11585 lines
518 KiB
Promela
11585 lines
518 KiB
Promela
!! DATE: 2022-07-05 UNITS: real
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##############################
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## ##
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## Force Field Definition ##
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## ##
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##############################
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forcefield AMOEBA-BIO-2009
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bond-cubic -2.55
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bond-quartic 3.793125
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angle-cubic -0.014
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angle-quartic 0.000056
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angle-pentic -0.0000007
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angle-sextic 0.000000022
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opbendtype ALLINGER
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opbend-cubic -0.014
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opbend-quartic 0.000056
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opbend-pentic -0.0000007
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opbend-sextic 0.000000022
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torsionunit 0.5
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vdwtype BUFFERED-14-7
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radiusrule CUBIC-MEAN
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radiustype R-MIN
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radiussize DIAMETER
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epsilonrule HHG
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dielectric 1.0
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polarization MUTUAL
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vdw-12-scale 0.0
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vdw-13-scale 0.0
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vdw-14-scale 1.0
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vdw-15-scale 1.0
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mpole-12-scale 0.0
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mpole-13-scale 0.0
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mpole-14-scale 0.4
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mpole-15-scale 1.0
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polar-12-scale 0.0
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polar-13-scale 0.0
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polar-14-scale 1.0
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polar-15-scale 1.0
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polar-12-intra 0.0
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polar-13-intra 0.0
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polar-14-intra 0.5
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polar-15-intra 1.0
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direct-11-scale 0.0
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direct-12-scale 1.0
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direct-13-scale 1.0
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direct-14-scale 1.0
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mutual-11-scale 1.0
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mutual-12-scale 1.0
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mutual-13-scale 1.0
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mutual-14-scale 1.0
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#############################
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## ##
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## Literature References ##
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## ##
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#############################
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This file contains the 2009 AMOEBA biopolymer force field, with updates
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to the original AMOEBA protein parameters made during Fall 2009, and a
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beta version of AMOEBA nucleic acid parameters due to Chuanjie Wu
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Y. Shi, Z. Xia, J. Zhang, R. Best, J. W. Ponder and P. Ren, "The Polarizable
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Atomic Multipole-Based AMOEBA Force Field for Proteins", J. Chem. Theory
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Comput., 9, 4046-4063 (2013)
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P. Ren, C. Wu and J. W. Ponder, "Polarizable Atomic Multipole-Based
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Molecular Mechanics for Organic Molecules", J. Chem. Theory Comput.,
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7, 3143-3161 (2011)
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J. C. Wu, J.-P. Piquemal, R. Chaudret, P. Reinhardt and P. Ren,
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"Polarizable Molecular Dynamics Simulation of Zn(II) in Water Using
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the AMOEBA Force Field", J. Chem. Theory Comput., 6, 2059-2070 (2010)
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A. Grossfield, P. Ren, J. W. Ponder, "Ion Solvation Thermodynamics from
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Simulation with a Polarizable Force Field", J. Am. Chem. Soc., 125,
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15671-15682 (2003)
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P. Ren and J. W. Ponder, "Polarizable Atomic Multipole Water Model for
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Molecular Mechanics Simulation", J. Phys. Chem. B, 107, 5933-5947 (2003)
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Monovalent ion parameters taken from Zhi Wang, Ph.D. thesis, Department
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of Chemistry, Washington University in St. Louis, May 2018; available
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from https://dasher.wustl.edu/ponder/
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###############################################
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## ##
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## AMOEBA Protein Force Field Atom Classes ##
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## ##
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## 1 Backbone Amide Nitrogen ##
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## 2 Glycine Alpha Carbon ##
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## 3 Backbone Carbonyl Carbon ##
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## 4 Amide or Guanidinium Hydrogen ##
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## 5 Amide Carbonyl Oxygen ##
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## 6 Methine Hydrogen ##
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## 7 Methine Carbon ##
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## 8 Methyl or Methylene Carbon ##
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## 9 Methyl or Methylene Hydrogen ##
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## 10 Hydroxyl Oxygen ##
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## 11 Hydroxyl Hydrogen ##
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## 12 Sulfide or Disulfide Sulfur ##
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## 13 Sulfhydryl Hydrogen ##
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## 14 Thiolate Sulfur ##
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## 15 Proline Backbone Nitrogen ##
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## 16 Proline Ring Methylene Carbon ##
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## 17 Phenyl Carbon ##
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## 18 Phenyl Hydrogen ##
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## 19 Phenolic Oxygen ##
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## 20 Phenolic Hydrogen ##
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## 21 Phenoxide Oxygen ##
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## 22 Indole Carbon ##
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## 23 Indole CH Hydrogen ##
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## 24 Imidazole or Indole NH Nitrogen ##
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## 25 Imidazole or Indole NH Hydrogen ##
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## 26 Imidazole C=C Carbon ##
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## 27 Imidazole CH Hydrogen ##
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## 28 Imidazole N=C-N Carbon ##
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## 29 Imidazole C=N Nitrogen ##
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## 30 Carboxylate Carbon ##
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## 31 Carboxylate Oxygen ##
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## 32 Carboxylic Acid Carbonyl Oxygen ##
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## 33 Carboxylic Acid Hydroxyl Oxygen ##
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## 34 Carboxylic Acid Hydrogen ##
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## 35 Amine or Ammonium Nitrogen ##
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## 36 Ammonium Hydrogen ##
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## 37 Amine Hydrogen ##
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## 38 Guanidinium Hydrogen ##
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## 39 Guanidinium Carbon ##
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## 40 Acetyl or NMe Methyl Carbon ##
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## 41 N-Terminal Ammonium Nitrogen ##
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## 42 N-Terminal Ammonium Hydrogen ##
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## ##
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###############################################
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#############################
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## ##
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## Atom Type Definitions ##
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## ##
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#############################
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atom 1 1 N "Glycine N" 7 14.003 3
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atom 2 2 CA "Glycine CA" 6 12.000 4
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atom 3 3 C "Glycine C" 6 12.000 3
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atom 4 4 HN "Glycine HN" 1 1.008 1
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atom 5 5 O "Glycine O" 8 15.995 1
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atom 6 6 H "Glycine HA" 1 1.008 1
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atom 7 1 N "Alanine N" 7 14.003 3
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atom 8 7 CA "Alanine CA" 6 12.000 4
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atom 9 3 C "Alanine C" 6 12.000 3
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atom 10 4 HN "Alanine HN" 1 1.008 1
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atom 11 5 O "Alanine O" 8 15.995 1
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atom 12 6 H "Alanine HA" 1 1.008 1
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atom 13 8 C "Alanine CB" 6 12.000 4
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atom 14 9 H "Alanine HB" 1 1.008 1
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atom 15 7 C "Valine CB" 6 12.000 4
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atom 16 6 H "Valine HB" 1 1.008 1
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atom 17 8 C "Valine CG" 6 12.000 4
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atom 18 9 H "Valine HG" 1 1.008 1
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atom 19 8 C "Leucine CB" 6 12.000 4
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atom 20 9 H "Leucine HB" 1 1.008 1
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atom 21 7 C "Leucine CG" 6 12.000 4
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atom 22 6 H "Leucine HG" 1 1.008 1
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atom 23 8 C "Leucine CD" 6 12.000 4
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atom 24 9 H "Leucine HD" 1 1.008 1
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atom 25 7 C "Isoleucine CB" 6 12.000 4
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atom 26 6 H "Isoleucine HB" 1 1.008 1
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atom 27 8 C "Isoleucine CG" 6 12.000 4
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atom 28 9 H "Isoleucine HG" 1 1.008 1
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atom 29 8 C "Isoleucine CG" 6 12.000 4
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atom 30 9 H "Isoleucine HG" 1 1.008 1
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atom 31 8 C "Isoleucine CD" 6 12.000 4
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atom 32 9 H "Isoleucine HD" 1 1.008 1
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atom 33 7 CA "Serine CA" 6 12.000 4
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atom 34 8 C "Serine CB" 6 12.000 4
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atom 35 9 H "Serine HB" 1 1.008 1
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atom 36 10 OH "Serine OG" 8 15.995 2
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atom 37 11 HO "Serine HG" 1 1.008 1
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atom 38 7 C "Threonine CB" 6 12.000 4
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atom 39 6 H "Threonine HB" 1 1.008 1
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atom 40 8 C "Threonine CG" 6 12.000 4
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atom 41 9 H "Threonine HG" 1 1.008 1
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atom 42 10 OH "Threonine O" 8 15.995 2
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atom 43 11 HO "Threonine H" 1 1.008 1
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atom 44 7 CA "Cysteine CA" 6 12.000 4
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atom 45 8 C "Cysteine CB" 6 12.000 4
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atom 46 9 H "Cysteine HB" 1 1.008 1
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atom 47 12 SH "Cysteine SG" 16 31.972 2
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atom 48 13 HS "Cysteine HG" 1 1.008 1
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atom 49 12 SS "Cystine SG" 16 31.972 2
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atom 50 8 C "Cysteine Anion CB" 6 12.000 4
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atom 51 9 H "Cysteine Anion HB" 1 1.008 1
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atom 52 14 S "Cysteine Anion S-" 16 31.972 1
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atom 53 15 N "Proline N" 7 14.003 3
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atom 54 7 CA "Proline CA" 6 12.000 4
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atom 55 3 C "Proline C" 6 12.000 3
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atom 56 5 O "Proline O" 8 15.995 1
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atom 57 6 H "Proline HA" 1 1.008 1
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atom 58 16 C "Proline CB" 6 12.000 4
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atom 59 9 H "Proline HB" 1 1.008 1
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atom 60 16 C "Proline CG" 6 12.000 4
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atom 61 9 H "Proline HG" 1 1.008 1
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atom 62 16 C "Proline CD" 6 12.000 4
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atom 63 6 H "Proline HD" 1 1.008 1
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atom 64 8 C "Phenylalanine CB" 6 12.000 4
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atom 65 9 H "Phenylalanine HB" 1 1.008 1
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atom 66 17 C "Phenylalanine CG" 6 12.000 3
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atom 67 17 C "Phenylalanine CD" 6 12.000 3
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atom 68 18 H "Phenylalanine HD" 1 1.008 1
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atom 69 17 C "Phenylalanine CE" 6 12.000 3
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atom 70 18 H "Phenylalanine HE" 1 1.008 1
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atom 71 17 C "Phenylalanine CZ" 6 12.000 3
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atom 72 18 H "Phenylalanine HZ" 1 1.008 1
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atom 73 8 C "Tyrosine CB" 6 12.000 4
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atom 74 9 H "Tyrosine HB" 1 1.008 1
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atom 75 17 C "Tyrosine CG" 6 12.000 3
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atom 76 17 C "Tyrosine CD" 6 12.000 3
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atom 77 18 H "Tyrosine HD" 1 1.008 1
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atom 78 17 C "Tyrosine CE" 6 12.000 3
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atom 79 18 H "Tyrosine HE" 1 1.008 1
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atom 80 17 C "Tyrosine CZ" 6 12.000 3
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atom 81 19 OH "Tyrosine OH" 8 15.995 2
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atom 82 20 HO "Tyrosine HH" 1 1.008 1
