  ekin = 1.99365997109403 |  erot = 3.12264199705152 | epot = -22.0954468558152 | etot = -16.9791448876697
-905000  ekin = 2.45160047861299 |  erot = 2.11889478277434 | epot = -22.0620083174753 | etot = -17.4915130560879
-906000  ekin = 2.69446662881178 |  erot = 1.66991631401456 | epot = -22.0555442490735 | etot = -17.6911613062471
-907000  ekin = 2.5734498863711 |  erot = 2.16877319112329 | epot = -22.0376984236082 | etot = -17.2954753461138
-908000  ekin = 2.9646776076989 |  erot = 2.40252252045294 | epot = -22.0191047803794 | etot = -16.6519046522276
-909000  ekin = 3.12793409264582 |  erot = 2.12009742665766 | epot = -22.0610667288554 | etot = -16.8130352095519
-910000  ekin = 2.92206025021313 |  erot = 3.50302372345592 | epot = -22.1277774480557 | etot = -15.7026934743867
-911000  ekin = 1.85381948048669 |  erot = 2.73401011795404 | epot = -22.1683975531304 | etot = -17.5805679546896
-912000  ekin = 2.64405242900445 |  erot = 1.86324838607163 | epot = -22.2002570143971 | etot = -17.692956199321
-913000  ekin = 2.46824283660223 |  erot = 2.0308633546605 | epot = -22.3203806242275 | etot = -17.8212744329647
-914000  ekin = 2.01871966356282 |  erot = 2.94283156821207 | epot = -22.3513452914152 | etot = -17.3897940596404
-915000  ekin = 2.82676643872102 |  erot = 2.11643553756712 | epot = -22.3640471312087 | etot = -17.4208451549205
-916000  ekin = 2.54227707175729 |  erot = 3.23335822897873 | epot = -22.4652663102875 | etot = -16.6896310095515
-917000  ekin = 2.31676859881433 |  erot = 2.2427200582576 | epot = -22.463585281336 | etot = -17.9040966242641
-918000  ekin = 2.08681780124233 |  erot = 2.05685815910104 | epot = -22.3748058531193 | etot = -18.231129892776
-919000  ekin = 2.60282015977208 |  erot = 2.38968293687319 | epot = -22.3822670579485 | etot = -17.3897639613032
-920000  ekin = 3.21847224306531 |  erot = 2.75010700480466 | epot = -22.4646189595793 | etot = -16.4960397117093
-921000  ekin = 2.67829101318104 |  erot = 1.98386933580364 | epot = -22.5250186592845 | etot = -17.8628583102998
-922000  ekin = 1.43283799739773 |  erot = 1.5210967069851 | epot = -22.5925015236451 | etot = -19.6385668192623
-923000  ekin = 1.69052063428542 |  erot = 1.88300391650268 | epot = -22.66377714455 | etot = -19.0902525937619
-924000  ekin = 2.14340021014736 |  erot = 1.52248843908134 | epot = -22.6402388027506 | etot = -18.9743501535219
-925000  ekin = 2.26091939109784 |  erot = 1.33050454776921 | epot = -22.5227280014394 | etot = -18.9313040625724
-926000  ekin = 2.00930540350536 |  erot = 2.07372939007629 | epot = -22.4428200376094 | etot = -18.3597852440277
-927000  ekin = 2.53289082621251 |  erot = 1.99783542507574 | epot = -22.5727269691716 | etot = -18.0420007178833
-928000  ekin = 2.57275295957812 |  erot = 2.50503787417693 | epot = -22.7397714760282 | etot = -17.6619806422732
-929000  ekin = 2.66131598383108 |  erot = 1.82871097568713 | epot = -22.7889092091996 | etot = -18.2988822496814
-930000  ekin = 2.41369096322635 |  erot = 2.00598415451171 | epot = -22.802343205586 | etot = -18.3826680878479
-931000  ekin = 3.02636364754007 |  erot = 2.115962250161 | epot = -22.7562575819635 | etot = -17.6139316842625
-932000  ekin = 2.34573343934799 |  erot = 1.88269819474441 | epot = -22.8028018252265 | etot = -18.5743701911341
-933000  ekin = 2.16951834533283 |  erot = 2.85677231086964 | epot = -22.8240172791919 | etot = -17.7977266229894
-934000  ekin = 2.17177152489559 |  erot = 2.1194660688678 | epot = -22.8652321779361 | etot = -18.5739945841727
-935000  ekin = 2.34485090948927 |  erot = 2.23417606918545 | epot = -22.85888707632 | etot = -18.2798600976452
-936000  ekin = 2.28188124919415 |  erot = 2.53015822921572 | epot = -22.9782518612072 | etot = -18.1662123827973
-937000  ekin = 2.3061925494295 |  erot = 2.82857457174385 | epot = -23.071665648819 | etot = -17.9368985276457
-938000  ekin = 2.44229226509271 |  erot = 2.00737414808353 | epot = -23.1363676072136 | etot = -18.6867011940373
-939000  ekin = 2.97744015155649 |  erot = 2.1021287084213 | epot = -23.1206613400026 | etot = -18.0410924800248
-940000  ekin = 3.74219661265262 |  erot = 2.68184060115531 | epot = -23.0494489680042 | etot = -16.6254117541962
-941000  ekin = 3.1130700754106 |  erot = 2.2870034463699 | epot = -22.9451834918749 | etot = -17.5451099700944
-942000  ekin = 3.46654816859628 |  erot = 1.87509182259239 | epot = -22.9048558084884 | etot = -17.5632158172997
-943000  ekin = 3.79224818385641 |  erot = 2.70927084823339 | epot = -22.8698482349086 | etot = -16.3683292028188
-944000  ekin = 2.65995525590795 |  erot = 2.74912726816423 | epot = -22.8317889960132 | etot = -17.422706471941
-945000  ekin = 2.54659137616624 |  erot = 2.02239421261018 | epot = -22.725938832337 | etot = -18.1569532435606
-946000  ekin = 2.46388617435412 |  erot = 1.67037983156324 | epot = -22.5545307163887 | etot = -18.4202647104713
-947000  ekin = 2.40803821488282 |  erot = 1.99424876436282 | epot = -22.4581247656853 | etot = -18.0558377864397
-948000  ekin = 3.53604042034895 |  erot = 2.57997877434838 | epot = -22.3226574127033 | etot = -16.206638218006
-949000  ekin = 2.98854271807069 |  erot = 2.434764866082 | epot = -22.1081978358246 | etot = -16.6848902516719
-950000  ekin = 1.85098760333696 |  erot = 3.0113849918017 | epot = -21.9481390655564 | etot = -17.0857664704178
-951000  ekin = 2.24140231384639 |  erot = 2.36101456496684 | epot = -21.9054305662226 | etot = -17.3030136874094
-952000  ekin = 2.1767459614223 |  erot = 1.66164476273624 | epot = -21.8857446244283 | etot = -18.0473539002697
-953000  ekin = 2.32434436644844 |  erot = 1.96780923551529 | epot = -21.864089307184 | etot = -17.5719357052203
-954000  ekin = 1.49071594272054 |  erot = 3.34931219540537 | epot = -21.7966718941878 | etot = -16.9566437560618
-955000  ekin = 1.88457697665867 |  erot = 2.69006961792184 | epot = -21.7221575712775 | etot = -17.147510976697
-956000  ekin = 1.69307087749046 |  erot = 2.16469646035311 | epot = -21.6721199805376 | etot = -17.814352642694
-957000  ekin = 1.73487330688787 |  erot = 1.64307450157792 | epot = -21.6559256952543 | etot = -18.2779778867885
-958000  ekin = 1.60385894866933 |  erot = 2.19168737006627 | epot = -21.6476897105175 | etot = -17.8521433917819
-959000  ekin = 2.59262245343361 |  erot = 2.48219361032086 | epot = -21.6596277279706 | etot = -16.5848116642161
-960000  ekin = 2.55386671368679 |  erot = 2.05771846301768 | epot = -21.6626200672138 | etot = -17.0510348905093
-961000  ekin = 2.27765806186204 |  erot = 2.17958354193562 | epot = -21.6544957188758 | etot = -17.1972541150782
-962000  ekin = 1.66004639932187 |  erot = 3.51004740828816 | epot = -21.6650529510449 | etot = -16.4949591434349
-963000  ekin = 1.98935936955203 |  erot = 1.50490949194663 | epot = -21.6088711497269 | etot = -18.1146022882282
-964000  ekin = 2.17983717879189 |  erot = 2.29031074234418 | epot = -21.5586262428098 | etot = -17.0884783216737
-965000  ekin = 2.10787439045543 |  erot = 2.3221077885109 | epot = -21.5497920382512 | etot = -17.1198098592849
-966000  ekin = 3.1408040905672 |  erot = 3.41823133718854 | epot = -21.5836404263088 | etot = -15.024604998553
-967000  ekin = 3.0568623124503 |  erot = 2.1733206632131 | epot = -21.5260931467358 | etot = -16.2959101710724
-968000  ekin = 2.05064192877792 |  erot = 2.14124924922397 | epot = -21.4479972163209 | etot = -17.256106038319
-969000  ekin = 2.21517858837652 |  erot = 2.21735686304378 | epot = -21.3822587820383 | etot = -16.949723330618
-970000  ekin = 2.44665062708039 |  erot = 2.63919176763313 | epot = -21.3192840477868 | etot = -16.2334416530733
-971000  ekin = 2.47241679333997 |  erot = 2.68621090896417 | epot = -21.3036698600044 | etot = -16.1450421577003
-972000  ekin = 3.18976408247808 |  erot = 2.45901954667695 | epot = -21.2523934460448 | etot = -15.6036098168898
-973000  ekin = 3.35475115149161 |  erot = 2.61012752320778 | epot = -21.183068859057 | etot = -15.2181901843576
-974000  ekin = 2.71127807449815 |  erot = 2.12974355852032 | epot = -21.0816906098712 | etot = -16.2406689768528
-975000  ekin = 1.81295894463494 |  erot = 2.0759564976921 | epot = -20.9964165264669 | etot = -17.1075010841398
-976000  ekin = 2.37619926790761 |  erot = 1.37981441384236 | epot = -20.8930101654836 | etot = -17.1369964837336
-977000  ekin = 2.85555210767404 |  erot = 3.03619369635208 | epot = -21.0095574945917 | etot = -15.1178116905656
-978000  ekin = 3.13849116757388 |  erot = 3.01118356119965 | epot = -21.0732326779663 | etot = -14.9235579491928
-979000  ekin = 3.64170438280054 |  erot = 2.4612126795782 | epot = -20.9593695826044 | etot = -14.8564525202257
-980000  ekin = 3.43680535726821 |  erot = 3.27333588575053 | epot = -20.9004670674903 | etot = -14.1903258244715
-981000  ekin = 2.95806185202903 |  erot = 2.46811293942083 | epot = -20.9868038459701 | etot = -15.5606290545202
-982000  ekin = 2.05823037945997 |  erot = 2.23573651589999 | epot = -21.0420814071854 | etot = -16.7481145118254
-983000  ekin = 2.5553610304344 |  erot = 1.97272050888114 | epot = -21.0434200461188 | etot = -16.5153385068032
-984000  ekin = 2.32140326985734 |  erot = 2.58284655378618 | epot = -21.0826601835729 | etot = -16.1784103599294
-985000  ekin = 2.30327577152247 |  erot = 3.01569210622987 | epot = -21.1731422974947 | etot = -15.8541744197424
-986000  ekin = 2.0247579133688 |  erot = 2.17885674714069 | epot = -21.2745593334952 | etot = -17.0709446729857
-987000  ekin = 2.38610984160001 |  erot = 1.60437579739602 | epot = -21.2569575649582 | etot = -17.2664719259622
-988000  ekin = 2.73926231299059 |  erot = 2.71146350841208 | epot = -21.1552791211025 | etot = -15.7045532996999
-989000  ekin = 2.26697151561908 |  erot = 2.87750604798637 | epot = -21.0937789068058 | etot = -15.9493013432004
-990000  ekin = 2.20943106152859 |  erot = 2.59684886899357 | epot = -21.0203331776818 | etot = -16.2140532471596
-991000  ekin = 2.18249266283082 |  erot = 2.54649657411172 | epot = -20.9130337682104 | etot = -16.1840445312679
-992000  ekin = 1.6979885228163 |  erot = 2.49592807829765 | epot = -20.97584958751 | etot = -16.781932986396
-993000  ekin = 1.37413745875443 |  erot = 1.97736806672932 | epot = -21.0653195519547 | etot = -17.713814026471
-994000  ekin = 1.46489942286098 |  erot = 2.9578292103502 | epot = -21.126186746174 | etot = -16.7034581129629
-995000  ekin = 2.313206084368 |  erot = 1.68064795849453 | epot = -21.1907262676309 | etot = -17.1968722247684
-996000  ekin = 2.91635623044139 |  erot = 2.86817278212845 | epot = -21.1749728841882 | etot = -15.3904438716184
-997000  ekin = 3.14117227050211 |  erot = 2.13892951607983 | epot = -21.1714996184258 | etot = -15.8913978318439
-998000  ekin = 2.24297046385175 |  erot = 3.02327291553881 | epot = -21.1032039558864 | etot = -15.8369605764958
-999000  ekin = 2.61553981530106 |  erot = 1.7387289184571 | epot = -21.0217257279766 | etot = -16.6674569942185
-1000000  ekin = 2.34012577497833 |  erot = 2.86436388995813 | epot = -21.0201566044041 | etot = -15.8156669394676
- 1000000   0.10400559   -1.3746133  0.060853481   -1.1675019 0.00013752759 
-Loop time of 59.4195 on 4 procs for 1000000 steps with 16 atoms
-
-Performance: 14540.686 tau/day, 16829.497 timesteps/s
-96.3% CPU use with 4 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 1.0304     | 20.212     | 37.839     | 369.5 | 34.02
-Bond    | 0.12844    | 0.57006    | 0.95643    |  49.6 |  0.96
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 4.3935     | 5.5635     | 6.7052     |  44.2 |  9.36
-Output  | 2.3e-05    | 3.575e-05  | 4.1e-05    |   0.0 |  0.00
-Modify  | 0.3513     | 3.4695     | 6.4366     | 144.3 |  5.84
-Other   |            | 29.6       |            |       | 49.82
-
-Nlocal:    4 ave 8 max 0 min
-Histogram: 1 1 0 0 0 0 0 0 1 1
-Nghost:    11 ave 14 max 8 min
-Histogram: 1 1 0 0 0 0 0 0 1 1
-Neighs:    46 ave 89 max 0 min
-Histogram: 1 1 0 0 0 0 0 0 0 2
-
-Total # of neighbors = 184
-Ave neighs/atom = 11.5
-Ave special neighs/atom = 3.75
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:59
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.1 b/examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.1
deleted file mode 100644
index 6b8b7161d5..0000000000
--- a/examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.1
+++ /dev/null
@@ -1,1172 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000113 secs
-  read_data CPU = 0.00275 secs
-
-set atom * mass 1.0
-  10 settings made for mass
-
-group all type 1 4
-10 atoms in group all
-
-# oxDNA bond interactions - FENE backbone
-bond_style oxdna2/fene
-bond_coeff * 2.0 0.25 0.7564
-
-# 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 0.6 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 0.6 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
-
-#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 = 2.6274
-  ghost atom cutoff = 2.6274
-  binsize = 1.3137, 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
-Per MPI rank memory allocation (min/avg/max) = 3.023 | 3.023 | 3.023 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
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-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
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-137000  ekin = 0.127443476996608 |  erot = 0.391972186713592 | epot = -15.1443194057199 | etot = -14.6249037420097
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-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
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-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
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-167000  ekin = 0.155644496809548 |  erot = 0.700111698658369 | epot = -15.4806599377741 | etot = -14.6249037423062
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-172000  ekin = 0.172273671159511 |  erot = 0.667951149520835 | epot = -15.4651285629069 | etot = -14.6249037422266
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-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
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-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
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-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
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-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
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-195000  ekin = 0.281592637347121 |  erot = 0.570914645865623 | epot = -15.4774110258523 | etot = -14.6249037426396
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-201000  ekin = 0.214214012278847 |  erot = 0.556955381706859 | epot = -15.3960731362566 | etot = -14.6249037422709
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-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
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-225000  ekin = 0.438137198422833 |  erot = 0.454489515561399 | epot = -15.5175304563959 | etot = -14.6249037424116
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-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
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-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
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-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
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-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
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-407000  ekin = 0.27795179501284 |  erot = 0.540438449781457 | epot = -15.4432939872644 | etot = -14.6249037424701
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-411000  ekin = 0.234219542826644 |  erot = 0.577428429926533 | epot = -15.4365517151989 | etot = -14.6249037424457
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-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
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-422000  ekin = 0.125576493084645 |  erot = 0.671901405101299 | epot = -15.4223816404261 | etot = -14.6249037422401
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-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
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-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
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-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
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-580000  ekin = 0.342901425190256 |  erot = 0.480981430412058 | epot = -15.4487865980916 | etot = -14.6249037424893
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-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
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-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
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-699000  ekin = 0.293570250406769 |  erot = 0.671848180609457 | epot = -15.5903221732877 | etot = -14.6249037422715
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-702000  ekin = 0.364075443764615 |  erot = 0.740637254695032 | epot = -15.7296164412337 | etot = -14.6249037427741
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-704000  ekin = 0.40306671671928 |  erot = 0.766018576887906 | epot = -15.7939890364911 | etot = -14.6249037428839
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-707000  ekin = 0.432328070473605 |  erot = 0.772470813770598 | epot = -15.8297026270152 | etot = -14.624903742771
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-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
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-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
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-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 20.5464 on 1 procs for 1000000 steps with 10 atoms
-
-Performance: 42051.215 tau/day, 48670.388 timesteps/s
-98.3% CPU use with 1 MPI tasks x no OpenMP threads
-
-MPI task timing breakdown:
-Section |  min time  |  avg time  |  max time  |%varavg| %total
----------------------------------------------------------------
-Pair    | 16.716     | 16.716     | 16.716     |   0.0 | 81.36
-Bond    | 0.6285     | 0.6285     | 0.6285     |   0.0 |  3.06
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 0.187      | 0.187      | 0.187      |   0.0 |  0.91
-Output  | 6e-06      | 6e-06      | 6e-06      |   0.0 |  0.00
-Modify  | 2.7186     | 2.7186     | 2.7186     |   0.0 | 13.23
-Other   |            | 0.2965     |            |       |  1.44
-
-Nlocal:    10 ave 10 max 10 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Nghost:    0 ave 0 max 0 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-Neighs:    45 ave 45 max 45 min
-Histogram: 1 0 0 0 0 0 0 0 0 0
-
-Total # of neighbors = 45
-Ave neighs/atom = 4.5
-Ave special neighs/atom = 3.6
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:20
diff --git a/examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.4 b/examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.4
deleted file mode 100644
index 60722d1063..0000000000
--- a/examples/USER/cgdna/examples/oxDNA2/duplex3/log.18Jun19.duplex3.g++.4
+++ /dev/null
@@ -1,1172 +0,0 @@
-LAMMPS (18 Jun 2019)
-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
-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 = 0.000189 secs
-  read_data CPU = 0.003302 secs
-
-set atom * mass 1.0
-  10 settings made for mass
-
-group all type 1 4
-10 atoms in group all
-
-# oxDNA bond interactions - FENE backbone
-bond_style oxdna2/fene
-bond_coeff * 2.0 0.25 0.7564
-
-# 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 0.6 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 0.6 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
-
-#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 = 2.6274
-  ghost atom cutoff = 2.6274
-  binsize = 1.3137, 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
-Per MPI rank memory allocation (min/avg/max) = 7.652 | 7.834 | 8.016 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
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-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
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-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
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-271000  ekin = 0.310703151367757 |  erot = 0.452552178356157 | epot = -15.3881590723317 | etot = -14.6249037426077
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-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
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-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
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-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
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-316000  ekin = 0.315175012816655 |  erot = 0.609166451967456 | epot = -15.5492452071862 | etot = -14.6249037424021
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-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
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-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
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-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
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-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
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-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
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-342000  ekin = 0.359561251230613 |  erot = 0.555400700218343 | epot = -15.5398656939398 | etot = -14.6249037424909
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-352000  ekin = 0.242146418558272 |  erot = 0.56251834442516 | epot = -15.4295685051533 | etot = -14.6249037421699
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-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
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-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
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-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
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-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
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-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
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-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
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-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 30.1999 on 4 procs for 1000000 steps with 10 atoms
-
-Performance: 28609.339 tau/day, 33112.661 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    | 0.90762    | 10.291     | 18.476     | 234.3 | 34.08
-Bond    | 0.11783    | 0.39332    | 0.61914    |  34.0 |  1.30
-Neigh   | 0          | 0          | 0          |   0.0 |  0.00
-Comm    | 2.8711     | 3.8042     | 4.7159     |  34.0 | 12.60
-Output  | 2e-05      | 3.15e-05   | 3.6e-05    |   0.0 |  0.00
-Modify  | 0.27052    | 1.1583     | 1.9428     |  63.9 |  3.84
-Other   |            | 14.55      |            |       | 48.19
-
-Nlocal:    2.5 ave 5 max 0 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-Nghost:    7.5 ave 10 max 5 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-Neighs:    18.5 ave 35 max 0 min
-Histogram: 1 0 1 0 0 0 0 0 1 1
-
-Total # of neighbors = 74
-Ave neighs/atom = 7.4
-Ave special neighs/atom = 3.6
-Neighbor list builds = 0
-Dangerous builds = 0
-
-#write_restart config.${number}.*
-Total wall time: 0:00:30

From fe20490891eb0229626b9b49a22c974c4bf51dfa Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Thu, 17 Oct 2019 13:18:02 -0400
Subject: [PATCH 10/21] more use of utils::sfread()

---
 src/ASPHERE/pair_gayberne.cpp              | 25 +++++----
 src/ASPHERE/pair_resquared.cpp             | 17 +++---
 src/CLASS2/angle_class2.cpp                | 23 ++++----
 src/CLASS2/bond_class2.cpp                 |  9 +--
 src/CLASS2/dihedral_class2.cpp             | 65 +++++++++++-----------
 src/CLASS2/improper_class2.cpp             | 17 +++---
 src/CLASS2/pair_lj_class2.cpp              | 17 +++---
 src/CLASS2/pair_lj_class2_coul_cut.cpp     | 21 +++----
 src/CLASS2/pair_lj_class2_coul_long.cpp    | 23 ++++----
 src/COLLOID/pair_brownian.cpp              | 29 +++++-----
 src/COLLOID/pair_colloid.cpp               | 19 ++++---
 src/COLLOID/pair_lubricate.cpp             | 25 +++++----
 src/COLLOID/pair_lubricateU.cpp            | 23 ++++----
 src/DIPOLE/pair_lj_cut_dipole_cut.cpp      | 19 ++++---
 src/DIPOLE/pair_lj_cut_dipole_long.cpp     | 18 +++---
 src/DIPOLE/pair_lj_long_dipole_long.cpp    | 19 ++++---
 src/GRANULAR/pair_gran_hooke_history.cpp   | 15 ++---
 src/GRANULAR/pair_granular.cpp             | 23 ++++----
 src/KSPACE/fix_tune_kspace.cpp             |  1 +
 src/KSPACE/pair_born_coul_long.cpp         | 29 +++++-----
 src/KSPACE/pair_buck_coul_long.cpp         | 25 +++++----
 src/KSPACE/pair_buck_long_coul_long.cpp    | 25 +++++----
 src/KSPACE/pair_coul_long.cpp              | 15 ++---
 src/KSPACE/pair_lj_charmm_coul_long.cpp    | 25 +++++----
 src/KSPACE/pair_lj_charmmfsw_coul_long.cpp | 25 +++++----
 src/KSPACE/pair_lj_cut_coul_long.cpp       | 23 ++++----
 src/KSPACE/pair_lj_cut_tip4p_long.cpp      | 25 +++++----
 src/KSPACE/pair_lj_long_coul_long.cpp      | 23 ++++----
 src/KSPACE/pair_lj_long_tip4p_long.cpp     | 23 ++++----
 src/KSPACE/pair_tip4p_long.cpp             | 11 ++--
 src/pair_dpd_tstat.cpp                     | 10 ++--
 src/pair_gauss.cpp                         | 15 ++---
 src/pair_hybrid.cpp                        | 18 +++---
 src/pair_lj96_cut.cpp                      | 15 ++---
 src/pair_lj_cubic.cpp                      | 13 +++--
 src/pair_lj_cut.cpp                        | 17 +++---
 src/pair_lj_cut_coul_cut.cpp               | 21 +++----
 src/pair_lj_cut_coul_debye.cpp             | 11 ++--
 src/pair_lj_cut_coul_dsf.cpp               | 21 +++----
 src/pair_lj_cut_coul_wolf.cpp              | 21 +++----
 src/pair_lj_expand.cpp                     | 19 ++++---
 src/pair_lj_gromacs.cpp                    | 19 ++++---
 src/pair_lj_gromacs_coul_gromacs.cpp       | 19 ++++---
 src/pair_lj_smooth.cpp                     | 19 ++++---
 src/pair_lj_smooth_linear.cpp              | 13 +++--
 src/pair_mie_cut.cpp                       | 21 +++----
 src/pair_morse.cpp                         | 17 +++---
 src/pair_soft.cpp                          | 11 ++--
 src/pair_table.cpp                         | 14 ++---
 src/pair_ufm.cpp                           | 15 ++---
 src/pair_yukawa.cpp                        | 15 ++---
 src/pair_zero.cpp                          |  9 +--
 src/read_restart.cpp                       | 29 +++++-----
 53 files changed, 544 insertions(+), 495 deletions(-)

diff --git a/src/ASPHERE/pair_gayberne.cpp b/src/ASPHERE/pair_gayberne.cpp
index 93b164c503..ea5a7e9aaa 100644
--- a/src/ASPHERE/pair_gayberne.cpp
+++ b/src/ASPHERE/pair_gayberne.cpp
@@ -28,6 +28,7 @@
 #include "citeme.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -460,20 +461,20 @@ void PairGayBerne::read_restart(FILE *fp)
   int i,j;
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
-    if (me == 0) fread(&setwell[i],sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&setwell[i],sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&setwell[i],1,MPI_INT,0,world);
     if (setwell[i]) {
-      if (me == 0) fread(&well[i][0],sizeof(double),3,fp);
+      if (me == 0) utils::sfread(FLERR,&well[i][0],sizeof(double),3,fp,NULL,error);
       MPI_Bcast(&well[i][0],3,MPI_DOUBLE,0,world);
     }
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -505,12 +506,12 @@ void PairGayBerne::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&gamma,sizeof(double),1,fp);
-    fread(&upsilon,sizeof(double),1,fp);
-    fread(&mu,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&gamma,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&upsilon,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mu,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&gamma,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&upsilon,1,MPI_DOUBLE,0,world);
diff --git a/src/ASPHERE/pair_resquared.cpp b/src/ASPHERE/pair_resquared.cpp
index f139564320..dd4b11935e 100644
--- a/src/ASPHERE/pair_resquared.cpp
+++ b/src/ASPHERE/pair_resquared.cpp
@@ -27,6 +27,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -438,20 +439,20 @@ void PairRESquared::read_restart(FILE *fp)
   int i,j;
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
-    if (me == 0) fread(&setwell[i],sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&setwell[i],sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&setwell[i],1,MPI_INT,0,world);
     if (setwell[i]) {
-      if (me == 0) fread(&well[i][0],sizeof(double),3,fp);
+      if (me == 0) utils::sfread(FLERR,&well[i][0],sizeof(double),3,fp,NULL,error);
       MPI_Bcast(&well[i][0],3,MPI_DOUBLE,0,world);
     }
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -479,8 +480,8 @@ void PairRESquared::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/CLASS2/angle_class2.cpp b/src/CLASS2/angle_class2.cpp
index 99e1b39c9d..fe567ead34 100644
--- a/src/CLASS2/angle_class2.cpp
+++ b/src/CLASS2/angle_class2.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -372,19 +373,19 @@ void AngleClass2::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k2[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k3[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k4[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k3[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k4[1],sizeof(double),atom->nangletypes,fp,NULL,error);
 