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atom 83 8 C "Tyrosine Anion CB" 6 12.000 4
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atom 84 9 H "Tyrosine Anion HB" 1 1.008 1
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atom 85 17 C "Tyrosine Anion CG" 6 12.000 3
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atom 86 17 C "Tyrosine Anion CD" 6 12.000 3
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atom 87 18 H "Tyrosine Anion HD" 1 1.008 1
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atom 88 17 C "Tyrosine Anion CE" 6 12.000 3
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atom 89 18 H "Tyrosine Anion HE" 1 1.008 1
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atom 90 17 C "Tyrosine Anion CZ" 6 12.000 3
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atom 91 21 O- "Tyrosine Anion O-" 8 15.995 1
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atom 92 8 C "Tryptophan CB" 6 12.000 4
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atom 93 9 H "Tryptophan HB" 1 1.008 1
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atom 94 22 C "Tryptophan CG" 6 12.000 3
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atom 95 22 C "Tryptophan CD1" 6 12.000 3
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atom 96 23 H "Tryptophan HD1" 1 1.008 1
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atom 97 22 C "Tryptophan CD2" 6 12.000 3
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atom 98 24 N "Tryptophan NE1" 7 14.003 3
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atom 99 25 HN "Tryptophan HE1" 1 1.008 1
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atom 100 22 C "Tryptophan CE2" 6 12.000 3
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atom 101 22 C "Tryptophan CE3" 6 12.000 3
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atom 102 23 H "Tryptophan HE3" 1 1.008 1
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atom 103 22 C "Tryptophan CZ2" 6 12.000 3
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atom 104 23 H "Tryptophan HZ2" 1 1.008 1
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atom 105 22 C "Tryptophan CZ3" 6 12.000 3
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atom 106 23 H "Tryptophan HZ3" 1 1.008 1
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atom 107 22 C "Tryptophan CH2" 6 12.000 3
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atom 108 23 H "Tryptophan HH2" 1 1.008 1
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atom 109 8 C "Histidine (+) CB" 6 12.000 4
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atom 110 9 H "Histidine (+) HB" 1 1.008 1
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atom 111 26 C "Histidine (+) CG" 6 12.000 3
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atom 112 24 N "Histidine (+) ND1" 7 14.003 3
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atom 113 25 HN "Histidine (+) HD1" 1 1.008 1
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atom 114 26 C "Histidine (+) CD2" 6 12.000 3
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atom 115 27 H "Histidine (+) HD2" 1 1.008 1
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atom 116 28 C "Histidine (+) CE1" 6 12.000 3
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atom 117 27 H "Histidine (+) HE1" 1 1.008 1
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atom 118 24 N "Histidine (+) NE2" 7 14.003 3
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atom 119 25 HN "Histidine (+) HE2" 1 1.008 1
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atom 120 8 C "Histidine (HD) CB" 6 12.000 4
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atom 121 9 H "Histidine (HD) HB" 1 1.008 1
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atom 122 26 C "Histidine (HD) CG" 6 12.000 3
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atom 123 24 N "Histidine (HD) ND1" 7 14.003 3
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atom 124 25 HN "Histidine (HD) HD1" 1 1.008 1
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atom 125 26 C "Histidine (HD) CD2" 6 12.000 3
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atom 126 27 H "Histidine (HD) HD2" 1 1.008 1
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atom 127 28 C "Histidine (HD) CE1" 6 12.000 3
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atom 128 27 H "Histidine (HD) HE1" 1 1.008 1
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atom 129 29 N "Histidine (HD) NE2" 7 14.003 2
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atom 130 8 C "Histidine (HE) CB" 6 12.000 4
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atom 131 9 H "Histidine (HE) HB" 1 1.008 1
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atom 132 26 C "Histidine (HE) CG" 6 12.000 3
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atom 133 29 N "Histidine (HE) ND1" 7 14.003 2
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atom 134 26 C "Histidine (HE) CD2" 6 12.000 3
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atom 135 27 H "Histidine (HE) HD2" 1 1.008 1
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atom 136 28 C "Histidine (HE) CE1" 6 12.000 3
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atom 137 27 H "Histidine (HE) HE1" 1 1.008 1
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atom 138 24 N "Histidine (HE) NE2" 7 14.003 3
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atom 139 25 HN "Histidine (HE) HE2" 1 1.008 1
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atom 140 8 C "Aspartate CB" 6 12.000 4
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atom 141 9 H "Aspartate HB" 1 1.008 1
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atom 142 30 C "Aspartate CG" 6 12.000 3
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atom 143 31 O "Aspartate OD" 8 15.995 1
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atom 144 8 C "Aspartic Acid CB" 6 12.000 4
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atom 145 9 H "Aspartic Acid HB" 1 1.008 1
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atom 146 30 C "Aspartic Acid CG" 6 12.000 3
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atom 147 32 O "Aspartic Acid OD1" 8 15.995 1
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atom 148 33 OH "Aspartic Acid OD2" 8 15.995 2
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atom 149 34 HO "Aspartic Acid HD2" 1 1.008 1
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atom 150 8 C "Asparagine CB" 6 12.000 4
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atom 151 9 H "Asparagine HB" 1 1.008 1
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atom 152 3 C "Asparagine CG" 6 12.000 3
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atom 153 5 O "Asparagine OD1" 8 15.995 1
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atom 154 1 N "Asparagine ND2" 7 14.003 3
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atom 155 4 HN "Asparagine HD2" 1 1.008 1
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atom 156 8 C "Glutamate CB" 6 12.000 4
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atom 157 9 H "Glutamate HB" 1 1.008 1
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atom 158 8 C "Glutamate CG" 6 12.000 4
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atom 159 9 H "Glutamate HG" 1 1.008 1
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atom 160 30 C "Glutamate CD" 6 12.000 3
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atom 161 31 O "Glutamate OE" 8 15.995 1
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atom 162 8 C "Glutamic Acid CB" 6 12.000 4
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atom 163 9 H "Glutamic Acid HB" 1 1.008 1
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atom 164 8 C "Glutamic Acid CG" 6 12.000 4
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atom 165 9 H "Glutamic Acid HG" 1 1.008 1
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atom 166 30 C "Glutamic Acid CD" 6 12.000 3
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atom 167 32 O "Glutamic Acid OE1" 8 15.995 1
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atom 168 33 OH "Glutamic Acid OE2" 8 15.995 2
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atom 169 34 HO "Glutamic Acid HE2" 1 1.008 1
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atom 170 8 C "Glutamine CB" 6 12.000 4
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atom 171 9 H "Glutamine HB" 1 1.008 1
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atom 172 8 C "Glutamine CG" 6 12.000 4
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atom 173 9 H "Glutamine HG" 1 1.008 1
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atom 174 3 C "Glutamine CD" 6 12.000 3
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atom 175 5 O "Glutamine OE1" 8 15.995 1
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atom 176 1 N "Glutamine NE2" 7 14.003 3
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atom 177 4 HN "Glutamine HE2" 1 1.008 1
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atom 178 8 C "Methionine CB" 6 12.000 4
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atom 179 9 H "Methionine HB" 1 1.008 1
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atom 180 8 C "Methionine CG" 6 12.000 4
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atom 181 9 H "Methionine HG" 1 1.008 1
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atom 182 12 S "Methionine SD" 16 31.972 2
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atom 183 8 C "Methionine CE" 6 12.000 4
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atom 184 9 H "Methionine HE" 1 1.008 1
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atom 185 8 C "Lysine CB" 6 12.000 4
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atom 186 9 H "Lysine HB" 1 1.008 1
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atom 187 8 C "Lysine CG" 6 12.000 4
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atom 188 9 H "Lysine HG" 1 1.008 1
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atom 189 8 C "Lysine CD" 6 12.000 4
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atom 190 9 H "Lysine HD" 1 1.008 1
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atom 191 8 C "Lysine CE" 6 12.000 4
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atom 192 9 H "Lysine HE" 1 1.008 1
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atom 193 35 N "Lysine NZ" 7 14.003 4
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atom 194 36 HN "Lysine HN" 1 1.008 1
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atom 195 8 C "Lysine (Neutral) CB" 6 12.000 4
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atom 196 9 H "Lysine (Neutral) HB" 1 1.008 1
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atom 197 8 C "Lysine (Neutral) CG" 6 12.000 4
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atom 198 9 H "Lysine (Neutral) HG" 1 1.008 1
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atom 199 8 C "Lysine (Neutral) CD" 6 12.011 4
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atom 200 9 H "Lysine (Neutral) HD" 1 1.008 1
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atom 201 8 C "Lysine (Neutral) CE" 6 12.011 4
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atom 202 9 H "Lysine (Neutral) HE" 1 1.008 1
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atom 203 35 N "Lysine (Neutral) NZ" 7 14.007 3
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atom 204 37 HN "Lysine (Neutral) HN" 1 1.008 1
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atom 205 8 C "Arginine CB" 6 12.000 4
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atom 206 9 H "Arginine HB" 1 1.008 1
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atom 207 8 C "Arginine CG" 6 12.000 4
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atom 208 9 H "Arginine HG" 1 1.008 1
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atom 209 8 C "Arginine CD" 6 12.000 4
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atom 210 9 H "Arginine HD" 1 1.008 1
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atom 211 1 N "Arginine NE" 7 14.003 3
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atom 212 38 HN "Arginine HE" 1 1.008 1
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atom 213 39 C "Arginine CZ" 6 12.000 3
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atom 214 1 N "Arginine NH" 7 14.003 3
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atom 215 38 HN "Arginine HH" 1 1.008 1
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atom 216 8 C "Ornithine CB" 6 12.000 4
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atom 217 9 H "Ornithine HB" 1 1.008 1
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atom 218 8 C "Ornithine CG" 6 12.000 4
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atom 219 9 H "Ornithine HG" 1 1.008 1
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atom 220 8 C "Ornithine CD" 6 12.000 4
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atom 221 9 H "Ornithine HD" 1 1.008 1
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atom 222 35 N "Ornithine NE" 7 14.003 4
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atom 223 36 HN "Ornithine HE" 1 1.008 1
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atom 224 40 C "Acetyl Cap CH3" 6 12.000 4
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atom 225 6 H "Acetyl Cap H3C" 1 1.008 1
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atom 226 3 C "Acetyl Cap C" 6 12.000 3
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atom 227 5 O "Acetyl Cap O" 8 15.995 1
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atom 228 1 N "Amide Cap NH2" 7 14.003 3
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atom 229 4 HN "Amide Cap H2N" 1 1.008 1
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atom 230 1 N "N-MeAmide Cap N" 7 14.003 3
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atom 231 4 HN "N-MeAmide Cap HN" 1 1.008 1
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atom 232 40 C "N-MeAmide Cap CH3" 6 12.000 4
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atom 233 6 H "N-MeAmide Cap H3C" 1 1.008 1
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atom 234 41 N "N-Terminal NH3+" 7 14.003 4
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atom 235 42 H "N-Terminal H3N+" 1 1.008 1
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atom 236 35 N "N-Terminal NH2" 7 14.003 3
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atom 237 37 H "N-Terminal H2N" 1 1.008 1
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atom 238 30 C "C-Terminal COO-" 6 12.000 3
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atom 239 31 O "C-Terminal COO-" 8 15.995 1
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atom 240 30 C "C-Terminal COOH" 6 12.000 3
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atom 241 32 O "C-Terminal COOH" 8 15.995 1
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atom 242 33 OH "C-Terminal COOH" 8 15.995 2
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atom 243 34 HO "C-Terminal COOH" 1 1.008 1
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atom 244 41 N "N-Terminal PRO NH2+" 7 14.003 4
|
|
atom 245 42 HN "N-Terminal PRO H2N+" 1 1.008 1
|
|
atom 246 7 CA "N-Terminal PRO CA" 6 12.000 4
|
|
atom 247 3 C "N-Terminal PRO C" 6 12.000 3
|
|
atom 248 5 O "N-Terminal PRO O" 8 15.995 1
|
|
atom 249 6 H "N-Terminal PRO HA" 1 1.008 1
|
|
atom 250 16 C "N-Terminal PRO CD" 6 12.000 4
|
|
atom 251 6 H "N-Terminal PRO HD" 1 1.008 1
|
|
atom 252 43 N* "Adenine N9" 7 14.007 3
|
|
atom 253 44 CB "Adenine C4" 6 12.011 3
|
|
atom 254 44 CB "Adenine C5" 6 12.011 3
|
|
atom 255 45 NB "Adenine N7" 7 14.007 2
|
|
atom 256 46 CK "Adenine C8" 6 12.011 3
|
|
atom 257 47 NC "Adenine N3" 7 14.007 2
|
|
atom 258 48 CQ "Adenine C2" 6 12.011 3
|
|
atom 259 47 NC "Adenine N1" 7 14.007 2
|
|
atom 260 49 CA "Adenine C6" 6 12.011 3
|
|
atom 261 50 H5 "Adenine H2" 1 1.008 1
|
|
atom 262 51 N2 "Adenine N6" 7 14.007 3
|
|
atom 263 52 H "Adenine H61" 1 1.008 1
|
|
atom 264 52 H "Adenine H62" 1 1.008 1
|
|
atom 265 50 H5 "Adenine H8" 1 1.008 1
|
|
atom 266 43 N* "Cytosine N1" 7 14.007 3
|
|
atom 267 53 C "Cytosine C2" 6 12.011 3
|
|
atom 268 47 NC "Cytosine N3" 7 14.007 2
|
|
atom 269 49 CA "Cytosine C4" 6 12.011 3
|
|
atom 270 54 CM "Cytosine C5" 6 12.011 3
|
|
atom 271 54 CM "Cytosine C6" 6 12.011 3
|
|
atom 272 55 O "Cytosine O2" 8 15.999 1
|
|
atom 273 51 N2 "Cytosine N4" 7 14.007 3
|
|
atom 274 52 H "Cytosine H41" 1 1.008 1
|
|
atom 275 52 H "Cytosine H42" 1 1.008 1
|
|
atom 276 56 HA "Cytosine H5" 1 1.008 1
|
|
atom 277 57 H4 "Cytosine H6" 1 1.008 1
|
|
atom 278 43 N* "Guanine N9" 7 14.007 3
|
|
atom 279 44 CB "Guanine C4" 6 12.011 3
|
|
atom 280 44 CB "Guanine C5" 6 12.011 3
|
|
atom 281 45 NB "Guanine N7" 7 14.007 2
|
|
atom 282 46 CK "Guanine C8" 6 12.011 3
|
|
atom 283 47 NC "Guanine N3" 7 14.007 2
|
|
atom 284 49 CA "Guanine C2" 6 12.011 3
|
|
atom 285 58 NA "Guanine N1" 7 14.007 3
|
|
atom 286 53 C "Guanine C6" 6 12.011 3
|
|
atom 287 59 H "Guanine H1" 1 1.008 1
|
|
atom 288 51 N2 "Guanine N2" 7 14.007 3
|
|
atom 289 52 H "Guanine H21" 1 1.008 1
|
|
atom 290 52 H "Guanine H22" 1 1.008 1
|
|
atom 291 55 O "Guanine O6" 8 15.999 1
|
|
atom 292 50 H5 "Guanine H8" 1 1.008 1
|
|
atom 293 43 N* "Thymine N1" 7 14.007 3
|
|
atom 294 53 C "Thymine C2" 6 12.011 3
|
|
atom 295 58 NA "Thymine N3" 7 14.007 3
|
|
atom 296 53 C "Thymine C4" 6 12.011 3
|
|
atom 297 54 CM "Thymine C5" 6 12.011 3
|
|
atom 298 54 CM "Thymine C6" 6 12.011 3
|
|
atom 299 55 O "Thymine O2" 8 15.999 1
|
|
atom 300 59 H "Thymine H3" 1 1.008 1
|
|
atom 301 55 O "Thymine O4" 8 15.999 1
|
|
atom 302 60 CT "Thymine C7" 6 12.011 4
|
|
atom 303 61 HC "Thymine H7" 1 1.008 1
|
|
atom 304 57 H4 "Thymine H6" 1 1.008 1
|
|
atom 305 43 N* "Uracil N1" 7 14.007 3
|
|
atom 306 53 C "Uracil C2" 6 12.011 3
|
|