-    fread(&bb_k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&bb_r1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&bb_r2[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&bb_k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&bb_r1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&bb_r2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
 
-    fread(&ba_k1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&ba_k2[1],sizeof(double),atom->nangletypes,fp);
-    fread(&ba_r1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&ba_r2[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&ba_k1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&ba_k2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&ba_r1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&ba_r2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
 
   MPI_Bcast(&theta0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/CLASS2/bond_class2.cpp b/src/CLASS2/bond_class2.cpp
index cfc1a93bde..0651db75fb 100644
--- a/src/CLASS2/bond_class2.cpp
+++ b/src/CLASS2/bond_class2.cpp
@@ -24,6 +24,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -182,10 +183,10 @@ void BondClass2::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&k2[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&k3[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&k4[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&k3[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&k4[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&k2[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/CLASS2/dihedral_class2.cpp b/src/CLASS2/dihedral_class2.cpp
index 725228666e..11faefee8f 100644
--- a/src/CLASS2/dihedral_class2.cpp
+++ b/src/CLASS2/dihedral_class2.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -835,45 +836,45 @@ void DihedralClass2::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&k2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&k3[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&phi1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&phi2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&phi3[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&k1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&k3[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&phi1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&phi2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&phi3[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
 
-    fread(&mbt_f1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&mbt_f2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&mbt_f3[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&mbt_r0[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&mbt_f1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&mbt_f2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&mbt_f3[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&mbt_r0[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
 
-    fread(&ebt_f1_1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&ebt_f2_1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&ebt_f3_1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&ebt_r0_1[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&ebt_f1_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&ebt_f2_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&ebt_f3_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&ebt_r0_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
 
-    fread(&ebt_f1_2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&ebt_f2_2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&ebt_f3_2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&ebt_r0_2[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&ebt_f1_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&ebt_f2_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&ebt_f3_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&ebt_r0_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
 
-    fread(&at_f1_1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&at_f2_1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&at_f3_1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&at_theta0_1[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&at_f1_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&at_f2_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&at_f3_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&at_theta0_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
 
-    fread(&at_f1_2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&at_f2_2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&at_f3_2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&at_theta0_2[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&at_f1_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&at_f2_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&at_f3_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&at_theta0_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
 
-    fread(&aat_k[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&aat_theta0_1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&aat_theta0_2[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&aat_k[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&aat_theta0_1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&aat_theta0_2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
 
-    fread(&bb13t_k[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&bb13t_r10[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&bb13t_r30[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&bb13t_k[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&bb13t_r10[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&bb13t_r30[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
   }
 
   MPI_Bcast(&k1[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
diff --git a/src/CLASS2/improper_class2.cpp b/src/CLASS2/improper_class2.cpp
index ca7ac95239..a3b8b4b672 100644
--- a/src/CLASS2/improper_class2.cpp
+++ b/src/CLASS2/improper_class2.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -604,15 +605,15 @@ void ImproperClass2::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k0[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&chi0[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k0[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&chi0[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
 
-    fread(&aa_k1[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&aa_k2[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&aa_k3[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&aa_theta0_1[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&aa_theta0_2[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&aa_theta0_3[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&aa_k1[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&aa_k2[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&aa_k3[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&aa_theta0_1[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&aa_theta0_2[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&aa_theta0_3[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k0[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&chi0[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/CLASS2/pair_lj_class2.cpp b/src/CLASS2/pair_lj_class2.cpp
index a0088e52b7..641ca67226 100644
--- a/src/CLASS2/pair_lj_class2.cpp
+++ b/src/CLASS2/pair_lj_class2.cpp
@@ -24,6 +24,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -610,13 +611,13 @@ void PairLJClass2::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -645,10 +646,10 @@ void PairLJClass2::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/CLASS2/pair_lj_class2_coul_cut.cpp b/src/CLASS2/pair_lj_class2_coul_cut.cpp
index e999a3682e..89a0d74b5a 100644
--- a/src/CLASS2/pair_lj_class2_coul_cut.cpp
+++ b/src/CLASS2/pair_lj_class2_coul_cut.cpp
@@ -23,6 +23,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -362,14 +363,14 @@ void PairLJClass2CoulCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -399,11 +400,11 @@ void PairLJClass2CoulCut::write_restart_settings(FILE *fp)
 void PairLJClass2CoulCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul_global,1,MPI_DOUBLE,0,world);
diff --git a/src/CLASS2/pair_lj_class2_coul_long.cpp b/src/CLASS2/pair_lj_class2_coul_long.cpp
index b56c076996..5487878f27 100644
--- a/src/CLASS2/pair_lj_class2_coul_long.cpp
+++ b/src/CLASS2/pair_lj_class2_coul_long.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -805,13 +806,13 @@ void PairLJClass2CoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -842,13 +843,13 @@ void PairLJClass2CoulLong::write_restart_settings(FILE *fp)
 void PairLJClass2CoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/COLLOID/pair_brownian.cpp b/src/COLLOID/pair_brownian.cpp
index 71a5f8c056..d73789d890 100644
--- a/src/COLLOID/pair_brownian.cpp
+++ b/src/COLLOID/pair_brownian.cpp
@@ -36,6 +36,7 @@
 #include "math_special.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -602,12 +603,12 @@ void PairBrownian::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&cut_inner[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -642,17 +643,17 @@ void PairBrownian::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&mu,sizeof(double),1,fp);
-    fread(&flaglog,sizeof(int),1,fp);
-    fread(&flagfld,sizeof(int),1,fp);
-    fread(&cut_inner_global,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&t_target, sizeof(double),1,fp);
-    fread(&seed, sizeof(int),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&flagHI,sizeof(int),1,fp);
-    fread(&flagVF,sizeof(int),1,fp);
+    utils::sfread(FLERR,&mu,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&flaglog,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagfld,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_inner_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&t_target, sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed, sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagHI,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagVF,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&mu,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&flaglog,1,MPI_INT,0,world);
diff --git a/src/COLLOID/pair_colloid.cpp b/src/COLLOID/pair_colloid.cpp
index ad25184181..d1c6e4594f 100644
--- a/src/COLLOID/pair_colloid.cpp
+++ b/src/COLLOID/pair_colloid.cpp
@@ -25,6 +25,7 @@
 #include "math_special.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathSpecial;
@@ -394,15 +395,15 @@ void PairColloid::read_restart(FILE *fp)
 
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (comm->me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (comm->me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (comm->me == 0) {
-          fread(&a12[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&d1[i][j],sizeof(double),1,fp);
-          fread(&d2[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a12[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&d1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&d2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a12[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -432,9 +433,9 @@ void PairColloid::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/COLLOID/pair_lubricate.cpp b/src/COLLOID/pair_lubricate.cpp
index b6288c34d2..a72eaef679 100644
--- a/src/COLLOID/pair_lubricate.cpp
+++ b/src/COLLOID/pair_lubricate.cpp
@@ -35,6 +35,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -682,12 +683,12 @@ void PairLubricate::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&cut_inner[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -720,15 +721,15 @@ void PairLubricate::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&mu,sizeof(double),1,fp);
-    fread(&flaglog,sizeof(int),1,fp);
-    fread(&flagfld,sizeof(int),1,fp);
-    fread(&cut_inner_global,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&flagHI,sizeof(int),1,fp);
-    fread(&flagVF,sizeof(int),1,fp);
+    utils::sfread(FLERR,&mu,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&flaglog,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagfld,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_inner_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagHI,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagVF,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&mu,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&flaglog,1,MPI_INT,0,world);
diff --git a/src/COLLOID/pair_lubricateU.cpp b/src/COLLOID/pair_lubricateU.cpp
index 4f7e3917e8..e8715cec36 100644
--- a/src/COLLOID/pair_lubricateU.cpp
+++ b/src/COLLOID/pair_lubricateU.cpp
@@ -34,6 +34,7 @@
 #include "variable.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -1908,12 +1909,12 @@ void PairLubricateU::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&cut_inner[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -1945,14 +1946,14 @@ void PairLubricateU::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&mu,sizeof(double),1,fp);
-    fread(&flaglog,sizeof(int),1,fp);
-    fread(&cut_inner_global,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&flagHI,sizeof(int),1,fp);
-    fread(&flagVF,sizeof(int),1,fp);
+    utils::sfread(FLERR,&mu,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&flaglog,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_inner_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagHI,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&flagVF,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&mu,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&flaglog,1,MPI_INT,0,world);
diff --git a/src/DIPOLE/pair_lj_cut_dipole_cut.cpp b/src/DIPOLE/pair_lj_cut_dipole_cut.cpp
index 14c511c100..9f9e897357 100644
--- a/src/DIPOLE/pair_lj_cut_dipole_cut.cpp
+++ b/src/DIPOLE/pair_lj_cut_dipole_cut.cpp
@@ -23,6 +23,7 @@
 #include "memory.h"
 #include "error.h"
 #include "update.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -437,14 +438,14 @@ void PairLJCutDipoleCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -473,10 +474,10 @@ void PairLJCutDipoleCut::write_restart_settings(FILE *fp)
 void PairLJCutDipoleCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul_global,1,MPI_DOUBLE,0,world);
diff --git a/src/DIPOLE/pair_lj_cut_dipole_long.cpp b/src/DIPOLE/pair_lj_cut_dipole_long.cpp
index fe020ed2e6..7fc03005b5 100644
--- a/src/DIPOLE/pair_lj_cut_dipole_long.cpp
+++ b/src/DIPOLE/pair_lj_cut_dipole_long.cpp
@@ -25,7 +25,7 @@
 #include "memory.h"
 #include "error.h"
 #include "update.h"
-
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -490,13 +490,13 @@ void PairLJCutDipoleLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -524,10 +524,10 @@ void PairLJCutDipoleLong::write_restart_settings(FILE *fp)
 void PairLJCutDipoleLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/DIPOLE/pair_lj_long_dipole_long.cpp b/src/DIPOLE/pair_lj_long_dipole_long.cpp
index 5e7819c2f4..d120eed76f 100644
--- a/src/DIPOLE/pair_lj_long_dipole_long.cpp
+++ b/src/DIPOLE/pair_lj_long_dipole_long.cpp
@@ -30,6 +30,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -344,13 +345,13 @@ void PairLJLongDipoleLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon_read[i][j],sizeof(double),1,fp);
-          fread(&sigma_read[i][j],sizeof(double),1,fp);
-          fread(&cut_lj_read[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon_read[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma_read[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj_read[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon_read[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma_read[i][j],1,MPI_DOUBLE,0,world);
@@ -379,11 +380,11 @@ void PairLJLongDipoleLong::write_restart_settings(FILE *fp)
 void PairLJLongDipoleLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&ewald_order,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ewald_order,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/GRANULAR/pair_gran_hooke_history.cpp b/src/GRANULAR/pair_gran_hooke_history.cpp
index 771a5566df..de205dce91 100644
--- a/src/GRANULAR/pair_gran_hooke_history.cpp
+++ b/src/GRANULAR/pair_gran_hooke_history.cpp
@@ -31,6 +31,7 @@
 #include "neigh_request.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -540,7 +541,7 @@ void PairGranHookeHistory::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
     }
 }
@@ -566,12 +567,12 @@ void PairGranHookeHistory::write_restart_settings(FILE *fp)
 void PairGranHookeHistory::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&kn,sizeof(double),1,fp);
-    fread(&kt,sizeof(double),1,fp);
-    fread(&gamman,sizeof(double),1,fp);
-    fread(&gammat,sizeof(double),1,fp);
-    fread(&xmu,sizeof(double),1,fp);
-    fread(&dampflag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&kn,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&kt,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&gamman,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&gammat,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&xmu,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&dampflag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&kn,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&kt,1,MPI_DOUBLE,0,world);
diff --git a/src/GRANULAR/pair_granular.cpp b/src/GRANULAR/pair_granular.cpp
index 54f6b77d2f..0b506060d6 100644
--- a/src/GRANULAR/pair_granular.cpp
+++ b/src/GRANULAR/pair_granular.cpp
@@ -34,6 +34,7 @@ See the README file in the top-level LAMMPS directory.
 #include "error.h"
 #include "math_const.h"
 #include "math_special.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -1251,20 +1252,20 @@ void PairGranular::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&normal_model[i][j],sizeof(int),1,fp);
-          fread(&damping_model[i][j],sizeof(int),1,fp);
-          fread(&tangential_model[i][j],sizeof(int),1,fp);
-          fread(&roll_model[i][j],sizeof(int),1,fp);
-          fread(&twist_model[i][j],sizeof(int),1,fp);
-          fread(normal_coeffs[i][j],sizeof(double),4,fp);
-          fread(tangential_coeffs[i][j],sizeof(double),3,fp);
-          fread(roll_coeffs[i][j],sizeof(double),3,fp);
-          fread(twist_coeffs[i][j],sizeof(double),3,fp);
-          fread(&cutoff_type[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&normal_model[i][j],sizeof(int),1,fp,NULL,error);
+          utils::sfread(FLERR,&damping_model[i][j],sizeof(int),1,fp,NULL,error);
+          utils::sfread(FLERR,&tangential_model[i][j],sizeof(int),1,fp,NULL,error);
+          utils::sfread(FLERR,&roll_model[i][j],sizeof(int),1,fp,NULL,error);
+          utils::sfread(FLERR,&twist_model[i][j],sizeof(int),1,fp,NULL,error);
+          utils::sfread(FLERR,normal_coeffs[i][j],sizeof(double),4,fp,NULL,error);
+          utils::sfread(FLERR,tangential_coeffs[i][j],sizeof(double),3,fp,NULL,error);
+          utils::sfread(FLERR,roll_coeffs[i][j],sizeof(double),3,fp,NULL,error);
+          utils::sfread(FLERR,twist_coeffs[i][j],sizeof(double),3,fp,NULL,error);
+          utils::sfread(FLERR,&cutoff_type[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&normal_model[i][j],1,MPI_INT,0,world);
         MPI_Bcast(&damping_model[i][j],1,MPI_INT,0,world);
diff --git a/src/KSPACE/fix_tune_kspace.cpp b/src/KSPACE/fix_tune_kspace.cpp
index cfd88609b3..a3a4956214 100644
--- a/src/KSPACE/fix_tune_kspace.cpp
+++ b/src/KSPACE/fix_tune_kspace.cpp
@@ -29,6 +29,7 @@
 #include "neighbor.h"
 #include "modify.h"
 #include "compute.h"
+
 #define SWAP(a,b) {temp=(a);(a)=(b);(b)=temp;}
 #define SIGN(a,b) ((b) >= 0.0 ? fabs(a) : -fabs(a))
 #define GOLD 1.618034
diff --git a/src/KSPACE/pair_born_coul_long.cpp b/src/KSPACE/pair_born_coul_long.cpp
index e248a24ef7..b5b3eda64f 100644
--- a/src/KSPACE/pair_born_coul_long.cpp
+++ b/src/KSPACE/pair_born_coul_long.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -421,16 +422,16 @@ void PairBornCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&d[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&d[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -464,13 +465,13 @@ void PairBornCoulLong::write_restart_settings(FILE *fp)
 void PairBornCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/KSPACE/pair_buck_coul_long.cpp b/src/KSPACE/pair_buck_coul_long.cpp
index c97856fa3c..a46424baf7 100644
--- a/src/KSPACE/pair_buck_coul_long.cpp
+++ b/src/KSPACE/pair_buck_coul_long.cpp
@@ -24,6 +24,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -399,14 +400,14 @@ void PairBuckCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -438,13 +439,13 @@ void PairBuckCoulLong::write_restart_settings(FILE *fp)
 void PairBuckCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/KSPACE/pair_buck_long_coul_long.cpp b/src/KSPACE/pair_buck_long_coul_long.cpp
index 8127cbc127..346643ae0a 100644
--- a/src/KSPACE/pair_buck_long_coul_long.cpp
+++ b/src/KSPACE/pair_buck_long_coul_long.cpp
@@ -31,6 +31,7 @@
 #include "respa.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -355,14 +356,14 @@ void PairBuckLongCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&buck_a_read[i][j],sizeof(double),1,fp);
-          fread(&buck_rho_read[i][j],sizeof(double),1,fp);
-          fread(&buck_c_read[i][j],sizeof(double),1,fp);
-          fread(&cut_buck_read[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&buck_a_read[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck_rho_read[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck_c_read[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_buck_read[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&buck_a_read[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&buck_rho_read[i][j],1,MPI_DOUBLE,0,world);
@@ -394,13 +395,13 @@ void PairBuckLongCoulLong::write_restart_settings(FILE *fp)
 void PairBuckLongCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_buck_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
-    fread(&ewald_order,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_buck_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&ewald_order,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_buck_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/KSPACE/pair_coul_long.cpp b/src/KSPACE/pair_coul_long.cpp
index 7cedf3d003..004835007d 100644
--- a/src/KSPACE/pair_coul_long.cpp
+++ b/src/KSPACE/pair_coul_long.cpp
@@ -27,6 +27,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -289,10 +290,10 @@ void PairCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
-        if (me == 0) fread(&scale[i][j],sizeof(double),1,fp);
+        if (me == 0) utils::sfread(FLERR,&scale[i][j],sizeof(double),1,fp,NULL,error);
         MPI_Bcast(&scale[i][j],1,MPI_DOUBLE,0,world);
       }
     }
@@ -318,11 +319,11 @@ void PairCoulLong::write_restart_settings(FILE *fp)
 void PairCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/KSPACE/pair_lj_charmm_coul_long.cpp b/src/KSPACE/pair_lj_charmm_coul_long.cpp
index 751ee77388..22ed923b49 100644
--- a/src/KSPACE/pair_lj_charmm_coul_long.cpp
+++ b/src/KSPACE/pair_lj_charmm_coul_long.cpp
@@ -29,6 +29,7 @@
 #include "neigh_request.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -822,14 +823,14 @@ void PairLJCharmmCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&eps14[i][j],sizeof(double),1,fp);
-          fread(&sigma14[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&eps14[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma14[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -861,13 +862,13 @@ void PairLJCharmmCoulLong::write_restart_settings(FILE *fp)
 void PairLJCharmmCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_inner,sizeof(double),1,fp);
-    fread(&cut_lj,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_inner,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj,1,MPI_DOUBLE,0,world);
diff --git a/src/KSPACE/pair_lj_charmmfsw_coul_long.cpp b/src/KSPACE/pair_lj_charmmfsw_coul_long.cpp
index 494a349768..ce7fda5f18 100644
--- a/src/KSPACE/pair_lj_charmmfsw_coul_long.cpp
+++ b/src/KSPACE/pair_lj_charmmfsw_coul_long.cpp
@@ -33,6 +33,7 @@
 #include "neigh_request.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -889,14 +890,14 @@ void PairLJCharmmfswCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&eps14[i][j],sizeof(double),1,fp);
-          fread(&sigma14[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&eps14[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma14[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -928,13 +929,13 @@ void PairLJCharmmfswCoulLong::write_restart_settings(FILE *fp)
 void PairLJCharmmfswCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_inner,sizeof(double),1,fp);
-    fread(&cut_lj,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_inner,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj,1,MPI_DOUBLE,0,world);
diff --git a/src/KSPACE/pair_lj_cut_coul_long.cpp b/src/KSPACE/pair_lj_cut_coul_long.cpp
index fb79451b37..23e182435d 100644
--- a/src/KSPACE/pair_lj_cut_coul_long.cpp
+++ b/src/KSPACE/pair_lj_cut_coul_long.cpp
@@ -31,6 +31,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -793,13 +794,13 @@ void PairLJCutCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -830,13 +831,13 @@ void PairLJCutCoulLong::write_restart_settings(FILE *fp)
 void PairLJCutCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/KSPACE/pair_lj_cut_tip4p_long.cpp b/src/KSPACE/pair_lj_cut_tip4p_long.cpp
index c98092f19b..a4f115568f 100644
--- a/src/KSPACE/pair_lj_cut_tip4p_long.cpp
+++ b/src/KSPACE/pair_lj_cut_tip4p_long.cpp
@@ -30,6 +30,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -528,19 +529,19 @@ void PairLJCutTIP4PLong::write_restart_settings(FILE *fp)
 void PairLJCutTIP4PLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&typeO,sizeof(int),1,fp);
-    fread(&typeH,sizeof(int),1,fp);
-    fread(&typeB,sizeof(int),1,fp);
-    fread(&typeA,sizeof(int),1,fp);
-    fread(&qdist,sizeof(double),1,fp);
+    utils::sfread(FLERR,&typeO,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeH,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeB,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeA,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&qdist,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
 
   MPI_Bcast(&typeO,1,MPI_INT,0,world);
diff --git a/src/KSPACE/pair_lj_long_coul_long.cpp b/src/KSPACE/pair_lj_long_coul_long.cpp
index 610fc4e89b..f3d06f33d2 100644
--- a/src/KSPACE/pair_lj_long_coul_long.cpp
+++ b/src/KSPACE/pair_lj_long_coul_long.cpp
@@ -33,6 +33,7 @@
 #include "respa.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -355,13 +356,13 @@ void PairLJLongCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon_read[i][j],sizeof(double),1,fp);
-          fread(&sigma_read[i][j],sizeof(double),1,fp);
-          fread(&cut_lj_read[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon_read[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma_read[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj_read[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon_read[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma_read[i][j],1,MPI_DOUBLE,0,world);
@@ -392,13 +393,13 @@ void PairLJLongCoulLong::write_restart_settings(FILE *fp)
 void PairLJLongCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
-    fread(&ewald_order,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&ewald_order,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/KSPACE/pair_lj_long_tip4p_long.cpp b/src/KSPACE/pair_lj_long_tip4p_long.cpp
index 08409dce72..b46fb64898 100644
--- a/src/KSPACE/pair_lj_long_tip4p_long.cpp
+++ b/src/KSPACE/pair_lj_long_tip4p_long.cpp
@@ -30,6 +30,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -1539,18 +1540,18 @@ void PairLJLongTIP4PLong::write_restart_settings(FILE *fp)
 void PairLJLongTIP4PLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&typeO,sizeof(int),1,fp);
-    fread(&typeH,sizeof(int),1,fp);
-    fread(&typeB,sizeof(int),1,fp);
-    fread(&typeA,sizeof(int),1,fp);
-    fread(&qdist,sizeof(double),1,fp);
+    utils::sfread(FLERR,&typeO,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeH,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeB,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeA,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&qdist,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
 
   MPI_Bcast(&typeO,1,MPI_INT,0,world);
diff --git a/src/KSPACE/pair_tip4p_long.cpp b/src/KSPACE/pair_tip4p_long.cpp
index 2c47f42beb..c3ec44b7eb 100644
--- a/src/KSPACE/pair_tip4p_long.cpp
+++ b/src/KSPACE/pair_tip4p_long.cpp
@@ -30,6 +30,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -467,11 +468,11 @@ void PairTIP4PLong::read_restart_settings(FILE *fp)
   PairCoulLong::read_restart_settings(fp);
 
   if (comm->me == 0) {
-    fread(&typeO,sizeof(int),1,fp);
-    fread(&typeH,sizeof(int),1,fp);
-    fread(&typeB,sizeof(int),1,fp);
-    fread(&typeA,sizeof(int),1,fp);
-    fread(&qdist,sizeof(double),1,fp);
+    utils::sfread(FLERR,&typeO,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeH,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeB,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeA,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&qdist,sizeof(double),1,fp,NULL,error);
   }
 
   MPI_Bcast(&typeO,1,MPI_INT,0,world);
diff --git a/src/pair_dpd_tstat.cpp b/src/pair_dpd_tstat.cpp
index 96e910d830..8366ff459f 100644
--- a/src/pair_dpd_tstat.cpp
+++ b/src/pair_dpd_tstat.cpp
@@ -265,11 +265,11 @@ void PairDPDTstat::write_restart_settings(FILE *fp)
 void PairDPDTstat::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&t_start,sizeof(double),1,fp);
-    fread(&t_stop,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&t_start,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&t_stop,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&t_start,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&t_stop,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_gauss.cpp b/src/pair_gauss.cpp
index 7fd3233f4c..dcc3ac5f51 100644
--- a/src/pair_gauss.cpp
+++ b/src/pair_gauss.cpp
@@ -25,6 +25,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -279,13 +280,13 @@ void PairGauss::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&b[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&b[i][j],1,MPI_DOUBLE,0,world);
@@ -312,9 +313,9 @@ void PairGauss::write_restart_settings(FILE *fp)
 void PairGauss::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_hybrid.cpp b/src/pair_hybrid.cpp
index 3c619b6c95..b853ef1db1 100644
--- a/src/pair_hybrid.cpp
+++ b/src/pair_hybrid.cpp
@@ -26,6 +26,7 @@
 #include "memory.h"
 #include "error.h"
 #include "respa.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -681,7 +682,7 @@ void PairHybrid::write_restart(FILE *fp)
 void PairHybrid::read_restart(FILE *fp)
 {
   int me = comm->me;
-  if (me == 0) fread(&nstyles,sizeof(int),1,fp);
+  if (me == 0) utils::sfread(FLERR,&nstyles,sizeof(int),1,fp,NULL,error);
   MPI_Bcast(&nstyles,1,MPI_INT,0,world);
 
   // allocate list of sub-styles
@@ -704,32 +705,32 @@ void PairHybrid::read_restart(FILE *fp)
   // each sub-style is created via new_pair()
   // each reads its settings, but no coeff info
 