atom 307 58 NA "Uracil N3" 7 14.007 3
|
|
atom 308 53 C "Uracil C4" 6 12.011 3
|
|
atom 309 54 CM "Uracil C5" 6 12.011 3
|
|
atom 310 54 CM "Uracil C6" 6 12.011 3
|
|
atom 311 55 O "Uracil O2" 8 15.999 1
|
|
atom 312 59 H "Uracil H3" 1 1.008 1
|
|
atom 313 55 O "Uracil O4" 8 15.999 1
|
|
atom 314 56 HA "Uracil H5" 1 1.008 1
|
|
atom 315 57 H4 "Uracil H6" 1 1.008 1
|
|
atom 316 62 OS "Ribose O5' (CU)" 8 15.999 2
|
|
atom 317 60 CT "Ribose C5' (CU)" 6 12.011 4
|
|
atom 318 61 H1 "Ribose H5'1 (CU)" 1 1.008 1
|
|
atom 319 61 H1 "Ribose H5'2 (CU)" 1 1.008 1
|
|
atom 320 63 CT "Ribose C4' (CU)" 6 12.011 4
|
|
atom 321 64 H1 "Ribose H4' (CU)" 1 1.008 1
|
|
atom 322 62 OS "Ribose O4' (CU)" 8 15.999 2
|
|
atom 323 63 CT "Ribose C1' (CU)" 6 12.011 4
|
|
atom 324 65 H2 "Ribose H1' (CU)" 1 1.008 1
|
|
atom 325 63 CT "Ribose C3' (CU)" 6 12.011 4
|
|
atom 326 64 H1 "Ribose H3' (CU)" 1 1.008 1
|
|
atom 327 63 CT "Ribose C2' (CU)" 6 12.011 4
|
|
atom 328 64 H1 "Ribose H2'1 (CU)" 1 1.008 1
|
|
atom 329 66 OH "Ribose O2' (CU)" 8 15.999 2
|
|
atom 330 67 HO "Ribose HO'2 (CU)" 1 1.008 1
|
|
atom 331 62 OS "Ribose O3' (CU)" 8 15.999 2
|
|
atom 332 62 OS "Ribose O5' (AG)" 8 15.999 2
|
|
atom 333 60 CT "Ribose C5' (AG)" 6 12.011 4
|
|
atom 334 61 H1 "Ribose H5'1 (AG)" 1 1.008 1
|
|
atom 335 61 H1 "Ribose H5'2 (AG)" 1 1.008 1
|
|
atom 336 63 CT "Ribose C4' (AG)" 6 12.011 4
|
|
atom 337 64 H1 "Ribose H4' (AG)" 1 1.008 1
|
|
atom 338 68 OS "Ribose O4' (AG)" 8 15.999 2
|
|
atom 339 63 CT "Ribose C1' (AG)" 6 12.011 4
|
|
atom 340 65 H2 "Ribose H1' (AG)" 1 1.008 1
|
|
atom 341 63 CT "Ribose C3' (AG)" 6 12.011 4
|
|
atom 342 64 H1 "Ribose H3' (AG)" 1 1.008 1
|
|
atom 343 63 CT "Ribose C2' (AG)" 6 12.011 4
|
|
atom 344 64 H1 "Ribose H2'1 (AG)" 1 1.008 1
|
|
atom 345 66 OH "Ribose O2' (AG)" 8 15.999 2
|
|
atom 346 67 HO "Ribose HO'2 (AG)" 1 1.008 1
|
|
atom 347 62 OS "Ribose O3' (AG)" 8 15.999 2
|
|
atom 348 62 OS "Deoxyribose O5' (CT)" 8 15.999 2
|
|
atom 349 60 CT "Deoxyribose C5' (CT)" 6 12.011 4
|
|
atom 350 61 H1 "Deoxyribose H5'1 (CT)" 1 1.008 1
|
|
atom 351 61 H1 "Deoxyribose H5'2 (CT)" 1 1.008 1
|
|
atom 352 69 CT "Deoxyribose C4' (CT)" 6 12.011 4
|
|
atom 353 64 H1 "Deoxyribose H4' (CT)" 1 1.008 1
|
|
atom 354 62 OS "Deoxyribose O4' (CT)" 8 15.999 2
|
|
atom 355 69 CT "Deoxyribose C1' (CT)" 6 12.011 4
|
|
atom 356 65 H2 "Deoxyribose H1' (CT)" 1 1.008 1
|
|
atom 357 69 CT "Deoxyribose C3' (CT)" 6 12.011 4
|
|
atom 358 64 H1 "Deoxyribose H3' (CT)" 1 1.008 1
|
|
atom 359 69 CT "Deoxyribose C2' (CT)" 6 12.011 4
|
|
atom 360 64 H1 "Deoxyribose H2'1 (CT)" 1 1.008 1
|
|
atom 361 64 H1 "Deoxyribose H2'2 (CT)" 1 1.008 1
|
|
atom 362 62 OS "Deoxyribose O3' (CT)" 8 15.999 2
|
|
atom 363 62 OS "Deoxyribose O5' (AG)" 8 15.999 2
|
|
atom 364 60 CT "Deoxyribose C5' (AG)" 6 12.011 4
|
|
atom 365 61 H1 "Deoxyribose H5'1 (AG)" 1 1.008 1
|
|
atom 366 61 H1 "Deoxyribose H5'2 (AG)" 1 1.008 1
|
|
atom 367 69 CT "Deoxyribose C4' (AG)" 6 12.011 4
|
|
atom 368 64 H1 "Deoxyribose H4' (AG)" 1 1.008 1
|
|
atom 369 68 OS "Deoxyribose O4' (AG)" 8 15.999 2
|
|
atom 370 69 CT "Deoxyribose C1' (AG)" 6 12.011 4
|
|
atom 371 65 H2 "Deoxyribose H1' (AG)" 1 1.008 1
|
|
atom 372 69 CT "Deoxyribose C3' (AG)" 6 12.011 4
|
|
atom 373 64 H1 "Deoxyribose H3' (AG)" 1 1.008 1
|
|
atom 374 69 CT "Deoxyribose C2' (AG)" 6 12.011 4
|
|
atom 375 64 H1 "Deoxyribose H2'1 (AG)" 1 1.008 1
|
|
atom 376 64 H1 "Deoxyribose H2'2 (AG)" 1 1.008 1
|
|
atom 377 62 OS "Deoxyribose O3' (AG)" 8 15.999 2
|
|
atom 378 70 P "R-Phosphodiester P" 15 30.974 4
|
|
atom 379 71 O2 "R-Phosphodiester OP" 8 15.999 1
|
|
atom 380 62 OH "R-5'-Hydroxyl O5'T" 8 15.999 2
|
|
atom 381 72 HO "R-5'-Hydroxyl H5T" 1 1.008 1
|
|
atom 382 62 OS "R-5'-Phosphate O5'" 8 15.999 2
|
|
atom 383 70 P "R-5'-Phosphate P" 15 30.974 4
|
|
atom 384 71 O2 "R-5'-Phosphate OP" 8 15.999 1
|
|
atom 385 62 OH "R-3'-Hydroxyl O3'T" 8 15.999 2
|
|
atom 386 72 HO "R-3'-Hydroxyl H3T" 1 1.008 1
|
|
atom 387 62 OS "R-3'-Phosphate O3'" 8 15.999 2
|
|
atom 388 70 P "R-3'-Phosphate P" 15 30.974 4
|
|
atom 389 71 O2 "R-3'-Phosphate OP" 8 15.999 1
|
|
atom 390 70 P "D-Phosphodiester P" 15 30.974 4
|
|
atom 391 71 O2 "D-Phosphodiester OP" 8 15.999 1
|
|
atom 392 62 OH "D-5'-Hydroxyl O5'T" 8 15.999 2
|
|
atom 393 72 HO "D-5'-Hydroxyl H5T" 1 1.008 1
|
|
atom 394 62 OS "D-5'-Phosphate O5'" 8 15.999 2
|
|
atom 395 70 P "D-5'-Phosphate P" 15 30.974 4
|
|
atom 396 71 O2 "D-5'-Phosphate OP" 8 15.999 1
|
|
atom 397 62 OH "D-3'-Hydroxyl O3'T" 8 15.999 2
|
|
atom 398 72 HO "D-3'-Hydroxyl H3T" 1 1.008 1
|
|
atom 399 62 OS "D-3'-Phosphate O3'" 8 15.999 2
|
|
atom 400 70 P "D-3'-Phosphate P" 15 30.974 4
|
|
atom 401 71 O2 "D-3'-Phosphate OP" 8 15.999 1
|
|
atom 402 73 O "AMOEBA Water O" 8 15.999 2
|
|
atom 403 74 H "AMOEBA Water H" 1 1.008 1
|
|
atom 404 75 Li+ "Lithium Ion Li+" 3 6.941 0
|
|
atom 405 76 Na+ "Sodium Ion Na+" 11 22.990 0
|
|
atom 406 77 K+ "Potassium Ion K+" 19 39.098 0
|
|
atom 407 78 Rb+ "Rubidium Ion Rb+" 37 85.468 0
|
|
atom 408 79 Cs+ "Cesium Ion Cs+" 55 132.905 0
|
|
atom 409 80 Be+ "Beryllium Ion Be+2" 4 9.012 0
|
|
atom 410 81 Mg+ "Magnesium Ion Mg+2" 12 24.305 0
|
|
atom 411 82 Ca+ "Calcium Ion Ca+2" 20 40.078 0
|
|
atom 412 83 Zn+ "Zinc Ion Zn+2" 30 65.380 0
|
|
atom 413 84 F- "Fluoride Ion F-" 9 18.998 0
|
|
atom 414 85 Cl- "Chloride Ion Cl-" 17 35.453 0
|
|
atom 415 86 Br- "Bromide Ion Br-" 35 79.904 0
|
|
atom 416 87 I- "Iodide Ion I-" 53 126.904 0
|
|
|
|
|
|
################################
|
|
## ##
|
|
## Van der Waals Parameters ##
|
|
## ##
|
|
################################
|
|
|
|
|
|
vdw 1 3.7100 0.1100
|
|
vdw 2 3.8200 0.1010
|
|
vdw 3 3.8200 0.1060
|
|
vdw 4 2.5900 0.0220 0.900
|
|
vdw 5 3.3000 0.1120
|
|
vdw 6 2.9400 0.0260 0.910
|
|
vdw 7 3.6500 0.1010
|
|
vdw 8 3.8200 0.1010
|
|
vdw 9 2.9800 0.0240 0.920
|
|
vdw 10 3.4050 0.1100
|
|
vdw 11 2.6550 0.0135 0.910
|
|
vdw 12 3.9100 0.3850
|
|
vdw 13 3.0000 0.0265 0.980
|
|
vdw 14 4.3500 0.3850
|
|
vdw 15 3.7100 0.1100
|
|
vdw 16 3.8200 0.1010
|
|
vdw 17 3.8000 0.0890
|
|
vdw 18 2.9800 0.0260 0.920
|
|
vdw 19 3.4050 0.1100
|
|
vdw 20 2.6550 0.0135 0.910
|
|
vdw 21 3.3200 0.1120
|
|
vdw 22 3.8000 0.1010
|
|
vdw 23 2.9800 0.0260 0.920
|
|
vdw 24 3.7100 0.1100
|
|
vdw 25 2.5900 0.0220 0.900
|
|
vdw 26 3.8000 0.1010
|
|
vdw 27 2.9800 0.0260 0.920
|
|
vdw 28 3.8000 0.1010
|
|
vdw 29 3.7100 0.1100
|
|
vdw 30 3.8200 0.1060
|
|
vdw 31 3.4500 0.1120
|
|
vdw 32 3.3000 0.1120
|
|
vdw 33 3.4050 0.1100
|
|
vdw 34 2.6550 0.0150 0.910
|
|
vdw 35 3.7100 0.1050
|
|
vdw 36 2.4800 0.0180 0.910
|
|
vdw 37 2.7000 0.0200 0.910
|
|
vdw 38 2.4200 0.0200 0.900
|
|
vdw 39 3.6500 0.1010
|
|
vdw 40 3.8200 0.1010
|
|
vdw 41 3.7100 0.1050
|
|
vdw 42 2.4800 0.0180 0.910
|
|
vdw 43 3.6800 0.1050
|
|
vdw 44 3.7800 0.1010
|
|
vdw 45 3.5000 0.1010
|
|
vdw 46 3.7800 0.1010
|
|
vdw 47 3.5000 0.1050
|
|
vdw 48 3.7800 0.1010
|
|
vdw 49 3.7800 0.1010
|
|
vdw 50 2.6000 0.0180 0.910
|
|
vdw 51 3.5000 0.1010
|
|
vdw 52 2.5500 0.0190 0.910
|
|
vdw 53 3.7800 0.1010
|
|
vdw 54 3.7800 0.1010
|
|
vdw 55 3.3000 0.1120
|
|
vdw 56 2.8000 0.0240 0.910
|
|
vdw 57 2.8000 0.0240 0.910
|
|
vdw 58 3.5000 0.1050
|
|
vdw 59 2.3000 0.0101 0.900
|
|
vdw 60 3.8200 0.1010
|
|
vdw 61 2.9800 0.0240 0.920
|
|
vdw 62 3.4050 0.1120
|
|
vdw 63 3.8200 0.1010
|
|
vdw 64 2.9800 0.0240 0.920
|
|
vdw 65 2.9800 0.0240 0.920
|
|
vdw 66 3.4050 0.1100
|
|
vdw 67 2.6550 0.0135 0.910
|
|
vdw 68 3.4050 0.1100
|
|
vdw 69 3.8200 0.1010
|
|
vdw 70 4.4500 0.3900
|
|
vdw 71 3.3600 0.1120
|
|
vdw 72 2.6550 0.0135 0.910
|
|
vdw 73 3.4050 0.1100
|
|
vdw 74 2.6550 0.0135 0.910
|
|
vdw 75 2.2000 0.0660
|
|
vdw 76 2.9550 0.2800
|
|
vdw 77 3.6800 0.3500
|
|
vdw 78 3.9000 0.3800
|
|
vdw 79 4.1400 0.4200
|
|
vdw 80 1.8800 0.0910
|
|
vdw 81 2.9400 0.3000
|
|
vdw 82 3.6300 0.3500
|
|
vdw 83 2.6800 0.2220
|
|
vdw 84 3.4300 0.2500
|
|
vdw 85 4.1200 0.3400
|
|
vdw 86 4.3200 0.4300
|
|
vdw 87 4.6100 0.5200
|
|
|
|
|
|
#####################################
|
|
## ##
|
|
## Van der Waals Pair Parameters ##
|
|
## ##
|
|
#####################################
|
|
|
|
|
|
vdwpr 77 85 4.2360 0.1512
|
|
vdwpr 77 86 4.3790 0.1664
|
|
vdwpr 77 87 4.6360 0.1720
|
|
vdwpr 78 85 4.3150 0.1859
|
|
vdwpr 78 86 4.4480 0.2068
|
|
vdwpr 78 87 4.6900 0.2145
|
|
vdwpr 79 85 4.3450 0.2894
|
|
vdwpr 79 86 4.4750 0.3307
|
|
vdwpr 79 87 4.7110 0.3466
|
|
|
|
|
|
##################################
|
|
## ##
|
|
## Bond Stretching Parameters ##
|
|
## ##
|
|
##################################
|
|
|
|
|
|
bond 1 2 375.00 1.4370
|
|
bond 1 3 482.00 1.3450
|
|
bond 1 4 487.00 1.0280
|
|
bond 1 7 375.00 1.4370
|
|
bond 1 8 374.80 1.4460
|
|
bond 1 38 487.00 1.0280
|
|
bond 1 39 491.40 1.3250
|
|
bond 1 40 375.00 1.4370
|
|
bond 2 3 345.00 1.5090
|
|
bond 2 6 341.00 1.1120
|
|
bond 2 30 345.00 1.5090
|
|
bond 2 35 381.30 1.4610
|
|
bond 2 41 381.30 1.4480
|
|
bond 3 5 662.00 1.2255
|
|
bond 3 7 345.00 1.5090
|
|
bond 3 8 345.00 1.5090
|
|
bond 3 15 482.00 1.3450
|
|
bond 3 40 345.00 1.5090
|
|
bond 6 7 341.00 1.1120
|
|
bond 6 16 341.00 1.1120
|
|
bond 6 40 341.00 1.1120
|
|
bond 7 7 323.00 1.5250
|
|
bond 7 8 323.00 1.5250
|
|
bond 7 10 410.00 1.4130
|
|
bond 7 15 375.00 1.4370
|
|
bond 7 16 323.00 1.5250
|
|
bond 7 30 345.00 1.5090
|
|
bond 7 35 381.30 1.4610
|
|
bond 7 41 381.30 1.4480
|
|
bond 8 8 323.00 1.5250
|
|
bond 8 9 341.00 1.1120
|
|
bond 8 10 410.00 1.4130
|
|
bond 8 12 215.80 1.8050
|
|
bond 8 17 453.20 1.4990
|
|
bond 8 22 345.00 1.5090
|
|
bond 8 26 453.20 1.4930
|
|
bond 8 30 345.00 1.5090
|
|
bond 8 35 381.30 1.4480
|
|
bond 8 14 216.00 1.8225
|
|
bond 9 16 341.00 1.1120
|
|
bond 10 11 548.90 0.9470
|
|
bond 12 12 188.50 2.0190
|
|
bond 12 13 278.40 1.3420
|
|
bond 15 16 375.00 1.4370
|
|
bond 16 16 323.00 1.5247
|
|
bond 16 41 381.30 1.4480
|
|
bond 17 17 471.90 1.3887
|
|
bond 17 18 370.50 1.1000
|
|
bond 17 19 431.60 1.3550
|
|
bond 17 21 680.00 1.2747
|
|
bond 19 20 548.90 0.9470
|
|
bond 22 22 471.90 1.3887
|
|
bond 22 23 370.50 1.1010
|
|
bond 22 24 653.90 1.3550
|
|
bond 24 25 467.60 1.0300
|
|
bond 24 26 653.90 1.3730
|
|
bond 24 28 653.90 1.3520
|
|
bond 26 26 539.60 1.3710
|
|
bond 26 27 370.50 1.0810
|
|
bond 26 29 670.00 1.3740
|
|
bond 27 28 370.50 1.0810
|
|
bond 28 29 670.00 1.3270
|
|
bond 30 31 705.00 1.2553
|
|
bond 30 32 705.00 1.2255
|
|
bond 30 33 431.60 1.3498
|
|
bond 33 34 514.40 0.9737
|
|
bond 35 36 461.90 1.0150
|
|
bond 35 37 515.90 1.0190
|
|
bond 41 42 461.90 1.0150
|
|
bond 43 44 350.90 1.3888
|
|
bond 43 46 470.70 1.3610
|
|
bond 43 49 455.70 1.4430
|
|
bond 43 53 435.20 1.3620
|
|
bond 43 54 437.60 1.3300
|
|
bond 43 63 498.90 1.4350
|
|
bond 43 69 498.90 1.4350
|
|
bond 43 72 575.00 1.0220
|
|
bond 44 44 314.40 1.4223
|
|
bond 44 45 342.20 1.3809
|
|
bond 44 47 415.70 1.3439
|
|
bond 44 49 335.20 1.3900
|
|
bond 44 53 324.70 1.4280
|
|
bond 45 46 588.30 1.2938
|
|
bond 46 50 426.10 1.0820
|
|
bond 47 48 439.00 1.3115
|
|
bond 47 49 489.70 1.3083
|
|
bond 47 53 432.70 1.3600
|
|
bond 48 50 381.30 1.0910
|
|
bond 49 50 402.10 1.0970
|
|
bond 49 51 455.40 1.3516
|
|
bond 49 54 410.30 1.4100
|
|
bond 49 58 377.90 1.3460
|
|
bond 51 52 300.00 1.0170
|
|
bond 51 59 539.40 1.0170
|
|
bond 53 54 420.70 1.4320
|
|
bond 53 55 732.70 1.2320
|
|
bond 53 58 210.70 1.3900
|
|
bond 54 54 654.20 1.3200
|
|
bond 54 56 441.30 1.0710
|
|
bond 54 57 426.60 1.0760
|
|
bond 54 60 292.30 1.4570
|
|
bond 58 59 532.70 1.0480
|
|
bond 60 61 398.50 1.1000
|
|
bond 60 62 484.00 1.4150
|
|
bond 60 63 390.10 1.5130
|
|
bond 60 69 380.10 1.5130
|
|
bond 62 63 484.00 1.4180
|
|
bond 62 69 384.00 1.4180
|
|
bond 62 70 450.10 1.5900
|
|
bond 62 72 557.50 0.9650
|
|
bond 63 63 385.10 1.5130
|
|
bond 63 64 389.50 1.1000
|
|
bond 63 65 392.00 1.1050
|
|
bond 63 66 580.00 1.3750
|
|
bond 63 68 484.00 1.4180
|
|
bond 64 69 389.50 1.1000
|
|
bond 65 69 405.10 1.0917
|
|
bond 66 67 530.50 0.9620
|
|
bond 68 69 384.00 1.4180
|
|
bond 69 69 320.10 1.5130
|
|
bond 70 71 776.90 1.4800
|
|
bond 73 74 556.85 0.9572
|
|
|
|
|
|
################################
|
|
## ##
|
|
## Angle Bending Parameters ##
|
|
## ##
|
|
################################
|
|
|
|
|
|
anglep 2 1 3 50.00 122.00
|
|
anglep 2 1 4 32.00 117.00
|
|
anglep 3 1 4 36.00 121.00
|
|
anglep 3 1 7 50.00 122.00
|
|
anglep 3 1 40 50.00 121.00
|
|
anglep 4 1 4 29.50 123.00
|
|
anglep 4 1 7 32.00 117.00
|
|
anglep 4 1 8 13.70 122.40
|
|
anglep 4 1 39 41.70 120.50
|
|
anglep 4 1 40 32.00 117.00
|
|
anglep 8 1 38 13.70 122.40
|
|
anglep 8 1 39 52.50 120.40
|
|
anglep 38 1 38 29.50 120.00
|
|
anglep 38 1 39 41.70 120.50
|
|
angle 1 2 3 55.00 109.80
|
|
angle 1 2 6 55.00 111.00
|
|
angle 1 2 30 61.00 109.60
|
|
angle 3 2 6 39.00 109.50
|
|
angle 3 2 35 75.20 112.10
|
|
angle 3 2 41 75.20 110.70
|
|
angle 6 2 6 40.00 107.60
|
|
angle 6 2 30 39.00 109.50
|
|
angle 6 2 35 59.00 107.78
|
|
angle 6 2 41 59.00 109.30
|
|
anglep 1 3 2 70.00 113.40
|
|
anglep 1 3 5 77.00 124.20
|
|
anglep 1 3 7 70.00 113.40
|
|
anglep 1 3 8 70.00 113.40
|
|
anglep 1 3 40 41.00 113.40
|
|
anglep 2 3 5 80.00 122.40
|
|
anglep 2 3 15 70.00 113.40
|
|
anglep 5 3 7 80.00 122.40
|
|
anglep 5 3 8 80.00 122.40
|
|
anglep 5 3 15 77.00 124.20
|
|
anglep 5 3 40 80.00 122.40
|
|
anglep 7 3 15 70.00 113.40
|
|
anglep 15 3 40 41.00 113.40
|
|
angle 1 7 3 61.00 109.60
|
|
angle 1 7 6 55.00 111.00
|
|
angle 1 7 7 54.00 111.30
|
|
angle 1 7 8 54.00 111.30
|
|
angle 1 7 30 61.00 109.60
|
|
angle 3 7 6 39.00 109.50
|
|
angle 3 7 7 58.00 110.60
|
|
angle 3 7 8 58.00 110.60
|
|
angle 3 7 15 61.00 109.60
|
|
angle 3 7 16 58.00 110.60
|
|
angle 3 7 35 75.20 112.10
|
|
angle 3 7 41 75.20 110.70
|
|
angle 6 7 7 42.00 110.70
|
|
angle 6 7 8 42.00 112.80
|
|
angle 6 7 10 59.00 110.00 108.90 108.70
|
|
angle 6 7 15 55.00 111.00
|
|
angle 6 7 16 42.00 112.80
|
|
angle 6 7 30 39.00 109.50
|
|
angle 6 7 35 59.00 107.78
|
|
angle 6 7 41 59.00 109.30
|
|
angle 7 7 8 48.20 109.50 110.20 111.00
|
|
angle 7 7 10 59.70 107.50
|
|
angle 7 7 30 58.00 110.60
|
|
angle 7 7 35 75.20 109.00
|
|
angle 7 7 41 56.10 108.50
|
|
angle 8 7 8 48.20 109.50 110.20 111.00
|
|
angle 8 7 10 59.70 107.50
|
|
angle 8 7 30 58.00 110.60
|
|
angle 8 7 35 75.20 109.00
|
|
angle 8 7 41 75.20 110.70
|
|
angle 15 7 16 54.00 104.00
|
|
angle 15 7 30 61.00 109.60
|
|
angle 16 7 30 58.00 110.60
|
|
angle 16 7 41 54.00 104.00
|
|
angle 1 8 8 56.10 109.50
|
|
angle 1 8 9 54.60 111.00
|
|
angle 3 8 7 47.60 110.60
|
|
angle 3 8 8 47.60 110.60
|
|
angle 3 8 9 39.00 109.50
|
|
angle 7 8 7 48.20 109.50 110.20 111.00
|
|
angle 7 8 8 48.20 109.50 110.20 111.00
|
|
angle 7 8 9 42.00 110.70
|
|
angle 7 8 10 59.70 107.50
|
|
angle 7 8 12 53.20 108.00 109.50 110.10
|
|
angle 7 8 17 38.90 110.60
|
|
angle 7 8 22 48.20 109.50 110.20 111.00
|
|
angle 7 8 26 38.80 112.70
|
|
angle 7 8 30 47.60 110.60
|
|
angle 7 8 14 53.20 112.73
|
|
angle 8 8 8 48.20 109.50 110.20 111.00
|
|
angle 8 8 9 42.00 110.70
|
|
angle 8 8 12 53.20 108.00 109.50 110.10
|
|
angle 8 8 30 47.60 110.60
|
|
angle 8 8 35 56.10 109.50
|
|
angle 9 8 9 40.00 107.80
|
|
angle 9 8 10 59.00 110.00 108.90 108.70
|
|
angle 9 8 12 53.20 110.80 110.80 108.00
|
|
angle 9 8 17 39.60 109.50 109.30 110.40
|
|
angle 9 8 22 61.20 109.80 109.30 110.70
|
|
angle 9 8 26 39.60 109.50
|
|
angle 9 8 30 39.00 109.50
|
|
angle 9 8 35 59.00 109.30
|
|
angle 9 8 14 35.00 109.98
|
|
angle 7 10 11 54.00 106.80
|
|
angle 8 10 11 54.00 106.80
|
|
angle 8 12 8 60.40 95.90
|
|
angle 8 12 12 71.90 101.80
|
|
angle 8 12 13 46.80 96.00
|
|
anglep 3 15 7 50.00 122.00
|
|
anglep 3 15 16 50.00 122.00
|
|
anglep 7 15 16 54.70 112.50
|
|
angle 6 16 6 40.00 107.80
|
|
angle 6 16 15 55.00 111.00
|
|
angle 6 16 16 42.00 110.70
|
|
angle 6 16 41 55.00 111.00
|
|
angle 7 16 9 42.00 110.70
|
|
angle 7 16 16 48.20 104.00
|
|
angle 9 16 9 40.00 107.80
|
|
angle 9 16 16 42.00 110.70
|
|
angle 15 16 16 54.00 104.00
|
|
angle 16 16 16 48.20 104.00
|
|
angle 16 16 41 54.00 104.00
|
|
anglep 8 17 17 33.80 122.30
|
|
anglep 17 17 17 54.70 121.70
|
|
anglep 17 17 18 35.30 120.00 120.50 0.00
|
|
anglep 17 17 19 43.20 120.00
|
|
anglep 17 17 21 60.00 123.57
|
|
angle 17 19 20 25.90 109.00
|
|
anglep 8 22 22 61.90 127.00
|
|
anglep 22 22 22 63.30 120.00
|
|
anglep 22 22 23 35.30 128.00
|
|
anglep 22 22 24 47.50 109.00
|
|
anglep 23 22 24 86.30 122.50
|
|
anglep 22 24 22 86.30 109.00
|
|
anglep 22 24 25 35.30 125.50
|
|
anglep 25 24 26 35.30 125.50
|
|
anglep 25 24 28 35.30 125.50
|
|
anglep 26 24 28 86.30 110.80
|
|
anglep 8 26 24 36.00 122.00
|
|
anglep 8 26 26 36.00 131.00
|
|
anglep 8 26 29 36.00 122.00
|
|
anglep 24 26 26 47.50 104.70
|
|
anglep 24 26 29 28.80 111.50
|
|
anglep 24 26 27 38.10 122.50
|
|
anglep 26 26 27 35.30 128.00
|
|
anglep 26 26 29 47.50 110.50
|
|
anglep 27 26 29 38.10 122.50
|
|
anglep 24 28 24 28.80 110.30
|
|
anglep 24 28 27 38.10 122.50
|
|
anglep 24 28 29 28.80 112.20
|
|
anglep 27 28 29 38.10 122.50
|
|
angle 26 29 28 86.30 104.30
|
|
anglep 2 30 31 80.00 122.40
|
|
anglep 2 30 32 80.00 122.40
|
|
anglep 2 30 33 111.50 110.30
|
|
anglep 7 30 31 80.00 122.40
|
|
anglep 7 30 32 80.00 122.40
|
|
anglep 7 30 33 111.50 110.30
|
|
anglep 8 30 31 80.00 122.40
|
|
anglep 8 30 32 80.00 122.40
|
|
angle 8 30 33 111.50 110.30
|
|
anglep 31 30 31 57.60 134.00
|
|
anglep 32 30 33 122.30 121.50
|
|
angle 30 33 34 49.60 108.70
|
|
angle 2 35 37 43.20 107.50
|
|
angle 7 35 37 43.20 107.50
|
|
angle 8 35 36 43.20 110.90
|
|
angle 8 35 37 43.16 108.10 110.90
|
|
angle 36 35 36 43.50 107.00
|
|
angle 37 35 37 34.50 106.40 107.10
|
|
anglep 1 39 1 28.80 120.00
|
|
angle 1 40 6 55.00 111.00
|
|
angle 3 40 6 39.00 109.50
|
|
angle 6 40 6 40.00 107.80
|
|
angle 2 41 42 43.20 108.50
|
|
angle 7 41 16 54.70 112.50
|
|
angle 7 41 42 43.20 108.50
|
|
angle 16 41 42 43.20 110.90
|
|
angle 42 41 42 43.20 105.40
|
|
anglep 44 43 46 89.50 109.95
|
|
anglep 44 43 49 82.10 123.90
|
|
anglep 44 43 63 82.10 122.40
|
|
anglep 44 43 69 82.10 122.40
|
|
anglep 46 43 49 73.30 125.50
|
|
anglep 46 43 63 73.30 127.30
|
|
anglep 46 43 69 73.30 127.30
|
|
anglep 53 43 54 88.10 121.00
|
|
anglep 53 43 63 86.10 117.00
|
|
anglep 53 43 69 86.10 117.00
|
|
anglep 54 43 63 84.00 122.00