-  if (me == 0) fread(compute_tally,sizeof(int),nstyles,fp);
+  if (me == 0) utils::sfread(FLERR,compute_tally,sizeof(int),nstyles,fp,NULL,error);
   MPI_Bcast(compute_tally,nstyles,MPI_INT,0,world);
 
   int n,dummy;
   for (int m = 0; m < nstyles; m++) {
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     keywords[m] = new char[n];
-    if (me == 0) fread(keywords[m],sizeof(char),n,fp);
+    if (me == 0) utils::sfread(FLERR,keywords[m],sizeof(char),n,fp,NULL,error);
     MPI_Bcast(keywords[m],n,MPI_CHAR,0,world);
     styles[m] = force->new_pair(keywords[m],0,dummy);
     styles[m]->read_restart_settings(fp);
     // read back per style special settings, if present
     special_lj[m] = special_coul[m] = NULL;
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     if (n > 0 ) {
       special_lj[m] = new double[4];
-      if (me == 0) fread(special_lj[m],sizeof(double),4,fp);
+      if (me == 0) utils::sfread(FLERR,special_lj[m],sizeof(double),4,fp,NULL,error);
       MPI_Bcast(special_lj[m],4,MPI_DOUBLE,0,world);
     }
-    if (me == 0) fread(&n,sizeof(int),1,fp);
+    if (me == 0) utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
     MPI_Bcast(&n,1,MPI_INT,0,world);
     if (n > 0 ) {
       special_coul[m] = new double[4];
-      if (me == 0) fread(special_coul[m],sizeof(double),4,fp);
+      if (me == 0) utils::sfread(FLERR,special_coul[m],sizeof(double),4,fp,NULL,error);
       MPI_Bcast(special_coul[m],4,MPI_DOUBLE,0,world);
     }
   }
@@ -766,7 +767,6 @@ double PairHybrid::single(int i, int j, int itype, int jtype,
   double fone;
   fforce = 0.0;
   double esum = 0.0;
-  int n = 0;
 
   for (int m = 0; m < nmap[itype][jtype]; m++) {
     if (rsq < styles[map[itype][jtype][m]]->cutsq[itype][jtype]) {
diff --git a/src/pair_lj96_cut.cpp b/src/pair_lj96_cut.cpp
index c27038900d..d0e625fad4 100644
--- a/src/pair_lj96_cut.cpp
+++ b/src/pair_lj96_cut.cpp
@@ -30,6 +30,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -609,9 +610,9 @@ void PairLJ96Cut::read_restart(FILE *fp)
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -640,10 +641,10 @@ void PairLJ96Cut::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_lj_cubic.cpp b/src/pair_lj_cubic.cpp
index 7990952494..98f221b689 100644
--- a/src/pair_lj_cubic.cpp
+++ b/src/pair_lj_cubic.cpp
@@ -25,6 +25,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace PairLJCubicConstants;
@@ -276,14 +277,14 @@ void PairLJCubic::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -310,7 +311,7 @@ void PairLJCubic::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
 }
diff --git a/src/pair_lj_cut.cpp b/src/pair_lj_cut.cpp
index 0302858adb..8765ba4313 100644
--- a/src/pair_lj_cut.cpp
+++ b/src/pair_lj_cut.cpp
@@ -30,6 +30,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -599,13 +600,13 @@ void PairLJCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -634,10 +635,10 @@ void PairLJCut::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_lj_cut_coul_cut.cpp b/src/pair_lj_cut_coul_cut.cpp
index d4640bee3a..621148dc9b 100644
--- a/src/pair_lj_cut_coul_cut.cpp
+++ b/src/pair_lj_cut_coul_cut.cpp
@@ -23,6 +23,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -352,14 +353,14 @@ void PairLJCutCoulCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -389,11 +390,11 @@ void PairLJCutCoulCut::write_restart_settings(FILE *fp)
 void PairLJCutCoulCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_lj_cut_coul_debye.cpp b/src/pair_lj_cut_coul_debye.cpp
index 4ef533a743..a65d7aa50f 100644
--- a/src/pair_lj_cut_coul_debye.cpp
+++ b/src/pair_lj_cut_coul_debye.cpp
@@ -19,6 +19,7 @@
 #include "force.h"
 #include "comm.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -170,11 +171,11 @@ void PairLJCutCoulDebye::write_restart_settings(FILE *fp)
 void PairLJCutCoulDebye::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&kappa,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&kappa,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_lj_cut_coul_dsf.cpp b/src/pair_lj_cut_coul_dsf.cpp
index 778f9f2fb4..3b78b8ad1d 100644
--- a/src/pair_lj_cut_coul_dsf.cpp
+++ b/src/pair_lj_cut_coul_dsf.cpp
@@ -28,6 +28,7 @@
 #include "memory.h"
 #include "math_const.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -375,13 +376,13 @@ void PairLJCutCoulDSF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -411,12 +412,12 @@ void PairLJCutCoulDSF::write_restart_settings(FILE *fp)
 void PairLJCutCoulDSF::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&alpha,sizeof(double),1,fp);
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&alpha,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&alpha,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_lj_cut_coul_wolf.cpp b/src/pair_lj_cut_coul_wolf.cpp
index 00a5832529..b4eaa070a7 100644
--- a/src/pair_lj_cut_coul_wolf.cpp
+++ b/src/pair_lj_cut_coul_wolf.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -367,13 +368,13 @@ void PairLJCutCoulWolf::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -404,12 +405,12 @@ void PairLJCutCoulWolf::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&alf,sizeof(double),1,fp);
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&alf,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&alf,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_lj_expand.cpp b/src/pair_lj_expand.cpp
index a5184bc2f5..16c8d586a2 100644
--- a/src/pair_lj_expand.cpp
+++ b/src/pair_lj_expand.cpp
@@ -22,6 +22,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -323,14 +324,14 @@ void PairLJExpand::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&shift[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&shift[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -359,10 +360,10 @@ void PairLJExpand::write_restart_settings(FILE *fp)
 void PairLJExpand::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_lj_gromacs.cpp b/src/pair_lj_gromacs.cpp
index baef482ef9..73f4307d62 100644
--- a/src/pair_lj_gromacs.cpp
+++ b/src/pair_lj_gromacs.cpp
@@ -24,6 +24,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -338,14 +339,14 @@ void PairLJGromacs::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -375,10 +376,10 @@ void PairLJGromacs::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_inner_global,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_inner_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_inner_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_lj_gromacs_coul_gromacs.cpp b/src/pair_lj_gromacs_coul_gromacs.cpp
index c62944b6a1..53b62bfdbd 100644
--- a/src/pair_lj_gromacs_coul_gromacs.cpp
+++ b/src/pair_lj_gromacs_coul_gromacs.cpp
@@ -25,6 +25,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -377,12 +378,12 @@ void PairLJGromacsCoulGromacs::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -411,12 +412,12 @@ void PairLJGromacsCoulGromacs::write_restart_settings(FILE *fp)
 void PairLJGromacsCoulGromacs::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_inner,sizeof(double),1,fp);
-    fread(&cut_lj,sizeof(double),1,fp);
-    fread(&cut_coul_inner,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_inner,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_lj_smooth.cpp b/src/pair_lj_smooth.cpp
index 7c7eb51b53..8c906dee46 100644
--- a/src/pair_lj_smooth.cpp
+++ b/src/pair_lj_smooth.cpp
@@ -24,6 +24,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -351,14 +352,14 @@ void PairLJSmooth::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -388,10 +389,10 @@ void PairLJSmooth::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_inner_global,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_inner_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_inner_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_lj_smooth_linear.cpp b/src/pair_lj_smooth_linear.cpp
index bc2904c262..16d5e96c12 100644
--- a/src/pair_lj_smooth_linear.cpp
+++ b/src/pair_lj_smooth_linear.cpp
@@ -24,6 +24,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -284,13 +285,13 @@ void PairLJSmoothLinear::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -317,8 +318,8 @@ void PairLJSmoothLinear::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/pair_mie_cut.cpp b/src/pair_mie_cut.cpp
index 46657687f6..4ce82381f3 100644
--- a/src/pair_mie_cut.cpp
+++ b/src/pair_mie_cut.cpp
@@ -30,6 +30,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -626,15 +627,15 @@ void PairMIECut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&gamR[i][j],sizeof(double),1,fp);
-          fread(&gamA[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamR[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamA[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -665,10 +666,10 @@ void PairMIECut::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_morse.cpp b/src/pair_morse.cpp
index d088f98bf4..86f0e34bf8 100644
--- a/src/pair_morse.cpp
+++ b/src/pair_morse.cpp
@@ -21,6 +21,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -264,14 +265,14 @@ void PairMorse::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&d0[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&r0[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&d0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&r0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&d0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&alpha[i][j],1,MPI_DOUBLE,0,world);
@@ -299,9 +300,9 @@ void PairMorse::write_restart_settings(FILE *fp)
 void PairMorse::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_soft.cpp b/src/pair_soft.cpp
index 6f821e684b..ddfc4476dc 100644
--- a/src/pair_soft.cpp
+++ b/src/pair_soft.cpp
@@ -22,6 +22,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -244,12 +245,12 @@ void PairSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&prefactor[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&prefactor[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&prefactor[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -274,8 +275,8 @@ void PairSoft::write_restart_settings(FILE *fp)
 void PairSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/pair_table.cpp b/src/pair_table.cpp
index 9fcbc3ee9f..9cb86b4123 100644
--- a/src/pair_table.cpp
+++ b/src/pair_table.cpp
@@ -976,13 +976,13 @@ void PairTable::write_restart_settings(FILE *fp)
 void PairTable::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&tabstyle,sizeof(int),1,fp);
-    fread(&tablength,sizeof(int),1,fp);
-    fread(&ewaldflag,sizeof(int),1,fp);
-    fread(&pppmflag,sizeof(int),1,fp);
-    fread(&msmflag,sizeof(int),1,fp);
-    fread(&dispersionflag,sizeof(int),1,fp);
-    fread(&tip4pflag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&tabstyle,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tablength,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ewaldflag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&pppmflag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&msmflag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&dispersionflag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tip4pflag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&tabstyle,1,MPI_INT,0,world);
   MPI_Bcast(&tablength,1,MPI_INT,0,world);
diff --git a/src/pair_ufm.cpp b/src/pair_ufm.cpp
index 8cc4d2796f..ba3ad9ee50 100644
--- a/src/pair_ufm.cpp
+++ b/src/pair_ufm.cpp
@@ -27,6 +27,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -278,13 +279,13 @@ void PairUFM::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -312,9 +313,9 @@ void PairUFM::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/pair_yukawa.cpp b/src/pair_yukawa.cpp
index e8775c9668..d1e06fdb84 100644
--- a/src/pair_yukawa.cpp
+++ b/src/pair_yukawa.cpp
@@ -20,6 +20,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -252,12 +253,12 @@ void PairYukawa::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -284,10 +285,10 @@ void PairYukawa::write_restart_settings(FILE *fp)
 void PairYukawa::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&kappa,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&kappa,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&kappa,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/pair_zero.cpp b/src/pair_zero.cpp
index 403bd73944..a549848a9c 100644
--- a/src/pair_zero.cpp
+++ b/src/pair_zero.cpp
@@ -23,6 +23,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -170,11 +171,11 @@ void PairZero::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
       }
@@ -199,8 +200,8 @@ void PairZero::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&coeffflag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&coeffflag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&coeffflag,1,MPI_INT,0,world);
diff --git a/src/read_restart.cpp b/src/read_restart.cpp
index 62ce209b90..a31700990d 100644
--- a/src/read_restart.cpp
+++ b/src/read_restart.cpp
@@ -35,6 +35,7 @@
 #include "mpiio.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -302,24 +303,24 @@ void ReadRestart::command(int narg, char **arg)
         error->one(FLERR,str);
       }
 
-      fread(&flag,sizeof(int),1,fp);
+      utils::sfread(FLERR,&flag,sizeof(int),1,fp,NULL,error);
       if (flag != PROCSPERFILE)
         error->one(FLERR,"Invalid flag in peratom section of restart file");
       int procsperfile;
-      fread(&procsperfile,sizeof(int),1,fp);
+      utils::sfread(FLERR,&procsperfile,sizeof(int),1,fp,NULL,error);
 
       for (int i = 0; i < procsperfile; i++) {
-        fread(&flag,sizeof(int),1,fp);
+        utils::sfread(FLERR,&flag,sizeof(int),1,fp,NULL,error);
         if (flag != PERPROC)
           error->one(FLERR,"Invalid flag in peratom section of restart file");
 
-        fread(&n,sizeof(int),1,fp);
+        utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
         if (n > maxbuf) {
           maxbuf = n;
           memory->destroy(buf);
           memory->create(buf,maxbuf,"read_restart:buf");
         }
-        fread(buf,sizeof(double),n,fp);
+        utils::sfread(FLERR,buf,sizeof(double),n,fp,NULL,error);
 
         m = 0;
         while (m < n) m += avec->unpack_restart(&buf[m]);
@@ -379,10 +380,10 @@ void ReadRestart::command(int narg, char **arg)
     int flag,procsperfile;
 
     if (filereader) {
-      fread(&flag,sizeof(int),1,fp);
+      utils::sfread(FLERR,&flag,sizeof(int),1,fp,NULL,error);
       if (flag != PROCSPERFILE)
         error->one(FLERR,"Invalid flag in peratom section of restart file");
-      fread(&procsperfile,sizeof(int),1,fp);
+      utils::sfread(FLERR,&procsperfile,sizeof(int),1,fp,NULL,error);
     }
     MPI_Bcast(&procsperfile,1,MPI_INT,0,clustercomm);
 
@@ -391,17 +392,17 @@ void ReadRestart::command(int narg, char **arg)
 
     for (int i = 0; i < procsperfile; i++) {
       if (filereader) {
-        fread(&flag,sizeof(int),1,fp);
+        utils::sfread(FLERR,&flag,sizeof(int),1,fp,NULL,error);
         if (flag != PERPROC)
           error->one(FLERR,"Invalid flag in peratom section of restart file");
 
-        fread(&n,sizeof(int),1,fp);
+        utils::sfread(FLERR,&n,sizeof(int),1,fp,NULL,error);
         if (n > maxbuf) {
           maxbuf = n;
           memory->destroy(buf);
           memory->create(buf,maxbuf,"read_restart:buf");
         }
-        fread(buf,sizeof(double),n,fp);
+        utils::sfread(FLERR,buf,sizeof(double),n,fp,NULL,error);
 
         if (i % nclusterprocs) {
           iproc = me + (i % nclusterprocs);
@@ -1105,7 +1106,7 @@ void ReadRestart::file_layout()
           memory->create(nproc_chunk_number,nprocs,
                          "write_restart:nproc_chunk_number");
 
-          fread(all_written_send_sizes,sizeof(int),nprocs_file,fp);
+          utils::sfread(FLERR,all_written_send_sizes,sizeof(int),nprocs_file,fp,NULL,error);
 
           if ((nprocs != nprocs_file) && !(atom->nextra_store)) {
             // nprocs differ, but atom sizes are fixed length, yeah!
@@ -1287,7 +1288,7 @@ char *ReadRestart::read_string()
   int n = read_int();
   if (n < 0) error->all(FLERR,"Illegal size string or corrupt restart");
   char *value = new char[n];
-  if (me == 0) fread(value,sizeof(char),n,fp);
+  if (me == 0) utils::sfread(FLERR,value,sizeof(char),n,fp,NULL,error);
   MPI_Bcast(value,n,MPI_CHAR,0,world);
   return value;
 }
@@ -1299,7 +1300,7 @@ char *ReadRestart::read_string()
 void ReadRestart::read_int_vec(int n, int *vec)
 {
   if (n < 0) error->all(FLERR,"Illegal size integer vector read requested");
-  if (me == 0) fread(vec,sizeof(int),n,fp);
+  if (me == 0) utils::sfread(FLERR,vec,sizeof(int),n,fp,NULL,error);
   MPI_Bcast(vec,n,MPI_INT,0,world);
 }
 
@@ -1310,6 +1311,6 @@ void ReadRestart::read_int_vec(int n, int *vec)
 void ReadRestart::read_double_vec(int n, double *vec)
 {
   if (n < 0) error->all(FLERR,"Illegal size double vector read requested");
-  if (me == 0) fread(vec,sizeof(double),n,fp);
+  if (me == 0) utils::sfread(FLERR,vec,sizeof(double),n,fp,NULL,error);
   MPI_Bcast(vec,n,MPI_DOUBLE,0,world);
 }

From 30cff3faf332b9a4608fb9e0ba644cdfa93dbeb7 Mon Sep 17 00:00:00 2001
From: Michael Brown <michael.w.brown@intel.com>
Date: Fri, 18 Oct 2019 03:10:31 -0700
Subject: [PATCH 11/21] Fixing Gay-Berne "extra" documentation to define
 epsilon parameters consistent with LAMMPS input.

---
 doc/src/PDF/pair_gayberne_extra.pdf | Bin 55448 -> 99860 bytes
 doc/src/PDF/pair_gayberne_extra.tex |   8 ++++----
 2 files changed, 4 insertions(+), 4 deletions(-)

diff --git a/doc/src/PDF/pair_gayberne_extra.pdf b/doc/src/PDF/pair_gayberne_extra.pdf
index c82233992d48be53584344510152bd8f5173d87a..b794ac3382f2ed43d801ff97f68c81ae60eb8ac3 100644
GIT binary patch
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zvYs<EXRBWsAoe7-=;wjfvVqCXsiUmUt@@3L-oiW)rG<)NDL>yKxkTsaoufxsJ0Zbd
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z6U@kgyKm$<TM(7Y?v=ihg&D8e5OMC$_Nx5+4H<TM&~8tY%FR`dYyQPGV&G^0y*08#
zqR8;N$X@q;$N6^4g+bJ5<dKxOsZ7`6%2H`u-wE#Zyv&BV_0pUdLj7aJ&Q7k@7Ca9X
zPtPT!l7kbaa5rpjYWLrnESBYtHSq`L4VCvNR!TRMl6!lNCBJPf<{n~<xIY;Fe9$_+
zhQhthS*$Y^XJt@yR9I}isJyk?vjI9NyJ>MSq*R+C*dq;iU#l@Rcb6jtnw8dMVLkeO
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zkD&Z+xDP|4f7uG?FF&Dw<ovg-{B@M|-~F5)4?7=0`OR$qii8;mSvUHZ+5RKvzo9Vy
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ze@U(XOk;+ef_Rh$1U}f=!{^U@AXXMGNasCD12R7@3t|CrL2T;Rd@LNSzooH)I3PCl
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zE7!x2@0T`!r2Q3(qrJWv#N8n9@{$6S%-q2bJ_4X<W8+Brhu4LS6eO&TZAky{rw<px
zq*}ae!YrIZf)KCB%*xIwBp|}hCM*hZB?9ci!YnMJoE-e5|Mx69r2PB{4vrB1_&<CT
Rhz)Y)3W1VRL{1dp{{UQ};P?Ol

diff --git a/doc/src/PDF/pair_gayberne_extra.tex b/doc/src/PDF/pair_gayberne_extra.tex
index 5f0d97d7ab..a63ab2b1ce 100644
--- a/doc/src/PDF/pair_gayberne_extra.tex
+++ b/doc/src/PDF/pair_gayberne_extra.tex
@@ -48,8 +48,8 @@ $$ \mathbf{G}_{12} = \mathbf{A}_1^T \mathbf{S}_1^2 \mathbf{A}_1 +
 \mathbf{G}_2. $$
 
 Let the relative energy matrices $\mathbf{E}_i = \mbox{diag}
-(\epsilon_{ia}, \epsilon_{ib}, \epsilon_{ic})$ be given by 
-the relative well depths (dimensionless energy scales 
+(\epsilon_{ia}^{-1/\mu}, \epsilon_{ib}^{-1/\mu}, \epsilon_{ic}^{-1/\mu})$
+be given by the relative well depths (dimensionless energy scales 
 inversely proportional to the well-depths of the respective 
 orthogonal configurations of the interacting molecules). The 
 $\chi$ orientation-dependent energy based on the user-specified 
@@ -62,8 +62,8 @@ $$ \hat{\mathbf{r}}_{12} = { \mathbf{r}_{12} } / |\mathbf{r}_{12}|, $$
 
 and
 
-$$ \mathbf{B}_{12} = \mathbf{A}_1^T \mathbf{E}_1^2 \mathbf{A}_1 +
-\mathbf{A}_2^T \mathbf{E}_2^2 \mathbf{A}_2 = \mathbf{B}_1 +
+$$ \mathbf{B}_{12} = \mathbf{A}_1^T \mathbf{E}_1 \mathbf{A}_1 +
+\mathbf{A}_2^T \mathbf{E}_2 \mathbf{A}_2 = \mathbf{B}_1 +
 \mathbf{B}_2. $$
 
 Here, we use the distance of closest approach approximation given by the

From 3017f78e2eda30e4ae91d80627b4cb143448614e Mon Sep 17 00:00:00 2001
From: Michael Brown <michael.w.brown@intel.com>
Date: Fri, 18 Oct 2019 03:22:41 -0700
Subject: [PATCH 12/21] Adding -std=c++11 specifier to Intel Makefiles

---
 src/MAKE/OPTIONS/Makefile.intel_coprocessor  | 4 ++--
 src/MAKE/OPTIONS/Makefile.intel_cpu          | 4 ++--
 src/MAKE/OPTIONS/Makefile.intel_cpu_intelmpi | 4 ++--
 src/MAKE/OPTIONS/Makefile.intel_cpu_mpich    | 4 ++--
 src/MAKE/OPTIONS/Makefile.intel_cpu_openmpi  | 4 ++--
 src/MAKE/OPTIONS/Makefile.knl                | 4 ++--
 6 files changed, 12 insertions(+), 12 deletions(-)

diff --git a/src/MAKE/OPTIONS/Makefile.intel_coprocessor b/src/MAKE/OPTIONS/Makefile.intel_coprocessor
index 75e4d89170..44f5c99f70 100644
--- a/src/MAKE/OPTIONS/Makefile.intel_coprocessor
+++ b/src/MAKE/OPTIONS/Makefile.intel_coprocessor
@@ -6,7 +6,7 @@ SHELL = /bin/sh
 # compiler/linker settings
 # specify flags and libraries needed for your compiler
 
-CC =		mpiicpc 
+CC =		mpiicpc -std=c++11
 MIC_OPT =       -qoffload-option,mic,compiler,"-fp-model fast=2 -mGLOB_default_function_attrs=\"gather_scatter_loop_unroll=4\""
 CCFLAGS =	-g -O3 -qopenmp -DLMP_INTEL_OFFLOAD -DLAMMPS_MEMALIGN=64 \
                 -xHost -fno-alias -ansi-alias -restrict -DLMP_INTEL_USELRT \
@@ -14,7 +14,7 @@ CCFLAGS =	-g -O3 -qopenmp -DLMP_INTEL_OFFLOAD -DLAMMPS_MEMALIGN=64 \
 SHFLAGS =	-fPIC
 DEPFLAGS =	-M
 
-LINK =		mpiicpc
+LINK =		mpiicpc -std=c++11
 LINKFLAGS =	-g -O3 -xHost -qopenmp -qoffload
 LIB =           -ltbbmalloc
 SIZE =		size
diff --git a/src/MAKE/OPTIONS/Makefile.intel_cpu b/src/MAKE/OPTIONS/Makefile.intel_cpu
index 57e25e30cd..f52b4f3029 100644
--- a/src/MAKE/OPTIONS/Makefile.intel_cpu
+++ b/src/MAKE/OPTIONS/Makefile.intel_cpu
@@ -6,7 +6,7 @@ SHELL = /bin/sh
 # compiler/linker settings
 # specify flags and libraries needed for your compiler
 
-CC =		mpiicpc 
+CC =		mpiicpc -std=c++11
 OPTFLAGS =      -xHost -O2 -fp-model fast=2 -no-prec-div -qoverride-limits \
                 -qopt-zmm-usage=high
 CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
@@ -15,7 +15,7 @@ CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
 SHFLAGS =	-fPIC
 DEPFLAGS =	-M
 
-LINK =		mpiicpc
+LINK =		mpiicpc -std=c++11
 LINKFLAGS =	-qopenmp $(OPTFLAGS) -L$(MKLROOT)/lib/intel64/
 LIB =           -ltbbmalloc -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core
 SIZE =		size
diff --git a/src/MAKE/OPTIONS/Makefile.intel_cpu_intelmpi b/src/MAKE/OPTIONS/Makefile.intel_cpu_intelmpi
index 1731203cb0..07d720a592 100644
--- a/src/MAKE/OPTIONS/Makefile.intel_cpu_intelmpi
+++ b/src/MAKE/OPTIONS/Makefile.intel_cpu_intelmpi
@@ -6,7 +6,7 @@ SHELL = /bin/sh
 # compiler/linker settings
 # specify flags and libraries needed for your compiler
 
-CC =		mpiicpc 
+CC =		mpiicpc -std=c++11
 OPTFLAGS =      -xHost -O2 -fp-model fast=2 -no-prec-div -qoverride-limits \
                 -qopt-zmm-usage=high
 CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
@@ -15,7 +15,7 @@ CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
 SHFLAGS =	-fPIC
 DEPFLAGS =	-M
 
-LINK =		mpiicpc
+LINK =		mpiicpc -std=c++11
 LINKFLAGS =	-qopenmp $(OPTFLAGS) -L$(MKLROOT)/lib/intel64/
 LIB =           -ltbbmalloc -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core	
 SIZE =		size
diff --git a/src/MAKE/OPTIONS/Makefile.intel_cpu_mpich b/src/MAKE/OPTIONS/Makefile.intel_cpu_mpich
index 9419537006..51cf975e5c 100644
--- a/src/MAKE/OPTIONS/Makefile.intel_cpu_mpich
+++ b/src/MAKE/OPTIONS/Makefile.intel_cpu_mpich
@@ -6,7 +6,7 @@ SHELL = /bin/sh
 # compiler/linker settings
 # specify flags and libraries needed for your compiler
 
-CC =		mpicxx -cxx=icc
+CC =		mpicxx -cxx=icc -std=c++11
 OPTFLAGS =      -xHost -O2 -fp-model fast=2 -no-prec-div -qoverride-limits \
                 -qopt-zmm-usage=high
 CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
@@ -15,7 +15,7 @@ CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
 SHFLAGS =	-fPIC
 DEPFLAGS =	-M
 
-LINK =		mpicxx -cxx=icc
+LINK =		mpicxx -cxx=icc -std=c++11
 LINKFLAGS =	-qopenmp $(OPTFLAGS) -L$(MKLROOT)/lib/intel64/
 LIB =           -ltbbmalloc -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core
 SIZE =		size
diff --git a/src/MAKE/OPTIONS/Makefile.intel_cpu_openmpi b/src/MAKE/OPTIONS/Makefile.intel_cpu_openmpi
index c983943f5e..342637a460 100644
--- a/src/MAKE/OPTIONS/Makefile.intel_cpu_openmpi
+++ b/src/MAKE/OPTIONS/Makefile.intel_cpu_openmpi
@@ -7,7 +7,7 @@ SHELL = /bin/sh
 # specify flags and libraries needed for your compiler
 
 export OMPI_CXX = icc
-CC =		mpicxx
+CC =		mpicxx -std=c++11
 OPTFLAGS =      -xHost -O2 -fp-model fast=2 -no-prec-div -qoverride-limits \
                 -qopt-zmm-usage=high
 CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
@@ -16,7 +16,7 @@ CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
 SHFLAGS =	-fPIC
 DEPFLAGS =	-M
 
-LINK =		mpicxx
+LINK =		mpicxx -std=c++11
 LINKFLAGS =	-qopenmp $(OPTFLAGS) -L$(MKLROOT)/lib/intel64/
 LIB =           -ltbbmalloc -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core
 SIZE =		size
diff --git a/src/MAKE/OPTIONS/Makefile.knl b/src/MAKE/OPTIONS/Makefile.knl
index a361e9e258..ab1b756a67 100644
--- a/src/MAKE/OPTIONS/Makefile.knl
+++ b/src/MAKE/OPTIONS/Makefile.knl
@@ -6,7 +6,7 @@ SHELL = /bin/sh
 # compiler/linker settings
 # specify flags and libraries needed for your compiler
 
-CC =		mpiicpc
+CC =		mpiicpc -std=c++11
 OPTFLAGS =      -xMIC-AVX512 -O2 -fp-model fast=2 -no-prec-div -qoverride-limits
 CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
                 -DLMP_INTEL_USELRT -DLMP_USE_MKL_RNG $(OPTFLAGS) \
@@ -14,7 +14,7 @@ CCFLAGS =	-qopenmp -qno-offload -ansi-alias -restrict \
 SHFLAGS =	-fPIC
 DEPFLAGS =	-M
 
-LINK =		mpiicpc
+LINK =		mpiicpc -std=c++11
 LINKFLAGS =	-qopenmp $(OPTFLAGS) -L$(MKLROOT)/lib/intel64/
 LIB =           -ltbbmalloc -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core
 SIZE =		size

From e2988c5c20be066cc886a9031f25e6aabb2ab8bf Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Fri, 18 Oct 2019 17:55:28 +0200
Subject: [PATCH 13/21] refactor sfgets() and sfread() to both allow NULL
 filenames and guess from /proc if needed and possible

---
 src/pair_lj96_cut.cpp |  2 +-
 src/utils.cpp         | 49 ++++++++++++++++++++++++++++---------------
 src/utils.h           |  2 +-
 3 files changed, 34 insertions(+), 19 deletions(-)

diff --git a/src/pair_lj96_cut.cpp b/src/pair_lj96_cut.cpp
index d0e625fad4..f554872965 100644
--- a/src/pair_lj96_cut.cpp
+++ b/src/pair_lj96_cut.cpp
@@ -606,7 +606,7 @@ void PairLJ96Cut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
diff --git a/src/utils.cpp b/src/utils.cpp
index 8f1dadad0b..f6556a3ac8 100644
--- a/src/utils.cpp
+++ b/src/utils.cpp
@@ -107,14 +107,43 @@ int utils::cfvarg(std::string mode, const char *arg, char *&cfv_id)
   return rv;
 }
 