|
|
anglep 54 43 69 84.00 122.00
|
|
anglep 63 43 72 45.90 105.10
|
|
anglep 69 43 72 45.90 105.10
|
|
anglep 72 43 72 45.40 102.20
|
|
anglep 43 44 44 84.00 107.00
|
|
anglep 43 44 47 79.20 119.20
|
|
anglep 44 44 45 87.20 112.10
|
|
anglep 44 44 47 78.80 133.70
|
|
anglep 44 44 49 76.90 121.00
|
|
anglep 44 44 53 88.70 120.40
|
|
anglep 45 44 49 87.70 126.90
|
|
anglep 45 44 53 89.40 127.50
|
|
angle 44 45 46 109.80 100.70
|
|
anglep 43 46 45 83.73 110.60
|
|
anglep 43 46 50 39.24 122.40
|
|
anglep 45 46 50 35.30 127.00
|
|
angle 44 47 48 95.91 115.00
|
|
angle 44 47 49 89.47 111.50
|
|
angle 48 47 49 125.64 114.80
|
|
angle 49 47 53 66.62 115.00
|
|
anglep 47 48 47 88.19 132.60
|
|
anglep 47 48 50 39.32 113.65
|
|
anglep 43 49 50 63.30 108.00
|
|
anglep 44 49 47 69.11 118.50
|
|
anglep 44 49 51 56.60 121.80
|
|
anglep 47 49 51 68.40 118.20
|
|
anglep 47 49 54 88.76 125.00
|
|
anglep 47 49 58 55.82 125.80
|
|
anglep 50 49 50 40.81 111.10
|
|
anglep 51 49 54 80.82 117.50
|
|
anglep 51 49 58 89.11 114.10
|
|
anglep 49 51 52 50.23 118.00
|
|
anglep 49 51 59 50.23 118.00
|
|
anglep 52 51 52 27.64 121.00
|
|
anglep 59 51 59 27.64 121.00
|
|
anglep 43 53 47 88.10 116.55
|
|
anglep 43 53 55 85.90 115.00
|
|
anglep 43 53 58 81.10 119.10
|
|
anglep 44 53 55 88.40 128.50
|
|
anglep 44 53 58 88.70 115.50
|
|
anglep 47 53 55 80.70 128.50
|
|
anglep 54 53 55 49.60 127.00
|
|
anglep 54 53 58 68.80 112.00
|
|
anglep 55 53 58 80.70 120.00
|
|
anglep 43 54 54 89.30 117.80
|
|
anglep 43 54 57 35.70 115.70
|
|
anglep 49 54 54 81.80 113.70
|
|
anglep 49 54 56 38.80 123.10
|
|
anglep 53 54 54 69.20 114.00
|
|
anglep 53 54 56 39.50 121.30
|
|
anglep 53 54 60 35.60 121.08
|
|
anglep 54 54 56 31.90 124.70
|
|
anglep 54 54 57 31.90 126.50
|
|
anglep 54 54 60 30.00 126.21
|
|
anglep 49 58 53 80.70 127.00
|
|
anglep 49 58 59 30.60 117.00
|
|
anglep 53 58 53 36.60 126.00
|
|
anglep 53 58 59 47.80 117.00
|
|
angle 54 60 61 68.10 108.85
|
|
angle 61 60 61 34.50 109.00
|
|
angle 61 60 62 51.50 110.00
|
|
angle 61 60 63 38.00 109.00
|
|
angle 61 60 69 38.00 109.50
|
|
angle 62 60 63 75.00 113.00
|
|
angle 62 60 69 75.00 113.00
|
|
angle 60 62 70 80.30 110.80
|
|
angle 60 62 72 55.30 104.00
|
|
angle 63 62 63 88.70 107.50
|
|
angle 63 62 70 80.30 110.80
|
|
angle 63 62 72 55.30 102.15
|
|
angle 69 62 69 88.70 108.00
|
|
angle 69 62 70 80.30 110.80
|
|
angle 69 62 72 55.30 102.15
|
|
angle 43 63 62 35.50 110.00
|
|
angle 43 63 63 40.90 102.00
|
|
angle 43 63 65 50.60 108.00
|
|
angle 43 63 68 35.50 110.00
|
|
angle 60 63 62 65.00 110.00
|
|
angle 60 63 63 50.00 109.35
|
|
angle 60 63 64 38.20 111.00
|
|
angle 60 63 68 65.00 110.00
|
|
angle 62 63 63 88.00 108.50
|
|
angle 62 63 64 54.10 111.80
|
|
angle 62 63 65 55.30 109.30
|
|
angle 63 63 63 60.00 109.35
|
|
angle 63 63 64 38.20 109.00
|
|
angle 63 63 65 36.00 112.60
|
|
angle 63 63 66 88.00 108.50
|
|
angle 63 63 68 88.00 108.50
|
|
angle 64 63 64 35.20 108.00
|
|
angle 64 63 66 54.10 111.00
|
|
angle 64 63 68 54.10 111.80
|
|
angle 65 63 65 32.80 111.10
|
|
angle 65 63 68 55.30 109.30
|
|
angle 63 66 67 55.30 101.15
|
|
angle 63 68 63 88.70 107.50
|
|
angle 69 68 69 88.70 108.00
|
|
angle 43 69 62 35.50 118.00
|
|
angle 43 69 65 52.60 106.66
|
|
angle 43 69 68 35.50 109.00
|
|
angle 43 69 69 40.90 111.00
|
|
angle 60 69 62 65.00 110.00
|
|
angle 60 69 63 65.00 110.00
|
|
angle 60 69 64 38.20 111.00
|
|
angle 60 69 68 65.00 110.00
|
|
angle 60 69 69 50.00 109.35
|
|
angle 62 69 64 54.10 111.80
|
|
angle 62 69 65 55.30 109.30
|
|
angle 62 69 69 88.00 110.00
|
|
angle 64 69 64 25.20 108.00
|
|
angle 64 69 68 54.10 111.80
|
|
angle 64 69 69 38.20 109.00
|
|
angle 65 69 65 35.50 110.60
|
|
angle 65 69 68 55.30 109.30
|
|
angle 65 69 69 36.00 112.60
|
|
angle 68 69 69 88.00 110.00
|
|
angle 69 69 69 60.00 109.35
|
|
angle 62 70 62 65.58 97.00
|
|
angle 62 70 71 75.86 110.00
|
|
angle 71 70 71 89.88 121.20
|
|
angle 74 73 74 48.70 108.50
|
|
|
|
|
|
###############################
|
|
## ##
|
|
## Stretch-Bend Parameters ##
|
|
## ##
|
|
###############################
|
|
|
|
|
|
strbnd 2 1 3 7.20 7.20
|
|
strbnd 2 1 4 4.30 4.30
|
|
strbnd 3 1 4 4.30 4.30
|
|
strbnd 3 1 7 7.20 7.20
|
|
strbnd 3 1 40 7.20 7.20
|
|
strbnd 4 1 7 4.30 4.30
|
|
strbnd 4 1 8 4.30 4.30
|
|
strbnd 4 1 39 4.30 4.30
|
|
strbnd 38 1 39 4.30 4.30
|
|
strbnd 4 1 40 4.30 4.30
|
|
strbnd 8 1 38 4.30 4.30
|
|
strbnd 8 1 39 7.20 7.20
|
|
strbnd 1 2 3 18.70 18.70
|
|
strbnd 1 2 6 11.50 11.50
|
|
strbnd 1 2 30 18.70 18.70
|
|
strbnd 3 2 6 11.50 11.50
|
|
strbnd 3 2 35 18.70 18.70
|
|
strbnd 3 2 41 18.70 18.70
|
|
strbnd 6 2 30 11.50 11.50
|
|
strbnd 6 2 35 11.50 11.50
|
|
strbnd 6 2 41 11.50 11.50
|
|
strbnd 1 3 2 18.70 18.70
|
|
strbnd 1 3 5 18.70 18.70
|
|
strbnd 1 3 7 18.70 18.70
|
|
strbnd 1 3 8 18.70 18.70
|
|
strbnd 1 3 40 18.70 18.70
|
|
strbnd 2 3 5 18.70 18.70
|
|
strbnd 2 3 15 18.70 18.70
|
|
strbnd 5 3 7 18.70 18.70
|
|
strbnd 5 3 8 18.70 18.70
|
|
strbnd 5 3 15 18.70 18.70
|
|
strbnd 5 3 40 18.70 18.70
|
|
strbnd 7 3 15 18.70 18.70
|
|
strbnd 15 3 40 18.70 18.70
|
|
strbnd 1 7 3 18.70 18.70
|
|
strbnd 1 7 6 11.50 11.50
|
|
strbnd 1 7 7 18.70 18.70
|
|
strbnd 1 7 8 18.70 18.70
|
|
strbnd 1 7 30 18.70 18.70
|
|
strbnd 3 7 6 11.50 11.50
|
|
strbnd 3 7 7 18.70 18.70
|
|
strbnd 3 7 8 18.70 18.70
|
|
strbnd 3 7 15 18.70 18.70
|
|
strbnd 3 7 16 18.70 18.70
|
|
strbnd 3 7 35 18.70 18.70
|
|
strbnd 3 7 41 18.70 18.70
|
|
strbnd 6 7 7 11.50 11.50
|
|
strbnd 6 7 8 11.50 11.50
|
|
strbnd 6 7 10 11.50 11.50
|
|
strbnd 6 7 15 11.50 11.50
|
|
strbnd 6 7 16 11.50 11.50
|
|
strbnd 6 7 30 11.50 11.50
|
|
strbnd 6 7 35 11.50 11.50
|
|
strbnd 6 7 41 11.50 11.50
|
|
strbnd 7 7 8 18.70 18.70
|
|
strbnd 7 7 10 18.70 18.70
|
|
strbnd 7 7 30 18.70 18.70
|
|
strbnd 7 7 41 18.70 18.70
|
|
strbnd 8 7 8 18.70 18.70
|
|
strbnd 8 7 10 18.70 18.70
|
|
strbnd 8 7 30 18.70 18.70
|
|
strbnd 8 7 41 18.70 18.70
|
|
strbnd 15 7 16 18.70 18.70
|
|
strbnd 15 7 30 18.70 18.70
|
|
strbnd 16 7 30 18.70 18.70
|
|
strbnd 16 7 41 18.70 18.70
|
|
strbnd 1 8 8 18.70 18.70
|
|
strbnd 1 8 9 11.50 11.50
|
|
strbnd 3 8 7 18.70 18.70
|
|
strbnd 3 8 8 18.70 18.70
|
|
strbnd 3 8 9 11.50 11.50
|
|
strbnd 7 8 7 18.70 18.70
|
|
strbnd 7 8 8 18.70 18.70
|
|
strbnd 7 8 9 11.50 11.50
|
|
strbnd 7 8 10 18.70 18.70
|
|
strbnd 7 8 12 18.70 18.70
|
|
strbnd 7 8 17 18.70 18.70
|
|
strbnd 7 8 22 18.70 18.70
|
|
strbnd 7 8 26 18.70 18.70
|
|
strbnd 7 8 30 18.70 18.70
|
|
strbnd 7 8 14 18.70 18.70
|
|
strbnd 8 8 8 18.70 18.70
|
|
strbnd 8 8 9 11.50 11.50
|
|
strbnd 8 8 12 18.70 18.70
|
|
strbnd 8 8 30 18.70 18.70
|
|
strbnd 8 8 35 18.70 18.70
|
|
strbnd 9 8 10 11.50 11.50
|
|
strbnd 9 8 12 11.50 11.50
|
|
strbnd 9 8 17 11.50 11.50
|
|
strbnd 9 8 22 11.50 11.50
|
|
strbnd 9 8 26 11.50 11.50
|
|
strbnd 9 8 30 11.50 11.50
|
|
strbnd 9 8 35 11.50 11.50
|
|
strbnd 7 10 11 12.95 12.95
|
|
strbnd 8 10 11 12.95 12.95
|
|
strbnd 8 12 8 -5.75 -5.75
|
|
strbnd 8 12 12 -5.75 -5.75
|
|
strbnd 8 12 13 1.45 1.45
|
|
strbnd 3 15 7 7.20 7.20
|
|
strbnd 3 15 16 7.20 7.20
|
|
strbnd 7 15 16 7.20 7.20
|
|
strbnd 6 16 15 11.50 11.50
|
|
strbnd 6 16 16 11.50 11.50
|
|
strbnd 6 16 41 11.50 11.50
|
|
strbnd 7 16 9 11.50 11.50
|
|
strbnd 7 16 16 18.70 18.70
|
|
strbnd 9 16 16 11.50 11.50
|
|
strbnd 15 16 16 18.70 18.70
|
|
strbnd 16 16 16 18.70 18.70
|
|
strbnd 16 16 41 18.70 18.70
|
|
strbnd 8 17 17 18.70 18.70
|
|
strbnd 17 17 17 18.70 18.70
|
|
strbnd 17 17 18 11.50 11.50
|
|
strbnd 17 17 19 18.70 18.70
|
|
strbnd 17 17 21 18.70 18.70
|
|
strbnd 17 19 20 12.95 12.95
|
|
strbnd 8 22 22 18.70 18.70
|
|
strbnd 22 22 22 18.70 18.70
|
|
strbnd 22 22 23 11.50 11.50
|
|
strbnd 22 22 24 18.70 18.70
|
|
strbnd 23 22 24 11.50 11.50
|
|
strbnd 22 24 22 14.40 14.40
|
|
strbnd 22 24 25 4.30 4.30
|
|
strbnd 25 24 26 4.30 4.30
|
|
strbnd 25 24 28 4.30 4.30
|
|
strbnd 26 24 28 14.40 14.40
|
|
strbnd 8 26 24 18.70 18.70
|
|
strbnd 8 26 26 18.70 18.70
|
|
strbnd 8 26 29 18.70 18.70
|
|
strbnd 24 26 26 18.70 18.70
|
|
strbnd 24 26 29 18.70 18.70
|
|
strbnd 24 26 27 11.50 11.50
|
|
strbnd 26 26 27 11.50 11.50
|
|
strbnd 26 26 29 18.70 18.70
|
|
strbnd 27 26 29 11.50 11.50
|
|
strbnd 24 28 24 18.70 18.70
|
|
strbnd 24 28 27 11.50 11.50
|
|
strbnd 24 28 29 18.70 18.70
|
|
strbnd 27 28 29 11.50 11.50
|
|
strbnd 26 29 28 14.40 14.40
|
|
strbnd 2 30 31 18.70 18.70
|
|
strbnd 2 30 32 18.70 18.70
|
|
strbnd 2 30 33 18.70 18.70
|
|
strbnd 7 30 31 18.70 18.70
|
|
strbnd 7 30 32 18.70 18.70
|
|
strbnd 7 30 33 18.70 18.70
|
|
strbnd 8 30 31 18.70 18.70
|
|
strbnd 8 30 32 18.70 18.70
|
|
strbnd 8 30 33 18.70 18.70
|
|
strbnd 31 30 31 18.70 18.70
|
|
strbnd 32 30 33 18.70 18.70
|
|
strbnd 2 35 37 4.30 4.30
|
|
strbnd 7 35 37 4.30 4.30
|
|
strbnd 8 35 36 4.30 4.30
|
|
strbnd 8 35 37 4.30 4.30
|
|
strbnd 1 39 1 18.70 18.70
|
|
strbnd 1 40 6 11.50 11.50
|
|
strbnd 3 40 6 11.50 11.50
|
|
strbnd 2 41 42 4.30 4.30
|
|
strbnd 7 41 16 7.20 7.20
|
|
strbnd 7 41 42 4.30 4.30
|
|
strbnd 16 41 42 4.30 4.30
|
|
strbnd 44 43 46 14.40 14.40
|
|
strbnd 44 43 49 14.40 14.40
|
|
strbnd 44 43 63 14.40 14.40
|
|
strbnd 44 43 69 14.40 14.40
|
|
strbnd 46 43 49 14.40 14.40
|
|
strbnd 46 43 63 14.40 14.40
|
|
strbnd 46 43 69 14.40 14.40
|
|
strbnd 53 43 54 14.40 14.40
|
|
strbnd 53 43 63 14.40 14.40
|
|
strbnd 53 43 69 14.40 14.40
|
|
strbnd 54 43 63 14.40 14.40
|
|
strbnd 54 43 69 14.40 14.40
|
|
strbnd 63 43 72 4.30 4.30
|
|
strbnd 69 43 72 4.30 4.30
|
|
strbnd 43 44 44 18.70 18.70
|
|
strbnd 43 44 47 18.70 18.70
|
|
strbnd 44 44 45 18.70 18.70
|
|
strbnd 44 44 47 18.70 18.70
|
|
strbnd 44 44 49 18.70 18.70
|
|
strbnd 44 44 53 18.70 18.70
|
|
strbnd 45 44 49 18.70 18.70
|
|
strbnd 45 44 53 18.70 18.70
|
|
strbnd 44 45 46 14.40 14.40
|
|
strbnd 43 46 45 18.70 18.70
|
|
strbnd 43 46 50 11.50 11.50
|
|
strbnd 45 46 50 11.50 11.50
|
|
strbnd 44 47 48 14.40 14.40
|
|
strbnd 44 47 49 14.40 14.40
|
|
strbnd 48 47 49 14.40 14.40
|
|
strbnd 49 47 53 14.40 14.40
|
|
strbnd 47 48 47 18.70 18.70
|
|
strbnd 47 48 50 11.50 11.50
|
|
strbnd 43 49 50 11.50 11.50
|
|
strbnd 44 49 47 18.70 18.70
|
|
strbnd 44 49 51 18.70 18.70
|
|
strbnd 47 49 51 18.70 18.70
|
|
strbnd 47 49 54 18.70 18.70
|
|
strbnd 47 49 58 18.70 18.70
|
|
strbnd 51 49 54 18.70 18.70
|
|
strbnd 51 49 58 18.70 18.70
|
|
strbnd 49 51 52 4.30 4.30
|
|
strbnd 49 51 59 4.30 4.30
|
|
strbnd 43 53 47 18.70 18.70
|
|
strbnd 43 53 55 18.70 18.70
|
|
strbnd 43 53 58 18.70 18.70
|
|
strbnd 44 53 55 18.70 18.70
|
|
strbnd 44 53 58 18.70 18.70
|
|
strbnd 47 53 55 18.70 18.70
|
|
strbnd 54 53 55 18.70 18.70
|
|
strbnd 54 53 58 18.70 18.70
|
|
strbnd 55 53 58 18.70 18.70
|
|
strbnd 43 54 54 18.70 18.70
|
|
strbnd 43 54 57 11.50 11.50
|
|
strbnd 49 54 54 18.70 18.70
|
|
strbnd 49 54 56 11.50 11.50
|
|
strbnd 53 54 54 18.70 18.70
|
|
strbnd 53 54 56 11.50 11.50
|
|
strbnd 53 54 60 18.70 18.70
|
|
strbnd 54 54 56 11.50 11.50
|
|
strbnd 54 54 57 11.50 11.50
|
|
strbnd 54 54 60 18.70 18.70
|
|
strbnd 49 58 53 7.20 7.20
|
|
strbnd 49 58 59 4.30 4.30
|
|
strbnd 53 58 53 7.20 7.20
|
|
strbnd 53 58 59 4.30 4.30
|
|
strbnd 54 60 61 11.50 11.50
|
|
strbnd 61 60 62 11.50 11.50
|
|
strbnd 61 60 63 11.50 11.50
|
|
strbnd 61 60 69 11.50 11.50
|
|
strbnd 62 60 63 18.70 18.70
|
|
strbnd 62 60 69 18.70 18.70
|
|
strbnd 60 62 70 14.40 14.40
|
|
strbnd 60 62 72 12.95 12.95
|
|
strbnd 63 62 63 14.40 14.40
|
|
strbnd 63 62 70 14.40 14.40
|
|
strbnd 63 62 72 12.95 12.95
|
|
strbnd 69 62 69 14.40 14.40
|
|
strbnd 69 62 70 14.40 14.40
|
|
strbnd 69 62 72 12.95 12.95
|
|
strbnd 43 63 62 18.70 18.70
|
|
strbnd 43 63 63 18.70 18.70
|
|
strbnd 43 63 65 11.50 11.50
|
|
strbnd 43 63 68 18.70 18.70
|
|
strbnd 60 63 62 18.70 18.70
|
|
strbnd 60 63 63 18.70 18.70
|
|
strbnd 60 63 64 11.50 11.50
|
|
strbnd 60 63 68 18.70 18.70
|
|
strbnd 62 63 63 18.70 18.70
|
|
strbnd 62 63 64 11.50 11.50
|
|
strbnd 62 63 65 11.50 11.50
|
|
strbnd 63 63 63 18.70 18.70
|
|
strbnd 63 63 64 11.50 11.50
|
|
strbnd 63 63 65 11.50 11.50
|
|
strbnd 63 63 66 18.70 18.70
|
|
strbnd 63 63 68 18.70 18.70
|
|
strbnd 64 63 66 11.50 11.50
|
|
strbnd 64 63 68 11.50 11.50
|
|
strbnd 65 63 68 11.50 11.50
|
|
strbnd 43 69 62 18.70 18.70
|
|
strbnd 43 69 65 11.50 11.50
|
|
strbnd 43 69 68 18.70 18.70
|
|
strbnd 43 69 69 18.70 18.70
|
|
strbnd 60 69 62 18.70 18.70
|
|
strbnd 60 69 63 18.70 18.70
|
|
strbnd 60 69 64 11.50 11.50
|
|
strbnd 60 69 68 18.70 18.70
|
|
strbnd 60 69 69 18.70 18.70
|
|
strbnd 62 69 64 11.50 11.50
|
|
strbnd 62 69 65 11.50 11.50
|
|
strbnd 62 69 69 18.70 18.70
|
|
strbnd 64 69 68 11.50 11.50
|
|
strbnd 64 69 69 11.50 11.50
|
|
strbnd 65 69 68 11.50 11.50
|
|
strbnd 65 69 69 11.50 11.50
|
|
strbnd 68 69 69 18.70 18.70
|
|
strbnd 69 69 69 18.70 18.70
|
|
strbnd 62 70 62 14.40 14.40
|
|
strbnd 62 70 71 14.40 14.40
|
|
strbnd 71 70 71 14.40 14.40
|
|
|
|
|
|
###############################
|
|
## ##
|
|
## Urey-Bradley Parameters ##
|
|
## ##
|
|
###############################
|
|
|
|
|
|
ureybrad 74 73 74 -7.60 1.5537
|
|
|
|
|
|
####################################
|
|
## ##
|
|
## Out-of-Plane Bend Parameters ##
|
|
## ##
|
|
####################################
|
|
|
|
|
|
opbend 2 1 0 0 41.70
|
|
opbend 3 1 0 0 70.50
|
|
opbend 4 1 0 0 12.90
|
|
opbend 7 1 0 0 41.70
|
|
opbend 8 1 0 0 0.70
|
|
opbend 38 1 0 0 12.90
|
|
opbend 39 1 0 0 3.60
|
|
opbend 40 1 0 0 41.70
|
|
opbend 1 3 0 0 107.90
|
|
opbend 2 3 0 0 49.60
|
|
opbend 5 3 0 0 54.00
|
|
opbend 7 3 0 0 49.60
|
|
opbend 8 3 0 0 20.90
|
|
opbend 15 3 0 0 49.60
|
|
opbend 40 3 0 0 49.60
|
|
opbend 3 15 0 0 14.40
|
|
opbend 7 15 0 0 14.40
|
|
opbend 16 15 0 0 14.40
|
|
opbend 40 15 0 0 14.40
|
|
opbend 8 17 0 0 14.40
|
|
opbend 17 17 0 0 14.40
|
|
opbend 18 17 0 0 15.10
|
|
opbend 19 17 0 0 14.40
|
|
opbend 21 17 0 0 14.40
|
|
opbend 8 22 0 0 14.40
|
|
opbend 22 22 0 0 14.40
|
|
opbend 23 22 0 0 15.10
|
|
opbend 24 22 0 0 14.40
|
|
opbend 22 24 0 0 34.50
|
|
opbend 25 24 0 0 12.90
|
|
opbend 26 24 0 0 15.10
|
|
opbend 28 24 0 0 15.10
|
|
opbend 8 26 0 0 14.40
|
|
opbend 24 26 0 0 14.40
|
|
opbend 26 26 0 0 14.40
|
|
opbend 27 26 0 0 14.40
|
|
opbend 29 26 0 0 14.40
|
|
opbend 24 28 0 0 14.40
|
|
opbend 27 28 0 0 14.40
|
|
opbend 29 28 0 0 14.40
|
|
opbend 2 30 0 0 121.60
|
|
opbend 7 30 0 0 121.60
|
|
opbend 8 30 0 0 121.60
|
|
opbend 31 30 0 0 118.70
|
|
opbend 32 30 0 0 118.70
|
|
opbend 33 30 0 0 122.30
|
|
opbend 1 39 0 0 1.40
|
|
opbend 44 43 0 0 15.10
|
|
opbend 46 43 0 0 15.10
|
|
opbend 49 43 0 0 133.10
|
|
opbend 53 43 0 0 14.40
|
|
opbend 54 43 0 0 14.40
|
|
opbend 63 43 0 0 133.10
|
|
opbend 69 43 0 0 133.10
|
|
opbend 72 43 0 0 0.00
|
|
opbend 43 44 0 0 14.40
|
|
opbend 44 44 0 0 14.40
|
|
opbend 45 44 0 0 14.40
|
|
opbend 47 44 0 0 14.40
|
|
opbend 49 44 0 0 14.40
|
|
opbend 53 44 0 0 14.40
|
|
opbend 43 46 0 0 14.40
|
|
opbend 45 46 0 0 14.40
|
|
opbend 50 46 0 0 57.60
|
|
opbend 47 48 0 0 14.40
|
|
opbend 50 48 0 0 18.00
|
|
opbend 44 49 0 0 14.40
|
|
opbend 47 49 0 0 14.40
|
|
opbend 51 49 0 0 46.80
|
|
opbend 54 49 0 0 21.60
|
|
opbend 58 49 0 0 14.40
|
|
opbend 49 51 0 0 14.40
|
|
opbend 52 51 0 0 14.40
|
|
opbend 59 51 0 0 14.40
|
|
opbend 43 53 0 0 14.40
|
|
opbend 44 53 0 0 121.60
|
|
opbend 47 53 0 0 118.70
|
|
opbend 54 53 0 0 20.90
|
|
opbend 55 53 0 0 86.30
|
|
opbend 58 53 0 0 86.30
|
|
opbend 43 54 0 0 14.40
|
|
opbend 49 54 0 0 14.40
|
|
opbend 53 54 0 0 14.40
|
|
opbend 54 54 0 0 14.40
|
|
opbend 56 54 0 0 14.40
|
|
opbend 57 54 0 0 14.40
|
|
opbend 60 54 0 0 14.40
|
|
opbend 49 58 0 0 15.10
|
|
opbend 53 58 0 0 15.10
|
|
opbend 59 58 0 0 12.90
|
|
|
|
|
|
############################
|
|
## ##
|
|
## Torsional Parameters ##
|
|
## ##
|
|
############################
|
|
|
|
|
|
torsion 3 1 2 3 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 3 1 2 6 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 3 1 2 30 -0.856 0.0 1 0.048 180.0 2 -1.842 0.0 3
|
|
torsion 4 1 2 3 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 2 6 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 2 30 0.000 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 2 1 3 2 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 2 1 3 5 1.000 0.0 1 2.250 180.0 2 -2.250 0.0 3
|
|
torsion 2 1 3 7 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 2 1 3 40 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 4 1 3 2 0.000 0.0 1 1.000 180.0 2 0.800 0.0 3
|
|
torsion 4 1 3 5 0.000 0.0 1 1.000 180.0 2 -0.550 0.0 3
|
|
torsion 4 1 3 7 0.000 0.0 1 1.000 180.0 2 0.800 0.0 3
|
|
torsion 4 1 3 8 0.000 0.0 1 1.000 180.0 2 0.800 0.0 3
|
|
torsion 4 1 3 40 0.000 0.0 1 1.000 180.0 2 0.800 0.0 3
|
|
torsion 7 1 3 2 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 7 1 3 5 1.000 0.0 1 2.250 180.0 2 -2.250 0.0 3
|
|
torsion 7 1 3 7 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 7 1 3 40 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 40 1 3 2 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 40 1 3 5 1.000 0.0 1 2.250 180.0 2 -2.250 0.0 3
|
|
torsion 40 1 3 7 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 3 1 7 3 0.794 0.0 1 -0.639 180.0 2 0.720 0.0 3
|
|
torsion 3 1 7 6 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 3 1 7 7 1.999 0.0 1 0.021 180.0 2 0.000 0.0 3
|
|
torsion 3 1 7 8 1.999 0.0 1 0.021 180.0 2 0.000 0.0 3
|
|
torsion 3 1 7 30 -0.856 0.0 1 0.048 180.0 2 -1.842 0.0 3
|
|
torsion 4 1 7 3 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 7 6 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 7 7 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 7 8 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 7 30 0.000 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 8 8 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 8 9 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 38 1 8 8 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 38 1 8 9 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 39 1 8 8 0.982 0.0 1 0.994 180.0 2 0.170 0.0 3
|
|
torsion 39 1 8 9 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 3 1 40 6 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 4 1 40 6 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 4 1 39 1 0.000 0.0 1 4.000 180.0 2 0.000 0.0 3