+/** \brief try to detect pathname from FILE pointer. Currently only supported on Linux, otherwise will report "(unknown)".
+ *
+ *  \param buf  storage buffer for pathname. output will be truncated if not large enough
+ *  \param len  size of storage buffer. output will be truncated to this length - 1
+ *  \param fp   FILE pointer structe from STDIO library for which we want to detect the name
+ *  \return pointer to the storage buffer, i.e. buf
+ */
+static const char *guesspath(char *buf, int len, FILE *fp)
+{
+  memset(buf,0,len);
+
+#if defined(__linux)
+  char procpath[32];
+  int fd = fileno(fp);
+  snprintf(procpath,32,"/proc/self/fd/%d",fd);
+  // get pathname from /proc or copy (unknown)
+  if (readlink(procpath,buf,len-1) <= 0) strcpy(buf,"(unknown)");
+#else
+  strcpy(buf,"(unknown)");
+#endif
+  return buf;
+}
+
+#define MAXPATHLENBUF 1024
 /* like fgets() but aborts with an error or EOF is encountered */
 void utils::sfgets(const char *srcname, int srcline, char *s, int size,
                    FILE *fp, const char *filename, Error *error)
 {
   char *rv = fgets(s,size,fp);
   if (rv == NULL) { // something went wrong
+    char buf[MAXPATHLENBUF];
     std::string errmsg;
 
+    // try to figure out the file name from the file pointer
+    if (!filename)
+      filename = guesspath(buf,MAXPATHLENBUF,fp);
+
     if (feof(fp)) {
       errmsg = "Unexpected end of file while reading file '";
     } else if (ferror(fp)) {
@@ -131,32 +160,18 @@ void utils::sfgets(const char *srcname, int srcline, char *s, int size,
   return;
 }
 
-#define MAXFILEBUF 1024
 /* like fread() but aborts with an error or EOF is encountered */
 void utils::sfread(const char *srcname, int srcline, void *s, size_t size,
                    size_t num, FILE *fp, const char *filename, Error *error)
 {
-  char inferred_name[MAXFILEBUF];
   size_t rv = fread(s,size,num,fp);
   if (rv != num) { // something went wrong
+    char buf[MAXPATHLENBUF];
     std::string errmsg;
 
     // try to figure out the file name from the file pointer
-    if (!filename) {
-      // on Linux we can infer the name of the open file from /proc
-      // otherwise we set it to "(unknown)"
-#if defined(__linux)
-      char procpath[32];
-      int fd = fileno(fp);
-      snprintf(procpath,32,"/proc/self/fd/%d",fd);
-      memset(inferred_name,0,MAXFILEBUF);
-      if (readlink(procpath,inferred_name,MAXFILEBUF) <= 0)
-        strcpy(inferred_name,"(unknown)");
-#else
-      strcpy(inferred_name,"(unknown)");
-#endif
-      filename = inferred_name;
-    }
+    if (!filename)
+      filename = guesspath(buf,MAXPATHLENBUF,fp);
 
     if (feof(fp)) {
       errmsg = "Unexpected end of file while reading file '";
diff --git a/src/utils.h b/src/utils.h
index 8b18f95c77..e87aa4bb91 100644
--- a/src/utils.h
+++ b/src/utils.h
@@ -63,7 +63,7 @@ namespace LAMMPS_NS {
      *  \param s        buffer for storing the result of fgets()
      *  \param size     size of buffer s (max number of bytes read by fgets())
      *  \param fp       file pointer used by fgets()
-     *  \param filename file name associated with fp (for error message)
+     *  \param filename file name associated with fp (may be NULL; then LAMMPS will try to detect)
      *  \param error    pointer to Error class instance (for abort)
      */
     void sfgets(const char *srcname, int srcline, char *s, int size,

From 7358a3ce06223419c7ca7778ed71440f53ce6d33 Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Fri, 18 Oct 2019 18:34:39 -0400
Subject: [PATCH 14/21] mirror changes to conventional build to forcibly enable
 c++11 for intel compilers

---
 cmake/CMakeLists.txt | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/cmake/CMakeLists.txt b/cmake/CMakeLists.txt
index af782d28ae..a9644bf4db 100644
--- a/cmake/CMakeLists.txt
+++ b/cmake/CMakeLists.txt
@@ -53,7 +53,7 @@ include(CheckCCompilerFlag)
 include(CheckIncludeFileCXX)
 
 if(${CMAKE_CXX_COMPILER_ID} STREQUAL "Intel")
-  set (CMAKE_CXX_FLAGS "${CMAKE_CXX_FLAGS} -restrict")
+  set (CMAKE_CXX_FLAGS "${CMAKE_CXX_FLAGS} -restrict -std=c++11")
 endif()
 
 option(DISABLE_CXX11_REQUIREMENT "Disable check that requires C++11 for compiling LAMMPS" OFF)

From 73892711a5dfc41288ae16b0ad83ae3748452b32 Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Sat, 19 Oct 2019 08:26:31 -0400
Subject: [PATCH 15/21] mass replace calls to fread() with utils::sfread()

---
 src/MANYBODY/pair_atm.cpp                     |  9 +-
 src/MC/pair_dsmc.cpp                          | 17 ++--
 src/MISC/pair_nm_cut.cpp                      | 21 +++--
 src/MISC/pair_nm_cut_coul_cut.cpp             | 25 ++---
 src/MISC/pair_nm_cut_coul_long.cpp            | 27 +++---
 src/MOLECULE/angle_charmm.cpp                 |  9 +-
 src/MOLECULE/angle_cosine.cpp                 |  3 +-
 src/MOLECULE/angle_cosine_periodic.cpp        |  7 +-
 src/MOLECULE/angle_cosine_squared.cpp         |  5 +-
 src/MOLECULE/angle_harmonic.cpp               |  5 +-
 src/MOLECULE/angle_table.cpp                  |  5 +-
 src/MOLECULE/bond_fene.cpp                    |  9 +-
 src/MOLECULE/bond_fene_expand.cpp             | 11 ++-
 src/MOLECULE/bond_gromos.cpp                  |  5 +-
 src/MOLECULE/bond_harmonic.cpp                |  5 +-
 src/MOLECULE/bond_morse.cpp                   |  7 +-
 src/MOLECULE/bond_nonlinear.cpp               |  7 +-
 src/MOLECULE/bond_quartic.cpp                 | 11 ++-
 src/MOLECULE/bond_table.cpp                   |  4 +-
 src/MOLECULE/dihedral_charmm.cpp              | 11 ++-
 src/MOLECULE/dihedral_charmmfsw.cpp           | 11 ++-
 src/MOLECULE/dihedral_harmonic.cpp            |  7 +-
 src/MOLECULE/dihedral_helix.cpp               |  7 +-
 src/MOLECULE/dihedral_multi_harmonic.cpp      | 11 ++-
 src/MOLECULE/dihedral_opls.cpp                |  9 +-
 src/MOLECULE/improper_cvff.cpp                |  7 +-
 src/MOLECULE/improper_harmonic.cpp            |  5 +-
 src/MOLECULE/improper_umbrella.cpp            |  7 +-
 src/MOLECULE/pair_lj_charmm_coul_charmm.cpp   | 23 ++---
 .../pair_lj_charmmfsw_coul_charmmfsh.cpp      | 21 +++--
 src/MOLECULE/pair_lj_cut_tip4p_cut.cpp        | 29 +++---
 src/MOLECULE/pair_tip4p_cut.cpp               | 15 +--
 src/PERI/pair_peri_eps.cpp                    | 15 +--
 src/PERI/pair_peri_lps.cpp                    | 13 +--
 src/PERI/pair_peri_pmb.cpp                    | 11 ++-
 src/PERI/pair_peri_ves.cpp                    | 17 ++--
 src/SPIN/pair_spin_dipole_cut.cpp             | 10 +-
 src/SPIN/pair_spin_dipole_long.cpp            | 10 +-
 src/SPIN/pair_spin_dmi.cpp                    | 25 ++---
 src/SPIN/pair_spin_exchange.cpp               | 19 ++--
 src/SPIN/pair_spin_magelec.cpp                | 19 ++--
 src/SPIN/pair_spin_neel.cpp                   | 27 +++---
 src/USER-AWPMD/pair_awpmd_cut.cpp             | 11 ++-
 src/USER-CGDNA/bond_oxdna_fene.cpp            |  7 +-
 src/USER-CGDNA/pair_oxdna2_coaxstk.cpp        | 71 ++++++++-------
 src/USER-CGDNA/pair_oxdna2_dh.cpp             | 19 ++--
 src/USER-CGDNA/pair_oxdna_coaxstk.cpp         | 83 ++++++++---------
 src/USER-CGDNA/pair_oxdna_excv.cpp            | 39 ++++----
 src/USER-CGDNA/pair_oxdna_hbond.cpp           | 91 ++++++++++---------
 src/USER-CGDNA/pair_oxdna_stk.cpp             | 77 ++++++++--------
 src/USER-CGDNA/pair_oxdna_xstk.cpp            | 87 +++++++++---------
 src/USER-CGSDK/angle_sdk.cpp                  |  7 +-
 src/USER-CGSDK/pair_lj_sdk.cpp                | 19 ++--
 src/USER-CGSDK/pair_lj_sdk_coul_long.cpp      | 25 ++---
 src/USER-DPD/pair_dpd_fdt.cpp                 | 17 ++--
 src/USER-DPD/pair_dpd_fdt_energy.cpp          | 17 ++--
 src/USER-DPD/pair_exp6_rx.cpp                 | 13 +--
 src/USER-DPD/pair_multi_lucy.cpp              |  5 +-
 src/USER-DPD/pair_multi_lucy_rx.cpp           |  5 +-
 src/USER-DRUDE/pair_lj_cut_thole_long.cpp     | 31 ++++---
 src/USER-DRUDE/pair_thole.cpp                 | 17 ++--
 src/USER-EFF/pair_eff_cut.cpp                 | 11 ++-
 src/USER-FEP/pair_coul_cut_soft.cpp           | 17 ++--
 src/USER-FEP/pair_coul_long_soft.cpp          | 15 +--
 .../pair_lj_charmm_coul_long_soft.cpp         | 29 +++---
 src/USER-FEP/pair_lj_class2_coul_cut_soft.cpp | 29 +++---
 .../pair_lj_class2_coul_long_soft.cpp         | 27 +++---
 src/USER-FEP/pair_lj_class2_soft.cpp          | 23 ++---
 src/USER-FEP/pair_lj_cut_coul_cut_soft.cpp    | 29 +++---
 src/USER-FEP/pair_lj_cut_coul_long_soft.cpp   | 27 +++---
 src/USER-FEP/pair_lj_cut_soft.cpp             | 23 ++---
 src/USER-FEP/pair_lj_cut_tip4p_long_soft.cpp  | 21 +++--
 src/USER-FEP/pair_morse_soft.cpp              | 13 +--
 src/USER-FEP/pair_tip4p_long_soft.cpp         | 11 ++-
 src/USER-MESO/pair_edpd.cpp                   | 27 +++---
 src/USER-MESO/pair_mdpd.cpp                   | 21 +++--
 src/USER-MESO/pair_tdpd.cpp                   | 27 +++---
 src/USER-MISC/angle_cosine_shift.cpp          |  9 +-
 src/USER-MISC/angle_cosine_shift_exp.cpp      | 11 ++-
 src/USER-MISC/angle_dipole.cpp                |  5 +-
 src/USER-MISC/angle_fourier.cpp               |  9 +-
 src/USER-MISC/angle_fourier_simple.cpp        |  7 +-
 src/USER-MISC/angle_quartic.cpp               |  9 +-
 src/USER-MISC/bond_harmonic_shift.cpp         |  7 +-
 src/USER-MISC/bond_harmonic_shift_cut.cpp     |  7 +-
 src/USER-MISC/dihedral_cosine_shift_exp.cpp   | 11 ++-
 src/USER-MISC/dihedral_fourier.cpp            |  9 +-
 src/USER-MISC/dihedral_nharmonic.cpp          |  5 +-
 src/USER-MISC/dihedral_quadratic.cpp          |  5 +-
 src/USER-MISC/dihedral_spherical.cpp          | 23 ++---
 src/USER-MISC/dihedral_table.cpp              |  5 +-
 src/USER-MISC/dihedral_table_cut.cpp          |  4 +-
 src/USER-MISC/improper_cossq.cpp              |  5 +-
 src/USER-MISC/improper_distance.cpp           |  5 +-
 src/USER-MISC/improper_fourier.cpp            | 11 ++-
 src/USER-MISC/improper_ring.cpp               |  5 +-
 src/USER-MISC/pair_buck_mdf.cpp               | 19 ++--
 src/USER-MISC/pair_cosine_squared.cpp         | 13 +--
 src/USER-MISC/pair_coul_diel.cpp              | 13 +--
 src/USER-MISC/pair_coul_shield.cpp            | 11 ++-
 src/USER-MISC/pair_gauss_cut.cpp              | 17 ++--
 src/USER-MISC/pair_lennard_mdf.cpp            | 13 +--
 src/USER-MISC/pair_lj_expand_coul_long.cpp    | 25 ++---
 src/USER-MISC/pair_lj_mdf.cpp                 | 13 +--
 src/USER-MISC/pair_lj_sf_dipole_sf.cpp        | 19 ++--
 src/USER-MISC/pair_momb.cpp                   | 25 ++---
 src/USER-MISC/pair_morse_smooth_linear.cpp    | 15 +--
 src/USER-MISC/pair_srp.cpp                    | 20 ++--
 src/USER-MOFFF/angle_class2_p6.cpp            | 27 +++---
 src/USER-MOFFF/angle_cosine_buck6d.cpp        |  7 +-
 .../improper_inversion_harmonic.cpp           |  5 +-
 src/USER-MOFFF/pair_buck6d_coul_gauss_dsf.cpp | 27 +++---
 .../pair_buck6d_coul_gauss_long.cpp           | 29 +++---
 src/USER-YAFF/angle_cross.cpp                 | 13 +--
 src/USER-YAFF/angle_mm3.cpp                   |  5 +-
 src/USER-YAFF/bond_mm3.cpp                    |  5 +-
 src/USER-YAFF/improper_distharm.cpp           |  5 +-
 src/USER-YAFF/improper_sqdistharm.cpp         |  5 +-
 .../pair_lj_switch3_coulgauss_long.cpp        | 27 +++---
 .../pair_mm3_switch3_coulgauss_long.cpp       | 28 +++---
 120 files changed, 1082 insertions(+), 968 deletions(-)

diff --git a/src/MANYBODY/pair_atm.cpp b/src/MANYBODY/pair_atm.cpp
index e604f44003..e943b6bfdd 100644
--- a/src/MANYBODY/pair_atm.cpp
+++ b/src/MANYBODY/pair_atm.cpp
@@ -27,6 +27,7 @@
 #include "neigh_list.h"
 #include "neigh_request.h"
 #include "neighbor.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -310,10 +311,10 @@ void PairATM::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) for (k = j; k <= atom->ntypes; k++) {
-        if (me == 0) fread(&nu[i][j][k],sizeof(double),1,fp);
+          if (me == 0) utils::sfread(FLERR,&nu[i][j][k],sizeof(double),1,fp,NULL,error);
         MPI_Bcast(&nu[i][j][k],1,MPI_DOUBLE,0,world);
       }
     }
@@ -338,8 +339,8 @@ void PairATM::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&cut_triple,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_triple,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_triple,1,MPI_DOUBLE,0,world);
diff --git a/src/MC/pair_dsmc.cpp b/src/MC/pair_dsmc.cpp
index 43bffa7e8d..dbb68b56f7 100644
--- a/src/MC/pair_dsmc.cpp
+++ b/src/MC/pair_dsmc.cpp
@@ -27,6 +27,7 @@
 #include "domain.h"
 #include "update.h"
 #include "random_mars.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -345,12 +346,12 @@ void PairDSMC::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -378,11 +379,11 @@ void PairDSMC::write_restart_settings(FILE *fp)
 void PairDSMC::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&max_cell_size,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&max_cell_size,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/MISC/pair_nm_cut.cpp b/src/MISC/pair_nm_cut.cpp
index a084491a78..07731fe93b 100644
--- a/src/MISC/pair_nm_cut.cpp
+++ b/src/MISC/pair_nm_cut.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -318,15 +319,15 @@ void PairNMCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&e0[i][j],sizeof(double),1,fp);
-          fread(&r0[i][j],sizeof(double),1,fp);
-          fread(&nn[i][j],sizeof(double),1,fp);
-          fread(&mm[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&e0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&r0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&nn[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&mm[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&e0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&r0[i][j],1,MPI_DOUBLE,0,world);
@@ -356,10 +357,10 @@ void PairNMCut::write_restart_settings(FILE *fp)
 void PairNMCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/MISC/pair_nm_cut_coul_cut.cpp b/src/MISC/pair_nm_cut_coul_cut.cpp
index df8a34062a..270f4080ee 100644
--- a/src/MISC/pair_nm_cut_coul_cut.cpp
+++ b/src/MISC/pair_nm_cut_coul_cut.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -369,16 +370,16 @@ void PairNMCutCoulCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&e0[i][j],sizeof(double),1,fp);
-          fread(&r0[i][j],sizeof(double),1,fp);
-          fread(&nn[i][j],sizeof(double),1,fp);
-          fread(&mm[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&e0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&r0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&nn[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&mm[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&e0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&r0[i][j],1,MPI_DOUBLE,0,world);
@@ -410,11 +411,11 @@ void PairNMCutCoulCut::write_restart_settings(FILE *fp)
 void PairNMCutCoulCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul_global,1,MPI_DOUBLE,0,world);
diff --git a/src/MISC/pair_nm_cut_coul_long.cpp b/src/MISC/pair_nm_cut_coul_long.cpp
index 4109fb0d9e..b63ede2b63 100644
--- a/src/MISC/pair_nm_cut_coul_long.cpp
+++ b/src/MISC/pair_nm_cut_coul_long.cpp
@@ -28,6 +28,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -413,15 +414,15 @@ void PairNMCutCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&e0[i][j],sizeof(double),1,fp);
-          fread(&r0[i][j],sizeof(double),1,fp);
-          fread(&nn[i][j],sizeof(double),1,fp);
-          fread(&mm[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&e0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&r0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&nn[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&mm[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&e0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&r0[i][j],1,MPI_DOUBLE,0,world);
@@ -454,13 +455,13 @@ void PairNMCutCoulLong::write_restart_settings(FILE *fp)
 void PairNMCutCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/angle_charmm.cpp b/src/MOLECULE/angle_charmm.cpp
index 8a45f29368..161ad90ea3 100644
--- a/src/MOLECULE/angle_charmm.cpp
+++ b/src/MOLECULE/angle_charmm.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -245,10 +246,10 @@ void AngleCharmm::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k_ub[1],sizeof(double),atom->nangletypes,fp);
-    fread(&r_ub[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k_ub[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&r_ub[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&theta0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/angle_cosine.cpp b/src/MOLECULE/angle_cosine.cpp
index 645cf66ff2..59593d2448 100644
--- a/src/MOLECULE/angle_cosine.cpp
+++ b/src/MOLECULE/angle_cosine.cpp
@@ -22,6 +22,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -193,7 +194,7 @@ void AngleCosine::read_restart(FILE *fp)
 {
   allocate();
 
-  if (comm->me == 0) fread(&k[1],sizeof(double),atom->nangletypes,fp);
+  if (comm->me == 0) utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
 
   for (int i = 1; i <= atom->nangletypes; i++) setflag[i] = 1;
diff --git a/src/MOLECULE/angle_cosine_periodic.cpp b/src/MOLECULE/angle_cosine_periodic.cpp
index 22c2f7ce8b..95f299683e 100644
--- a/src/MOLECULE/angle_cosine_periodic.cpp
+++ b/src/MOLECULE/angle_cosine_periodic.cpp
@@ -27,6 +27,7 @@
 #include "math_special.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -246,9 +247,9 @@ void AngleCosinePeriodic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&b[1],sizeof(int),atom->nangletypes,fp);
-    fread(&multiplicity[1],sizeof(int),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&b[1],sizeof(int),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&multiplicity[1],sizeof(int),atom->nangletypes,fp,NULL,error);
   }
 
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/angle_cosine_squared.cpp b/src/MOLECULE/angle_cosine_squared.cpp
index 56b3ee58cf..9056600c3f 100644
--- a/src/MOLECULE/angle_cosine_squared.cpp
+++ b/src/MOLECULE/angle_cosine_squared.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -215,8 +216,8 @@ void AngleCosineSquared::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&theta0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/angle_harmonic.cpp b/src/MOLECULE/angle_harmonic.cpp
index 2e96884c9d..baeb9a8ed8 100644
--- a/src/MOLECULE/angle_harmonic.cpp
+++ b/src/MOLECULE/angle_harmonic.cpp
@@ -22,6 +22,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -215,8 +216,8 @@ void AngleHarmonic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&theta0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/angle_table.cpp b/src/MOLECULE/angle_table.cpp
index 54046c2ba8..b6439084a6 100644
--- a/src/MOLECULE/angle_table.cpp
+++ b/src/MOLECULE/angle_table.cpp
@@ -29,6 +29,7 @@
 #include "memory.h"
 #include "error.h"
 #include "utils.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -309,8 +310,8 @@ void AngleTable::write_restart_settings(FILE *fp)
 void AngleTable::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&tabstyle,sizeof(int),1,fp);
-    fread(&tablength,sizeof(int),1,fp);
+    utils::sfread(FLERR,&tabstyle,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tablength,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&tabstyle,1,MPI_INT,0,world);
   MPI_Bcast(&tablength,1,MPI_INT,0,world);
diff --git a/src/MOLECULE/bond_fene.cpp b/src/MOLECULE/bond_fene.cpp
index 776291701b..b8e197a344 100644
--- a/src/MOLECULE/bond_fene.cpp
+++ b/src/MOLECULE/bond_fene.cpp
@@ -21,6 +21,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -215,10 +216,10 @@ void BondFENE::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&epsilon[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&sigma[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&epsilon[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&sigma[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/bond_fene_expand.cpp b/src/MOLECULE/bond_fene_expand.cpp
index d03dfd9125..9cdc2639a5 100644
--- a/src/MOLECULE/bond_fene_expand.cpp
+++ b/src/MOLECULE/bond_fene_expand.cpp
@@ -21,6 +21,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -224,11 +225,11 @@ void BondFENEExpand::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&epsilon[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&sigma[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&shift[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&epsilon[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&sigma[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&shift[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/bond_gromos.cpp b/src/MOLECULE/bond_gromos.cpp
index 284c9202fd..6732cc4457 100644
--- a/src/MOLECULE/bond_gromos.cpp
+++ b/src/MOLECULE/bond_gromos.cpp
@@ -24,6 +24,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -166,8 +167,8 @@ void BondGromos::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/bond_harmonic.cpp b/src/MOLECULE/bond_harmonic.cpp
index 7b19034629..569c92f99d 100644
--- a/src/MOLECULE/bond_harmonic.cpp
+++ b/src/MOLECULE/bond_harmonic.cpp
@@ -21,6 +21,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -167,8 +168,8 @@ void BondHarmonic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/bond_morse.cpp b/src/MOLECULE/bond_morse.cpp
index 6e16070cae..249f92928f 100644
--- a/src/MOLECULE/bond_morse.cpp
+++ b/src/MOLECULE/bond_morse.cpp
@@ -24,6 +24,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -171,9 +172,9 @@ void BondMorse::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&d0[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&alpha[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&d0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&alpha[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&d0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&alpha[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/bond_nonlinear.cpp b/src/MOLECULE/bond_nonlinear.cpp
index e06b1b9aac..ee943ad28f 100644
--- a/src/MOLECULE/bond_nonlinear.cpp
+++ b/src/MOLECULE/bond_nonlinear.cpp
@@ -20,6 +20,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -166,9 +167,9 @@ void BondNonlinear::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&epsilon[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&lamda[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&epsilon[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&lamda[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&epsilon[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/bond_quartic.cpp b/src/MOLECULE/bond_quartic.cpp
index 352b642bbe..813e322473 100644
--- a/src/MOLECULE/bond_quartic.cpp
+++ b/src/MOLECULE/bond_quartic.cpp
@@ -25,6 +25,7 @@
 #include "pair.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -275,11 +276,11 @@ void BondQuartic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&b1[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&b2[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&rc[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&u0[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&b1[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&b2[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&rc[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&u0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&b1[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/bond_table.cpp b/src/MOLECULE/bond_table.cpp
index ce41303a7d..20e4e311c8 100644
--- a/src/MOLECULE/bond_table.cpp
+++ b/src/MOLECULE/bond_table.cpp
@@ -252,8 +252,8 @@ void BondTable::write_restart_settings(FILE *fp)
 void BondTable::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&tabstyle,sizeof(int),1,fp);
-    fread(&tablength,sizeof(int),1,fp);
+    utils::sfread(FLERR,&tabstyle,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tablength,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&tabstyle,1,MPI_INT,0,world);
   MPI_Bcast(&tablength,1,MPI_INT,0,world);
diff --git a/src/MOLECULE/dihedral_charmm.cpp b/src/MOLECULE/dihedral_charmm.cpp
index 8cc0713024..e66165efd7 100644
--- a/src/MOLECULE/dihedral_charmm.cpp
+++ b/src/MOLECULE/dihedral_charmm.cpp
@@ -29,6 +29,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -423,11 +424,11 @@ void DihedralCharmm::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&multiplicity[1],sizeof(int),atom->ndihedraltypes,fp);
-    fread(&shift[1],sizeof(int),atom->ndihedraltypes,fp);
-    fread(&weight[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&weightflag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&multiplicity[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&shift[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&weight[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&weightflag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&multiplicity[1],atom->ndihedraltypes,MPI_INT,0,world);
diff --git a/src/MOLECULE/dihedral_charmmfsw.cpp b/src/MOLECULE/dihedral_charmmfsw.cpp
index f384c4cd36..efff35d9c5 100644
--- a/src/MOLECULE/dihedral_charmmfsw.cpp
+++ b/src/MOLECULE/dihedral_charmmfsw.cpp
@@ -32,6 +32,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -466,11 +467,11 @@ void DihedralCharmmfsw::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&multiplicity[1],sizeof(int),atom->ndihedraltypes,fp);
-    fread(&shift[1],sizeof(int),atom->ndihedraltypes,fp);
-    fread(&weight[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&weightflag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&multiplicity[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&shift[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&weight[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&weightflag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&multiplicity[1],atom->ndihedraltypes,MPI_INT,0,world);
diff --git a/src/MOLECULE/dihedral_harmonic.cpp b/src/MOLECULE/dihedral_harmonic.cpp
index 4f6a88eca5..48adf07903 100644
--- a/src/MOLECULE/dihedral_harmonic.cpp
+++ b/src/MOLECULE/dihedral_harmonic.cpp
@@ -25,6 +25,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -327,9 +328,9 @@ void DihedralHarmonic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&sign[1],sizeof(int),atom->ndihedraltypes,fp);
-    fread(&multiplicity[1],sizeof(int),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&sign[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&multiplicity[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&sign[1],atom->ndihedraltypes,MPI_INT,0,world);
diff --git a/src/MOLECULE/dihedral_helix.cpp b/src/MOLECULE/dihedral_helix.cpp
index 56f7a3b5e8..26461883c6 100644
--- a/src/MOLECULE/dihedral_helix.cpp
+++ b/src/MOLECULE/dihedral_helix.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -322,9 +323,9 @@ void DihedralHelix::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&aphi[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&bphi[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&cphi[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&aphi[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&bphi[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&cphi[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
   }
   MPI_Bcast(&aphi[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&bphi[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/dihedral_multi_harmonic.cpp b/src/MOLECULE/dihedral_multi_harmonic.cpp
index eda7cede3e..b5db685247 100644
--- a/src/MOLECULE/dihedral_multi_harmonic.cpp
+++ b/src/MOLECULE/dihedral_multi_harmonic.cpp
@@ -25,6 +25,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -318,11 +319,11 @@ void DihedralMultiHarmonic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&a1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&a2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&a3[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&a4[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&a5[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&a1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&a2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&a3[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&a4[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&a5[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
   }
   MPI_Bcast(&a1[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&a2[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/dihedral_opls.cpp b/src/MOLECULE/dihedral_opls.cpp
index 556efd850a..5dd268b39f 100644
--- a/src/MOLECULE/dihedral_opls.cpp
+++ b/src/MOLECULE/dihedral_opls.cpp
@@ -25,6 +25,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -330,10 +331,10 @@ void DihedralOPLS::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k1[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&k2[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&k3[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&k4[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&k1[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&k3[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&k4[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
   }
   MPI_Bcast(&k1[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&k2[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/improper_cvff.cpp b/src/MOLECULE/improper_cvff.cpp
index abd2d4e11e..0ffb3f3c31 100644
--- a/src/MOLECULE/improper_cvff.cpp
+++ b/src/MOLECULE/improper_cvff.cpp
@@ -21,6 +21,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -333,9 +334,9 @@ void ImproperCvff::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&sign[1],sizeof(int),atom->nimpropertypes,fp);
-    fread(&multiplicity[1],sizeof(int),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&sign[1],sizeof(int),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&multiplicity[1],sizeof(int),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&sign[1],atom->nimpropertypes,MPI_INT,0,world);
diff --git a/src/MOLECULE/improper_harmonic.cpp b/src/MOLECULE/improper_harmonic.cpp
index 778fe646e1..e90bc04c90 100644
--- a/src/MOLECULE/improper_harmonic.cpp
+++ b/src/MOLECULE/improper_harmonic.cpp
@@ -22,6 +22,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -274,8 +275,8 @@ void ImproperHarmonic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&chi[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&chi[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&chi[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/improper_umbrella.cpp b/src/MOLECULE/improper_umbrella.cpp
index d3adf19993..5259b6baf4 100644
--- a/src/MOLECULE/improper_umbrella.cpp
+++ b/src/MOLECULE/improper_umbrella.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -315,9 +316,9 @@ void ImproperUmbrella::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&kw[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&w0[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&C[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&kw[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&w0[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&C[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&kw[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&w0[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/pair_lj_charmm_coul_charmm.cpp b/src/MOLECULE/pair_lj_charmm_coul_charmm.cpp
index 5ebfe0a110..0712f6be73 100644
--- a/src/MOLECULE/pair_lj_charmm_coul_charmm.cpp
+++ b/src/MOLECULE/pair_lj_charmm_coul_charmm.cpp
@@ -26,6 +26,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -374,14 +375,14 @@ void PairLJCharmmCoulCharmm::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&eps14[i][j],sizeof(double),1,fp);
-          fread(&sigma14[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&eps14[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma14[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -435,12 +436,12 @@ void PairLJCharmmCoulCharmm::write_restart_settings(FILE *fp)
 void PairLJCharmmCoulCharmm::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_inner,sizeof(double),1,fp);
-    fread(&cut_lj,sizeof(double),1,fp);
-    fread(&cut_coul_inner,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_inner,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj,1,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/pair_lj_charmmfsw_coul_charmmfsh.cpp b/src/MOLECULE/pair_lj_charmmfsw_coul_charmmfsh.cpp
index 4fb7cc5229..026b96c00c 100644
--- a/src/MOLECULE/pair_lj_charmmfsw_coul_charmmfsh.cpp
+++ b/src/MOLECULE/pair_lj_charmmfsw_coul_charmmfsh.cpp
@@ -31,6 +31,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -432,14 +433,14 @@ void PairLJCharmmfswCoulCharmmfsh::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&eps14[i][j],sizeof(double),1,fp);
-          fread(&sigma14[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&eps14[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma14[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -469,11 +470,11 @@ void PairLJCharmmfswCoulCharmmfsh::write_restart_settings(FILE *fp)
 void PairLJCharmmfswCoulCharmmfsh::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_inner,sizeof(double),1,fp);
-    fread(&cut_lj,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_inner,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj,1,MPI_DOUBLE,0,world);
diff --git a/src/MOLECULE/pair_lj_cut_tip4p_cut.cpp b/src/MOLECULE/pair_lj_cut_tip4p_cut.cpp
index e5f25a511b..673fb83066 100644
--- a/src/MOLECULE/pair_lj_cut_tip4p_cut.cpp
+++ b/src/MOLECULE/pair_lj_cut_tip4p_cut.cpp
@@ -30,6 +30,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -617,13 +618,13 @@ void PairLJCutTIP4PCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -659,17 +660,17 @@ void PairLJCutTIP4PCut::write_restart_settings(FILE *fp)
 void PairLJCutTIP4PCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&typeO,sizeof(int),1,fp);
-    fread(&typeH,sizeof(int),1,fp);
-    fread(&typeB,sizeof(int),1,fp);
-    fread(&typeA,sizeof(int),1,fp);
-    fread(&qdist,sizeof(double),1,fp);
+    utils::sfread(FLERR,&typeO,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeH,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeB,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeA,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&qdist,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&typeO,1,MPI_INT,0,world);
diff --git a/src/MOLECULE/pair_tip4p_cut.cpp b/src/MOLECULE/pair_tip4p_cut.cpp
index 3a6702c9b2..334dbf89c8 100644
--- a/src/MOLECULE/pair_tip4p_cut.cpp
+++ b/src/MOLECULE/pair_tip4p_cut.cpp
@@ -28,6 +28,7 @@
 #include "comm.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -474,7 +475,7 @@ void PairTIP4PCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
     }
 }
@@ -501,13 +502,13 @@ void PairTIP4PCut::write_restart_settings(FILE *fp)
 void PairTIP4PCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&typeO,sizeof(int),1,fp);
-    fread(&typeH,sizeof(int),1,fp);
-    fread(&typeB,sizeof(int),1,fp);
-    fread(&typeA,sizeof(int),1,fp);
-    fread(&qdist,sizeof(double),1,fp);
+    utils::sfread(FLERR,&typeO,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeH,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeB,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeA,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&qdist,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_coul,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
   }
 