|
|
torsion 8 1 39 1 0.000 0.0 1 4.500 180.0 2 0.000 0.0 3
|
|
torsion 38 1 39 1 0.000 0.0 1 4.000 180.0 2 0.000 0.0 3
|
|
torsion 1 2 3 1 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 2 3 5 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 2 3 15 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 6 2 3 1 0.000 0.0 1 0.000 180.0 2 -0.010 0.0 3
|
|
torsion 6 2 3 5 0.000 0.0 1 0.000 180.0 2 0.235 0.0 3
|
|
torsion 6 2 3 15 0.000 0.0 1 0.000 180.0 2 -0.010 0.0 3
|
|
torsion 41 2 3 1 -0.397 0.0 1 2.196 180.0 2 -0.371 0.0 3
|
|
torsion 41 2 3 5 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 41 2 3 15 -0.397 0.0 1 2.196 180.0 2 -0.371 0.0 3
|
|
torsion 1 2 30 31 -0.059 0.0 1 1.900 180.0 2 -0.045 0.0 3
|
|
torsion 1 2 30 32 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 2 30 33 -0.059 0.0 1 1.900 180.0 2 -0.045 0.0 3
|
|
torsion 6 2 30 31 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 6 2 30 32 0.000 0.0 1 0.000 180.0 2 0.235 0.0 3
|
|
torsion 6 2 30 33 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 3 2 41 42 1.239 0.0 1 -0.405 180.0 2 0.035 0.0 3
|
|
torsion 6 2 41 42 0.000 0.0 1 -0.081 180.0 2 0.370 0.0 3
|
|
torsion 1 3 7 1 -1.688 0.0 1 4.249 180.0 2 0.000 0.0 3
|
|
torsion 1 3 7 6 0.000 0.0 1 0.000 180.0 2 -0.010 0.0 3
|
|
torsion 1 3 7 7 0.447 0.0 1 1.707 180.0 2 -1.342 0.0 3
|
|
torsion 1 3 7 8 0.447 0.0 1 1.707 180.0 2 -1.342 0.0 3
|
|
torsion 1 3 7 15 -2.118 0.0 1 1.173 180.0 2 0.000 0.0 3
|
|
torsion 1 3 7 16 2.225 0.0 1 -1.252 180.0 2 -1.067 0.0 3
|
|
torsion 1 3 7 35 -0.397 0.0 1 2.196 180.0 2 -0.371 0.0 3
|
|
torsion 1 3 7 41 -0.397 0.0 1 2.196 180.0 2 -0.371 0.0 3
|
|
torsion 5 3 7 1 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 5 3 7 6 0.000 0.0 1 0.000 180.0 2 0.235 0.0 3
|
|
torsion 5 3 7 7 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 5 3 7 8 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 5 3 7 15 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 5 3 7 16 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 5 3 7 35 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 5 3 7 41 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 15 3 7 1 -1.804 0.0 1 3.612 180.0 2 -0.196 0.0 3
|
|
torsion 15 3 7 6 0.000 0.0 1 0.000 180.0 2 -0.010 0.0 3
|
|
torsion 15 3 7 7 0.355 0.0 1 1.478 180.0 2 -0.896 0.0 3
|
|
torsion 15 3 7 8 0.355 0.0 1 1.478 180.0 2 -0.896 0.0 3
|
|
torsion 15 3 7 15 -2.118 0.0 1 1.173 180.0 2 0.000 0.0 3
|
|
torsion 15 3 7 16 2.225 0.0 1 -1.252 180.0 2 -1.067 0.0 3
|
|
torsion 15 3 7 41 -0.397 0.0 1 2.196 180.0 2 -0.371 0.0 3
|
|
torsion 1 3 8 7 0.281 0.0 1 0.664 180.0 2 -0.847 0.0 3
|
|
torsion 1 3 8 8 -0.475 0.0 1 0.775 180.0 2 0.042 0.0 3
|
|
torsion 1 3 8 9 0.000 0.0 1 0.000 180.0 2 0.230 0.0 3
|
|
torsion 5 3 8 7 1.091 0.0 1 0.448 180.0 2 0.596 0.0 3
|
|
torsion 5 3 8 8 0.454 0.0 1 0.080 180.0 2 -0.310 0.0 3
|
|
torsion 5 3 8 9 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 2 3 15 7 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 2 3 15 16 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 5 3 15 7 1.000 0.0 1 2.250 180.0 2 -2.250 0.0 3
|
|
torsion 5 3 15 16 1.000 0.0 1 2.250 180.0 2 -2.250 0.0 3
|
|
torsion 7 3 15 7 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 7 3 15 16 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 40 3 15 7 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 40 3 15 16 -1.000 0.0 1 2.000 180.0 2 2.000 0.0 3
|
|
torsion 1 3 40 6 0.000 0.0 1 0.000 180.0 2 -0.010 0.0 3
|
|
torsion 5 3 40 6 0.000 0.0 1 0.000 180.0 2 0.235 0.0 3
|
|
torsion 15 3 40 6 0.000 0.0 1 0.000 180.0 2 -0.010 0.0 3
|
|
torsion 1 7 7 6 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 1 7 7 8 0.774 0.0 1 -1.686 180.0 2 0.000 0.0 3
|
|
torsion 1 7 7 10 -1.094 0.0 1 0.621 180.0 2 0.018 0.0 3
|
|
torsion 3 7 7 6 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 3 7 7 8 1.343 0.0 1 0.135 180.0 2 0.000 0.0 3
|
|
torsion 3 7 7 10 -0.538 0.0 1 0.703 180.0 2 -0.166 0.0 3
|
|
torsion 6 7 7 6 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 6 7 7 8 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 6 7 7 10 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 6 7 7 30 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 6 7 7 35 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 6 7 7 41 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 8 7 7 30 1.343 0.0 1 0.135 180.0 2 0.000 0.0 3
|
|
torsion 8 7 7 35 -0.282 0.0 1 -0.258 180.0 2 0.000 0.0 3
|
|
torsion 8 7 7 41 -0.282 0.0 1 -0.258 180.0 2 0.000 0.0 3
|
|
torsion 10 7 7 17 -0.538 0.0 1 0.703 180.0 2 -0.166 0.0 3
|
|
torsion 10 7 7 30 -0.538 0.0 1 0.703 180.0 2 -0.166 0.0 3
|
|
torsion 10 7 7 35 -1.094 0.0 1 0.621 180.0 2 0.018 0.0 3
|
|
torsion 10 7 7 41 -1.094 0.0 1 0.621 180.0 2 0.018 0.0 3
|
|
torsion 1 7 8 3 -0.508 0.0 1 -0.213 180.0 2 -0.337 0.0 3
|
|
torsion 1 7 8 7 -0.899 0.0 1 1.078 180.0 2 -0.341 0.0 3
|
|
torsion 1 7 8 8 0.370 0.0 1 0.594 180.0 2 -0.226 0.0 3
|
|
torsion 1 7 8 9 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 1 7 8 10 0.192 0.0 1 -0.115 180.0 2 -0.309 0.0 3
|
|
torsion 1 7 8 12 -0.870 0.0 1 0.910 180.0 2 -0.718 0.0 3
|
|
torsion 1 7 8 17 -2.284 0.0 1 1.340 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 22 -3.042 0.0 1 1.086 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 26 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 30 0.165 0.0 1 1.400 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 14 3.405 0.0 1 2.860 180.0 2 -0.401 0.0 3
|
|
torsion 3 7 8 3 -3.063 0.0 1 -0.952 180.0 2 0.398 0.0 3
|
|
torsion 3 7 8 7 1.148 0.0 1 -0.289 180.0 2 -0.557 0.0 3
|
|
torsion 3 7 8 8 2.523 0.0 1 0.931 180.0 2 -0.410 0.0 3
|
|
torsion 3 7 8 9 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 3 7 8 10 -1.664 0.0 1 -0.531 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 12 -2.400 0.0 1 0.550 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 17 -3.229 0.0 1 0.588 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 22 -1.155 0.0 1 1.249 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 26 0.139 0.0 1 -0.814 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 30 -1.178 0.0 1 1.055 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 14 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 6 7 8 3 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 6 7 8 7 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 6 7 8 8 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 6 7 8 9 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 6 7 8 10 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 6 7 8 12 0.000 0.0 1 0.000 180.0 2 0.475 0.0 3
|
|
torsion 6 7 8 17 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 6 7 8 22 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 6 7 8 26 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 6 7 8 30 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 6 7 8 14 0.000 0.0 1 0.000 180.0 2 0.475 0.0 3
|
|
torsion 7 7 8 8 0.856 0.0 1 0.841 180.0 2 -0.374 0.0 3
|
|
torsion 7 7 8 9 0.000 0.0 1 0.000 180.0 2 0.091 0.0 3
|
|
torsion 8 7 8 7 -0.631 0.0 1 1.067 180.0 2 -0.703 0.0 3
|
|
torsion 8 7 8 8 -0.631 0.0 1 1.067 180.0 2 -0.703 0.0 3
|
|
torsion 8 7 8 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 10 7 8 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 30 7 8 3 -2.457 0.0 1 0.853 180.0 2 -0.025 0.0 3
|
|
torsion 30 7 8 7 -1.349 0.0 1 0.221 180.0 2 -0.157 0.0 3
|
|
torsion 30 7 8 8 0.267 0.0 1 -0.324 180.0 2 -0.321 0.0 3
|
|
torsion 30 7 8 9 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 30 7 8 10 -0.538 0.0 1 0.703 180.0 2 -0.166 0.0 3
|
|
torsion 30 7 8 12 -2.400 0.0 1 0.550 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 17 -3.229 0.0 1 0.588 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 22 -1.155 0.0 1 1.249 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 26 0.139 0.0 1 -0.814 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 30 -1.178 0.0 1 1.055 180.0 2 0.000 0.0 3
|
|
torsion 35 7 8 7 -1.602 0.0 1 1.213 180.0 2 -0.466 0.0 3
|
|
torsion 35 7 8 9 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 35 7 8 10 -1.094 0.0 1 0.621 180.0 2 0.018 0.0 3
|
|
torsion 35 7 8 12 -1.070 0.0 1 1.510 180.0 2 -0.718 0.0 3
|
|
torsion 35 7 8 17 -2.284 0.0 1 1.340 180.0 2 0.000 0.0 3
|
|
torsion 35 7 8 22 -3.042 0.0 1 1.086 180.0 2 0.000 0.0 3
|
|
torsion 35 7 8 26 -1.642 0.0 1 -1.232 180.0 2 0.000 0.0 3
|
|
torsion 35 7 8 30 0.165 0.0 1 1.400 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 3 -0.536 0.0 1 0.869 180.0 2 -0.995 0.0 3
|
|
torsion 41 7 8 7 -1.602 0.0 1 1.213 180.0 2 -0.466 0.0 3
|
|
torsion 41 7 8 8 0.122 0.0 1 0.091 180.0 2 0.024 0.0 3
|
|
torsion 41 7 8 9 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 41 7 8 10 -1.094 0.0 1 0.621 180.0 2 0.018 0.0 3
|
|
torsion 41 7 8 12 -1.070 0.0 1 1.510 180.0 2 -0.718 0.0 3
|
|
torsion 41 7 8 17 -2.284 0.0 1 1.340 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 22 -3.042 0.0 1 1.086 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 26 -1.642 0.0 1 -1.232 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 30 0.165 0.0 1 1.400 180.0 2 0.000 0.0 3
|
|
torsion 6 7 10 11 0.000 0.0 1 0.000 180.0 2 0.266 0.0 3
|
|
torsion 7 7 10 11 -1.372 0.0 1 0.232 180.0 2 0.400 0.0 3
|
|
torsion 8 7 10 11 -1.372 0.0 1 0.232 180.0 2 0.400 0.0 3
|
|
torsion 3 7 15 3 -0.240 0.0 1 -3.086 180.0 2 -1.829 0.0 3
|
|
torsion 3 7 15 16 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 6 7 15 3 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 6 7 15 16 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 16 7 15 3 3.089 0.0 1 5.376 180.0 2 -1.829 0.0 3
|
|
torsion 16 7 15 16 2.216 0.0 1 0.215 180.0 2 0.810 0.0 3
|
|
torsion 30 7 15 3 -0.240 0.0 1 -3.086 180.0 2 -1.829 0.0 3
|
|
torsion 30 7 15 16 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 3 7 16 9 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 3 7 16 16 -0.928 0.0 1 1.027 180.0 2 0.000 0.0 3
|
|
torsion 6 7 16 9 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 6 7 16 16 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 15 7 16 9 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 15 7 16 16 -0.201 0.0 1 0.687 180.0 2 0.000 0.0 3
|
|
torsion 30 7 16 9 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 30 7 16 16 -0.928 0.0 1 1.027 180.0 2 0.000 0.0 3
|
|
torsion 41 7 16 9 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 41 7 16 16 -0.201 0.0 1 0.687 180.0 2 0.000 0.0 3
|
|
torsion 1 7 30 31 -0.059 0.0 1 1.900 180.0 2 -0.045 0.0 3
|
|
torsion 1 7 30 32 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 7 30 33 -0.059 0.0 1 1.900 180.0 2 -0.045 0.0 3
|
|
torsion 6 7 30 31 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 6 7 30 32 0.000 0.0 1 0.000 180.0 2 0.235 0.0 3
|
|
torsion 6 7 30 33 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 7 7 30 31 0.000 0.0 1 -0.489 180.0 2 0.000 0.0 3
|
|
torsion 7 7 30 32 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 7 7 30 33 0.000 0.0 1 -0.489 180.0 2 0.000 0.0 3
|
|
torsion 8 7 30 31 0.000 0.0 1 -0.489 180.0 2 0.000 0.0 3
|
|
torsion 8 7 30 32 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 8 7 30 33 0.000 0.0 1 -0.489 180.0 2 0.000 0.0 3
|
|
torsion 15 7 30 31 -0.059 0.0 1 1.900 180.0 2 -0.045 0.0 3
|
|
torsion 15 7 30 32 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 15 7 30 33 -0.059 0.0 1 1.900 180.0 2 -0.045 0.0 3
|
|
torsion 16 7 30 31 0.000 0.0 1 -0.489 180.0 2 0.000 0.0 3
|
|
torsion 16 7 30 32 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 16 7 30 33 0.000 0.0 1 -0.489 180.0 2 0.000 0.0 3
|
|
torsion 3 7 35 37 -0.107 0.0 1 0.512 180.0 2 0.365 0.0 3
|
|
torsion 6 7 35 37 0.072 0.0 1 -0.012 180.0 2 0.563 0.0 3
|
|
torsion 7 7 35 37 -0.107 0.0 1 0.512 180.0 2 0.365 0.0 3
|
|
torsion 8 7 35 37 -0.107 0.0 1 0.512 180.0 2 0.365 0.0 3
|
|
torsion 3 7 41 16 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 3 7 41 42 1.239 0.0 1 -0.405 180.0 2 0.035 0.0 3
|
|
torsion 6 7 41 16 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 6 7 41 42 0.000 0.0 1 -0.081 180.0 2 0.370 0.0 3
|
|
torsion 7 7 41 42 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 8 7 41 42 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 16 7 41 16 2.216 0.0 1 0.215 180.0 2 0.810 0.0 3
|
|
torsion 16 7 41 42 -0.939 0.0 1 -0.159 180.0 2 0.246 0.0 3
|
|
torsion 1 8 8 8 -0.535 0.0 1 -0.110 180.0 2 -0.073 0.0 3
|
|
torsion 1 8 8 9 0.000 0.0 1 0.000 180.0 2 0.374 0.0 3
|
|
torsion 3 8 8 7 -0.257 0.0 1 -0.220 180.0 2 0.000 0.0 3
|
|
torsion 3 8 8 9 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 7 8 8 8 0.152 0.0 1 -0.231 180.0 2 0.378 0.0 3
|
|
torsion 7 8 8 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 7 8 8 12 0.250 0.0 1 0.160 180.0 2 -1.805 0.0 3
|
|
torsion 7 8 8 30 -4.257 0.0 1 -0.220 180.0 2 0.000 0.0 3
|
|
torsion 8 8 8 8 0.152 0.0 1 -0.231 180.0 2 0.378 0.0 3
|
|
torsion 8 8 8 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 8 8 8 35 0.000 0.0 1 0.064 180.0 2 0.605 0.0 3
|
|
torsion 9 8 8 9 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 9 8 8 12 0.000 0.0 1 0.000 180.0 2 0.475 0.0 3
|
|
torsion 9 8 8 30 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 9 8 8 35 0.000 0.0 1 0.000 180.0 2 0.374 0.0 3
|
|
torsion 7 8 10 11 1.270 0.0 1 -1.023 180.0 2 -0.727 0.0 3
|
|
torsion 9 8 10 11 0.000 0.0 1 0.000 180.0 2 0.274 0.0 3
|
|
torsion 7 8 12 12 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 7 8 12 13 -1.096 0.0 1 0.079 180.0 2 0.384 0.0 3
|
|
torsion 8 8 12 8 -1.061 0.0 1 0.132 180.0 2 0.330 0.0 3
|
|
torsion 9 8 12 8 0.000 0.0 1 0.000 180.0 2 0.660 0.0 3
|
|
torsion 9 8 12 12 0.300 0.0 1 0.000 180.0 2 0.600 0.0 3
|
|
torsion 9 8 12 13 0.000 0.0 1 0.000 180.0 2 0.238 0.0 3
|
|
torsion 7 8 17 17 -0.495 0.0 1 0.720 180.0 2 -0.484 0.0 3
|
|
torsion 9 8 17 17 0.000 0.0 1 0.000 180.0 2 -0.090 0.0 3
|
|
torsion 7 8 22 22 0.093 0.0 1 0.153 180.0 2 0.538 0.0 3
|
|
torsion 9 8 22 22 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 7 8 26 24 -1.821 0.0 1 -2.437 180.0 2 2.059 0.0 3
|
|
torsion 7 8 26 26 1.094 0.0 1 -0.160 180.0 2 0.503 0.0 3
|
|
torsion 7 8 26 29 -0.224 0.0 1 -0.084 180.0 2 0.518 0.0 3
|
|
torsion 9 8 26 24 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 9 8 26 26 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 9 8 26 29 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 7 8 30 31 0.000 0.0 1 1.039 180.0 2 0.000 0.0 3
|
|
torsion 7 8 30 32 -0.092 0.0 1 1.124 180.0 2 0.435 0.0 3
|
|
torsion 7 8 30 33 0.677 0.0 1 1.020 180.0 2 0.163 0.0 3
|
|
torsion 8 8 30 31 0.000 0.0 1 0.100 180.0 2 0.000 0.0 3
|
|
torsion 8 8 30 32 -0.092 0.0 1 1.124 180.0 2 0.435 0.0 3
|
|
torsion 8 8 30 33 0.677 0.0 1 1.020 180.0 2 0.163 0.0 3
|
|
torsion 9 8 30 31 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 9 8 30 32 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 9 8 30 33 0.250 0.0 1 0.850 180.0 2 0.000 0.0 3
|
|
torsion 8 8 35 36 0.000 0.0 1 0.000 180.0 2 -0.110 0.0 3
|
|
torsion 8 8 35 37 -0.107 0.0 1 0.512 180.0 2 0.365 0.0 3
|
|
torsion 9 8 35 36 0.000 0.0 1 -0.081 180.0 2 0.370 0.0 3
|
|
torsion 9 8 35 37 0.000 0.0 1 0.661 180.0 2 0.288 0.0 3
|
|
torsion 8 12 12 8 -0.940 0.0 1 -6.900 180.0 2 0.300 0.0 3
|
|
torsion 3 15 16 6 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 3 15 16 16 2.216 0.0 1 0.215 180.0 2 0.810 0.0 3
|
|
torsion 7 15 16 6 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 7 15 16 16 2.216 0.0 1 0.215 180.0 2 0.810 0.0 3
|
|
torsion 6 16 16 9 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 6 16 16 16 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 7 16 16 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 7 16 16 16 0.152 0.0 1 -0.231 180.0 2 0.378 0.0 3
|
|
torsion 9 16 16 9 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 9 16 16 15 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 9 16 16 16 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 9 16 16 41 0.000 0.0 1 0.000 180.0 2 0.500 0.0 3
|
|
torsion 15 16 16 16 -0.201 0.0 1 0.687 180.0 2 0.000 0.0 3
|
|
torsion 16 16 16 41 -0.201 0.0 1 0.687 180.0 2 0.000 0.0 3
|
|
torsion 6 16 41 7 0.000 0.0 1 0.000 180.0 2 -0.126 0.0 3
|
|
torsion 6 16 41 42 0.000 0.0 1 -0.014 180.0 2 0.295 0.0 3
|
|
torsion 16 16 41 7 2.216 0.0 1 0.215 180.0 2 0.810 0.0 3
|
|
torsion 16 16 41 42 -0.939 0.0 1 -0.159 180.0 2 0.246 0.0 3
|
|
torsion 8 17 17 17 -0.610 0.0 1 4.212 180.0 2 0.000 0.0 3
|
|
torsion 8 17 17 18 0.000 0.0 1 4.104 180.0 2 0.000 0.0 3
|
|
torsion 17 17 17 17 -0.670 0.0 1 4.004 180.0 2 0.000 0.0 3
|
|
torsion 17 17 17 18 0.550 0.0 1 4.534 180.0 2 -0.550 0.0 3
|
|
torsion 17 17 17 19 0.000 0.0 1 4.470 180.0 2 0.000 0.0 3
|
|
torsion 17 17 17 21 0.000 0.0 1 4.470 180.0 2 0.000 0.0 3
|
|
torsion 18 17 17 18 0.000 0.0 1 4.072 180.0 2 0.000 0.0 3
|
|
torsion 18 17 17 19 0.000 0.0 1 4.470 180.0 2 0.000 0.0 3
|
|
torsion 18 17 17 21 0.000 0.0 1 4.470 180.0 2 0.000 0.0 3
|
|
torsion 17 17 19 20 0.000 0.0 1 2.081 180.0 2 0.000 0.0 3
|
|
torsion 8 22 22 22 -0.062 0.0 1 0.197 180.0 2 0.025 0.0 3
|
|
torsion 8 22 22 23 0.000 0.0 1 3.104 180.0 2 0.000 0.0 3
|
|
torsion 8 22 22 24 0.000 0.0 1 4.470 180.0 2 0.000 0.0 3
|
|
torsion 22 22 22 22 -0.670 0.0 1 4.304 180.0 2 0.000 0.0 3
|
|
torsion 22 22 22 23 0.250 0.0 1 4.534 180.0 2 -0.550 0.0 3
|
|
torsion 22 22 22 24 0.000 0.0 1 4.470 180.0 2 0.000 0.0 3
|
|
torsion 23 22 22 23 0.000 0.0 1 3.072 180.0 2 0.000 0.0 3
|
|
torsion 23 22 22 24 -3.150 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 22 22 24 22 0.000 0.0 1 10.000 180.0 2 0.000 0.0 3
|
|
torsion 22 22 24 25 -3.150 0.0 1 5.000 180.0 2 0.000 0.0 3
|
|
torsion 23 22 24 22 -6.650 0.0 1 10.000 180.0 2 0.000 0.0 3
|
|
torsion 23 22 24 25 -0.530 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 25 24 26 8 0.000 0.0 1 4.104 180.0 2 0.000 0.0 3
|
|
torsion 25 24 26 26 -3.150 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 25 24 26 27 -0.530 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 28 24 26 8 0.000 0.0 1 4.212 180.0 2 0.000 0.0 3
|
|
torsion 28 24 26 26 0.000 0.0 1 6.000 180.0 2 0.000 0.0 3
|
|