   MPI_Bcast(&typeO,1,MPI_INT,0,world);
diff --git a/src/PERI/pair_peri_eps.cpp b/src/PERI/pair_peri_eps.cpp
index 2579a9b75a..595070265c 100644
--- a/src/PERI/pair_peri_eps.cpp
+++ b/src/PERI/pair_peri_eps.cpp
@@ -31,6 +31,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -564,16 +565,16 @@ void PairPeriEPS::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&bulkmodulus[i][j],sizeof(double),1,fp);
-          fread(&shearmodulus[i][j],sizeof(double),1,fp);
-          fread(&s00[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
-          fread(&m_yieldstress[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&bulkmodulus[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&shearmodulus[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&s00[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&m_yieldstress[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&bulkmodulus[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&shearmodulus[i][j],1,MPI_DOUBLE,0,world);
diff --git a/src/PERI/pair_peri_lps.cpp b/src/PERI/pair_peri_lps.cpp
index f32ce5fb1c..18fee8eeb8 100644
--- a/src/PERI/pair_peri_lps.cpp
+++ b/src/PERI/pair_peri_lps.cpp
@@ -31,6 +31,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "math_const.h"
 
 using namespace LAMMPS_NS;
@@ -489,15 +490,15 @@ void PairPeriLPS::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&bulkmodulus[i][j],sizeof(double),1,fp);
-          fread(&shearmodulus[i][j],sizeof(double),1,fp);
-          fread(&s00[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&bulkmodulus[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&shearmodulus[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&s00[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&bulkmodulus[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&shearmodulus[i][j],1,MPI_DOUBLE,0,world);
diff --git a/src/PERI/pair_peri_pmb.cpp b/src/PERI/pair_peri_pmb.cpp
index ceab40d88d..c268bec6ed 100644
--- a/src/PERI/pair_peri_pmb.cpp
+++ b/src/PERI/pair_peri_pmb.cpp
@@ -32,6 +32,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -418,14 +419,14 @@ void PairPeriPMB::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&kspring[i][j],sizeof(double),1,fp);
-          fread(&s00[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&kspring[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&s00[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&kspring[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&s00[i][j],1,MPI_DOUBLE,0,world);
diff --git a/src/PERI/pair_peri_ves.cpp b/src/PERI/pair_peri_ves.cpp
index bd1eaa5fd2..a0b33def16 100644
--- a/src/PERI/pair_peri_ves.cpp
+++ b/src/PERI/pair_peri_ves.cpp
@@ -31,6 +31,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "update.h"
 
 using namespace LAMMPS_NS;
@@ -547,17 +548,17 @@ void PairPeriVES::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&bulkmodulus[i][j],sizeof(double),1,fp);
-          fread(&shearmodulus[i][j],sizeof(double),1,fp);
-          fread(&s00[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
-          fread(&m_lambdai[i][j],sizeof(double),1,fp);
-          fread(&m_taubi[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&bulkmodulus[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&shearmodulus[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&s00[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&m_lambdai[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&m_taubi[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&bulkmodulus[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&shearmodulus[i][j],1,MPI_DOUBLE,0,world);
diff --git a/src/SPIN/pair_spin_dipole_cut.cpp b/src/SPIN/pair_spin_dipole_cut.cpp
index ebcc59d499..e0a9405a3a 100644
--- a/src/SPIN/pair_spin_dipole_cut.cpp
+++ b/src/SPIN/pair_spin_dipole_cut.cpp
@@ -38,7 +38,7 @@
 #include "modify.h"
 #include "error.h"
 #include "update.h"
-
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -500,11 +500,11 @@ void PairSpinDipoleCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
 	if (me == 0) {
-	  fread(&cut_spin_long[i][j],sizeof(int),1,fp);
+	  utils::sfread(FLERR,&cut_spin_long[i][j],sizeof(int),1,fp,NULL,error);
 	}
 	MPI_Bcast(&cut_spin_long[i][j],1,MPI_INT,0,world);
       }
@@ -529,8 +529,8 @@ void PairSpinDipoleCut::write_restart_settings(FILE *fp)
 void PairSpinDipoleCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_spin_long_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_spin_long_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_spin_long_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/SPIN/pair_spin_dipole_long.cpp b/src/SPIN/pair_spin_dipole_long.cpp
index bb42fb70b4..878325a90f 100644
--- a/src/SPIN/pair_spin_dipole_long.cpp
+++ b/src/SPIN/pair_spin_dipole_long.cpp
@@ -34,7 +34,7 @@
 #include "modify.h"
 #include "error.h"
 #include "update.h"
-
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -566,11 +566,11 @@ void PairSpinDipoleLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&cut_spin_long[i][j],sizeof(int),1,fp);
+          utils::sfread(FLERR,&cut_spin_long[i][j],sizeof(int),1,fp,NULL,error);
         }
         MPI_Bcast(&cut_spin_long[i][j],1,MPI_INT,0,world);
       }
@@ -595,8 +595,8 @@ void PairSpinDipoleLong::write_restart_settings(FILE *fp)
 void PairSpinDipoleLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_spin_long_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_spin_long_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_spin_long_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/SPIN/pair_spin_dmi.cpp b/src/SPIN/pair_spin_dmi.cpp
index 3fee84d5fc..403b2a3801 100644
--- a/src/SPIN/pair_spin_dmi.cpp
+++ b/src/SPIN/pair_spin_dmi.cpp
@@ -37,6 +37,7 @@
 #include "memory.h"
 #include "modify.h"
 #include "update.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -532,18 +533,18 @@ void PairSpinDmi::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&DM[i][j],sizeof(double),1,fp);
-          fread(&v_dmx[i][j],sizeof(double),1,fp);
-          fread(&v_dmy[i][j],sizeof(double),1,fp);
-          fread(&v_dmz[i][j],sizeof(double),1,fp);
-          fread(&vmech_dmx[i][j],sizeof(double),1,fp);
-          fread(&vmech_dmy[i][j],sizeof(double),1,fp);
-          fread(&vmech_dmz[i][j],sizeof(double),1,fp);
-          fread(&cut_spin_dmi[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&DM[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&v_dmx[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&v_dmy[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&v_dmz[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&vmech_dmx[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&vmech_dmy[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&vmech_dmz[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_spin_dmi[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&DM[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&v_dmx[i][j],1,MPI_DOUBLE,0,world);
@@ -577,9 +578,9 @@ void PairSpinDmi::write_restart_settings(FILE *fp)
 void PairSpinDmi::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_spin_dmi_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_spin_dmi_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_spin_dmi_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/SPIN/pair_spin_exchange.cpp b/src/SPIN/pair_spin_exchange.cpp
index 7a54eba9d7..7124037664 100644
--- a/src/SPIN/pair_spin_exchange.cpp
+++ b/src/SPIN/pair_spin_exchange.cpp
@@ -37,6 +37,7 @@
 #include "memory.h"
 #include "modify.h"
 #include "update.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -497,15 +498,15 @@ void PairSpinExchange::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&J1_mag[i][j],sizeof(double),1,fp);
-          fread(&J1_mech[i][j],sizeof(double),1,fp);
-          fread(&J2[i][j],sizeof(double),1,fp);
-          fread(&J3[i][j],sizeof(double),1,fp);
-          fread(&cut_spin_exchange[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&J1_mag[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&J1_mech[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&J2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&J3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_spin_exchange[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&J1_mag[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&J1_mech[i][j],1,MPI_DOUBLE,0,world);
@@ -536,9 +537,9 @@ void PairSpinExchange::write_restart_settings(FILE *fp)
 void PairSpinExchange::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_spin_exchange_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_spin_exchange_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_spin_exchange_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/SPIN/pair_spin_magelec.cpp b/src/SPIN/pair_spin_magelec.cpp
index 6756ebc3cc..8c0980c0b5 100644
--- a/src/SPIN/pair_spin_magelec.cpp
+++ b/src/SPIN/pair_spin_magelec.cpp
@@ -37,6 +37,7 @@
 #include "memory.h"
 #include "modify.h"
 #include "update.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -516,15 +517,15 @@ void PairSpinMagelec::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&ME[i][j],sizeof(double),1,fp);
-          fread(&v_mex[i][j],sizeof(double),1,fp);
-          fread(&v_mey[i][j],sizeof(double),1,fp);
-          fread(&v_mez[i][j],sizeof(double),1,fp);
-          fread(&cut_spin_magelec[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&ME[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&v_mex[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&v_mey[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&v_mez[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_spin_magelec[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&ME[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&v_mex[i][j],1,MPI_DOUBLE,0,world);
@@ -554,9 +555,9 @@ void PairSpinMagelec::write_restart_settings(FILE *fp)
 void PairSpinMagelec::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_spin_magelec_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_spin_magelec_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_spin_magelec_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/SPIN/pair_spin_neel.cpp b/src/SPIN/pair_spin_neel.cpp
index 017682593a..1dd898a9cb 100644
--- a/src/SPIN/pair_spin_neel.cpp
+++ b/src/SPIN/pair_spin_neel.cpp
@@ -37,6 +37,7 @@
 #include "memory.h"
 #include "modify.h"
 #include "update.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -685,19 +686,19 @@ void PairSpinNeel::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&g1[i][j],sizeof(double),1,fp);
-          fread(&g1_mech[i][j],sizeof(double),1,fp);
-          fread(&g2[i][j],sizeof(double),1,fp);
-          fread(&g3[i][j],sizeof(double),1,fp);
-          fread(&q1[i][j],sizeof(double),1,fp);
-          fread(&q1_mech[i][j],sizeof(double),1,fp);
-          fread(&q2[i][j],sizeof(double),1,fp);
-          fread(&q3[i][j],sizeof(double),1,fp);
-          fread(&cut_spin_neel[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&g1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&g1_mech[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&g2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&g3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&q1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&q1_mech[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&q2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&q3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_spin_neel[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&g1[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&g1_mech[i][j],1,MPI_DOUBLE,0,world);
@@ -731,9 +732,9 @@ void PairSpinNeel::write_restart_settings(FILE *fp)
 void PairSpinNeel::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_spin_neel_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_spin_neel_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_spin_neel_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-AWPMD/pair_awpmd_cut.cpp b/src/USER-AWPMD/pair_awpmd_cut.cpp
index 75ebb0e251..c1cd804ce5 100644
--- a/src/USER-AWPMD/pair_awpmd_cut.cpp
+++ b/src/USER-AWPMD/pair_awpmd_cut.cpp
@@ -32,6 +32,7 @@
 #include "neigh_request.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 #include "logexc.h"
 #include "vector_3.h"
@@ -600,10 +601,10 @@ void PairAWPMDCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
-        if (me == 0) fread(&cut[i][j],sizeof(double),1,fp);
+        if (me == 0) utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
       }
     }
@@ -627,9 +628,9 @@ void PairAWPMDCut::write_restart_settings(FILE *fp)
 void PairAWPMDCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGDNA/bond_oxdna_fene.cpp b/src/USER-CGDNA/bond_oxdna_fene.cpp
index f549fc423d..1cb332df8f 100644
--- a/src/USER-CGDNA/bond_oxdna_fene.cpp
+++ b/src/USER-CGDNA/bond_oxdna_fene.cpp
@@ -24,6 +24,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -379,9 +380,9 @@ void BondOxdnaFene::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&Delta[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&Delta[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&Delta[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-CGDNA/pair_oxdna2_coaxstk.cpp b/src/USER-CGDNA/pair_oxdna2_coaxstk.cpp
index 609b63e27f..3687c27b31 100644
--- a/src/USER-CGDNA/pair_oxdna2_coaxstk.cpp
+++ b/src/USER-CGDNA/pair_oxdna2_coaxstk.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -829,47 +830,47 @@ void PairOxdna2Coaxstk::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
 
-          fread(&k_cxst[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_0[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_c[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_lo[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_hi[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_lc[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_hc[i][j],sizeof(double),1,fp);
-          fread(&b_cxst_lo[i][j],sizeof(double),1,fp);
-          fread(&b_cxst_hi[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&k_cxst[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_hi[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_lc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_hc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst_hi[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst1[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst1_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst1_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst1[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst1_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst1_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst1_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst1_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst4[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst4_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst4_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst4[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst4_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst4_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst4_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst4_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst5[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst5_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst5_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst5[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst5_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst5[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst5_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst5_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst5[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst5_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst6[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst6_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst6_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst6[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst6_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst6[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst6_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst6_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst6[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst6_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&AA_cxst1[i][j],sizeof(double),1,fp);
-          fread(&BB_cxst1[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&AA_cxst1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&BB_cxst1[i][j],sizeof(double),1,fp,NULL,error);
 
         }
 
@@ -933,9 +934,9 @@ void PairOxdna2Coaxstk::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGDNA/pair_oxdna2_dh.cpp b/src/USER-CGDNA/pair_oxdna2_dh.cpp
index 630dd7a559..5f2d1d24c8 100644
--- a/src/USER-CGDNA/pair_oxdna2_dh.cpp
+++ b/src/USER-CGDNA/pair_oxdna2_dh.cpp
@@ -25,6 +25,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -450,16 +451,16 @@ void PairOxdna2Dh::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
 
-          fread(&kappa_dh[i][j],sizeof(double),1,fp);
-          fread(&qeff_dh_pf[i][j],sizeof(double),1,fp);
-          fread(&b_dh[i][j],sizeof(double),1,fp);
-          fread(&cut_dh_ast[i][j],sizeof(double),1,fp);
-          fread(&cut_dh_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&kappa_dh[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&qeff_dh_pf[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_dh[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_dh_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_dh_c[i][j],sizeof(double),1,fp,NULL,error);
 
         }
 
@@ -492,9 +493,9 @@ void PairOxdna2Dh::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGDNA/pair_oxdna_coaxstk.cpp b/src/USER-CGDNA/pair_oxdna_coaxstk.cpp
index d71acc2029..61efb5522c 100644
--- a/src/USER-CGDNA/pair_oxdna_coaxstk.cpp
+++ b/src/USER-CGDNA/pair_oxdna_coaxstk.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -988,53 +989,53 @@ void PairOxdnaCoaxstk::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
 
-          fread(&k_cxst[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_0[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_c[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_lo[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_hi[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_lc[i][j],sizeof(double),1,fp);
-          fread(&cut_cxst_hc[i][j],sizeof(double),1,fp);
-          fread(&b_cxst_lo[i][j],sizeof(double),1,fp);
-          fread(&b_cxst_hi[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&k_cxst[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_hi[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_lc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_cxst_hc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst_hi[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst1[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst1_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst1_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst1[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst1_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst1_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst1_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst1_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst4[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst4_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst4_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst4[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst4_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst4_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst4_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst4_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst5[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst5_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst5_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst5[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst5_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst5[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst5_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst5_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst5[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst5_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst6[i][j],sizeof(double),1,fp);
-          fread(&theta_cxst6_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst6_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst6[i][j],sizeof(double),1,fp);
-          fread(&dtheta_cxst6_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst6[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_cxst6_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst6_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst6[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_cxst6_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_cxst3p[i][j],sizeof(double),1,fp);
-          fread(&cosphi_cxst3p_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst3p[i][j],sizeof(double),1,fp);
-          fread(&cosphi_cxst3p_c[i][j],sizeof(double),1,fp);
-          fread(&a_cxst4p[i][j],sizeof(double),1,fp);
-          fread(&cosphi_cxst4p_ast[i][j],sizeof(double),1,fp);
-          fread(&b_cxst4p[i][j],sizeof(double),1,fp);
-          fread(&cosphi_cxst4p_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_cxst3p[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_cxst3p_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst3p[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_cxst3p_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&a_cxst4p[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_cxst4p_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_cxst4p[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_cxst4p_c[i][j],sizeof(double),1,fp,NULL,error);
 
         }
 
@@ -1104,9 +1105,9 @@ void PairOxdnaCoaxstk::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGDNA/pair_oxdna_excv.cpp b/src/USER-CGDNA/pair_oxdna_excv.cpp
index f187fc7403..08d0d8b132 100644
--- a/src/USER-CGDNA/pair_oxdna_excv.cpp
+++ b/src/USER-CGDNA/pair_oxdna_excv.cpp
@@ -26,6 +26,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -710,26 +711,26 @@ void PairOxdnaExcv::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
 
-          fread(&epsilon_ss[i][j],sizeof(double),1,fp);
-          fread(&sigma_ss[i][j],sizeof(double),1,fp);
-          fread(&cut_ss_ast[i][j],sizeof(double),1,fp);
-          fread(&b_ss[i][j],sizeof(double),1,fp);
-          fread(&cut_ss_c[i][j],sizeof(double),1,fp);
-          fread(&epsilon_sb[i][j],sizeof(double),1,fp);
-          fread(&sigma_sb[i][j],sizeof(double),1,fp);
-          fread(&cut_sb_ast[i][j],sizeof(double),1,fp);
-          fread(&b_sb[i][j],sizeof(double),1,fp);
-          fread(&cut_sb_c[i][j],sizeof(double),1,fp);
-          fread(&epsilon_bb[i][j],sizeof(double),1,fp);
-          fread(&sigma_bb[i][j],sizeof(double),1,fp);
-          fread(&cut_bb_ast[i][j],sizeof(double),1,fp);
-          fread(&b_bb[i][j],sizeof(double),1,fp);
-          fread(&cut_bb_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon_ss[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma_ss[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_ss_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_ss[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_ss_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&epsilon_sb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma_sb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_sb_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_sb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_sb_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&epsilon_bb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma_bb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_bb_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_bb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_bb_c[i][j],sizeof(double),1,fp,NULL,error);
 
          }
 
@@ -772,9 +773,9 @@ void PairOxdnaExcv::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGDNA/pair_oxdna_hbond.cpp b/src/USER-CGDNA/pair_oxdna_hbond.cpp
index e9852d0e38..01339cda4d 100644
--- a/src/USER-CGDNA/pair_oxdna_hbond.cpp
+++ b/src/USER-CGDNA/pair_oxdna_hbond.cpp
@@ -26,6 +26,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -973,58 +974,58 @@ void PairOxdnaHbond::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
 
-          fread(&epsilon_hb[i][j],sizeof(double),1,fp);
-          fread(&a_hb[i][j],sizeof(double),1,fp);
-          fread(&cut_hb_0[i][j],sizeof(double),1,fp);
-          fread(&cut_hb_c[i][j],sizeof(double),1,fp);
-          fread(&cut_hb_lo[i][j],sizeof(double),1,fp);
-          fread(&cut_hb_hi[i][j],sizeof(double),1,fp);
-          fread(&cut_hb_lc[i][j],sizeof(double),1,fp);
-          fread(&cut_hb_hc[i][j],sizeof(double),1,fp);
-          fread(&b_hb_lo[i][j],sizeof(double),1,fp);
-          fread(&b_hb_hi[i][j],sizeof(double),1,fp);
-          fread(&shift_hb[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon_hb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&a_hb[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_hb_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_hb_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_hb_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_hb_hi[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_hb_lc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_hb_hc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb_hi[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&shift_hb[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_hb1[i][j],sizeof(double),1,fp);
-          fread(&theta_hb1_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb1_ast[i][j],sizeof(double),1,fp);
-          fread(&b_hb1[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb1_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_hb1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_hb1_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb1_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb1_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_hb2[i][j],sizeof(double),1,fp);
-          fread(&theta_hb2_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb2_ast[i][j],sizeof(double),1,fp);
-          fread(&b_hb2[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb2_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_hb2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_hb2_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb2_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb2_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_hb3[i][j],sizeof(double),1,fp);
-          fread(&theta_hb3_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb3_ast[i][j],sizeof(double),1,fp);
-          fread(&b_hb3[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb3_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_hb3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_hb3_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb3_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb3_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_hb4[i][j],sizeof(double),1,fp);
-          fread(&theta_hb4_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb4_ast[i][j],sizeof(double),1,fp);
-          fread(&b_hb4[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb4_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_hb4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_hb4_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb4_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb4_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_hb7[i][j],sizeof(double),1,fp);
-          fread(&theta_hb7_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb7_ast[i][j],sizeof(double),1,fp);
-          fread(&b_hb7[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb7_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_hb7[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_hb7_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb7_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb7[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb7_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_hb8[i][j],sizeof(double),1,fp);
-          fread(&theta_hb8_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb8_ast[i][j],sizeof(double),1,fp);
-          fread(&b_hb8[i][j],sizeof(double),1,fp);
-          fread(&dtheta_hb8_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_hb8[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_hb8_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb8_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_hb8[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_hb8_c[i][j],sizeof(double),1,fp,NULL,error);
 
         }
 
@@ -1099,9 +1100,9 @@ void PairOxdnaHbond::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGDNA/pair_oxdna_stk.cpp b/src/USER-CGDNA/pair_oxdna_stk.cpp
index 3d0c4e9136..3e4421835a 100644
--- a/src/USER-CGDNA/pair_oxdna_stk.cpp
+++ b/src/USER-CGDNA/pair_oxdna_stk.cpp
@@ -26,6 +26,7 @@
 #include "neighbor.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -1079,49 +1080,49 @@ void PairOxdnaStk::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
 