torsion 28 24 26 27 0.000 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 25 24 28 24 -2.744 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 25 24 28 27 -0.530 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 25 24 28 29 -2.744 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 26 24 28 24 0.000 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 26 24 28 27 0.000 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 26 24 28 29 0.000 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 8 26 26 24 0.000 0.0 1 4.212 180.0 2 0.000 0.0 3
|
|
torsion 8 26 26 27 0.000 0.0 1 4.102 180.0 2 0.000 0.0 3
|
|
torsion 8 26 26 29 0.000 0.0 1 4.212 180.0 2 0.000 0.0 3
|
|
torsion 24 26 26 24 0.900 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 24 26 26 27 0.755 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 24 26 26 29 0.900 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 27 26 26 29 0.755 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 8 26 29 28 0.000 0.0 1 4.212 180.0 2 0.000 0.0 3
|
|
torsion 26 26 29 28 0.000 0.0 1 6.000 180.0 2 0.000 0.0 3
|
|
torsion 27 26 29 28 0.000 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 24 28 29 26 0.000 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 27 28 29 26 0.000 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 2 30 33 34 0.000 0.0 1 5.390 180.0 2 1.230 0.0 3
|
|
torsion 7 30 33 34 0.000 0.0 1 5.390 180.0 2 1.230 0.0 3
|
|
torsion 8 30 33 34 0.000 0.0 1 5.390 180.0 2 1.230 0.0 3
|
|
torsion 32 30 33 34 -1.200 0.0 1 5.390 180.0 2 0.400 0.0 3
|
|
torsion 46 43 44 44 0.000 0.0 1 8.761 180.0 2 0.000 0.0 3
|
|
torsion 46 43 44 47 0.000 0.0 1 9.022 180.0 2 0.000 0.0 3
|
|
torsion 49 43 44 44 0.000 0.0 1 8.406 180.0 2 0.000 0.0 3
|
|
torsion 49 43 44 47 0.000 0.0 1 9.925 180.0 2 0.000 0.0 3
|
|
torsion 63 43 44 44 0.000 0.0 1 8.406 180.0 2 0.000 0.0 3
|
|
torsion 63 43 44 47 0.000 0.0 1 9.925 180.0 2 0.000 0.0 3
|
|
torsion 69 43 44 44 0.000 0.0 1 8.406 180.0 2 0.000 0.0 3
|
|
torsion 69 43 44 47 0.000 0.0 1 9.925 180.0 2 0.000 0.0 3
|
|
torsion 44 43 46 45 0.000 0.0 1 5.807 180.0 2 0.000 0.0 3
|
|
torsion 44 43 46 50 0.000 0.0 1 9.943 180.0 2 0.000 0.0 3
|
|
torsion 49 43 46 45 0.000 0.0 1 0.111 180.0 2 0.000 0.0 3
|
|
torsion 49 43 46 50 0.000 0.0 1 9.536 180.0 2 0.000 0.0 3
|
|
torsion 63 43 46 45 0.000 0.0 1 6.111 180.0 2 0.000 0.0 3
|
|
torsion 63 43 46 50 0.000 0.0 1 8.536 180.0 2 0.000 0.0 3
|
|
torsion 69 43 46 45 0.000 0.0 1 9.911 180.0 2 0.000 0.0 3
|
|
torsion 69 43 46 50 0.000 0.0 1 8.536 180.0 2 0.000 0.0 3
|
|
torsion 44 43 49 50 0.000 0.0 1 2.100 180.0 2 0.000 0.0 3
|
|
torsion 54 43 53 47 0.000 0.0 1 3.000 180.0 2 0.600 0.0 3
|
|
torsion 54 43 53 55 0.000 0.0 1 -9.900 180.0 2 -0.027 0.0 3
|
|
torsion 54 43 53 58 0.000 0.0 1 9.900 180.0 2 0.000 0.0 3
|
|
torsion 63 43 53 47 0.000 0.0 1 0.000 180.0 2 -0.532 0.0 6
|
|
torsion 63 43 53 55 0.000 0.0 1 0.000 180.0 2 0.112 0.0 6
|
|
torsion 63 43 53 58 0.000 0.0 1 0.000 180.0 2 -0.532 0.0 6
|
|
torsion 69 43 53 47 0.000 0.0 1 0.500 180.0 2 -0.532 0.0 3
|
|
torsion 69 43 53 55 0.000 0.0 1 0.000 180.0 2 0.112 0.0 3
|
|
torsion 69 43 53 58 0.000 0.0 1 0.000 180.0 2 -0.532 0.0 6
|
|
torsion 53 43 54 54 0.000 0.0 1 4.500 180.0 2 0.000 0.0 3
|
|
torsion 53 43 54 57 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 63 43 54 54 0.000 0.0 1 0.000 180.0 2 -0.532 0.0 6
|
|
torsion 63 43 54 57 0.000 0.0 1 0.000 180.0 2 0.109 0.0 6
|
|
torsion 69 43 54 54 0.000 0.0 1 0.000 180.0 2 -0.532 0.0 6
|
|
torsion 69 43 54 57 0.000 0.0 1 0.000 180.0 2 0.109 0.0 6
|
|
torsion 44 43 63 62 -3.000 0.0 1 0.000 180.0 2 -0.900 0.0 3
|
|
torsion 44 43 63 63 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 44 43 63 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 44 43 63 68 0.000 0.0 1 -5.600 180.0 2 0.000 0.0 3
|
|
torsion 46 43 63 62 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 46 43 63 63 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 46 43 63 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 46 43 63 68 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 53 43 63 62 -3.000 0.0 1 0.000 180.0 2 0.950 0.0 3
|
|
torsion 53 43 63 63 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 53 43 63 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 54 43 63 62 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 54 43 63 63 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 54 43 63 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 72 43 63 62 0.000 0.0 1 0.000 180.0 2 0.587 0.0 3
|
|
torsion 72 43 63 63 0.000 0.0 1 0.000 180.0 2 0.585 0.0 3
|
|
torsion 72 43 63 65 0.000 0.0 1 4.500 180.0 2 0.480 0.0 3
|
|
torsion 44 43 69 62 0.000 0.0 1 -7.550 180.0 2 0.880 0.0 3
|
|
torsion 44 43 69 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 44 43 69 68 0.000 0.0 1 -5.200 180.0 2 0.800 0.0 3
|
|
torsion 44 43 69 69 0.000 0.0 1 2.000 180.0 2 0.800 0.0 3
|
|
torsion 46 43 69 62 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 46 43 69 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 46 43 69 68 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 46 43 69 69 0.000 0.0 1 -5.100 180.0 2 0.800 0.0 3
|
|
torsion 53 43 69 62 0.000 0.0 1 -1.600 180.0 2 0.000 0.0 3
|
|
torsion 53 43 69 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 53 43 69 69 0.000 0.0 1 -1.500 180.0 2 0.000 0.0 3
|
|
torsion 54 43 69 62 0.000 0.0 1 -5.600 180.0 2 -0.650 0.0 3
|
|
torsion 54 43 69 65 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 54 43 69 69 0.000 0.0 1 -2.000 180.0 2 0.000 0.0 3
|
|
torsion 72 43 69 62 0.000 0.0 1 0.000 180.0 2 0.587 0.0 3
|
|
torsion 72 43 69 65 0.000 0.0 1 4.500 180.0 2 0.480 0.0 3
|
|
torsion 72 43 69 69 0.000 0.0 1 2.500 180.0 2 0.585 0.0 3
|
|
torsion 43 44 44 45 0.000 0.0 1 7.121 180.0 2 0.000 0.0 3
|
|
torsion 43 44 44 49 0.000 0.0 1 8.267 180.0 2 0.000 0.0 3
|
|
torsion 43 44 44 53 0.000 0.0 1 8.538 180.0 2 0.000 0.0 3
|
|
torsion 45 44 44 47 0.000 0.0 1 5.794 180.0 2 0.000 0.0 3
|
|
torsion 47 44 44 49 0.000 0.0 1 9.772 180.0 2 0.000 0.0 3
|
|
torsion 47 44 44 53 0.000 0.0 1 4.676 180.0 2 0.000 0.0 3
|
|
torsion 44 44 45 46 0.000 0.0 1 9.600 180.0 2 0.000 0.0 3
|
|
torsion 49 44 45 46 0.000 0.0 1 8.083 180.0 2 0.000 0.0 3
|
|
torsion 53 44 45 46 0.000 0.0 1 6.522 180.0 2 0.000 0.0 3
|
|
torsion 43 44 47 48 0.000 0.0 1 8.058 180.0 2 0.000 0.0 3
|
|
torsion 43 44 47 49 0.000 0.0 1 5.000 180.0 2 0.000 0.0 3
|
|
torsion 44 44 47 48 0.000 0.0 1 8.174 180.0 2 0.000 0.0 3
|
|
torsion 44 44 47 49 0.000 0.0 1 3.500 180.0 2 0.000 0.0 3
|
|
torsion 44 44 49 47 0.000 0.0 1 8.034 180.0 2 0.000 0.0 3
|
|
torsion 44 44 49 51 0.000 0.0 1 8.960 180.0 2 0.000 0.0 3
|
|
torsion 45 44 49 47 0.000 0.0 1 8.118 180.0 2 0.000 0.0 3
|
|
torsion 45 44 49 51 0.000 0.0 1 6.606 180.0 2 0.000 0.0 3
|
|
torsion 44 44 53 55 0.000 0.0 1 9.293 180.0 2 0.000 0.0 3
|
|
torsion 44 44 53 58 0.000 0.0 1 1.587 180.0 2 0.000 0.0 3
|
|
torsion 45 44 53 55 0.000 0.0 1 1.522 180.0 2 0.000 0.0 3
|
|
torsion 45 44 53 58 0.000 0.0 1 8.876 180.0 2 0.000 0.0 3
|
|
torsion 44 45 46 43 0.000 0.0 1 9.800 180.0 2 0.000 0.0 3
|
|
torsion 44 45 46 50 0.000 0.0 1 7.386 180.0 2 0.000 0.0 3
|
|
torsion 44 47 48 47 0.000 0.0 1 8.468 180.0 2 0.000 0.0 3
|
|
torsion 44 47 48 50 0.000 0.0 1 8.900 180.0 2 0.000 0.0 3
|
|
torsion 49 47 48 47 0.000 0.0 1 9.883 180.0 2 0.000 0.0 3
|
|
torsion 49 47 48 50 0.000 0.0 1 10.000 180.0 2 0.000 0.0 3
|
|
torsion 44 47 49 51 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 44 47 49 58 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 48 47 49 44 0.000 0.0 1 9.804 180.0 2 0.000 0.0 3
|
|
torsion 48 47 49 51 0.000 0.0 1 1.928 180.0 2 0.000 0.0 3
|
|
torsion 53 47 49 51 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 53 47 49 54 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 49 47 53 43 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 49 47 53 55 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 44 49 51 52 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 44 49 51 59 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 47 49 51 52 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 47 49 51 59 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 54 49 51 52 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 54 49 51 59 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 58 49 51 52 0.000 0.0 1 5.000 180.0 2 0.000 0.0 3
|
|
torsion 58 49 51 59 0.000 0.0 1 5.000 180.0 2 0.000 0.0 3
|
|
torsion 47 49 54 54 0.000 0.0 1 9.974 180.0 2 0.000 0.0 3
|
|
torsion 47 49 54 56 0.000 0.0 1 9.548 180.0 2 0.000 0.0 3
|
|
torsion 51 49 54 54 0.000 0.0 1 5.322 180.0 2 0.000 0.0 3
|
|
torsion 51 49 54 56 0.000 0.0 1 4.112 180.0 2 0.000 0.0 3
|
|
torsion 47 49 58 53 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 47 49 58 59 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 51 49 58 53 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 51 49 58 59 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 55 53 54 54 0.000 0.0 1 2.654 180.0 2 0.000 0.0 3
|
|
torsion 55 53 54 56 0.000 0.0 1 3.756 180.0 2 0.000 0.0 3
|
|
torsion 55 53 54 60 0.000 0.0 1 4.085 180.0 2 0.000 0.0 3
|
|
torsion 58 53 54 54 0.000 0.0 1 5.537 180.0 2 0.000 0.0 3
|
|
torsion 58 53 54 56 0.000 0.0 1 6.277 180.0 2 0.000 0.0 3
|
|
torsion 58 53 54 60 0.000 0.0 1 2.346 180.0 2 0.000 0.0 3
|
|
torsion 43 53 58 53 0.000 0.0 1 2.500 180.0 2 0.000 0.0 3
|
|
torsion 43 53 58 59 0.000 0.0 1 3.300 180.0 2 0.000 0.0 3
|
|
torsion 44 53 58 49 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 44 53 58 59 0.000 0.0 1 2.000 180.0 2 0.000 0.0 3
|
|
torsion 54 53 58 53 0.000 0.0 1 1.000 180.0 2 0.000 0.0 3
|
|
torsion 54 53 58 59 0.000 0.0 1 2.500 180.0 2 0.000 0.0 3
|
|
torsion 55 53 58 49 0.000 0.0 1 8.000 180.0 2 0.000 0.0 3
|
|
torsion 55 53 58 53 0.000 0.0 1 3.100 180.0 2 0.000 0.0 3
|
|
torsion 55 53 58 59 0.000 0.0 1 1.155 180.0 2 0.000 0.0 3
|
|
torsion 43 54 54 49 0.000 0.0 1 7.934 180.0 2 0.000 0.0 3
|
|
torsion 43 54 54 53 0.000 0.0 1 -9.000 180.0 2 0.000 0.0 3
|
|
torsion 43 54 54 56 0.000 0.0 1 1.094 180.0 2 0.000 0.0 3
|
|
torsion 43 54 54 60 0.000 0.0 1 5.133 180.0 2 0.000 0.0 3
|
|
torsion 49 54 54 57 0.000 0.0 1 7.193 180.0 2 0.000 0.0 3
|
|
torsion 53 54 54 57 0.000 0.0 1 6.193 180.0 2 0.000 0.0 3
|
|
torsion 56 54 54 57 0.000 0.0 1 4.226 180.0 2 0.000 0.0 3
|
|
torsion 57 54 54 60 0.000 0.0 1 6.519 180.0 2 0.000 0.0 3
|
|
torsion 53 54 60 61 0.000 0.0 1 0.000 180.0 2 0.319 0.0 3
|
|
torsion 54 54 60 61 0.000 0.0 1 0.000 180.0 2 -0.091 0.0 3
|
|
torsion 61 60 62 70 0.000 0.0 1 0.000 180.0 2 -0.070 0.0 3
|
|
torsion 61 60 62 72 0.000 0.0 1 0.000 180.0 2 0.169 0.0 3
|
|
torsion 63 60 62 70 0.000 0.0 1 -2.500 180.0 2 -0.603 0.0 3
|
|
torsion 63 60 62 72 0.000 0.0 1 -0.580 180.0 2 0.980 0.0 3
|
|
torsion 69 60 62 70 0.000 0.0 1 -2.500 180.0 2 -0.603 0.0 3
|
|
torsion 69 60 62 72 0.000 0.0 1 -0.580 180.0 2 0.980 0.0 3
|
|
torsion 61 60 63 62 0.000 0.0 1 0.000 180.0 2 0.380 0.0 3
|
|
torsion 61 60 63 63 0.000 0.0 1 0.000 180.0 2 0.380 0.0 3
|
|
torsion 61 60 63 64 0.000 0.0 1 0.000 180.0 2 0.380 0.0 3
|
|
torsion 61 60 63 68 0.000 0.0 1 0.000 180.0 2 0.380 0.0 3
|
|
torsion 62 60 63 62 0.000 0.0 1 -3.500 180.0 2 0.380 0.0 3
|
|
torsion 62 60 63 63 0.000 0.0 1 3.500 180.0 2 -0.370 0.0 3
|
|
torsion 62 60 63 64 0.000 0.0 1 0.000 180.0 2 0.382 0.0 3
|
|
torsion 62 60 63 68 0.000 0.0 1 -3.500 180.0 2 0.380 0.0 3
|
|
torsion 61 60 69 62 0.000 0.0 1 0.000 180.0 2 0.480 0.0 3
|
|
torsion 61 60 69 64 0.000 0.0 1 0.000 180.0 2 0.480 0.0 3
|
|
torsion 61 60 69 68 0.000 0.0 1 0.000 180.0 2 0.480 0.0 3
|
|
torsion 61 60 69 69 0.000 0.0 1 0.000 180.0 2 0.480 0.0 3
|
|
torsion 62 60 69 62 0.000 0.0 1 -1.500 180.0 2 0.280 0.0 3
|
|
torsion 62 60 69 64 0.000 0.0 1 0.000 180.0 2 0.280 0.0 3
|
|
torsion 62 60 69 68 0.000 0.0 1 -1.500 180.0 2 0.280 0.0 3
|
|
torsion 62 60 69 69 0.000 0.0 1 3.000 180.0 2 -0.370 0.0 3
|
|
torsion 63 62 63 43 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 63 62 63 60 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 63 62 63 63 0.000 0.0 1 0.000 180.0 2 0.786 0.0 3
|
|
torsion 63 62 63 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 63 62 63 65 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 70 62 63 63 0.000 0.0 1 0.000 180.0 2 0.886 0.0 3
|
|
torsion 70 62 63 64 0.000 0.0 1 0.000 180.0 2 -0.070 0.0 3
|
|
torsion 72 62 63 63 -1.500 0.0 1 2.000 180.0 2 0.186 0.0 3
|
|
torsion 72 62 63 64 0.000 0.0 1 0.000 180.0 2 0.686 0.0 3
|
|
torsion 69 62 69 43 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 69 62 69 60 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 69 62 69 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 69 62 69 65 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 69 62 69 69 2.000 0.0 1 -1.500 180.0 2 0.886 0.0 3
|
|
torsion 70 62 69 64 0.000 0.0 1 0.000 180.0 2 -0.070 0.0 3
|
|
torsion 70 62 69 69 0.000 0.0 1 0.000 180.0 2 0.886 0.0 3
|
|
torsion 72 62 69 64 0.000 0.0 1 0.000 180.0 2 0.686 0.0 3
|
|
torsion 72 62 69 69 -1.500 0.0 1 2.000 180.0 2 0.186 0.0 3
|
|
torsion 60 62 70 62 -2.000 0.0 1 -1.680 180.0 2 -0.800 0.0 3
|
|
torsion 60 62 70 71 0.000 0.0 1 0.000 180.0 2 0.990 0.0 3
|
|
torsion 63 62 70 62 -2.000 0.0 1 -1.680 180.0 2 -0.800 0.0 3
|
|
torsion 63 62 70 71 0.000 0.0 1 0.000 180.0 2 0.990 0.0 3
|
|
torsion 69 62 70 62 -2.000 0.0 1 -1.680 180.0 2 -0.800 0.0 3
|
|
torsion 69 62 70 71 0.000 0.0 1 0.000 180.0 2 0.990 0.0 3
|
|
torsion 43 63 63 63 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 43 63 63 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 43 63 63 66 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 60 63 63 62 0.000 0.0 1 0.500 180.0 2 0.486 0.0 3
|
|
torsion 60 63 63 63 0.000 0.0 1 0.000 180.0 2 -0.286 0.0 3
|
|
torsion 60 63 63 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 62 63 63 62 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 62 63 63 63 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 62 63 63 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 62 63 63 66 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 62 63 63 68 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 63 63 63 63 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 63 63 63 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 63 63 63 65 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 63 63 63 66 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 63 63 63 68 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 64 63 63 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 64 63 63 65 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 64 63 63 66 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 64 63 63 68 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 65 63 63 66 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 66 63 63 68 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 63 63 66 67 -3.500 0.0 1 1.000 180.0 2 0.186 0.0 3
|
|
torsion 64 63 66 67 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 43 63 68 63 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 60 63 68 63 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 63 63 68 63 0.000 0.0 1 0.000 180.0 2 0.886 0.0 3
|
|
torsion 64 63 68 63 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 65 63 68 63 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 69 68 69 43 0.000 0.0 1 0.000 180.0 2 0.086 0.0 3
|
|
torsion 69 68 69 60 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 69 68 69 64 0.000 0.0 1 0.000 180.0 2 0.286 0.0 3
|
|
torsion 69 68 69 65 0.000 0.0 1 0.000 180.0 2 0.386 0.0 3
|
|
torsion 69 68 69 69 3.000 0.0 1 -3.000 180.0 2 -0.886 0.0 3
|
|
torsion 43 69 69 64 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 43 69 69 69 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 60 69 69 62 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 60 69 69 64 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 60 69 69 69 0.000 0.0 1 0.000 180.0 2 0.886 0.0 3
|
|
torsion 62 69 69 62 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 62 69 69 64 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 62 69 69 68 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 62 69 69 69 0.000 0.0 1 0.000 180.0 2 0.886 0.0 3
|
|
torsion 64 69 69 64 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 64 69 69 65 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 64 69 69 68 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 64 69 69 69 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 65 69 69 69 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 68 69 69 69 0.000 0.0 1 0.000 180.0 2 0.186 0.0 3
|
|
torsion 69 69 69 69 0.000 0.0 1 0.000 180.0 2 0.886 0.0 3
|
|
|
|
|
|
#############################
|
|
## ##
|
|
## Pi-Torsion Parameters ##
|
|
## ##
|
|
#############################
|
|
|
|
|
|
pitors 1 3 6.85
|
|
pitors 3 15 6.85
|
|
pitors 17 17 6.85
|
|
pitors 22 22 6.85
|
|
pitors 22 24 6.85
|
|
pitors 24 26 6.85
|
|
pitors 24 28 6.85
|
|
pitors 26 26 6.85
|
|
pitors 43 44 5.85
|
|
pitors 43 46 5.85
|
|
pitors 43 53 5.85
|
|
pitors 43 54 5.85
|
|
pitors 44 44 5.85
|
|
pitors 44 45 5.85
|
|
pitors 44 47 5.85
|
|
pitors 44 49 5.85
|
|
pitors 44 53 5.85
|
|
pitors 45 46 5.85
|
|
pitors 47 48 5.85
|
|
pitors 47 49 5.85
|
|
pitors 47 53 5.85
|
|
pitors 49 54 5.85
|
|
pitors 49 58 9.85
|
|
pitors 53 54 5.85
|
|
pitors 53 58 5.85
|
|
pitors 54 54 7.85
|
|
|
|
|
|
##################################
|
|
## ##
|
|
## Torsion-Torsion Parameters ##
|
|
## ##
|
|
##################################
|
|
|
|
|
|
tortors 3 1 2 3 1 25 25
|
|
-180.0 -180.0 0.00000
|
|
-165.0 -180.0 -0.15918
|
|
-150.0 -180.0 -0.46924
|
|
-135.0 -180.0 -0.94887
|
|
-120.0 -180.0 -1.41919
|
|
-105.0 -180.0 -1.89608
|
|
-90.0 -180.0 -2.35024
|
|
-75.0 -180.0 -2.81648
|
|
-60.0 -180.0 -3.17758
|
|
-45.0 -180.0 -2.91092
|
|
-30.0 -180.0 -1.84916
|
|
-15.0 -180.0 -0.61868
|
|
0.0 -180.0 1.44957
|
|
15.0 -180.0 -0.61868
|
|
30.0 -180.0 -1.84916
|
|
45.0 -180.0 -2.91092
|
|
60.0 -180.0 -3.17758
|
|
75.0 -180.0 -2.81793
|
|
90.0 -180.0 -2.34954
|
|
105.0 -180.0 -1.91578
|
|
120.0 -180.0 -1.41919
|
|
135.0 -180.0 -0.94887