-          fread(&epsilon_st[i][j],sizeof(double),1,fp);
-          fread(&a_st[i][j],sizeof(double),1,fp);
-          fread(&cut_st_0[i][j],sizeof(double),1,fp);
-          fread(&cut_st_c[i][j],sizeof(double),1,fp);
-          fread(&cut_st_lo[i][j],sizeof(double),1,fp);
-          fread(&cut_st_hi[i][j],sizeof(double),1,fp);
-          fread(&cut_st_lc[i][j],sizeof(double),1,fp);
-          fread(&cut_st_hc[i][j],sizeof(double),1,fp);
-          fread(&b_st_lo[i][j],sizeof(double),1,fp);
-          fread(&b_st_hi[i][j],sizeof(double),1,fp);
-          fread(&shift_st[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon_st[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&a_st[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_st_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_st_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_st_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_st_hi[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_st_lc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_st_hc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_st_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_st_hi[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&shift_st[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_st4[i][j],sizeof(double),1,fp);
-          fread(&theta_st4_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_st4_ast[i][j],sizeof(double),1,fp);
-          fread(&b_st4[i][j],sizeof(double),1,fp);
-          fread(&dtheta_st4_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_st4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_st4_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_st4_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_st4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_st4_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_st5[i][j],sizeof(double),1,fp);
-          fread(&theta_st5_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_st5_ast[i][j],sizeof(double),1,fp);
-          fread(&b_st5[i][j],sizeof(double),1,fp);
-          fread(&dtheta_st5_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_st5[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_st5_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_st5_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_st5[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_st5_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_st6[i][j],sizeof(double),1,fp);
-          fread(&theta_st6_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_st6_ast[i][j],sizeof(double),1,fp);
-          fread(&b_st6[i][j],sizeof(double),1,fp);
-          fread(&dtheta_st6_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_st6[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_st6_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_st6_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_st6[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_st6_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_st1[i][j],sizeof(double),1,fp);
-          fread(&cosphi_st1_ast[i][j],sizeof(double),1,fp);
-          fread(&b_st1[i][j],sizeof(double),1,fp);
-          fread(&cosphi_st1_c[i][j],sizeof(double),1,fp);
-          fread(&a_st2[i][j],sizeof(double),1,fp);
-          fread(&cosphi_st2_ast[i][j],sizeof(double),1,fp);
-          fread(&b_st2[i][j],sizeof(double),1,fp);
-          fread(&cosphi_st2_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_st1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_st1_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_st1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_st1_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&a_st2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_st2_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_st2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cosphi_st2_c[i][j],sizeof(double),1,fp,NULL,error);
 
         }
 
@@ -1187,9 +1188,9 @@ void PairOxdnaStk::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGDNA/pair_oxdna_xstk.cpp b/src/USER-CGDNA/pair_oxdna_xstk.cpp
index 95f5694818..a6b8d386c7 100644
--- a/src/USER-CGDNA/pair_oxdna_xstk.cpp
+++ b/src/USER-CGDNA/pair_oxdna_xstk.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "atom_vec_ellipsoid.h"
 #include "math_extra.h"
 
@@ -947,56 +948,56 @@ void PairOxdnaXstk::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
 
-          fread(&k_xst[i][j],sizeof(double),1,fp);
-          fread(&cut_xst_0[i][j],sizeof(double),1,fp);
-          fread(&cut_xst_c[i][j],sizeof(double),1,fp);
-          fread(&cut_xst_lo[i][j],sizeof(double),1,fp);
-          fread(&cut_xst_hi[i][j],sizeof(double),1,fp);
-          fread(&cut_xst_lc[i][j],sizeof(double),1,fp);
-          fread(&cut_xst_hc[i][j],sizeof(double),1,fp);
-          fread(&b_xst_lo[i][j],sizeof(double),1,fp);
-          fread(&b_xst_hi[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&k_xst[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_xst_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_xst_c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_xst_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_xst_hi[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_xst_lc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_xst_hc[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst_lo[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst_hi[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_xst1[i][j],sizeof(double),1,fp);
-          fread(&theta_xst1_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst1_ast[i][j],sizeof(double),1,fp);
-          fread(&b_xst1[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst1_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_xst1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_xst1_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst1_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst1_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_xst2[i][j],sizeof(double),1,fp);
-          fread(&theta_xst2_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst2_ast[i][j],sizeof(double),1,fp);
-          fread(&b_xst2[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst2_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_xst2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_xst2_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst2_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst2_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_xst3[i][j],sizeof(double),1,fp);
-          fread(&theta_xst3_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst3_ast[i][j],sizeof(double),1,fp);
-          fread(&b_xst3[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst3_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_xst3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_xst3_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst3_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst3_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_xst4[i][j],sizeof(double),1,fp);
-          fread(&theta_xst4_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst4_ast[i][j],sizeof(double),1,fp);
-          fread(&b_xst4[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst4_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_xst4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_xst4_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst4_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst4_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_xst7[i][j],sizeof(double),1,fp);
-          fread(&theta_xst7_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst7_ast[i][j],sizeof(double),1,fp);
-          fread(&b_xst7[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst7_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_xst7[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_xst7_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst7_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst7[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst7_c[i][j],sizeof(double),1,fp,NULL,error);
 
-          fread(&a_xst8[i][j],sizeof(double),1,fp);
-          fread(&theta_xst8_0[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst8_ast[i][j],sizeof(double),1,fp);
-          fread(&b_xst8[i][j],sizeof(double),1,fp);
-          fread(&dtheta_xst8_c[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a_xst8[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&theta_xst8_0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst8_ast[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&b_xst8[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&dtheta_xst8_c[i][j],sizeof(double),1,fp,NULL,error);
 
         }
 
@@ -1069,9 +1070,9 @@ void PairOxdnaXstk::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGSDK/angle_sdk.cpp b/src/USER-CGSDK/angle_sdk.cpp
index 862c165bbd..11b3a8308c 100644
--- a/src/USER-CGSDK/angle_sdk.cpp
+++ b/src/USER-CGSDK/angle_sdk.cpp
@@ -30,6 +30,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 #include "lj_sdk_common.h"
 
@@ -332,9 +333,9 @@ void AngleSDK::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
-    fread(&repscale[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&repscale[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&theta0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-CGSDK/pair_lj_sdk.cpp b/src/USER-CGSDK/pair_lj_sdk.cpp
index 1301dc4155..3e4f8deee8 100644
--- a/src/USER-CGSDK/pair_lj_sdk.cpp
+++ b/src/USER-CGSDK/pair_lj_sdk.cpp
@@ -26,6 +26,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 #define LMP_NEED_SDK_FIND_LJ_TYPE 1
 #include "lj_sdk_common.h"
@@ -373,14 +374,14 @@ void PairLJSDK::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&lj_type[i][j],sizeof(int),1,fp);
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&lj_type[i][j],sizeof(int),1,fp,NULL,error);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&lj_type[i][j],1,MPI_INT,0,world);
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
@@ -410,10 +411,10 @@ void PairLJSDK::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-CGSDK/pair_lj_sdk_coul_long.cpp b/src/USER-CGSDK/pair_lj_sdk_coul_long.cpp
index 62acf00d27..5721e72d08 100644
--- a/src/USER-CGSDK/pair_lj_sdk_coul_long.cpp
+++ b/src/USER-CGSDK/pair_lj_sdk_coul_long.cpp
@@ -28,6 +28,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 #define LMP_NEED_SDK_FIND_LJ_TYPE 1
 #include "lj_sdk_common.h"
@@ -465,14 +466,14 @@ void PairLJSDKCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&lj_type[i][j],sizeof(int),1,fp);
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&lj_type[i][j],sizeof(int),1,fp,NULL,error);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&lj_type[i][j],1,MPI_INT,0,world);
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
@@ -504,13 +505,13 @@ void PairLJSDKCoulLong::write_restart_settings(FILE *fp)
 void PairLJSDKCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-DPD/pair_dpd_fdt.cpp b/src/USER-DPD/pair_dpd_fdt.cpp
index 1cb9d68d06..a073fae83f 100644
--- a/src/USER-DPD/pair_dpd_fdt.cpp
+++ b/src/USER-DPD/pair_dpd_fdt.cpp
@@ -30,6 +30,7 @@
 #include "memory.h"
 #include "modify.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -375,13 +376,13 @@ void PairDPDfdt::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a0[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -410,10 +411,10 @@ void PairDPDfdt::write_restart_settings(FILE *fp)
 void PairDPDfdt::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&temperature,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&temperature,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&temperature,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-DPD/pair_dpd_fdt_energy.cpp b/src/USER-DPD/pair_dpd_fdt_energy.cpp
index 22741a055d..e48410cb73 100644
--- a/src/USER-DPD/pair_dpd_fdt_energy.cpp
+++ b/src/USER-DPD/pair_dpd_fdt_energy.cpp
@@ -30,6 +30,7 @@
 #include "memory.h"
 #include "modify.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -476,14 +477,14 @@ void PairDPDfdtEnergy::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a0[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&kappa[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&kappa[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -513,9 +514,9 @@ void PairDPDfdtEnergy::write_restart_settings(FILE *fp)
 void PairDPDfdtEnergy::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&seed,1,MPI_INT,0,world);
diff --git a/src/USER-DPD/pair_exp6_rx.cpp b/src/USER-DPD/pair_exp6_rx.cpp
index 5cf2859ae3..5e23113feb 100644
--- a/src/USER-DPD/pair_exp6_rx.cpp
+++ b/src/USER-DPD/pair_exp6_rx.cpp
@@ -24,6 +24,7 @@
 #include "math_special.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "modify.h"
 #include "fix.h"
 
@@ -968,11 +969,11 @@ void PairExp6rx::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
       }
@@ -998,10 +999,10 @@ void PairExp6rx::write_restart_settings(FILE *fp)
 void PairExp6rx::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-DPD/pair_multi_lucy.cpp b/src/USER-DPD/pair_multi_lucy.cpp
index ffc1562f88..ea09d94535 100644
--- a/src/USER-DPD/pair_multi_lucy.cpp
+++ b/src/USER-DPD/pair_multi_lucy.cpp
@@ -33,6 +33,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "citeme.h"
 
 using namespace LAMMPS_NS;
@@ -705,8 +706,8 @@ void PairMultiLucy::write_restart_settings(FILE *fp)
 void PairMultiLucy::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&tabstyle,sizeof(int),1,fp);
-    fread(&tablength,sizeof(int),1,fp);
+    utils::sfread(FLERR,&tabstyle,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tablength,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&tabstyle,1,MPI_INT,0,world);
   MPI_Bcast(&tablength,1,MPI_INT,0,world);
diff --git a/src/USER-DPD/pair_multi_lucy_rx.cpp b/src/USER-DPD/pair_multi_lucy_rx.cpp
index 801e8ff039..f08a49546e 100644
--- a/src/USER-DPD/pair_multi_lucy_rx.cpp
+++ b/src/USER-DPD/pair_multi_lucy_rx.cpp
@@ -33,6 +33,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "citeme.h"
 #include "modify.h"
 #include "fix.h"
@@ -850,8 +851,8 @@ void PairMultiLucyRX::write_restart_settings(FILE *fp)
 void PairMultiLucyRX::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&tabstyle,sizeof(int),1,fp);
-    fread(&tablength,sizeof(int),1,fp);
+    utils::sfread(FLERR,&tabstyle,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tablength,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&tabstyle,1,MPI_INT,0,world);
   MPI_Bcast(&tablength,1,MPI_INT,0,world);
diff --git a/src/USER-DRUDE/pair_lj_cut_thole_long.cpp b/src/USER-DRUDE/pair_lj_cut_thole_long.cpp
index 851effd89c..2b1c929769 100644
--- a/src/USER-DRUDE/pair_lj_cut_thole_long.cpp
+++ b/src/USER-DRUDE/pair_lj_cut_thole_long.cpp
@@ -29,6 +29,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "modify.h"
 #include "domain.h"
 
@@ -488,16 +489,16 @@ void PairLJCutTholeLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&polar[i][j],sizeof(double),1,fp);
-          fread(&thole[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&polar[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&thole[i][j],sizeof(double),1,fp,NULL,error);
           ascreen[i][j] = thole[i][j] / pow(polar[i][j], 1./3.);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -533,15 +534,15 @@ void PairLJCutTholeLong::write_restart_settings(FILE *fp)
 void PairLJCutTholeLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&thole_global,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&thole_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-DRUDE/pair_thole.cpp b/src/USER-DRUDE/pair_thole.cpp
index 1f81263e95..6eadfa8bf6 100644
--- a/src/USER-DRUDE/pair_thole.cpp
+++ b/src/USER-DRUDE/pair_thole.cpp
@@ -22,6 +22,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "fix.h"
 #include "fix_drude.h"
 #include "domain.h"
@@ -311,13 +312,13 @@ void PairThole::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&polar[i][j],sizeof(double),1,fp);
-          fread(&thole[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&polar[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&thole[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
           ascreen[i][j] = thole[i][j] / pow(polar[i][j], 1./3.);
           }
         MPI_Bcast(&polar[i][j],1,MPI_DOUBLE,0,world);
@@ -347,10 +348,10 @@ void PairThole::write_restart_settings(FILE *fp)
 void PairThole::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&thole_global,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&thole_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&thole_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-EFF/pair_eff_cut.cpp b/src/USER-EFF/pair_eff_cut.cpp
index a4c0557620..e7aed14030 100644
--- a/src/USER-EFF/pair_eff_cut.cpp
+++ b/src/USER-EFF/pair_eff_cut.cpp
@@ -31,6 +31,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -965,10 +966,10 @@ void PairEffCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
-        if (me == 0) fread(&cut[i][j],sizeof(double),1,fp);
+        if (me == 0) utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
       }
     }
@@ -992,9 +993,9 @@ void PairEffCut::write_restart_settings(FILE *fp)
 void PairEffCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-FEP/pair_coul_cut_soft.cpp b/src/USER-FEP/pair_coul_cut_soft.cpp
index a4ff3ca846..5a87a2f740 100644
--- a/src/USER-FEP/pair_coul_cut_soft.cpp
+++ b/src/USER-FEP/pair_coul_cut_soft.cpp
@@ -26,6 +26,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -272,12 +273,12 @@ void PairCoulCutSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&lambda[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -306,12 +307,12 @@ void PairCoulCutSoft::write_restart_settings(FILE *fp)
 void PairCoulCutSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphac,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphac,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&alphac,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_coul_long_soft.cpp b/src/USER-FEP/pair_coul_long_soft.cpp
index c0030f8935..a631dca1b7 100644
--- a/src/USER-FEP/pair_coul_long_soft.cpp
+++ b/src/USER-FEP/pair_coul_long_soft.cpp
@@ -28,6 +28,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -294,11 +295,11 @@ void PairCoulLongSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0)
-          fread(&lambda[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
         MPI_Bcast(&lambda[i][j],1,MPI_DOUBLE,0,world);
       }
     }
@@ -325,12 +326,12 @@ void PairCoulLongSoft::write_restart_settings(FILE *fp)
 void PairCoulLongSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphac,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphac,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&alphac,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_charmm_coul_long_soft.cpp b/src/USER-FEP/pair_lj_charmm_coul_long_soft.cpp
index 4c3be6addb..f20d351d1c 100644
--- a/src/USER-FEP/pair_lj_charmm_coul_long_soft.cpp
+++ b/src/USER-FEP/pair_lj_charmm_coul_long_soft.cpp
@@ -31,6 +31,7 @@
 #include "neigh_request.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -836,15 +837,15 @@ void PairLJCharmmCoulLongSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&eps14[i][j],sizeof(double),1,fp);
-          fread(&sigma14[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&eps14[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma14[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -879,15 +880,15 @@ void PairLJCharmmCoulLongSoft::write_restart_settings(FILE *fp)
 void PairLJCharmmCoulLongSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphalj,sizeof(double),1,fp);
-    fread(&alphac,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphalj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphac,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_inner,sizeof(double),1,fp);
-    fread(&cut_lj,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_inner,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_class2_coul_cut_soft.cpp b/src/USER-FEP/pair_lj_class2_coul_cut_soft.cpp
index bbe67e4ff3..4913cf1271 100644
--- a/src/USER-FEP/pair_lj_class2_coul_cut_soft.cpp
+++ b/src/USER-FEP/pair_lj_class2_coul_cut_soft.cpp
@@ -23,6 +23,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -380,15 +381,15 @@ void PairLJClass2CoulCutSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -423,15 +424,15 @@ void PairLJClass2CoulCutSoft::write_restart_settings(FILE *fp)
 void PairLJClass2CoulCutSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphalj,sizeof(double),1,fp);
-    fread(&alphac,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphalj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphac,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&alphalj,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_class2_coul_long_soft.cpp b/src/USER-FEP/pair_lj_class2_coul_long_soft.cpp
index a3e0f732a2..dda10ed9e0 100644
--- a/src/USER-FEP/pair_lj_class2_coul_long_soft.cpp
+++ b/src/USER-FEP/pair_lj_class2_coul_long_soft.cpp
@@ -24,6 +24,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -396,14 +397,14 @@ void PairLJClass2CoulLongSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -437,15 +438,15 @@ void PairLJClass2CoulLongSoft::write_restart_settings(FILE *fp)
 void PairLJClass2CoulLongSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphalj,sizeof(double),1,fp);
-    fread(&alphac,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphalj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphac,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&alphalj,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_class2_soft.cpp b/src/USER-FEP/pair_lj_class2_soft.cpp
index d98a5db5f3..eccc07f7c1 100644
--- a/src/USER-FEP/pair_lj_class2_soft.cpp
+++ b/src/USER-FEP/pair_lj_class2_soft.cpp
@@ -22,6 +22,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -319,14 +320,14 @@ void PairLJClass2Soft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -358,12 +359,12 @@ void PairLJClass2Soft::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphalj,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphalj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&alphalj,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_cut_coul_cut_soft.cpp b/src/USER-FEP/pair_lj_cut_coul_cut_soft.cpp
index 38fcb6fc07..6e5e746879 100644
--- a/src/USER-FEP/pair_lj_cut_coul_cut_soft.cpp
+++ b/src/USER-FEP/pair_lj_cut_coul_cut_soft.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -376,15 +377,15 @@ void PairLJCutCoulCutSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -419,15 +420,15 @@ void PairLJCutCoulCutSoft::write_restart_settings(FILE *fp)
 void PairLJCutCoulCutSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphalj,sizeof(double),1,fp);
-    fread(&alphac,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphalj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphac,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_cut_coul_long_soft.cpp b/src/USER-FEP/pair_lj_cut_coul_long_soft.cpp
index 740daabf62..cf80a3e405 100644
--- a/src/USER-FEP/pair_lj_cut_coul_long_soft.cpp
+++ b/src/USER-FEP/pair_lj_cut_coul_long_soft.cpp
@@ -32,6 +32,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -792,14 +793,14 @@ void PairLJCutCoulLongSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -833,15 +834,15 @@ void PairLJCutCoulLongSoft::write_restart_settings(FILE *fp)
 void PairLJCutCoulLongSoft::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphalj,sizeof(double),1,fp);
-    fread(&alphac,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphalj,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphac,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_cut_soft.cpp b/src/USER-FEP/pair_lj_cut_soft.cpp
index 5e9a77877e..62b7e76977 100644
--- a/src/USER-FEP/pair_lj_cut_soft.cpp
+++ b/src/USER-FEP/pair_lj_cut_soft.cpp
@@ -31,6 +31,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -653,14 +654,14 @@ void PairLJCutSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -693,13 +694,13 @@ void PairLJCutSoft::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&nlambda,sizeof(double),1,fp);
-    fread(&alphalj,sizeof(double),1,fp);
+    utils::sfread(FLERR,&nlambda,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&alphalj,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&nlambda,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&alphalj,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_lj_cut_tip4p_long_soft.cpp b/src/USER-FEP/pair_lj_cut_tip4p_long_soft.cpp
index d4f6dcb910..0601a641ac 100644
--- a/src/USER-FEP/pair_lj_cut_tip4p_long_soft.cpp
+++ b/src/USER-FEP/pair_lj_cut_tip4p_long_soft.cpp
@@ -31,6 +31,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -516,17 +517,17 @@ void PairLJCutTIP4PLongSoft::read_restart_settings(FILE *fp)
   PairLJCutCoulLongSoft::read_restart_settings(fp);
 
   if (comm->me == 0) {
-    fread(&typeO,sizeof(int),1,fp);
-    fread(&typeH,sizeof(int),1,fp);
-    fread(&typeB,sizeof(int),1,fp);
-    fread(&typeA,sizeof(int),1,fp);
-    fread(&qdist,sizeof(double),1,fp);
+    utils::sfread(FLERR,&typeO,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeH,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeB,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeA,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&qdist,sizeof(double),1,fp,NULL,error);
 
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&typeO,1,MPI_INT,0,world);
diff --git a/src/USER-FEP/pair_morse_soft.cpp b/src/USER-FEP/pair_morse_soft.cpp
index 2803e7df49..54123bf3cd 100644
--- a/src/USER-FEP/pair_morse_soft.cpp
+++ b/src/USER-FEP/pair_morse_soft.cpp
@@ -22,6 +22,7 @@
 #include "memory.h"
 #include "math_special.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathSpecial;
@@ -312,15 +313,15 @@ void PairMorseSoft::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&d0[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&r0[i][j],sizeof(double),1,fp);
-          fread(&lambda[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&d0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&r0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&lambda[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&d0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&alpha[i][j],1,MPI_DOUBLE,0,world);
diff --git a/src/USER-FEP/pair_tip4p_long_soft.cpp b/src/USER-FEP/pair_tip4p_long_soft.cpp
index 9cea5b54c5..d5e1ae116c 100644
--- a/src/USER-FEP/pair_tip4p_long_soft.cpp
+++ b/src/USER-FEP/pair_tip4p_long_soft.cpp
@@ -31,6 +31,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -453,11 +454,11 @@ void PairTIP4PLongSoft::read_restart_settings(FILE *fp)
   PairCoulLongSoft::read_restart_settings(fp);
 
   if (comm->me == 0) {
-    fread(&typeO,sizeof(int),1,fp);
-    fread(&typeH,sizeof(int),1,fp);
-    fread(&typeB,sizeof(int),1,fp);
-    fread(&typeA,sizeof(int),1,fp);
-    fread(&qdist,sizeof(double),1,fp);
+    utils::sfread(FLERR,&typeO,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeH,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeB,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&typeA,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&qdist,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&typeO,1,MPI_INT,0,world);
   MPI_Bcast(&typeH,1,MPI_INT,0,world);
diff --git a/src/USER-MESO/pair_edpd.cpp b/src/USER-MESO/pair_edpd.cpp
index f72b6d6b93..c32477513d 100644
--- a/src/USER-MESO/pair_edpd.cpp
+++ b/src/USER-MESO/pair_edpd.cpp
@@ -31,6 +31,7 @@
 #include "citeme.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -452,24 +453,24 @@ void PairEDPD::read_restart(FILE *fp)
   int me = comm->me;
   for (int i = 1; i <= atom->ntypes; i++)
     for (int j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a0[i][j],sizeof(double),1,fp);
-          fread(&gamma[i][j],sizeof(double),1,fp);
-          fread(&power[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
-          fread(&kappa[i][j],sizeof(double),1,fp);
-          fread(&powerT[i][j],sizeof(double),1,fp);
-          fread(&cutT[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&power[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&kappa[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&powerT[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cutT[i][j],sizeof(double),1,fp,NULL,error);
           if(power_flag)
           for (int k = 0; k < 4; k++)
-            fread(&sc[i][j][k],sizeof(double),1,fp);
+            utils::sfread(FLERR,&sc[i][j][k],sizeof(double),1,fp,NULL,error);
 
           if(kappa_flag)
           for (int k = 0; k < 4; k++)
-            fread(&kc[i][j][k],sizeof(double),1,fp);
+            utils::sfread(FLERR,&kc[i][j][k],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&gamma[i][j],1,MPI_DOUBLE,0,world);
@@ -507,9 +508,9 @@ void PairEDPD::write_restart_settings(FILE *fp)
 void PairEDPD::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&seed,1,MPI_INT,0,world);
diff --git a/src/USER-MESO/pair_mdpd.cpp b/src/USER-MESO/pair_mdpd.cpp
index 56adad26ce..7f98e6da79 100644
--- a/src/USER-MESO/pair_mdpd.cpp
+++ b/src/USER-MESO/pair_mdpd.cpp
@@ -30,6 +30,7 @@
 #include "citeme.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -347,15 +348,15 @@ void PairMDPD::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&A_att[i][j],sizeof(double),1,fp);
-          fread(&B_rep[i][j],sizeof(double),1,fp);
-          fread(&gamma[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
-          fread(&cut_r[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&A_att[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&B_rep[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_r[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&A_att[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&B_rep[i][j],1,MPI_DOUBLE,0,world);
@@ -385,10 +386,10 @@ void PairMDPD::write_restart_settings(FILE *fp)
 void PairMDPD::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&temperature,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&temperature,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&temperature,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-MESO/pair_tdpd.cpp b/src/USER-MESO/pair_tdpd.cpp
index 346401b1ba..f5350de53d 100644
--- a/src/USER-MESO/pair_tdpd.cpp
+++ b/src/USER-MESO/pair_tdpd.cpp
@@ -29,6 +29,7 @@
 #include "citeme.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -394,19 +395,19 @@ void PairTDPD::read_restart(FILE *fp)
   int me = comm->me;
   for (int i = 1; i <= atom->ntypes; i++)
     for (int j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a0[i][j],sizeof(double),1,fp);
-          fread(&gamma[i][j],sizeof(double),1,fp);
-          fread(&power[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
-          fread(&cutcc[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&power[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cutcc[i][j],sizeof(double),1,fp,NULL,error);
           for(int k=0; k<cc_species; k++) {
-            fread(&kappa[i][j][k],sizeof(double),1,fp);
-            fread(&epsilon[i][j][k],sizeof(double),1,fp);
-            fread(&powercc[i][j][k],sizeof(double),1,fp);
+            utils::sfread(FLERR,&kappa[i][j][k],sizeof(double),1,fp,NULL,error);
+            utils::sfread(FLERR,&epsilon[i][j][k],sizeof(double),1,fp,NULL,error);
+            utils::sfread(FLERR,&powercc[i][j][k],sizeof(double),1,fp,NULL,error);
           }
         }
         MPI_Bcast(&a0[i][j],1,MPI_DOUBLE,0,world);
@@ -442,10 +443,10 @@ void PairTDPD::write_restart_settings(FILE *fp)
 void PairTDPD::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&temperature,sizeof(double),1,fp);
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&seed,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&temperature,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&seed,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&temperature,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/angle_cosine_shift.cpp b/src/USER-MISC/angle_cosine_shift.cpp
index b18ddc79d3..d403b61c42 100644
--- a/src/USER-MISC/angle_cosine_shift.cpp
+++ b/src/USER-MISC/angle_cosine_shift.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -224,10 +225,10 @@ void AngleCosineShift::read_restart(FILE *fp)
 
   if (comm->me == 0)
     {
-       fread(&k[1],sizeof(double),atom->nangletypes,fp);
-       fread(&kcost[1],sizeof(double),atom->nangletypes,fp);
-       fread(&ksint[1],sizeof(double),atom->nangletypes,fp);
-       fread(&theta[1],sizeof(double),atom->nangletypes,fp);
+      utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+      utils::sfread(FLERR,&kcost[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+      utils::sfread(FLERR,&ksint[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+      utils::sfread(FLERR,&theta[1],sizeof(double),atom->nangletypes,fp,NULL,error);
     }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&kcost[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/angle_cosine_shift_exp.cpp b/src/USER-MISC/angle_cosine_shift_exp.cpp
index 79cb0fea7c..ef5a2824b9 100644
--- a/src/USER-MISC/angle_cosine_shift_exp.cpp
+++ b/src/USER-MISC/angle_cosine_shift_exp.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -256,11 +257,11 @@ void AngleCosineShiftExp::read_restart(FILE *fp)
 
   if (comm->me == 0)
       {
-         fread(&umin[1],sizeof(double),atom->nangletypes,fp);
-         fread(&a[1],sizeof(double),atom->nangletypes,fp);
-         fread(&cost[1],sizeof(double),atom->nangletypes,fp);
-         fread(&sint[1],sizeof(double),atom->nangletypes,fp);
-         fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
+        utils::sfread(FLERR,&umin[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+        utils::sfread(FLERR,&a[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+        utils::sfread(FLERR,&cost[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+        utils::sfread(FLERR,&sint[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+        utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
       }
   MPI_Bcast(&umin[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&a[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/angle_dipole.cpp b/src/USER-MISC/angle_dipole.cpp
index 0956ba3b8f..e2fd7e618f 100644
--- a/src/USER-MISC/angle_dipole.cpp
+++ b/src/USER-MISC/angle_dipole.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -205,8 +206,8 @@ void AngleDipole::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&gamma0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&gamma0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&gamma0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/angle_fourier.cpp b/src/USER-MISC/angle_fourier.cpp
index dcf5080431..f83c9c4f88 100644
--- a/src/USER-MISC/angle_fourier.cpp
+++ b/src/USER-MISC/angle_fourier.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -231,10 +232,10 @@ void AngleFourier::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&C0[1],sizeof(double),atom->nangletypes,fp);
-    fread(&C1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&C2[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&C0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&C1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&C2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&C0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/angle_fourier_simple.cpp b/src/USER-MISC/angle_fourier_simple.cpp
index bbe3f8520b..baf4953760 100644
--- a/src/USER-MISC/angle_fourier_simple.cpp
+++ b/src/USER-MISC/angle_fourier_simple.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -237,9 +238,9 @@ void AngleFourierSimple::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&C[1],sizeof(double),atom->nangletypes,fp);
-    fread(&N[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&C[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&N[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&C[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/angle_quartic.cpp b/src/USER-MISC/angle_quartic.cpp
index 5c5f3411e4..097e774f17 100644
--- a/src/USER-MISC/angle_quartic.cpp
+++ b/src/USER-MISC/angle_quartic.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -232,10 +233,10 @@ void AngleQuartic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k2[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k3[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k4[1],sizeof(double),atom->nangletypes,fp);
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k3[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k4[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
   MPI_Bcast(&k2[1],atom->nangletypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&k3[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/bond_harmonic_shift.cpp b/src/USER-MISC/bond_harmonic_shift.cpp
index fdd3111783..79e401eddb 100644
--- a/src/USER-MISC/bond_harmonic_shift.cpp
+++ b/src/USER-MISC/bond_harmonic_shift.cpp
@@ -24,6 +24,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -176,9 +177,9 @@ void BondHarmonicShift::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r1[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r1[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/bond_harmonic_shift_cut.cpp b/src/USER-MISC/bond_harmonic_shift_cut.cpp
index 0688cb428a..aa051f4bec 100644
--- a/src/USER-MISC/bond_harmonic_shift_cut.cpp
+++ b/src/USER-MISC/bond_harmonic_shift_cut.cpp
@@ -24,6 +24,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -178,9 +179,9 @@ void BondHarmonicShiftCut::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r1[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r1[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/dihedral_cosine_shift_exp.cpp b/src/USER-MISC/dihedral_cosine_shift_exp.cpp
index 820dfabdeb..0537e555a2 100644
--- a/src/USER-MISC/dihedral_cosine_shift_exp.cpp
+++ b/src/USER-MISC/dihedral_cosine_shift_exp.cpp
@@ -26,6 +26,7 @@
 #include "memory.h"
 #include "math_const.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -321,11 +322,11 @@ void DihedralCosineShiftExp::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&umin[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&a[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&cost[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&sint[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&theta[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&umin[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&a[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&cost[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&sint[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
   }
   MPI_Bcast(&umin[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&a[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/dihedral_fourier.cpp b/src/USER-MISC/dihedral_fourier.cpp
index 7cc250b1a8..f30a5e1eab 100644
--- a/src/USER-MISC/dihedral_fourier.cpp
+++ b/src/USER-MISC/dihedral_fourier.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -364,7 +365,7 @@ void DihedralFourier::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0)
-    fread(&nterms[1],sizeof(int),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&nterms[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
 
   MPI_Bcast(&nterms[1],atom->ndihedraltypes,MPI_INT,0,world);
 
@@ -379,9 +380,9 @@ void DihedralFourier::read_restart(FILE *fp)
 
   if (comm->me == 0) {
     for (int i=1; i<=atom->ndihedraltypes; i++) {
-      fread(k[i],sizeof(double),nterms[i],fp);
-      fread(multiplicity[i],sizeof(int),nterms[i],fp);
-      fread(shift[i],sizeof(double),nterms[i],fp);
+      utils::sfread(FLERR,k[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,multiplicity[i],sizeof(int),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,shift[i],sizeof(double),nterms[i],fp,NULL,error);
     }
   }
 
diff --git a/src/USER-MISC/dihedral_nharmonic.cpp b/src/USER-MISC/dihedral_nharmonic.cpp
index f1e0018689..56254a5c03 100644
--- a/src/USER-MISC/dihedral_nharmonic.cpp
+++ b/src/USER-MISC/dihedral_nharmonic.cpp
@@ -26,6 +26,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -318,7 +319,7 @@ void DihedralNHarmonic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0)
-    fread(&nterms[1],sizeof(int),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&nterms[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
 
   MPI_Bcast(&nterms[1],atom->ndihedraltypes,MPI_INT,0,world);
 
@@ -328,7 +329,7 @@ void DihedralNHarmonic::read_restart(FILE *fp)
 
   if (comm->me == 0) {
     for(int i = 1; i <= atom->ndihedraltypes; i++)
-      fread(a[i],sizeof(double),nterms[i],fp);
+      utils::sfread(FLERR,a[i],sizeof(double),nterms[i],fp,NULL,error);
   }
 
   for (int i = 1; i <= atom->ndihedraltypes; i++ )
diff --git a/src/USER-MISC/dihedral_quadratic.cpp b/src/USER-MISC/dihedral_quadratic.cpp
index 02effc2f4f..28efad65b7 100644
--- a/src/USER-MISC/dihedral_quadratic.cpp
+++ b/src/USER-MISC/dihedral_quadratic.cpp
@@ -27,6 +27,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -325,8 +326,8 @@ void DihedralQuadratic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->ndihedraltypes,fp);
-    fread(&phi0[1],sizeof(double),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
+    utils::sfread(FLERR,&phi0[1],sizeof(double),atom->ndihedraltypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&phi0[1],atom->ndihedraltypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/dihedral_spherical.cpp b/src/USER-MISC/dihedral_spherical.cpp
index 78d45f923d..c72570c494 100644
--- a/src/USER-MISC/dihedral_spherical.cpp
+++ b/src/USER-MISC/dihedral_spherical.cpp
@@ -30,6 +30,7 @@
 #include "math_extra.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace std;
 using namespace LAMMPS_NS;
@@ -755,7 +756,7 @@ void DihedralSpherical::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0)
-    fread(&nterms[1],sizeof(int),atom->ndihedraltypes,fp);
+    utils::sfread(FLERR,&nterms[1],sizeof(int),atom->ndihedraltypes,fp,NULL,error);
 
   MPI_Bcast(&nterms[1],atom->ndihedraltypes,MPI_INT,0,world);
 
@@ -775,16 +776,16 @@ void DihedralSpherical::read_restart(FILE *fp)
 
   if (comm->me == 0) {
     for (int i=1; i<=atom->ndihedraltypes; i++) {
-      fread(Ccoeff[i],sizeof(double),nterms[i],fp);
-      fread(phi_mult[i],sizeof(double),nterms[i],fp);
-      fread(phi_shift[i],sizeof(double),nterms[i],fp);
-      fread(phi_offset[i],sizeof(double),nterms[i],fp);
-      fread(theta1_mult[i],sizeof(double),nterms[i],fp);
-      fread(theta1_shift[i],sizeof(double),nterms[i],fp);
-      fread(theta1_offset[i],sizeof(double),nterms[i],fp);
-      fread(theta2_mult[i],sizeof(double),nterms[i],fp);
-      fread(theta2_shift[i],sizeof(double),nterms[i],fp);
-      fread(theta2_offset[i],sizeof(double),nterms[i],fp);
+      utils::sfread(FLERR,Ccoeff[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,phi_mult[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,phi_shift[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,phi_offset[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,theta1_mult[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,theta1_shift[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,theta1_offset[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,theta2_mult[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,theta2_shift[i],sizeof(double),nterms[i],fp,NULL,error);
+      utils::sfread(FLERR,theta2_offset[i],sizeof(double),nterms[i],fp,NULL,error);
     }
   }
 
diff --git a/src/USER-MISC/dihedral_table.cpp b/src/USER-MISC/dihedral_table.cpp
index 59a16f376f..a14c3d9d79 100644
--- a/src/USER-MISC/dihedral_table.cpp
+++ b/src/USER-MISC/dihedral_table.cpp
@@ -33,6 +33,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "dihedral_table.h"
 #include "utils.h"
 
@@ -1042,8 +1043,8 @@ void DihedralTable::write_restart_settings(FILE *fp)
 void DihedralTable::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&tabstyle,sizeof(int),1,fp);
-    fread(&tablength,sizeof(int),1,fp);
+    utils::sfread(FLERR,&tabstyle,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tablength,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&tabstyle,1,MPI_INT,0,world);
diff --git a/src/USER-MISC/dihedral_table_cut.cpp b/src/USER-MISC/dihedral_table_cut.cpp
index 87f0c9bf66..8d530253c2 100644
--- a/src/USER-MISC/dihedral_table_cut.cpp
+++ b/src/USER-MISC/dihedral_table_cut.cpp
@@ -1029,8 +1029,8 @@ void DihedralTableCut::write_restart_settings(FILE *fp)
 void DihedralTableCut::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&tabstyle,sizeof(int),1,fp);
-    fread(&tablength,sizeof(int),1,fp);
+    utils::sfread(FLERR,&tabstyle,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tablength,sizeof(int),1,fp,NULL,error);
   }
 
   MPI_Bcast(&tabstyle,1,MPI_INT,0,world);
diff --git a/src/USER-MISC/improper_cossq.cpp b/src/USER-MISC/improper_cossq.cpp
index 2ea804b95d..c5556b746d 100644
--- a/src/USER-MISC/improper_cossq.cpp
+++ b/src/USER-MISC/improper_cossq.cpp
@@ -26,6 +26,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "math_const.h"
 
 using namespace LAMMPS_NS;
@@ -301,8 +302,8 @@ void ImproperCossq::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&chi[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&chi[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&chi[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/improper_distance.cpp b/src/USER-MISC/improper_distance.cpp
index 2efab8b5f8..146bd344f1 100644
--- a/src/USER-MISC/improper_distance.cpp
+++ b/src/USER-MISC/improper_distance.cpp
@@ -25,6 +25,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -247,8 +248,8 @@ void ImproperDistance::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&chi[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&chi[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&chi[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/improper_fourier.cpp b/src/USER-MISC/improper_fourier.cpp
index a0ef3a2058..beb473d78c 100644
--- a/src/USER-MISC/improper_fourier.cpp
+++ b/src/USER-MISC/improper_fourier.cpp
@@ -26,6 +26,7 @@
 #include "update.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -325,11 +326,11 @@ void ImproperFourier::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&C0[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&C1[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&C2[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&all[1],sizeof(int),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&C0[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&C1[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&C2[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&all[1],sizeof(int),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&C0[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/improper_ring.cpp b/src/USER-MISC/improper_ring.cpp
index 48db5a41e9..7f818595a2 100644
--- a/src/USER-MISC/improper_ring.cpp
+++ b/src/USER-MISC/improper_ring.cpp
@@ -47,6 +47,7 @@
 #include "math_special.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -325,8 +326,8 @@ void ImproperRing::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&chi[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&chi[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&chi[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/pair_buck_mdf.cpp b/src/USER-MISC/pair_buck_mdf.cpp
index e977197522..6339f7d135 100644
--- a/src/USER-MISC/pair_buck_mdf.cpp
+++ b/src/USER-MISC/pair_buck_mdf.cpp
@@ -25,6 +25,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -302,14 +303,14 @@ void PairBuckMDF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&a[i][j],sizeof(double),1,fp);
-          fread(&rho[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rho[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rho[i][j],1,MPI_DOUBLE,0,world);
@@ -338,10 +339,10 @@ void PairBuckMDF::write_restart_settings(FILE *fp)
 void PairBuckMDF::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-MISC/pair_cosine_squared.cpp b/src/USER-MISC/pair_cosine_squared.cpp
index 4544a6db43..ffa8a6603c 100644
--- a/src/USER-MISC/pair_cosine_squared.cpp
+++ b/src/USER-MISC/pair_cosine_squared.cpp
@@ -30,6 +30,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -275,14 +276,14 @@ void PairCosineSquared::read_restart(FILE *fp)
   for (i = 1; i <= atom->ntypes; i++) {
     for (j = i; j <= atom->ntypes; j++) {
       if (me == 0)
-        fread(&setflag[i][j], sizeof(int), 1, fp);
+        utils::sfread(FLERR,&setflag[i][j], sizeof(int), 1, fp,NULL,error);
       MPI_Bcast(&setflag[i][j], 1, MPI_INT, 0, world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j], sizeof(double), 1, fp);
-          fread(&sigma[i][j], sizeof(double), 1, fp);
-          fread(&cut[i][j], sizeof(double), 1, fp);
-          fread(&wcaflag[i][j], sizeof(int), 1, fp);
+          utils::sfread(FLERR,&epsilon[i][j], sizeof(double), 1, fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j], sizeof(double), 1, fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j], sizeof(double), 1, fp,NULL,error);
+          utils::sfread(FLERR,&wcaflag[i][j], sizeof(int), 1, fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j], 1, MPI_DOUBLE, 0, world);
         MPI_Bcast(&sigma[i][j], 1, MPI_DOUBLE, 0, world);
@@ -310,7 +311,7 @@ void PairCosineSquared::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global, sizeof(double), 1, fp);
+    utils::sfread(FLERR,&cut_global, sizeof(double), 1, fp,NULL,error);
   }
   MPI_Bcast(&cut_global, 1, MPI_DOUBLE, 0, world);
 }
diff --git a/src/USER-MISC/pair_coul_diel.cpp b/src/USER-MISC/pair_coul_diel.cpp
index a375901ecd..bdb605f547 100644
--- a/src/USER-MISC/pair_coul_diel.cpp
+++ b/src/USER-MISC/pair_coul_diel.cpp
@@ -24,6 +24,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -282,9 +283,9 @@ void PairCoulDiel::read_restart(FILE *fp)
     for (j = i; j <= atom->ntypes; j++) {
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&rme[i][j],sizeof(double),1,fp);
-          fread(&sigmae[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&rme[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigmae[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&rme[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigmae[i][j],1,MPI_DOUBLE,0,world);
@@ -311,9 +312,9 @@ void PairCoulDiel::write_restart_settings(FILE *fp)
 void PairCoulDiel::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-MISC/pair_coul_shield.cpp b/src/USER-MISC/pair_coul_shield.cpp
index 9264e51287..980b4a71d5 100644
--- a/src/USER-MISC/pair_coul_shield.cpp
+++ b/src/USER-MISC/pair_coul_shield.cpp
@@ -28,6 +28,7 @@
 #include "memory.h"
 #include "math_special.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -298,8 +299,8 @@ void PairCoulShield::read_restart(FILE *fp)
     for (j = i; j <= atom->ntypes; j++) {
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&sigmae[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&sigmae[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&sigmae[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -325,9 +326,9 @@ void PairCoulShield::write_restart_settings(FILE *fp)
 void PairCoulShield::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-MISC/pair_gauss_cut.cpp b/src/USER-MISC/pair_gauss_cut.cpp
index e6cfc02f63..2a4f61cce3 100644
--- a/src/USER-MISC/pair_gauss_cut.cpp
+++ b/src/USER-MISC/pair_gauss_cut.cpp
@@ -24,6 +24,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "math_const.h"
 
 using namespace LAMMPS_NS;
@@ -300,14 +301,14 @@ void PairGaussCut::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&hgauss[i][j],sizeof(double),1,fp);
-          fread(&rmh[i][j],sizeof(double),1,fp);
-          fread(&sigmah[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&hgauss[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rmh[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigmah[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&hgauss[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&rmh[i][j],1,MPI_DOUBLE,0,world);
@@ -336,9 +337,9 @@ void PairGaussCut::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&offset_flag,1,MPI_INT,0,world);
diff --git a/src/USER-MISC/pair_lennard_mdf.cpp b/src/USER-MISC/pair_lennard_mdf.cpp
index 50f59107a0..c539bb30e2 100644
--- a/src/USER-MISC/pair_lennard_mdf.cpp
+++ b/src/USER-MISC/pair_lennard_mdf.cpp
@@ -26,6 +26,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -302,14 +303,14 @@ void PairLJ_AB_MDF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&aparm[i][j],sizeof(double),1,fp);
-          fread(&bparm[i][j],sizeof(double),1,fp);
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&aparm[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&bparm[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&aparm[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&bparm[i][j],1,MPI_DOUBLE,0,world);
@@ -336,7 +337,7 @@ void PairLJ_AB_MDF::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
 }
diff --git a/src/USER-MISC/pair_lj_expand_coul_long.cpp b/src/USER-MISC/pair_lj_expand_coul_long.cpp
index ffa828826f..957173bf7f 100644
--- a/src/USER-MISC/pair_lj_expand_coul_long.cpp
+++ b/src/USER-MISC/pair_lj_expand_coul_long.cpp
@@ -31,6 +31,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -828,14 +829,14 @@ void PairLJExpandCoulLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&shift[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&shift[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -867,13 +868,13 @@ void PairLJExpandCoulLong::write_restart_settings(FILE *fp)
 void PairLJExpandCoulLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/pair_lj_mdf.cpp b/src/USER-MISC/pair_lj_mdf.cpp
index 3fe0fa6bf9..51e24639b9 100644
--- a/src/USER-MISC/pair_lj_mdf.cpp
+++ b/src/USER-MISC/pair_lj_mdf.cpp
@@ -26,6 +26,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -310,14 +311,14 @@ void PairLJMDF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_inner[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_inner[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -344,7 +345,7 @@ void PairLJMDF::read_restart_settings(FILE *fp)
 {
   int me = comm->me;
   if (me == 0) {
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
 }
diff --git a/src/USER-MISC/pair_lj_sf_dipole_sf.cpp b/src/USER-MISC/pair_lj_sf_dipole_sf.cpp
index 758962ce29..19bc66bdcb 100644
--- a/src/USER-MISC/pair_lj_sf_dipole_sf.cpp
+++ b/src/USER-MISC/pair_lj_sf_dipole_sf.cpp
@@ -27,6 +27,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "update.h"
 
 using namespace LAMMPS_NS;
@@ -486,15 +487,15 @@ void PairLJSFDipoleSF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
-          fread(&cut_coul[i][j],sizeof(double),1,fp);
-          fread(&scale[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_coul[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&scale[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -523,9 +524,9 @@ void PairLJSFDipoleSF::write_restart_settings(FILE *fp)
 void PairLJSFDipoleSF::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul_global,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/pair_momb.cpp b/src/USER-MISC/pair_momb.cpp
index 29d5715302..8786394221 100644
--- a/src/USER-MISC/pair_momb.cpp
+++ b/src/USER-MISC/pair_momb.cpp
@@ -25,6 +25,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "citeme.h"
 
 using namespace LAMMPS_NS;
@@ -307,16 +308,16 @@ void PairMomb::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&d0[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&r0[i][j],sizeof(double),1,fp);
-          fread(&c[i][j],sizeof(double),1,fp);
-          fread(&rr[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&d0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&r0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&c[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&rr[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&d0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&alpha[i][j],1,MPI_DOUBLE,0,world);
@@ -348,11 +349,11 @@ void PairMomb::write_restart_settings(FILE *fp)
 void PairMomb::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&sscale,sizeof(double),1,fp);
-    fread(&dscale,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&sscale,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&dscale,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&sscale,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-MISC/pair_morse_smooth_linear.cpp b/src/USER-MISC/pair_morse_smooth_linear.cpp
index c3cbe39db7..bbdae231f8 100644
--- a/src/USER-MISC/pair_morse_smooth_linear.cpp
+++ b/src/USER-MISC/pair_morse_smooth_linear.cpp
@@ -21,6 +21,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -273,14 +274,14 @@ void PairMorseSmoothLinear::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&d0[i][j],sizeof(double),1,fp);
-          fread(&alpha[i][j],sizeof(double),1,fp);
-          fread(&r0[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&d0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&r0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&d0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&alpha[i][j],1,MPI_DOUBLE,0,world);
@@ -307,8 +308,8 @@ void PairMorseSmoothLinear::write_restart_settings(FILE *fp)
 void PairMorseSmoothLinear::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&mix_flag,1,MPI_INT,0,world);
diff --git a/src/USER-MISC/pair_srp.cpp b/src/USER-MISC/pair_srp.cpp
index 416ace8132..606fdc9fc5 100644
--- a/src/USER-MISC/pair_srp.cpp
+++ b/src/USER-MISC/pair_srp.cpp
@@ -44,6 +44,7 @@ Please contact Timothy Sirk for questions (tim.sirk@us.army.mil).
 #include "thermo.h"
 #include "output.h"
 #include "citeme.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -698,13 +699,12 @@ void PairSRP::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          printf(" i %d j %d \n",i,j);
-          fread(&a0[i][j],sizeof(double),1,fp);
-          fread(&cut[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&a0[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&a0[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&cut[i][j],1,MPI_DOUBLE,0,world);
@@ -732,12 +732,12 @@ void PairSRP::write_restart_settings(FILE *fp)
 void PairSRP::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_global,sizeof(double),1,fp);
-    fread(&bptype,sizeof(int),1,fp);
-    fread(&btype,sizeof(int),1,fp);
-    fread(&min,sizeof(int),1,fp);
-    fread(&midpoint,sizeof(int),1,fp);
-    fread(&exclude,sizeof(int),1,fp);
+    utils::sfread(FLERR,&cut_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&bptype,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&btype,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&min,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&midpoint,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&exclude,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_global,1,MPI_DOUBLE,0,world);
 }
diff --git a/src/USER-MOFFF/angle_class2_p6.cpp b/src/USER-MOFFF/angle_class2_p6.cpp
index bb0a01d546..839148bc13 100644
--- a/src/USER-MOFFF/angle_class2_p6.cpp
+++ b/src/USER-MOFFF/angle_class2_p6.cpp
@@ -28,6 +28,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -385,21 +386,21 @@ void AngleClass2P6::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k2[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k3[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k4[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k5[1],sizeof(double),atom->nangletypes,fp);
-    fread(&k6[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k3[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k4[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k5[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&k6[1],sizeof(double),atom->nangletypes,fp,NULL,error);
 
-    fread(&bb_k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&bb_r1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&bb_r2[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&bb_k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&bb_r1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&bb_r2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
 
-    fread(&ba_k1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&ba_k2[1],sizeof(double),atom->nangletypes,fp);
-    fread(&ba_r1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&ba_r2[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&ba_k1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&ba_k2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&ba_r1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&ba_r2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
 
   MPI_Bcast(&theta0[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MOFFF/angle_cosine_buck6d.cpp b/src/USER-MOFFF/angle_cosine_buck6d.cpp
index c17b2a1dba..a6643601c1 100644
--- a/src/USER-MOFFF/angle_cosine_buck6d.cpp
+++ b/src/USER-MOFFF/angle_cosine_buck6d.cpp
@@ -28,6 +28,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -331,9 +332,9 @@ void AngleCosineBuck6d::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nangletypes,fp);
-    fread(&multiplicity[1],sizeof(int),atom->nangletypes,fp);
-    fread(&th0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&multiplicity[1],sizeof(int),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&th0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
 
   MPI_Bcast(&k[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MOFFF/improper_inversion_harmonic.cpp b/src/USER-MOFFF/improper_inversion_harmonic.cpp
index 12f7062ccc..e38b82067d 100644
--- a/src/USER-MOFFF/improper_inversion_harmonic.cpp
+++ b/src/USER-MOFFF/improper_inversion_harmonic.cpp
@@ -29,6 +29,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -312,8 +313,8 @@ void ImproperInversionHarmonic::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&kw[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&w0[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&kw[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&w0[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&kw[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&w0[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-MOFFF/pair_buck6d_coul_gauss_dsf.cpp b/src/USER-MOFFF/pair_buck6d_coul_gauss_dsf.cpp
index 9c917d1c19..57a935a0b3 100644
--- a/src/USER-MOFFF/pair_buck6d_coul_gauss_dsf.cpp
+++ b/src/USER-MOFFF/pair_buck6d_coul_gauss_dsf.cpp
@@ -29,6 +29,7 @@
 #include "memory.h"
 #include "math_const.h"
 #include "error.h"
+#include "utils.h"
 #include "math_special.h"
 
 using namespace LAMMPS_NS;
@@ -414,16 +415,16 @@ void PairBuck6dCoulGaussDSF::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&buck6d1[i][j],sizeof(double),1,fp);
-          fread(&buck6d2[i][j],sizeof(double),1,fp);
-          fread(&buck6d3[i][j],sizeof(double),1,fp);
-          fread(&buck6d4[i][j],sizeof(double),1,fp);
-          fread(&alpha_ij[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&buck6d1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck6d2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck6d3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck6d4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha_ij[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&buck6d1[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&buck6d2[i][j],1,MPI_DOUBLE,0,world);
@@ -456,12 +457,12 @@ void PairBuck6dCoulGaussDSF::write_restart_settings(FILE *fp)
 void PairBuck6dCoulGaussDSF::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&vdwl_smooth,sizeof(double),1,fp);
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&vdwl_smooth,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&vdwl_smooth,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-MOFFF/pair_buck6d_coul_gauss_long.cpp b/src/USER-MOFFF/pair_buck6d_coul_gauss_long.cpp
index 953507ce21..d3ccec3a55 100644
--- a/src/USER-MOFFF/pair_buck6d_coul_gauss_long.cpp
+++ b/src/USER-MOFFF/pair_buck6d_coul_gauss_long.cpp
@@ -29,6 +29,7 @@
 #include "neigh_list.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 #include "math_special.h"
 
 using namespace LAMMPS_NS;
@@ -446,16 +447,16 @@ void PairBuck6dCoulGaussLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&buck6d1[i][j],sizeof(double),1,fp);
-          fread(&buck6d2[i][j],sizeof(double),1,fp);
-          fread(&buck6d3[i][j],sizeof(double),1,fp);
-          fread(&buck6d4[i][j],sizeof(double),1,fp);
-          fread(&alpha_ij[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&buck6d1[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck6d2[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck6d3[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&buck6d4[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&alpha_ij[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&buck6d1[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&buck6d2[i][j],1,MPI_DOUBLE,0,world);
@@ -489,13 +490,13 @@ void PairBuck6dCoulGaussLong::write_restart_settings(FILE *fp)
 void PairBuck6dCoulGaussLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&vdwl_smooth,sizeof(double),1,fp);
-    fread(&coul_smooth,sizeof(double),1,fp);
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
+    utils::sfread(FLERR,&vdwl_smooth,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&coul_smooth,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
   }
   MPI_Bcast(&vdwl_smooth,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&coul_smooth,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-YAFF/angle_cross.cpp b/src/USER-YAFF/angle_cross.cpp
index 0f8861cdf5..3d5715c23e 100644
--- a/src/USER-YAFF/angle_cross.cpp
+++ b/src/USER-YAFF/angle_cross.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -278,12 +279,12 @@ void AngleCross::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&kss[1],sizeof(double),atom->nangletypes,fp);
-    fread(&kbs0[1],sizeof(double),atom->nangletypes,fp);
-    fread(&kbs1[1],sizeof(double),atom->nangletypes,fp);
-    fread(&r00[1],sizeof(double),atom->nangletypes,fp);
-    fread(&r01[1],sizeof(double),atom->nangletypes,fp);
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&kss[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&kbs0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&kbs1[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&r00[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&r01[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
 
   MPI_Bcast(&kss[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-YAFF/angle_mm3.cpp b/src/USER-YAFF/angle_mm3.cpp
index b90db37afa..cb3010e97c 100644
--- a/src/USER-YAFF/angle_mm3.cpp
+++ b/src/USER-YAFF/angle_mm3.cpp
@@ -26,6 +26,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -225,8 +226,8 @@ void AngleMM3::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k2[1],sizeof(double),atom->nangletypes,fp);
-    fread(&theta0[1],sizeof(double),atom->nangletypes,fp);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->nangletypes,fp,NULL,error);
+    utils::sfread(FLERR,&theta0[1],sizeof(double),atom->nangletypes,fp,NULL,error);
   }
 