|
|
150.0 -180.0 -0.46924
|
|
165.0 -180.0 -0.15918
|
|
180.0 -180.0 0.00000
|
|
-180.0 -165.0 -0.03043
|
|
-165.0 -165.0 -0.40282
|
|
-150.0 -165.0 -0.84288
|
|
-135.0 -165.0 -1.22723
|
|
-120.0 -165.0 -1.58634
|
|
-105.0 -165.0 -1.98317
|
|
-90.0 -165.0 -2.46682
|
|
-75.0 -165.0 -2.96238
|
|
-60.0 -165.0 -3.27921
|
|
-45.0 -165.0 -2.85897
|
|
-30.0 -165.0 -1.66034
|
|
-15.0 -165.0 0.28654
|
|
0.0 -165.0 0.47583
|
|
15.0 -165.0 -0.59328
|
|
30.0 -165.0 -1.85441
|
|
45.0 -165.0 -2.72832
|
|
60.0 -165.0 -2.82977
|
|
75.0 -165.0 -2.43750
|
|
90.0 -165.0 -1.97978
|
|
105.0 -165.0 -1.47132
|
|
120.0 -165.0 -0.94989
|
|
135.0 -165.0 -0.44166
|
|
150.0 -165.0 -0.04055
|
|
165.0 -165.0 0.10146
|
|
180.0 -165.0 -0.03043
|
|
-180.0 -150.0 -0.05487
|
|
-165.0 -150.0 -0.49639
|
|
-150.0 -150.0 -0.83418
|
|
-135.0 -150.0 -1.02443
|
|
-120.0 -150.0 -1.24614
|
|
-105.0 -150.0 -1.65671
|
|
-90.0 -150.0 -2.17397
|
|
-75.0 -150.0 -2.73078
|
|
-60.0 -150.0 -2.95919
|
|
-45.0 -150.0 -2.36553
|
|
-30.0 -150.0 -0.65594
|
|
-15.0 -150.0 1.60921
|
|
0.0 -150.0 0.68197
|
|
15.0 -150.0 -0.47503
|
|
30.0 -150.0 -1.60792
|
|
45.0 -150.0 -2.28172
|
|
60.0 -150.0 -2.27657
|
|
75.0 -150.0 -1.84368
|
|
90.0 -150.0 -1.32072
|
|
105.0 -150.0 -0.79693
|
|
120.0 -150.0 -0.27502
|
|
135.0 -150.0 0.15792
|
|
150.0 -150.0 0.37394
|
|
165.0 -150.0 0.30007
|
|
180.0 -150.0 -0.05487
|
|
-180.0 -135.0 0.22137
|
|
-165.0 -135.0 -0.11507
|
|
-150.0 -135.0 -0.25069
|
|
-135.0 -135.0 -0.25120
|
|
-120.0 -135.0 -0.45372
|
|
-105.0 -135.0 -0.91494
|
|
-90.0 -135.0 -1.48283
|
|
-75.0 -135.0 -1.97985
|
|
-60.0 -135.0 -1.99291
|
|
-45.0 -135.0 -0.87317
|
|
-30.0 -135.0 2.15102
|
|
-15.0 -135.0 2.08125
|
|
0.0 -135.0 1.01469
|
|
15.0 -135.0 -0.13409
|
|
30.0 -135.0 -1.08446
|
|
45.0 -135.0 -1.57764
|
|
60.0 -135.0 -1.54005
|
|
75.0 -135.0 -1.11846
|
|
90.0 -135.0 -0.54882
|
|
105.0 -135.0 -0.14353
|
|
120.0 -135.0 0.35059
|
|
135.0 -135.0 0.78961
|
|
150.0 -135.0 0.82176
|
|
165.0 -135.0 0.59900
|
|
180.0 -135.0 0.22137
|
|
-180.0 -120.0 0.76282
|
|
-165.0 -120.0 0.65049
|
|
-150.0 -120.0 0.73226
|
|
-135.0 -120.0 0.80302
|
|
-120.0 -120.0 0.46767
|
|
-105.0 -120.0 -0.17578
|
|
-90.0 -120.0 -0.55868
|
|
-75.0 -120.0 -0.87022
|
|
-60.0 -120.0 -0.44624
|
|
-45.0 -120.0 1.42775
|
|
-30.0 -120.0 3.49117
|
|
-15.0 -120.0 2.47433
|
|
0.0 -120.0 1.40660
|
|
15.0 -120.0 0.51132
|
|
30.0 -120.0 -0.07964
|
|
45.0 -120.0 -0.49787
|
|
60.0 -120.0 -0.64487
|
|
75.0 -120.0 -0.35755
|
|
90.0 -120.0 0.18803
|
|
105.0 -120.0 0.54550
|
|
120.0 -120.0 0.97289
|
|
135.0 -120.0 1.16949
|
|
150.0 -120.0 1.15910
|
|
165.0 -120.0 1.05012
|
|
180.0 -120.0 0.76282
|
|
-180.0 -105.0 1.42827
|
|
-165.0 -105.0 1.50406
|
|
-150.0 -105.0 1.72284
|
|
-135.0 -105.0 1.64917
|
|
-120.0 -105.0 1.03764
|
|
-105.0 -105.0 0.56475
|
|
-90.0 -105.0 0.20084
|
|
-75.0 -105.0 0.20821
|
|
-60.0 -105.0 1.22814
|
|
-45.0 -105.0 2.98189
|
|
-30.0 -105.0 3.57647
|
|
-15.0 -105.0 2.65211
|
|
0.0 -105.0 1.95317
|
|
15.0 -105.0 1.65224
|
|
30.0 -105.0 1.43567
|
|
45.0 -105.0 0.92486
|
|
60.0 -105.0 0.55065
|
|
75.0 -105.0 0.46027
|
|
90.0 -105.0 0.60470
|
|
105.0 -105.0 1.02077
|
|
120.0 -105.0 1.33189
|
|
135.0 -105.0 1.51499
|
|
150.0 -105.0 1.50886
|
|
165.0 -105.0 1.53133
|
|
180.0 -105.0 1.42827
|
|
-180.0 -90.0 1.90401
|
|
-165.0 -90.0 2.03939
|
|
-150.0 -90.0 2.29924
|
|
-135.0 -90.0 1.79055
|
|
-120.0 -90.0 1.35280
|
|
-105.0 -90.0 1.02391
|
|
-90.0 -90.0 0.90562
|
|
-75.0 -90.0 1.23397
|
|
-60.0 -90.0 2.45075
|
|
-45.0 -90.0 3.45522
|
|
-30.0 -90.0 3.09983
|
|
-15.0 -90.0 2.62493
|
|
0.0 -90.0 2.65047
|
|
15.0 -90.0 3.09474
|
|
30.0 -90.0 2.79428
|
|
45.0 -90.0 2.15793
|
|
60.0 -90.0 1.57482
|
|
75.0 -90.0 1.33310
|
|
90.0 -90.0 1.13012
|
|
105.0 -90.0 1.17449
|
|
120.0 -90.0 1.41199
|
|
135.0 -90.0 1.62671
|
|
150.0 -90.0 1.81755
|
|
165.0 -90.0 1.82118
|
|
180.0 -90.0 1.90401
|
|
-180.0 -75.0 1.80621
|
|
-165.0 -75.0 2.08080
|
|
-150.0 -75.0 2.03556
|
|
-135.0 -75.0 1.68691
|
|
-120.0 -75.0 1.29208
|
|
-105.0 -75.0 1.22509
|
|
-90.0 -75.0 1.43311
|
|
-75.0 -75.0 2.16375
|
|
-60.0 -75.0 2.17320
|
|
-45.0 -75.0 2.21268
|
|
-30.0 -75.0 2.13049
|
|
-15.0 -75.0 2.40205
|
|
0.0 -75.0 3.24329
|
|
15.0 -75.0 4.06613
|
|
30.0 -75.0 3.57523
|
|
45.0 -75.0 2.86443
|
|
60.0 -75.0 2.31976
|
|
75.0 -75.0 1.66472
|
|
90.0 -75.0 1.27852
|
|
105.0 -75.0 1.09103
|
|
120.0 -75.0 1.36656
|
|
135.0 -75.0 1.53314
|
|
150.0 -75.0 1.59747
|
|
165.0 -75.0 1.64225
|
|
180.0 -75.0 1.80621
|
|
-180.0 -60.0 0.94133
|
|
-165.0 -60.0 1.07716
|
|
-150.0 -60.0 1.06365
|
|
-135.0 -60.0 0.96211
|
|
-120.0 -60.0 0.94411
|
|
-105.0 -60.0 1.25994
|
|
-90.0 -60.0 0.79628
|
|
-75.0 -60.0 0.57562
|
|
-60.0 -60.0 0.56577
|
|
-45.0 -60.0 0.74572
|
|
-30.0 -60.0 1.24745
|
|
-15.0 -60.0 2.21612
|
|
0.0 -60.0 3.54214
|
|
15.0 -60.0 3.78367
|
|
30.0 -60.0 3.40120
|
|
45.0 -60.0 2.89718
|
|
60.0 -60.0 1.94715
|
|
75.0 -60.0 1.36042
|
|
90.0 -60.0 0.79250
|
|
105.0 -60.0 0.57769
|
|
120.0 -60.0 0.77935
|
|
135.0 -60.0 0.79351
|
|
150.0 -60.0 0.75367
|
|
165.0 -60.0 0.78581
|
|
180.0 -60.0 0.94133
|
|
-180.0 -45.0 -0.67275
|
|
-165.0 -45.0 -0.59212
|
|
-150.0 -45.0 -0.42200
|
|
-135.0 -45.0 -0.01106
|
|
-120.0 -45.0 -0.51470
|
|
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|
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|
180.0 180.0 0.00000
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|
|
|
tortors 3 1 2 3 15 25 25
|
|
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|
0.0 -180.0 1.44957
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
180.0 -180.0 0.00000
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|
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|
|
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30.0 90.0 3.09673
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tortors 3 1 7 3 1 25 25
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60.0 90.0 1.52568
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105.0 90.0 0.07691
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120.0 90.0 -0.25244
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
|
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|
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|
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|
120.0 165.0 -0.49787
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
30.0 180.0 -1.32974
|
|
45.0 180.0 -1.31658
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|
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|
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|
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|
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|
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|
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|
|
150.0 180.0 0.13703
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|
165.0 180.0 0.66356
|
|
180.0 180.0 0.98936
|
|
|
|
tortors 3 1 7 3 15 25 25
|
|
-180.0 -180.0 0.98936
|
|
-165.0 -180.0 0.76408
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|
-150.0 -180.0 0.21674
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|
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|
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|
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|
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|
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|
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|
|
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|
-30.0 -180.0 -1.94076
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|
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|
|
0.0 -180.0 0.18253
|
|
15.0 -180.0 -0.80364
|
|
30.0 -180.0 -1.32974
|
|
45.0 -180.0 -1.31658
|
|
60.0 -180.0 -0.50140
|
|
75.0 -180.0 0.20431
|
|
90.0 -180.0 0.39356
|
|
105.0 -180.0 0.20356
|
|
120.0 -180.0 -0.16993
|
|
135.0 -180.0 -0.22733
|
|
150.0 -180.0 0.13703
|
|
165.0 -180.0 0.66356
|
|
180.0 -180.0 0.98936
|
|
-180.0 -165.0 0.96101
|
|
-165.0 -165.0 0.37535
|
|
-150.0 -165.0 -0.35733
|
|
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70.0 55.0 0.00000
|
|
-70.0 60.0 0.00000
|
|
-65.0 60.0 0.00000
|
|
-60.0 60.0 0.00000
|
|
-55.0 60.0 -3.69092
|
|
-50.0 60.0 -4.17700
|
|
-45.0 60.0 -5.34644
|
|
-40.0 60.0 -5.54562
|
|
-35.0 60.0 -5.72098
|
|
-30.0 60.0 0.00000
|
|
-25.0 60.0 0.00000
|
|
-20.0 60.0 0.00000
|
|
-15.0 60.0 0.00000
|
|
-10.0 60.0 0.00000
|
|
-5.0 60.0 0.00000
|
|
0.0 60.0 0.00000
|
|
5.0 60.0 0.00000
|
|
10.0 60.0 0.00000
|
|
15.0 60.0 0.00000
|
|
20.0 60.0 0.00000
|
|
25.0 60.0 0.00000
|
|
30.0 60.0 0.00000
|
|
35.0 60.0 0.00000
|
|
40.0 60.0 0.00000
|
|
45.0 60.0 0.00000
|
|
50.0 60.0 0.00000
|
|
55.0 60.0 0.00000
|
|
60.0 60.0 0.00000
|
|
65.0 60.0 0.00000
|
|
70.0 60.0 0.00000
|
|
-70.0 65.0 0.00000
|
|
-65.0 65.0 0.00000
|
|
-60.0 65.0 0.00000
|
|
-55.0 65.0 0.00000
|
|
-50.0 65.0 0.00000
|
|
-45.0 65.0 0.00000
|
|
-40.0 65.0 0.00000
|
|
-35.0 65.0 0.00000
|
|
-30.0 65.0 0.00000
|
|
-25.0 65.0 0.00000
|
|
-20.0 65.0 0.00000
|
|
-15.0 65.0 0.00000
|
|
-10.0 65.0 0.00000
|
|
-5.0 65.0 0.00000
|
|
0.0 65.0 0.00000
|
|
5.0 65.0 0.00000
|
|
10.0 65.0 0.00000
|
|
15.0 65.0 0.00000
|
|
20.0 65.0 0.00000
|
|
25.0 65.0 0.00000
|
|
30.0 65.0 0.00000
|
|
35.0 65.0 0.00000
|
|
40.0 65.0 0.00000
|
|
45.0 65.0 0.00000
|
|
50.0 65.0 0.00000
|
|
55.0 65.0 0.00000
|
|
60.0 65.0 0.00000
|
|
65.0 65.0 0.00000
|
|
70.0 65.0 0.00000
|
|
-70.0 70.0 0.00000
|
|
-65.0 70.0 0.00000
|
|
-60.0 70.0 0.00000
|
|
-55.0 70.0 0.00000
|
|
-50.0 70.0 0.00000
|
|
-45.0 70.0 0.00000
|
|
-40.0 70.0 0.00000
|
|
-35.0 70.0 0.00000
|
|
-30.0 70.0 0.00000
|
|
-25.0 70.0 0.00000
|
|
-20.0 70.0 0.00000
|
|
-15.0 70.0 0.00000
|
|
-10.0 70.0 0.00000
|
|
-5.0 70.0 0.00000
|
|
0.0 70.0 0.00000
|
|
5.0 70.0 0.00000
|
|
10.0 70.0 0.00000
|
|
15.0 70.0 0.00000
|
|
20.0 70.0 0.00000
|
|
25.0 70.0 0.00000
|
|
30.0 70.0 0.00000
|
|
35.0 70.0 0.00000
|
|
40.0 70.0 0.00000
|
|
45.0 70.0 0.00000
|
|
50.0 70.0 0.00000
|
|
55.0 70.0 0.00000
|
|
60.0 70.0 0.00000
|
|
65.0 70.0 0.00000
|
|
70.0 70.0 0.00000
|
|
|
|
|
|
###################################
|
|
## ##
|
|
## Atomic Multipole Parameters ##
|
|
## ##
|
|
###################################
|
|
|
|
|
|
multipole 1 2 4 -0.22620
|
|
0.08214 0.00000 0.34883
|
|
0.11775
|
|
0.00000 -1.02185
|
|
-0.17555 0.00000 0.90410
|
|
multipole 2 1 3 -0.15245
|
|
0.19517 0.00000 0.19687
|
|
-0.20677
|
|
0.00000 -0.48084
|
|
-0.01672 0.00000 0.68761
|
|
multipole 2 1 238 -0.26188
|
|
0.19517 0.00000 0.19687
|
|
-0.20677
|
|
0.00000 -0.48084
|
|
-0.01672 0.00000 0.68761
|
|
multipole 2 1 240 -0.06378
|
|
0.23312 0.13956 0.09887
|
|
-0.31660
|
|
-0.24134 -0.22704
|
|
0.00987 -0.17429 0.54364
|
|
multipole 2 234 3 -0.00060
|
|
0.19517 0.00000 0.19687
|
|
-0.20677
|
|
0.00000 -0.48084
|
|
-0.01672 0.00000 0.68761
|
|
multipole 2 236 3 -0.15431
|
|
0.17831 0.12028 0.04835
|
|
-0.18716
|
|
-0.14669 -0.30278
|
|
-0.23445 -0.03639 0.48994
|
|
multipole 3 5 2 0.84374
|
|
-0.10331 0.00000 0.21864
|
|
0.12993
|
|
0.00000 -0.31823
|
|
0.00297 0.00000 0.18830
|
|
multipole 4 1 2 0.12752
|
|
0.00647 0.00000 -0.12783
|
|
0.03203
|
|
0.00000 -0.02425
|
|
-0.00668 0.00000 -0.00778
|
|
multipole 5 3 2 -0.73597
|
|
-0.00206 0.00000 -0.19382
|
|
-0.52873
|
|
0.00000 0.31757
|
|
0.01718 0.00000 0.21116
|
|
multipole 6 2 6 0.07168
|
|
-0.00670 0.00000 -0.03554
|
|
-0.01145
|
|
0.00000 0.00424
|
|
0.00006 0.00000 0.00721
|
|
multipole 7 8 10 -0.14985
|
|
0.03550 0.00000 0.44301
|
|
0.09170
|
|
0.00000 -1.11491
|
|
-0.24348 0.00000 1.02321
|
|
multipole 7 33 10 -0.07700
|
|
0.07153 0.00000 0.47356
|
|
0.04187
|
|
0.00000 -1.12615
|
|
-0.13307 0.00000 1.08428
|
|
multipole 7 44 10 -0.14168
|
|
0.07684 0.00000 0.42468
|
|
0.07677
|
|
0.00000 -1.10639
|
|
-0.13195 0.00000 1.02962
|
|
multipole 8 7 9 12 -0.21238
|
|
0.15677 0.10446 0.14545
|
|
-0.17425
|
|
-0.22519 -0.40549
|
|
-0.00044 -0.22429 0.57974
|
|
multipole 8 7 238 12 -0.35660
|
|
0.15677 0.10446 0.14545
|
|
-0.17425
|
|
-0.22519 -0.40549
|
|
-0.00044 -0.22429 0.57974
|
|
multipole 8 7 240 12 -0.15850
|
|
0.23312 0.13956 0.09887
|
|
-0.31660
|
|
-0.24134 -0.22704
|
|
0.00987 -0.17429 0.54364
|
|
multipole 8 234 9 12 0.01822
|
|
0.16474 0.12633 0.26753
|
|
-0.21185
|
|
-0.16278 -0.28684
|
|
-0.20823 -0.06352 0.49869
|
|
multipole 8 236 9 12 -0.13549
|
|
0.17831 0.12028 0.04835
|
|
-0.18716
|
|
-0.14669 -0.30278
|
|
-0.23445 -0.03639 0.48994
|
|
multipole 9 11 8 0.85068
|
|
-0.01685 0.00000 0.27745
|
|
0.29463
|
|
0.00000 -0.41598
|
|
-0.00743 0.00000 0.12135
|
|
multipole 9 11 33 0.86830
|
|
-0.00831 0.00000 0.28673
|
|
0.31013
|
|
0.00000 -0.40744
|
|
-0.02007 0.00000 0.09731
|
|
multipole 9 11 44 0.86623
|
|
-0.01620 0.00000 0.28155
|
|
0.21345
|
|
0.00000 -0.37126
|
|
0.03757 0.00000 0.15781
|
|
multipole 10 7 8 0.12992
|
|
-0.00883 0.00000 -0.14169
|
|
0.04124
|
|
0.00000 -0.02603
|
|
-0.00466 0.00000 -0.01521
|
|
multipole 10 7 33 0.13014
|
|
-0.01463 0.00000 -0.14527
|
|
0.04339
|
|
0.00000 -0.02611
|
|
-0.00341 0.00000 -0.01728
|
|
multipole 10 7 44 0.13192
|
|
-0.02608 0.00000 -0.13150
|
|
0.02396
|
|
0.00000 -0.01254
|
|
0.00671 0.00000 -0.01142
|
|
multipole 11 9 8 -0.77770
|
|
-0.01897 0.00000 -0.21786
|
|
-0.61542
|
|
0.00000 0.33936
|
|
0.00866 0.00000 0.27606
|
|
multipole 11 9 33 -0.78568
|
|
-0.00475 0.00000 -0.21642
|
|
-0.63353
|
|
0.00000 0.34214
|
|
0.02232 0.00000 0.29139
|
|
multipole 11 9 44 -0.77214
|
|
-0.00136 0.00000 -0.21318
|
|
-0.59230
|
|
0.00000 0.31639
|
|
0.01541 0.00000 0.27591
|
|
multipole 12 8 13 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 15 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 19 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 25 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 64 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 73 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 92 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 109 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 120 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 130 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 140 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 144 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 150 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 156 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 170 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 178 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 185 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 195 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 205 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 216 0.08921
|
|
0.01405 0.00000 0.04185
|
|
-0.00099
|
|
0.00000 -0.00099
|
|
0.00801 0.00000 0.00198
|
|
multipole 12 8 83 0.08544
|
|
0.00588 0.00000 0.05950
|
|
0.02355
|
|
0.00000 -0.01645
|
|
0.01114 0.00000 -0.00710
|
|
multipole 12 8 162 0.08646
|
|
0.00138 0.00000 0.00677
|
|
-0.00925
|
|
0.00000 0.00263
|
|
0.01278 0.00000 0.00662
|
|
multipole 12 33 34 0.09030
|
|
0.00560 0.00000 0.05742
|
|
-0.00170
|
|
0.00000 0.00174
|
|
0.01050 0.00000 -0.00004
|
|
multipole 12 33 38 0.08972
|
|
-0.00888 0.00000 0.07916
|
|
-0.01768
|
|
0.00000 -0.01918
|
|
-0.00214 0.00000 0.03686
|
|
multipole 12 44 45 0.09885
|
|
0.01622 0.00000 0.05792
|
|
0.00647
|
|
0.00000 0.00221
|
|
0.01141 0.00000 -0.00868
|
|
multipole 12 44 50 0.09273
|
|
-0.01562 0.00000 0.07350
|
|
-0.08566
|
|
0.00000 0.06242
|
|
0.09474 0.00000 0.02324
|
|
multipole 13 8 12 -0.15440
|
|
-0.00010 0.00000 0.36287
|
|
-0.29475
|
|
0.00000 -0.29287
|
|
0.00762 0.00000 0.58762
|
|
multipole 14 13 8 0.07484
|
|
-0.00111 0.00000 -0.10010
|
|
-0.00304
|
|
0.00000 -0.01538
|
|
0.01240 0.00000 0.01842
|
|
multipole 15 16 8 0.01482
|
|
0.08020 0.00000 -0.26997
|
|
0.34033
|
|
0.00000 0.14255
|
|
-0.02494 0.00000 -0.48288
|
|
multipole 16 15 8 0.06618
|
|
-0.01550 0.00000 -0.03799
|
|
-0.02092
|
|
0.00000 -0.00865
|
|
0.00210 0.00000 0.02957
|
|
multipole 17 15 8 -0.17773
|
|
0.01639 0.00000 0.27595
|
|
-0.26651
|
|
0.00000 -0.24157
|
|
-0.00302 0.00000 0.50808
|
|
multipole 18 17 15 0.05743
|
|
0.00260 0.00000 -0.09807
|
|
-0.00994
|
|
0.00118 -0.01956
|
|
0.00000 0.00000 0.02950
|
|
multipole 19 8 21 -0.05880
|
|
0.26546 0.00000 0.21223
|
|
0.20945
|
|
0.00000 -0.58569
|
|
-0.11242 0.00000 0.37624
|
|
multipole 21 22 19 0.02425
|
|
0.13818 0.00000 -0.10780
|
|
0.34224
|
|
0.00000 0.03484
|
|
-0.07137 0.00000 -0.37708
|
|
multipole 23 21 19 -0.11850
|
|
0.02042 0.00000 0.27842
|
|
-0.21793
|
|
0.00000 -0.21279
|
|
-0.05341 0.00000 0.43072
|
|
multipole 20 19 21 0.04696
|
|
0.00607 0.00000 -0.06684
|
|
-0.06962
|
|
0.00000 -0.00388
|
|
0.07593 0.00000 0.07350
|
|
multipole 22 21 19 0.00841
|
|
-0.00672 0.00000 -0.06533
|
|
-0.02250
|
|
0.00000 -0.00022
|
|
0.02359 0.00000 0.02272
|
|
multipole 24 23 21 0.03989
|
|
-0.00280 0.00000 -0.10039
|
|
0.04169
|
|
0.00000 0.04396
|
|
-0.04893 0.00000 -0.08565
|
|
multipole 25 26 29 0.02186
|
|
0.08020 0.00000 -0.26997
|
|
0.34033
|
|
0.00000 0.14255
|
|
-0.02494 0.00000 -0.48288
|
|
multipole 26 25 29 0.06618
|
|
-0.01550 0.00000 -0.03799
|
|
-0.02092
|
|
0.00000 -0.00865
|
|
0.00210 0.00000 0.02957
|
|
multipole 27 25 29 -0.17773
|
|
0.01639 0.00000 0.27595
|
|
-0.26651
|
|
0.00000 -0.24157
|
|
-0.00302 0.00000 0.50808
|
|
multipole 28 27 25 0.05743
|
|
0.00260 0.00000 -0.09807
|
|
-0.00994
|
|
0.00118 -0.01956
|
|
0.00000 0.00000 0.02950
|
|
multipole 29 31 25 -0.13782
|
|
0.30388 0.00000 0.06758
|
|
0.23297
|
|
0.00000 -0.52767
|
|
-0.19079 0.00000 0.29470
|
|
multipole 30 29 25 0.05838
|
|
-0.00859 0.00000 -0.06224
|
|
-0.01816
|
|
0.00000 -0.01607
|
|
0.00914 0.00000 0.03423
|
|
multipole 31 29 32 -0.16689
|
|
0.00000 0.00000 0.21012
|
|
-0.26816
|
|
0.00000 -0.20521
|
|
0.00830 0.00000 0.47337
|
|
multipole 32 31 29 0.05849
|
|
0.01309 0.00000 -0.10315
|
|
-0.00194
|
|
0.00000 -0.01929
|
|
0.00780 0.00000 0.02123
|
|
multipole 33 7 9 12 -0.31424
|
|
0.10978 0.18667 0.05863
|
|
-0.13616
|
|
-0.31125 -0.33777
|
|
0.02536 -0.27378 0.47393
|
|
multipole 33 7 238 12 -0.44882
|
|
0.10978 0.18667 0.05863
|
|