   MPI_Bcast(&k2[1],atom->nangletypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-YAFF/bond_mm3.cpp b/src/USER-YAFF/bond_mm3.cpp
index 2a7d5d1843..8001e35d74 100644
--- a/src/USER-YAFF/bond_mm3.cpp
+++ b/src/USER-YAFF/bond_mm3.cpp
@@ -24,6 +24,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -178,8 +179,8 @@ void BondMM3::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k2[1],sizeof(double),atom->nbondtypes,fp);
-    fread(&r0[1],sizeof(double),atom->nbondtypes,fp);
+    utils::sfread(FLERR,&k2[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
+    utils::sfread(FLERR,&r0[1],sizeof(double),atom->nbondtypes,fp,NULL,error);
   }
   MPI_Bcast(&k2[1],atom->nbondtypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&r0[1],atom->nbondtypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-YAFF/improper_distharm.cpp b/src/USER-YAFF/improper_distharm.cpp
index 2b62f827e7..751e6e19c2 100644
--- a/src/USER-YAFF/improper_distharm.cpp
+++ b/src/USER-YAFF/improper_distharm.cpp
@@ -26,6 +26,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -256,8 +257,8 @@ void ImproperDistHarm::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&chi[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&chi[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&chi[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-YAFF/improper_sqdistharm.cpp b/src/USER-YAFF/improper_sqdistharm.cpp
index bcc0549f7e..82bf4a1755 100644
--- a/src/USER-YAFF/improper_sqdistharm.cpp
+++ b/src/USER-YAFF/improper_sqdistharm.cpp
@@ -26,6 +26,7 @@
 #include "force.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 
@@ -256,8 +257,8 @@ void ImproperSQDistHarm::read_restart(FILE *fp)
   allocate();
 
   if (comm->me == 0) {
-    fread(&k[1],sizeof(double),atom->nimpropertypes,fp);
-    fread(&chi[1],sizeof(double),atom->nimpropertypes,fp);
+    utils::sfread(FLERR,&k[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
+    utils::sfread(FLERR,&chi[1],sizeof(double),atom->nimpropertypes,fp,NULL,error);
   }
   MPI_Bcast(&k[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
   MPI_Bcast(&chi[1],atom->nimpropertypes,MPI_DOUBLE,0,world);
diff --git a/src/USER-YAFF/pair_lj_switch3_coulgauss_long.cpp b/src/USER-YAFF/pair_lj_switch3_coulgauss_long.cpp
index ab983a78bc..77a25db7cc 100644
--- a/src/USER-YAFF/pair_lj_switch3_coulgauss_long.cpp
+++ b/src/USER-YAFF/pair_lj_switch3_coulgauss_long.cpp
@@ -31,6 +31,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -520,14 +521,14 @@ void PairLJSwitch3CoulGaussLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&gamma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -560,14 +561,14 @@ void PairLJSwitch3CoulGaussLong::write_restart_settings(FILE *fp)
 void PairLJSwitch3CoulGaussLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&truncw,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&truncw,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
diff --git a/src/USER-YAFF/pair_mm3_switch3_coulgauss_long.cpp b/src/USER-YAFF/pair_mm3_switch3_coulgauss_long.cpp
index 4175ef915d..3a4a49c880 100644
--- a/src/USER-YAFF/pair_mm3_switch3_coulgauss_long.cpp
+++ b/src/USER-YAFF/pair_mm3_switch3_coulgauss_long.cpp
@@ -31,6 +31,7 @@
 #include "math_const.h"
 #include "memory.h"
 #include "error.h"
+#include "utils.h"
 
 using namespace LAMMPS_NS;
 using namespace MathConst;
@@ -520,14 +521,14 @@ void PairMM3Switch3CoulGaussLong::read_restart(FILE *fp)
   int me = comm->me;
   for (i = 1; i <= atom->ntypes; i++)
     for (j = i; j <= atom->ntypes; j++) {
-      if (me == 0) fread(&setflag[i][j],sizeof(int),1,fp);
+      if (me == 0) utils::sfread(FLERR,&setflag[i][j],sizeof(int),1,fp,NULL,error);
       MPI_Bcast(&setflag[i][j],1,MPI_INT,0,world);
       if (setflag[i][j]) {
         if (me == 0) {
-          fread(&epsilon[i][j],sizeof(double),1,fp);
-          fread(&sigma[i][j],sizeof(double),1,fp);
-          fread(&gamma[i][j],sizeof(double),1,fp);
-          fread(&cut_lj[i][j],sizeof(double),1,fp);
+          utils::sfread(FLERR,&epsilon[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&sigma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&gamma[i][j],sizeof(double),1,fp,NULL,error);
+          utils::sfread(FLERR,&cut_lj[i][j],sizeof(double),1,fp,NULL,error);
         }
         MPI_Bcast(&epsilon[i][j],1,MPI_DOUBLE,0,world);
         MPI_Bcast(&sigma[i][j],1,MPI_DOUBLE,0,world);
@@ -560,16 +561,15 @@ void PairMM3Switch3CoulGaussLong::write_restart_settings(FILE *fp)
 void PairMM3Switch3CoulGaussLong::read_restart_settings(FILE *fp)
 {
   if (comm->me == 0) {
-    fread(&cut_lj_global,sizeof(double),1,fp);
-    fread(&cut_coul,sizeof(double),1,fp);
-    fread(&truncw,sizeof(double),1,fp);
-    fread(&offset_flag,sizeof(int),1,fp);
-    fread(&mix_flag,sizeof(int),1,fp);
-    fread(&tail_flag,sizeof(int),1,fp);
-    fread(&ncoultablebits,sizeof(int),1,fp);
-    fread(&tabinner,sizeof(double),1,fp);
+    utils::sfread(FLERR,&cut_lj_global,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&cut_coul,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&truncw,sizeof(double),1,fp,NULL,error);
+    utils::sfread(FLERR,&offset_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&mix_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tail_flag,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&ncoultablebits,sizeof(int),1,fp,NULL,error);
+    utils::sfread(FLERR,&tabinner,sizeof(double),1,fp,NULL,error);
   }
-  printf("Reading from restart, trunc = %f\n",truncw);
   MPI_Bcast(&cut_lj_global,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&cut_coul,1,MPI_DOUBLE,0,world);
   MPI_Bcast(&truncw,1,MPI_DOUBLE,0,world);

From d429143589a3fd14fb42470ceb04db27ef3efb30 Mon Sep 17 00:00:00 2001
From: jrgissing <jrgiss05@gmail.com>
Date: Sat, 19 Oct 2019 22:15:52 -0600
Subject: [PATCH 16/21] bond/react: Arrhenius constraint

---
 doc/src/Eqs/fix_bond_react.jpg   | Bin 0 -> 2427 bytes
 doc/src/Eqs/fix_bond_react.tex   |   9 +++++
 doc/src/fix_bond_react.txt       |  23 ++++++++++-
 src/USER-MISC/fix_bond_react.cpp |  67 +++++++++++++++++++++++++++++--
 src/USER-MISC/fix_bond_react.h   |   5 ++-
 5 files changed, 99 insertions(+), 5 deletions(-)
 create mode 100644 doc/src/Eqs/fix_bond_react.jpg
 create mode 100644 doc/src/Eqs/fix_bond_react.tex

diff --git a/doc/src/Eqs/fix_bond_react.jpg b/doc/src/Eqs/fix_bond_react.jpg
new file mode 100644
index 0000000000000000000000000000000000000000..d63b983230c0c26a7bf9c50b38593bdd65196a35
GIT binary patch
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diff --git a/doc/src/Eqs/fix_bond_react.tex b/doc/src/Eqs/fix_bond_react.tex
new file mode 100644
index 0000000000..9400656038
--- /dev/null
+++ b/doc/src/Eqs/fix_bond_react.tex
@@ -0,0 +1,9 @@
+\documentstyle[12pt]{article}
+\pagestyle{empty}
+\begin{document}
+
+\begin{eqnarray*}
+   k = AT^{n}e^{\frac{-E_{a}}{k_{B}T}}
+\end{eqnarray*}                           
+
+\end{document}
diff --git a/doc/src/fix_bond_react.txt b/doc/src/fix_bond_react.txt
index fb8ed95afb..d101a20da5 100644
--- a/doc/src/fix_bond_react.txt
+++ b/doc/src/fix_bond_react.txt
@@ -266,7 +266,7 @@ either 'none' or 'charges.' Further details are provided in the
 discussion of the 'update_edges' keyword. The fourth optional section
 begins with the keyword 'Constraints' and lists additional criteria
 that must be satisfied in order for the reaction to occur. Currently,
-there are two types of constraints available, as discussed below.
+there are three types of constraints available, as discussed below.
 
 A sample map file is given below:
 
@@ -320,6 +320,27 @@ the central atom). Angles must be specified in degrees. This
 constraint can be used to enforce a certain orientation between
 reacting molecules.
 
+The constraint of type 'arrhenius' imposes an additional reaction
+probability according to the temperature-dependent Arrhenius equation:
+
+:c,image(Eqs/fix_bond_react.jpg)
+
+The Arrhenius constraint has the following syntax:
+
+arrhenius {A} {n} {E_a} {seed} :pre
+
+where 'arrhenius' is the required keyword, {A} is the pre-exponential
+factor, {n} is the exponent of the temperature dependence, {E_a} is
+the activation energy ("units"_units.html of energy), and {seed} is a
+random number seed. The temperature is defined as the instantaneous
+temperature averaged over all atoms in the reaction site, and is
+calculated in the same manner as for example
+"compute_temp_chunk"_compute_temp_chunk.html. Currently, there are no
+options for additional temperature averaging or velocity-biased
+temperature calculations. A uniform random number between 0 and 1 is
+generated using {seed}; if this number is less than the result of the
+Arrhenius equation above, the reaction is permitted occur.
+
 Once a reaction site has been successfully identified, data structures
 within LAMMPS that store bond topology are updated to reflect the
 post-reacted molecule template. All force fields with fixed bonds,
diff --git a/src/USER-MISC/fix_bond_react.cpp b/src/USER-MISC/fix_bond_react.cpp
index c34a7494d9..f52227ce26 100644
--- a/src/USER-MISC/fix_bond_react.cpp
+++ b/src/USER-MISC/fix_bond_react.cpp
@@ -71,7 +71,7 @@ static const char cite_fix_bond_react[] =
 enum{ACCEPT,REJECT,PROCEED,CONTINUE,GUESSFAIL,RESTORE};
 
 // types of available reaction constraints
-enum{DISTANCE,ANGLE};
+enum{DISTANCE,ANGLE,ARRHENIUS};
 
 /* ---------------------------------------------------------------------- */
 
@@ -100,6 +100,7 @@ FixBondReact::FixBondReact(LAMMPS *lmp, int narg, char **arg) :
   extvector = 0;
   rxnID = 0;
   nconstraints = 0;
+  narrhenius = 0;
   status = PROCEED;
 
   nxspecial = NULL;
@@ -322,6 +323,16 @@ FixBondReact::FixBondReact(LAMMPS *lmp, int narg, char **arg) :
     find_landlocked_atoms(i);
   }
 
+  // initialize Marsaglia RNG with processor-unique seed (Arrhenius prob)
+
+  rrhandom = new class RanMars*[narrhenius];
+  int tmp = 0;
+  for (int i = 0; i < nconstraints; i++) {
+    if (constraints[i][1] == ARRHENIUS) {
+      rrhandom[tmp++] = new RanMars(lmp,(int) constraints[i][6] + me);
+    }
+  }
+
   for (int i = 0; i < nreacts; i++) {
     delete [] files[i];
   }
@@ -348,7 +359,7 @@ FixBondReact::FixBondReact(LAMMPS *lmp, int narg, char **arg) :
     }
   }
 
-  // initialize Marsaglia RNG with processor-unique seed
+  // initialize Marsaglia RNG with processor-unique seed ('prob' keyword)
 
   random = new class RanMars*[nreacts];
   for (int i = 0; i < nreacts; i++) {
@@ -1640,7 +1651,7 @@ int FixBondReact::check_constraints()
   tagint atom1,atom2,atom3;
   double delx,dely,delz,rsq;
   double delx1,dely1,delz1,delx2,dely2,delz2;
-  double rsq1,rsq2,r1,r2,c;
+  double rsq1,rsq2,r1,r2,c,t,prrhob;
 
   double **x = atom->x;
 
@@ -1680,12 +1691,54 @@ int FixBondReact::check_constraints()
         if (c > 1.0) c = 1.0;
         if (c < -1.0) c = -1.0;
         if (acos(c) < constraints[i][5] || acos(c) > constraints[i][6]) return 0;
+      } else if (constraints[i][1] == ARRHENIUS) {
+        t = get_temperature();
+        prrhob = constraints[i][3]*pow(t,constraints[i][4])*
+               exp(-constraints[i][5]/(force->boltz*t));
+        if (prrhob < rrhandom[(int) constraints[i][2]]->uniform()) return 0;
       }
     }
   }
   return 1;
 }
 
+/* ----------------------------------------------------------------------
+compute local temperature: average over all atoms in reaction template
+------------------------------------------------------------------------- */
+
+double FixBondReact::get_temperature()
+{
+  int i,ilocal;
+  double adof = domain->dimension;
+
+  double **v = atom->v;
+  double *mass = atom->mass;
+  double *rmass = atom->rmass;
+  int *type = atom->type;
+
+  double t = 0.0;
+
+  if (rmass) {
+    for (i = 0; i < onemol->natoms; i++) {
+      ilocal = atom->map(glove[i][1]);
+      t += (v[ilocal][0]*v[ilocal][0] + v[ilocal][1]*v[ilocal][1] +
+        v[ilocal][2]*v[ilocal][2]) * rmass[ilocal];
+    }
+  } else {
+    for (i = 0; i < onemol->natoms; i++) {
+      ilocal = atom->map(glove[i][1]);
+      t += (v[ilocal][0]*v[ilocal][0] + v[ilocal][1]*v[ilocal][1] +
+        v[ilocal][2]*v[ilocal][2]) * mass[type[ilocal]];
+    }
+  }
+
+  // final temperature
+  double dof = adof*onemol->natoms;
+  double tfactor = force->mvv2e / (dof * force->boltz);
+  t *= tfactor;
+  return t;
+}
+
 /* ----------------------------------------------------------------------
   Get xspecials for current molecule templates
 ------------------------------------------------------------------------- */
@@ -2947,6 +3000,14 @@ void FixBondReact::Constraints(char *line, int myrxn)
       constraints[nconstraints][4] = tmp[2];
       constraints[nconstraints][5] = tmp[3]/180.0 * MY_PI;
       constraints[nconstraints][6] = tmp[4]/180.0 * MY_PI;
+    } else if (strcmp(constraint_type,"arrhenius") == 0) {
+      constraints[nconstraints][1] = ARRHENIUS;
+      constraints[nconstraints][2] = narrhenius++;
+      sscanf(line,"%*s %lg %lg %lg %lg",&tmp[0],&tmp[1],&tmp[2],&tmp[3]);
+      constraints[nconstraints][3] = tmp[0];
+      constraints[nconstraints][4] = tmp[1];
+      constraints[nconstraints][5] = tmp[2];
+      constraints[nconstraints][6] = tmp[3];
     } else
       error->one(FLERR,"Bond/react: Illegal constraint type in 'Constraints' section of map file");
     nconstraints++;
diff --git a/src/USER-MISC/fix_bond_react.h b/src/USER-MISC/fix_bond_react.h
index eda26f129d..f59e051ed1 100644
--- a/src/USER-MISC/fix_bond_react.h
+++ b/src/USER-MISC/fix_bond_react.h
@@ -65,6 +65,7 @@ class FixBondReact : public Fix {
   int *stabilize_steps_flag;
   int *update_edges_flag;
   int nconstraints;
+  int narrhenius;
   double **constraints;
   int status;
   int *groupbits;
@@ -88,7 +89,8 @@ class FixBondReact : public Fix {
   Fix *fix2;              // properties/atom used to indicate 1) relaxing atoms
                           //                                  2) to which 'react' atom belongs
   Fix *fix3;              // property/atom used for system-wide thermostat
-  class RanMars **random;
+  class RanMars **random; // random number for 'prob' keyword
+  class RanMars **rrhandom; // random number for Arrhenius constraint
   class NeighList *list;
 
   int *reacted_mol,*unreacted_mol;
@@ -156,6 +158,7 @@ class FixBondReact : public Fix {
   void inner_crosscheck_loop();
   void ring_check();
   int check_constraints();
+  double get_temperature();
 
   void open(char *);
   void readline(char *);

From a69bd0405ad842fe24eca399a5350427c2f2df22 Mon Sep 17 00:00:00 2001
From: jrgissing <jrgiss05@gmail.com>
Date: Sat, 19 Oct 2019 23:09:10 -0600
Subject: [PATCH 17/21] add lowercase 'arrhenius' keyword to spellcheck

---
 doc/utils/sphinx-config/false_positives.txt | 1 +
 1 file changed, 1 insertion(+)

diff --git a/doc/utils/sphinx-config/false_positives.txt b/doc/utils/sphinx-config/false_positives.txt
index f145227f7a..ff1f8241e2 100644
--- a/doc/utils/sphinx-config/false_positives.txt
+++ b/doc/utils/sphinx-config/false_positives.txt
@@ -108,6 +108,7 @@ Archlinux
 arcsin
 arg
 args
+arrhenius
 Arun
 arXiv
 asin

From e44402326f1fbef18401437ad6ad039a8ab5e066 Mon Sep 17 00:00:00 2001
From: jrgissing <jrgiss05@gmail.com>
Date: Sun, 20 Oct 2019 13:21:20 -0600
Subject: [PATCH 18/21] doc typo

---
 doc/src/fix_bond_react.txt | 4 ++--
 1 file changed, 2 insertions(+), 2 deletions(-)

diff --git a/doc/src/fix_bond_react.txt b/doc/src/fix_bond_react.txt
index d101a20da5..d729f09b54 100644
--- a/doc/src/fix_bond_react.txt
+++ b/doc/src/fix_bond_react.txt
@@ -339,7 +339,7 @@ calculated in the same manner as for example
 options for additional temperature averaging or velocity-biased
 temperature calculations. A uniform random number between 0 and 1 is
 generated using {seed}; if this number is less than the result of the
-Arrhenius equation above, the reaction is permitted occur.
+Arrhenius equation above, the reaction is permitted to occur.
 
 Once a reaction site has been successfully identified, data structures
 within LAMMPS that store bond topology are updated to reflect the
@@ -416,7 +416,7 @@ will apply to all reactions.
 Computationally, each timestep this fix operates, it loops over
 neighbor lists (for bond-forming reactions) and computes distances
 between pairs of atoms in the list. It also communicates between
-neighboring processors to coordinate which bonds  are created and/or
+neighboring processors to coordinate which bonds are created and/or
 removed. All of these operations increase the cost of a timestep. Thus
 you should be cautious about invoking this fix too frequently.
 

From 5200d60dd3be37df0246332dd52330722c387b90 Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Mon, 21 Oct 2019 11:29:08 +0200
Subject: [PATCH 19/21] update singularity definition files

---
 tools/singularity/README.md       |  2 ++
 tools/singularity/centos7.def     |  2 +-
 tools/singularity/centos8.def     | 14 ++++++++++++++
 tools/singularity/ubuntu16.04.def |  9 +++++++++
 tools/singularity/ubuntu18.04.def |  2 +-
 5 files changed, 27 insertions(+), 2 deletions(-)
 create mode 100644 tools/singularity/centos8.def
 create mode 100644 tools/singularity/ubuntu16.04.def

diff --git a/tools/singularity/README.md b/tools/singularity/README.md
index 4541ce285b..84b26bc911 100644
--- a/tools/singularity/README.md
+++ b/tools/singularity/README.md
@@ -25,4 +25,6 @@ make
 | Currently available: |     |
 | --- | --- |
 | centos7.def | CentOS 7.x with EPEL enabled |
+| centos8.def | CentOS 8.x with EPEL enabled |
+| ubuntu16.04.def | Ubuntu 16.04LTS with default MPI == OpenMPI |
 | ubuntu18.04.def | Ubuntu 18.04LTS with default MPI == OpenMPI |
diff --git a/tools/singularity/centos7.def b/tools/singularity/centos7.def
index c11357483b..8160105524 100644
--- a/tools/singularity/centos7.def
+++ b/tools/singularity/centos7.def
@@ -4,7 +4,7 @@ From: centos:7
 %post
 	yum -y install epel-release
         yum -y update
-	yum -y install vim-enhanced ccache gcc-c++ gcc-gfortran clang gdb valgrind-openmpi make cmake cmake3 patch which file git libpng-devel libjpeg-devel openmpi-devel mpich-devel python-devel python-virtualenv fftw-devel voro++-devel eigen3-devel gsl-devel openblas-devel enchant
+	yum -y install vim-enhanced ccache gcc-c++ gcc-gfortran clang gdb valgrind-openmpi make cmake cmake3 ninja-build patch which file git libpng-devel libjpeg-devel openmpi-devel mpich-devel python-devel python-virtualenv fftw-devel voro++-devel eigen3-devel gsl-devel openblas-devel enchant
 
 %labels
 	Author akohlmey
diff --git a/tools/singularity/centos8.def b/tools/singularity/centos8.def
new file mode 100644
index 0000000000..6f006b3092
--- /dev/null
+++ b/tools/singularity/centos8.def
@@ -0,0 +1,14 @@
+BootStrap: docker
+From: centos:8
+
+%post
+	dnf -y install epel-release
+        dnf -y update
+	dnf -y install vim-enhanced ccache gcc-c++ gcc-gfortran clang gdb make cmake patch which file git libpng-devel libjpeg-devel openmpi-devel mpich-devel fftw-devel voro++-devel gsl-devel enchant platform-python-devel python3-virtualenv valgrind openblas
+
+#No match for argument: valgrind-openmpi
+#No match for argument: ninja-build
+#No match for argument: eigen3-devel
+
+%labels
+	Author akohlmey
diff --git a/tools/singularity/ubuntu16.04.def b/tools/singularity/ubuntu16.04.def
new file mode 100644
index 0000000000..2f7841bd4a
--- /dev/null
+++ b/tools/singularity/ubuntu16.04.def
@@ -0,0 +1,9 @@
+BootStrap: docker
+From: ubuntu:16.04
+
+%post
+	apt-get update -y
+	env DEBIAN_FRONTEND=noninteractive apt-get install -y make cmake cmake-curses-gui ninja-build git ccache gcc g++ gfortran libfftw3-dev libjpeg-dev libpng12-dev libblas-dev liblapack-dev mpi-default-bin mpi-default-dev libeigen3-dev libgsl-dev libopenblas-dev virtualenv python-dev enchant vim-nox
+
+%labels
+	Author akohlmey
diff --git a/tools/singularity/ubuntu18.04.def b/tools/singularity/ubuntu18.04.def
index 46e3851d4f..c87daa8de5 100644
--- a/tools/singularity/ubuntu18.04.def
+++ b/tools/singularity/ubuntu18.04.def
@@ -3,7 +3,7 @@ From: ubuntu:18.04
 
 %post
 	apt-get update -y
-	env DEBIAN_FRONTEND=noninteractive apt-get install -y make cmake git gcc g++ gfortran libfftw3-dev libjpeg-dev libpng-dev libblas-dev liblapack-dev mpi-default-bin mpi-default-dev libeigen3-dev libgsl-dev libopenblas-dev virtualenv python-dev enchant vim-nox ccache voro++-dev
+	env DEBIAN_FRONTEND=noninteractive apt-get install -y make cmake cmake-curses-gui ninja-build git ccache gcc g++ gfortran libfftw3-dev libjpeg-dev libpng-dev libblas-dev liblapack-dev mpi-default-bin mpi-default-dev libeigen3-dev libgsl-dev libopenblas-dev virtualenv python-dev enchant vim-nox voro++-dev
 
 %labels
 	Author akohlmey

From 054766a380c53b6fbf3412890ceb57443d94bceb Mon Sep 17 00:00:00 2001
From: Axel Kohlmeyer <akohlmey@gmail.com>
Date: Mon, 21 Oct 2019 14:54:30 +0200
Subject: [PATCH 20/21] include info about ready-to-use images uploaded to the
 singularity library

---
 tools/singularity/README.md | 22 +++++++++++++++++++++-
 1 file changed, 21 insertions(+), 1 deletion(-)

diff --git a/tools/singularity/README.md b/tools/singularity/README.md
index 84b26bc911..d316e629f3 100644
--- a/tools/singularity/README.md
+++ b/tools/singularity/README.md
@@ -9,7 +9,13 @@ your development workstation, e.g. when bugs are reported that can only
 be reproduced on a specific OS or with specific (mostly older) versions
 of tools, compilers, or libraries.
 
-Here is a workflow for testing a compilation of LAMMPS with a CentOS 7.x container.
+Ready-to-use container images built from these definition files are
+occasionally uploaded to the container library at sylabs.io. They
+can be found here: https://cloud.sylabs.io/library/lammps/default/lammps_development#
+and will be signed with the key fingerprint: EEA103764C6C633EDC8AC428D9B44E93BF0C375A
+
+Here is a workflow for testing a compilation of LAMMPS with a locally
+built CentOS 7.x singularity container.
 
 ```
 cd some/work/directory
@@ -22,6 +28,20 @@ cmake -C ../cmake/presets/most.cmake -D CMAKE_CXX_FLAGS="-O3 -g -fopenmp -std=c+
 make
 ```
 
+And here is the equivalent workflow for testing a compilation of LAMMPS
+using a pre-built Ubuntu 18.04LTS singularity container.
+
+```
+cd some/work/directory
+git clone --depth 500  git://github.com/lammps/lammps.git lammps
+mkdir build-ubuntu18
+cd build-ubuntu18
+singularity pull library://lammps/default/lammps_development:ubuntu18.04
+singularity shell lammps_development_ubuntu18.04.sif
+cmake -C ../cmake/presets/most.cmake ../cmake
+make
+```
+
 | Currently available: |     |
 | --- | --- |
 | centos7.def | CentOS 7.x with EPEL enabled |

From 648799ef5e674800cf5b5c0db42b68dc8aee5c5c Mon Sep 17 00:00:00 2001
From: Richard Berger <richard.berger@temple.edu>
Date: Tue, 22 Oct 2019 11:19:55 -0400
Subject: [PATCH 21/21] Add PowerTools repo for CentOS8 Singularity definition

Some packages were moved into a PowerTools repo in RHEL8/CentOS8.
---
 tools/singularity/centos8.def | 7 +++----
 1 file changed, 3 insertions(+), 4 deletions(-)

diff --git a/tools/singularity/centos8.def b/tools/singularity/centos8.def
index 6f006b3092..b48979cab1 100644
--- a/tools/singularity/centos8.def
+++ b/tools/singularity/centos8.def
@@ -2,13 +2,12 @@ BootStrap: docker
 From: centos:8
 
 %post
-	dnf -y install epel-release
+	dnf -y install epel-release dnf-utils
+        dnf config-manager --set-enabled PowerTools
         dnf -y update
-	dnf -y install vim-enhanced ccache gcc-c++ gcc-gfortran clang gdb make cmake patch which file git libpng-devel libjpeg-devel openmpi-devel mpich-devel fftw-devel voro++-devel gsl-devel enchant platform-python-devel python3-virtualenv valgrind openblas
+	dnf -y install vim-enhanced ccache gcc-c++ gcc-gfortran clang gdb make cmake patch which file git libpng-devel libjpeg-devel openmpi-devel mpich-devel fftw-devel voro++-devel gsl-devel enchant platform-python-devel python3-virtualenv valgrind openblas ninja-build eigen3-devel
 
 #No match for argument: valgrind-openmpi
-#No match for argument: ninja-build
-#No match for argument: eigen3-devel
 
 %labels
 	Author akohlmey