-0.13616
|
|
-0.31125 -0.33777
|
|
0.02536 -0.27378 0.47393
|
|
multipole 33 234 9 12 -0.01057
|
|
0.10978 0.18667 0.25863
|
|
-0.13616
|
|
-0.31125 -0.33777
|
|
0.02536 -0.27378 0.47393
|
|
multipole 33 236 9 12 -0.16428
|
|
0.17831 0.12028 0.04835
|
|
-0.18716
|
|
-0.14669 -0.30278
|
|
-0.23445 -0.03639 0.48994
|
|
multipole 34 33 36 0.18740
|
|
0.32652 0.00000 0.16904
|
|
0.38884
|
|
0.00000 -0.64696
|
|
-0.40264 0.00000 0.25812
|
|
multipole 35 34 33 0.01982
|
|
-0.01239 0.00000 -0.11747
|
|
0.01971
|
|
0.00000 0.00381
|
|
-0.01013 0.00000 -0.02352
|
|
multipole 36 37 34 -0.41295
|
|
0.33448 0.00000 -0.14251
|
|
0.42448
|
|
0.00000 -0.41234
|
|
-0.38297 0.00000 -0.01214
|
|
multipole 37 36 34 0.27409
|
|
-0.00229 0.00000 -0.14154
|
|
0.03579
|
|
0.00000 -0.00191
|
|
0.07686 0.00000 -0.03388
|
|
multipole 38 42 33 0.17854
|
|
0.23880 0.00000 0.32060
|
|
0.10533
|
|
0.00000 -0.64403
|
|
-0.29222 0.00000 0.53870
|
|
multipole 39 38 42 0.02134
|
|
-0.00950 0.00000 -0.09928
|
|
0.00686
|
|
0.00000 0.00614
|
|
0.05736 0.00000 -0.01300
|
|
multipole 40 38 41 -0.15307
|
|
-0.00025 0.00000 0.38046
|
|
-0.30173
|
|
0.00000 -0.22953
|
|
-0.06348 0.00000 0.53126
|
|
multipole 41 40 38 0.07192
|
|
-0.00679 0.00000 -0.10053
|
|
0.06651
|
|
0.00000 0.02229
|
|
-0.00281 0.00000 -0.08880
|
|
multipole 42 43 38 -0.39938
|
|
0.31891 0.00000 0.06162
|
|
0.17801
|
|
0.00000 -0.65478
|
|
-0.34887 0.00000 0.47677
|
|
multipole 43 42 38 0.22557
|
|
-0.05057 0.00000 -0.02631
|
|
-0.03639
|
|
0.00000 -0.07964
|
|
-0.03676 0.00000 0.11603
|
|
multipole 44 7 9 12 -0.24710
|
|
0.10958 0.20789 0.11165
|
|
-0.29651
|
|
-0.34984 -0.19439
|
|
0.01482 -0.12065 0.49090
|
|
multipole 44 7 238 12 -0.37021
|
|
0.10958 0.20789 0.11165
|
|
-0.29651
|
|
-0.34984 -0.19439
|
|
0.01482 -0.12065 0.49090
|
|
multipole 44 234 9 12 -0.00633
|
|
0.10958 0.20789 0.25165
|
|
-0.29651
|
|
-0.34984 -0.19439
|
|
0.01482 -0.12065 0.49090
|
|
multipole 44 236 9 12 -0.16004
|
|
0.17831 0.12028 0.04835
|
|
-0.18716
|
|
-0.14669 -0.30278
|
|
-0.23445 -0.03639 0.48994
|
|
multipole 45 44 47 -0.15207
|
|
-0.06553 0.00000 0.34254
|
|
-0.30415
|
|
0.00000 -0.21377
|
|
-0.28927 0.00000 0.51792
|
|
multipole 45 44 49 -0.15207
|
|
-0.06553 0.00000 0.34254
|
|
-0.30415
|
|
0.00000 -0.21377
|
|
-0.28927 0.00000 0.51792
|
|
multipole 46 45 44 0.07591
|
|
-0.00889 0.00000 -0.04092
|
|
-0.18958
|
|
0.00000 0.00422
|
|
0.16671 0.00000 0.18536
|
|
multipole 47 48 45 -0.04712
|
|
0.52591 0.00000 -0.09604
|
|
1.70327
|
|
0.00000 -2.34352
|
|
-0.60679 0.00000 0.64025
|
|
multipole 48 47 45 0.11129
|
|
-0.04992 0.00000 -0.08691
|
|
0.05295
|
|
0.00000 0.13423
|
|
-0.05345 0.00000 -0.18718
|
|
multipole 49 49 45 0.06417
|
|
0.53667 0.00000 0.23589
|
|
1.30986
|
|
0.00000 -2.63022
|
|
-0.81921 0.00000 1.32036
|
|
multipole 50 44 52 0.02101
|
|
0.45179 0.00000 0.06973
|
|
0.09122
|
|
0.00000 -0.44012
|
|
-0.52228 0.00000 0.34890
|
|
multipole 51 50 51 0.00952
|
|
-0.01257 0.00000 -0.06988
|
|
0.12020
|
|
0.00000 -0.04321
|
|
0.05399 0.00000 -0.07699
|
|
multipole 52 50 44 -0.97001
|
|
0.10382 0.00000 0.32906
|
|
-1.26053
|
|
0.00000 -1.49518
|
|
-0.38944 0.00000 2.75571
|
|
multipole 53 54 62 -0.11893
|
|
0.34044 0.00000 0.34525
|
|
0.13454
|
|
0.00000 -1.26831
|
|
-0.55465 0.00000 1.13377
|
|
multipole 54 53 55 57 -0.38385
|
|
0.09303 0.30388 0.20804
|
|
-0.28513
|
|
-0.11620 -0.19141
|
|
-0.06760 -0.05551 0.47654
|
|
multipole 54 53 238 57 -0.44047
|
|
0.09303 0.30388 0.20804
|
|
-0.28513
|
|
-0.11620 -0.19141
|
|
-0.06760 -0.05551 0.47654
|
|
multipole 55 56 54 0.98874
|
|
0.02791 0.00000 0.30666
|
|
0.30672
|
|
0.00000 -0.48397
|
|
0.08782 0.00000 0.17725
|
|
multipole 56 55 54 -0.82816
|
|
-0.06750 0.00000 -0.25032
|
|
-0.71170
|
|
0.00000 0.39860
|
|
-0.05460 0.00000 0.31310
|
|
multipole 57 54 58 0.10715
|
|
0.00609 0.00000 0.07519
|
|
0.01670
|
|
0.00000 -0.01648
|
|
0.01130 0.00000 -0.00022
|
|
multipole 58 54 60 -0.09495
|
|
0.31121 0.00000 0.40605
|
|
0.22917
|
|
0.00000 -0.67119
|
|
-0.07599 0.00000 0.44202
|
|
multipole 58 246 60 -0.12680
|
|
0.31318 0.00000 0.41341
|
|
0.26389
|
|
0.00000 -0.70262
|
|
-0.10425 0.00000 0.43873
|
|
multipole 59 58 54 0.09275
|
|
-0.01264 0.00000 -0.07572
|
|
0.00128
|
|
0.00000 -0.02196
|
|
0.00991 0.00000 0.02068
|
|
multipole 59 58 246 0.11510
|
|
0.00090 0.00000 -0.07548
|
|
-0.00989
|
|
0.00000 -0.01502
|
|
0.00444 0.00000 0.02491
|
|
multipole 60 58 62 -0.11624
|
|
0.39225 0.00000 0.24210
|
|
0.33605
|
|
0.00000 -0.65320
|
|
-0.03333 0.00000 0.31715
|
|
multipole 60 58 250 -0.14420
|
|
0.42355 0.00000 0.25235
|
|
0.34755
|
|
0.00000 -0.69761
|
|
-0.08434 0.00000 0.35006
|
|
multipole 61 60 58 0.09217
|
|
-0.00152 0.00000 -0.07154
|
|
-0.00810
|
|
0.00000 -0.00700
|
|
0.00227 0.00000 0.01510
|
|
multipole 61 60 250 0.12121
|
|
-0.00270 0.00000 -0.06030
|
|
-0.00918
|
|
0.00000 -0.01098
|
|
0.00194 0.00000 0.02016
|
|
multipole 62 53 60 -0.02016
|
|
0.15944 0.00000 0.38838
|
|
-0.01606
|
|
0.00000 -0.54997
|
|
-0.05844 0.00000 0.56603
|
|
multipole 63 62 53 0.04828
|
|
-0.02837 0.00000 -0.10489
|
|
-0.01200
|
|
0.00000 0.00934
|
|
-0.02136 0.00000 0.00266
|
|
multipole 64 66 8 -0.01895
|
|
0.36956 0.00000 0.01114
|
|
0.41183
|
|
0.00000 -0.66411
|
|
-0.32852 0.00000 0.25228
|
|
multipole 65 64 66 0.06839
|
|
0.02787 0.00000 -0.13883
|
|
-0.00869
|
|
0.00000 0.08416
|
|
0.09373 0.00000 -0.07547
|
|
multipole 66 64 67 -0.06275
|
|
-0.01515 0.00000 0.11717
|
|
0.10484
|
|
0.00000 -0.26909
|
|
0.00249 0.00000 0.16425
|
|
multipole 67 66 69 0.00890
|
|
0.18546 0.00000 0.15071
|
|
0.47473
|
|
0.00000 -0.42840
|
|
0.28711 0.00000 -0.04633
|
|
multipole 68 67 66 0.02818
|
|
-0.01325 0.00000 -0.14859
|
|
0.07601
|
|
0.00000 0.09693
|
|
0.01121 0.00000 -0.17294
|
|
multipole 69 67 71 -0.05402
|
|
-0.00945 0.00000 0.02922
|
|
-0.00276
|
|
0.00000 -0.13432
|
|
-0.13875 0.00000 0.13708
|
|
multipole 70 69 67 0.03565
|
|
0.00481 0.00000 -0.15153
|
|
0.05398
|
|
0.00000 0.03814
|
|
0.00344 0.00000 -0.09212
|
|
multipole 71 69 69 -0.05826
|
|
-0.00098 0.00000 0.01245
|
|
-0.03242
|
|
0.00000 -0.17444
|
|
-0.15165 0.00000 0.20686
|
|
multipole 72 71 69 0.03588
|
|
0.00392 0.00000 -0.14928
|
|
0.04809
|
|
0.00000 0.01292
|
|
0.01455 0.00000 -0.06101
|
|
multipole 73 75 8 -0.08206
|
|
0.35542 0.00000 0.06495
|
|
0.41791
|
|
0.00000 -0.63807
|
|
-0.16042 0.00000 0.22016
|
|
multipole 74 73 75 0.09740
|
|
0.02115 0.00000 -0.06112
|
|
0.00978
|
|
0.00000 -0.01888
|
|
0.05469 0.00000 0.00910
|
|
multipole 75 73 76 -0.04596
|
|
0.07761 0.00000 0.13512
|
|
0.00091
|
|
0.00000 -0.42529
|
|
-0.06469 0.00000 0.42438
|
|
multipole 76 75 78 0.05037
|
|
0.23670 0.00000 0.14269
|
|
0.58628
|
|
0.00000 -0.49067
|
|
0.35910 0.00000 -0.09561
|
|
multipole 77 76 75 0.01064
|
|
-0.00997 0.00000 -0.17138
|
|
0.10326
|
|
0.00000 0.09710
|
|
0.00429 0.00000 -0.20036
|
|
multipole 78 76 80 -0.12462
|
|
-0.10481 0.00000 -0.00347
|
|
0.00581
|
|
0.00000 -0.19007
|
|
-0.11755 0.00000 0.18426
|
|
multipole 79 78 76 0.01162
|
|
0.02013 0.00000 -0.18305
|
|
0.05115
|
|
0.00000 0.05109
|
|
-0.00250 0.00000 -0.10224
|
|
multipole 80 81 78 0.34249
|
|
-0.01127 0.00000 0.41324
|
|
-0.24130
|
|
0.00000 -0.40041
|
|
0.28837 0.00000 0.64171
|
|
multipole 81 80 82 -0.46444
|
|
0.19999 0.00000 0.00411
|
|
0.31111
|
|
0.00000 -0.30294
|
|
-0.24184 0.00000 -0.00817
|
|
multipole 82 81 80 0.22927
|
|
-0.06046 0.00000 -0.00959
|
|
-0.06728
|
|
0.00000 -0.09125
|
|
0.00623 0.00000 0.15853
|
|
multipole 83 8 85 -0.14811
|
|
0.11344 0.00000 0.39909
|
|
0.03628
|
|
0.00000 -0.47377
|
|
0.02261 0.00000 0.43749
|
|
multipole 84 83 84 0.08044
|
|
0.01404 0.00000 -0.09182
|
|
0.04405
|
|
0.00000 0.01752
|
|
0.03456 0.00000 -0.06157
|
|
multipole 85 83 86 -0.21500
|
|
0.00000 0.00000 0.19889
|
|
0.43753
|
|
0.00000 -0.84736
|
|
0.00000 0.00000 0.40983
|
|
multipole 86 85 88 -0.04459
|
|
0.32216 0.00000 0.13839
|
|
0.73596
|
|
0.00000 -0.60409
|
|
0.25285 0.00000 -0.13187
|
|
multipole 87 86 85 0.01849
|
|
-0.02121 0.00000 -0.10542
|
|
0.08078
|
|
0.00000 0.10479
|
|
-0.00935 0.00000 -0.18557
|
|
multipole 88 86 90 -0.15802
|
|
0.03729 0.00000 0.15665
|
|
0.59432
|
|
0.00000 -0.78857
|
|
0.29227 0.00000 0.19425
|
|
multipole 89 88 90 -0.03234
|
|
0.03781 0.00000 -0.15021
|
|
0.16274
|
|
0.00000 0.11972
|
|
0.03565 0.00000 -0.28246
|
|
multipole 90 91 88 0.62054
|
|
0.00000 0.00000 0.43281
|
|
0.41363
|
|
0.00000 -0.34255
|
|
0.00000 0.00000 -0.07108
|
|
multipole 91 90 88 -0.91150
|
|
0.00000 0.00000 -0.26161
|
|
-0.27372
|
|
0.00000 0.34305
|
|
0.00000 0.00000 -0.06933
|
|
multipole 92 8 94 -0.16392
|
|
-0.01358 0.00000 0.40504
|
|
-0.28121
|
|
0.00000 -0.40534
|
|
0.19195 0.00000 0.68655
|
|
multipole 93 92 94 0.09307
|
|
0.02678 0.00000 -0.03143
|
|
0.01097
|
|
0.00000 -0.00954
|
|
0.00302 0.00000 -0.00143
|
|
multipole 94 95 97 -0.10518
|
|
-0.33769 0.00000 -0.13606
|
|
0.08389
|
|
0.00000 -0.32705
|
|
0.64420 0.00000 0.24316
|
|
multipole 95 98 94 0.06363
|
|
0.00315 0.00000 0.45577
|
|
-0.13664
|
|
0.00000 -0.45223
|
|
0.50170 0.00000 0.58887
|
|
multipole 96 95 98 0.02858
|
|
-0.00357 0.00000 -0.19861
|
|
0.04841
|
|
0.00000 0.04990
|
|
-0.01000 0.00000 -0.09831
|
|
multipole 97 94 101 0.00670
|
|
0.26019 0.00000 -0.05143
|
|
0.25420
|
|
0.00000 -0.02804
|
|
-0.10934 0.00000 -0.22616
|
|
multipole 98 95 100 -0.04014
|
|
0.12242 0.00000 0.33257
|
|
0.47182
|
|
0.00000 -0.95073
|
|
1.00232 0.00000 0.47891
|
|
multipole 99 98 95 0.08943
|
|
0.00257 0.00000 -0.22473
|
|
0.04808
|
|
0.00000 0.07642
|
|
-0.00228 0.00000 -0.12450
|
|
multipole 100 98 103 0.27213
|
|
-0.01020 0.00000 -0.04090
|
|
-0.56550
|
|
0.00000 -0.84235
|
|
0.01760 0.00000 1.40785
|
|
multipole 101 105 97 -0.21794
|
|
-0.35298 0.00000 0.10109
|
|
-0.40485
|
|
0.00000 0.29036
|
|
0.37638 0.00000 0.11449
|
|
multipole 102 101 105 0.00801
|
|
-0.00224 0.00000 -0.18002
|
|
0.06080
|
|
0.00000 0.00560
|
|
-0.00836 0.00000 -0.06640
|
|
multipole 103 107 100 -0.11761
|
|
-0.14109 0.00000 -0.03991
|
|
-0.10545
|
|
0.00000 0.00849
|
|
0.00884 0.00000 0.09696
|
|
multipole 104 103 107 0.00440
|
|
0.00483 0.00000 -0.18511
|
|
0.04514
|
|
0.00000 0.03804
|
|
0.00203 0.00000 -0.08318
|
|
multipole 105 101 107 0.10201
|
|
0.39384 0.00000 0.16841
|
|
0.80520
|
|
0.00000 -0.74064
|
|
0.63994 0.00000 -0.06456
|
|
multipole 106 105 101 0.00775
|
|
0.00480 0.00000 -0.17770
|
|
0.05191
|
|
0.00000 0.02589
|
|
0.00432 0.00000 -0.07780
|
|
multipole 107 105 103 -0.05764
|
|
-0.04918 0.00000 0.00068
|
|
0.03545
|
|
0.00000 -0.17480
|
|
-0.16395 0.00000 0.13935
|
|
multipole 108 107 105 0.00377
|
|
-0.00056 0.00000 -0.18221
|
|
0.03345
|
|
0.00000 0.00061
|
|
-0.01344 0.00000 -0.03406
|
|
multipole 109 8 111 -0.04139
|
|
0.26299 0.00000 0.34265
|
|
-0.03104
|
|
0.00000 -0.66907
|
|
-0.12227 0.00000 0.70011
|
|
multipole 110 109 111 0.12549
|
|
0.00988 0.00000 -0.08472
|
|
-0.00787
|
|
0.00000 -0.01467
|
|
0.00364 0.00000 0.02254
|
|
multipole 111 109 112 0.11571
|
|
0.11091 0.00000 0.20553
|
|
0.09544
|
|
0.00000 -0.36654
|
|
-0.23493 0.00000 0.27110
|
|
multipole 112 111 116 -0.06925
|
|
0.09513 0.00000 0.18944
|
|
0.51323
|
|
0.00000 -0.62541
|
|
0.37771 0.00000 0.11218
|
|
multipole 113 112 116 0.21415
|
|
0.05363 0.00000 -0.13189
|
|
0.01617
|
|
0.00000 0.05352
|
|
-0.01202 0.00000 -0.06969
|
|
multipole 114 111 118 0.01888
|
|
0.16232 0.00000 -0.27102
|
|
0.61022
|
|
0.00000 -0.20124
|
|
-0.21377 0.00000 -0.40898
|
|
multipole 115 114 118 0.06585
|
|
-0.00990 0.00000 -0.23803
|
|
0.03073
|
|
0.00000 0.02508
|
|
-0.00187 0.00000 -0.05581
|
|
multipole 116 112 118 0.36202
|
|
0.26903 0.00000 0.11759
|
|
0.06815
|
|
0.00000 -0.21124
|
|
-0.30196 0.00000 0.14309
|
|
multipole 117 116 118 0.08951
|
|
-0.00197 0.00000 -0.23328
|
|
0.03690
|
|
0.00000 0.02486
|
|
-0.00452 0.00000 -0.06176
|
|
multipole 118 114 116 -0.07427
|
|
-0.05556 0.00000 0.07966
|
|
0.34564
|
|
0.00000 -0.66163
|
|
0.31368 0.00000 0.31599
|
|
multipole 119 118 116 0.13793
|
|
-0.00888 0.00000 -0.25043
|
|
0.03808
|
|
0.00000 0.02080
|
|
-0.00306 0.00000 -0.05888
|
|
multipole 120 8 122 -0.07944
|
|
0.17672 0.00000 0.30763
|
|
-0.03832
|
|
0.00000 -0.44609
|
|
-0.06557 0.00000 0.48441
|
|
multipole 121 120 122 0.08230
|
|
0.02308 0.00000 -0.08228
|
|
-0.02794
|
|
0.00000 -0.01021
|
|
-0.00367 0.00000 0.03815
|
|
multipole 122 120 123 0.02915
|
|
0.31598 0.00000 0.18435
|
|
0.34260
|
|
0.00000 -0.59879
|
|
-0.18441 0.00000 0.25619
|
|
multipole 123 122 127 -0.20791
|
|
0.39981 0.00000 0.32325
|
|
0.06377
|
|
0.00000 -0.53895
|
|
0.03531 0.00000 0.47518
|
|
multipole 124 123 127 0.22642
|
|
0.02304 0.00000 -0.11797
|
|
-0.16063
|
|
0.00000 -0.09414
|
|
-0.05024 0.00000 0.25477
|
|
multipole 125 122 129 0.02645
|
|
0.22620 0.00000 -0.16529
|
|
0.33999
|
|
0.00000 -0.44311
|
|
-0.21659 0.00000 0.10312
|
|
multipole 126 125 129 0.05039
|
|
0.02238 0.00000 -0.15563
|
|
0.06418
|
|
0.00000 -0.03197
|
|
-0.06839 0.00000 -0.03221
|
|
multipole 127 123 129 0.27710
|
|
0.29162 0.00000 0.20834
|
|
-0.08914
|
|
0.00000 -0.52843
|
|
-0.39844 0.00000 0.61757
|
|
multipole 128 127 129 0.07110
|
|
-0.02202 0.00000 -0.17142
|
|
0.20449
|
|
0.00000 -0.02865
|
|
0.00605 0.00000 -0.17584
|
|
multipole 129 125 127 -0.48774
|
|
0.22946 0.00000 0.26151
|
|
0.03809
|
|
0.00000 -0.11680
|
|
-0.10207 0.00000 0.07871
|
|
multipole 130 8 132 -0.07191
|
|
0.28159 0.00000 0.28143
|
|
0.31037
|
|
0.00000 -0.69057
|
|
0.12423 0.00000 0.38020
|
|
multipole 131 130 132 0.09317
|
|
0.00776 0.00000 -0.05959
|
|
-0.00489
|
|
0.00000 -0.01510
|
|
-0.03160 0.00000 0.01999
|
|
multipole 132 130 133 0.21765
|
|
0.29985 0.00000 0.02736
|
|
0.07615
|
|
0.00000 -0.68598
|
|
0.04724 0.00000 0.60983
|
|
multipole 133 132 136 -0.58085
|
|
0.22726 0.00000 0.17315
|
|
-0.01899
|
|
0.00000 0.04259
|
|
-0.10366 0.00000 -0.02360
|
|
multipole 134 132 138 -0.05319
|
|
0.24583 0.00000 -0.18287
|
|
0.72454
|
|
0.00000 -0.35866
|
|
-0.27504 0.00000 -0.36588
|
|
multipole 135 134 138 0.03309
|
|
-0.01543 0.00000 -0.18397
|
|
0.06413
|
|
0.00000 0.01079
|
|
0.00873 0.00000 -0.07492
|
|
multipole 136 133 138 0.31901
|
|
0.20503 0.00000 0.21136
|
|
0.19503
|
|
0.00000 -0.33727
|
|
-0.42894 0.00000 0.14224
|
|
multipole 137 136 138 0.03395
|
|
-0.03428 0.00000 -0.19515
|
|
0.05553
|
|
0.00000 0.03619
|
|
-0.01089 0.00000 -0.09172
|
|
multipole 138 134 136 -0.11867
|
|
-0.00875 0.00000 0.10083
|
|
0.20131
|
|
0.00000 -0.72000
|
|
0.25215 0.00000 0.51869
|
|
multipole 139 138 136 0.10470
|
|
0.00835 0.00000 -0.20453
|
|
0.03062
|
|
0.00000 0.01424
|
|
0.02385 0.00000 -0.04486
|
|
multipole 140 8 142 -0.33040
|
|
-0.11155 0.00000 0.33205
|
|
-0.61968
|
|
0.00000 -0.26472
|
|
-0.14505 0.00000 0.88440
|
|
multipole 141 140 142 0.04893
|
|
0.05143 0.00000 -0.06648
|
|
0.28508
|
|
0.00000 0.01019
|
|
0.01023 0.00000 -0.29527
|
|
multipole 142 -143 -143 1.01644
|
|
0.00000 0.00000 0.08388
|
|
0.38943
|
|
0.00000 -0.40574
|
|
-0.48759 0.00000 0.01631
|
|
multipole 143 142 140 -0.85689
|
|
-0.12334 0.00000 -0.17900
|
|
-0.30556
|
|
0.00000 0.15089
|
|
-0.25593 0.00000 0.15467
|
|
multipole 144 8 146 -0.09907
|
|
0.28314 0.00000 0.21299
|
|
-0.02365
|
|
0.00000 -0.44590
|
|
-0.11454 0.00000 0.46955
|
|
multipole 145 144 146 0.09104
|
|
-0.00783 0.00000 -0.03880
|
|
0.00300
|
|
0.00000 -0.02251
|
|
0.00366 0.00000 0.01951
|
|
multipole 146 147 148 0.80267
|
|
0.20023 0.00000 0.07448
|
|
0.19047
|
|
0.00000 -0.27645
|
|
-0.23208 0.00000 0.08598
|
|
multipole 147 146 148 -0.61184
|
|
-0.02970 0.00000 -0.14127
|
|
-0.46989
|
|
0.00000 0.30054
|
|
-0.03964 0.00000 0.16935
|
|
multipole 148 146 149 -0.44451
|
|
0.25436 0.00000 -0.00470
|
|
0.30396
|
|
0.00000 -0.42103
|
|
-0.22422 0.00000 0.11707
|
|
multipole 149 148 146 0.24079
|
|
-0.02916 0.00000 -0.07474
|
|
-0.05892
|
|
0.00000 -0.07642
|
|
-0.01164 0.00000 0.13534
|
|
multipole 150 8 152 -0.15072
|
|
0.21350 0.00000 0.26252
|
|
0.05371
|
|
0.00000 -0.51087
|
|
-0.14685 0.00000 0.45716
|
|
multipole 151 150 152 0.09679
|
|
0.03329 0.00000 -0.09671
|
|
0.39142
|
|
0.00000 -0.06880
|
|
0.00874 0.00000 -0.32262
|
|
multipole 152 154 153 0.76960
|
|
0.30627 0.00000 -0.09362
|
|
0.21156
|
|
0.00000 -0.39797
|
|
0.03345 0.00000 0.18641
|
|
multipole 153 152 154 -0.72950
|
|
-0.03688 0.00000 -0.16002
|
|
-0.27527
|
|
0.00000 0.26973
|
|
0.01067 0.00000 0.00554
|
|
multipole 154 152 153 -0.38020
|
|
0.09353 0.00000 0.22182
|
|
-0.15418
|
|
0.00000 -0.46630
|
|
0.22562 0.00000 0.62048
|
|
multipole 155 154 152 0.18368
|
|
-0.03978 0.00000 -0.31735
|
|
0.10703
|
|
0.00000 0.19471
|
|
-0.10853 0.00000 -0.30174
|
|
multipole 156 8 158 0.00410
|
|
0.19527 0.00000 0.18895
|
|
0.21464
|
|
0.00000 -0.87217
|
|
-0.58720 0.00000 0.65753
|
|
multipole 157 156 158 0.04082
|
|
0.05593 0.00000 -0.13609
|
|
0.19339
|
|
0.00000 0.00486
|
|
0.13648 0.00000 -0.19825
|
|
multipole 158 156 160 -0.36014
|
|
-0.21199 0.00000 0.25528
|
|
-0.92519
|
|
0.00000 0.11101
|
|
-0.02016 0.00000 0.81418
|
|
multipole 159 158 160 -0.00356
|
|
0.01435 0.00000 -0.03733
|
|
0.30641
|
|
0.00000 -0.10229
|
|
-0.17820 0.00000 -0.20412
|
|
multipole 160 -161 -161 1.14596
|
|
0.00000 0.00000 -0.08110
|
|
0.47468
|
|
0.00000 -0.53790
|
|
-0.20865 0.00000 0.06322
|
|
multipole 161 160 161 -0.89716
|
|
0.23089 0.00000 -0.27964
|
|
-0.48791
|
|
0.00000 0.28534
|
|
0.25648 0.00000 0.20257
|
|
multipole 162 8 164 -0.07714
|
|
0.26038 0.00000 0.20993
|
|
0.22883
|
|
0.00000 -0.64833
|
|
-0.23553 0.00000 0.41950
|
|
multipole 163 162 8 0.09378
|
|
-0.01574 0.00000 -0.05078
|
|
-0.02530
|
|
0.00000 0.00147
|
|
0.02003 0.00000 0.02383
|
|
multipole 164 162 166 -0.20674
|
|
0.26277 0.00000 0.16246
|
|
-0.04934
|
|
0.00000 -0.40226
|
|
-0.12563 0.00000 0.45160
|
|
multipole 165 164 166 0.09104
|
|
-0.00783 0.00000 -0.03880
|
|
0.00300
|
|
0.00000 -0.02251
|
|
0.00366 0.00000 0.01951
|
|
multipole 166 167 168 0.80267
|
|
0.20023 0.00000 0.07448
|
|
0.19047
|
|
0.00000 -0.27645
|
|
-0.23208 0.00000 0.08598
|
|
multipole 167 166 168 -0.61184
|
|
-0.02970 0.00000 -0.14127
|
|
-0.46989
|
|
0.00000 0.30054
|
|
-0.03964 0.00000 0.16935
|
|
multipole 168 166 169 -0.44451
|
|
0.25436 0.00000 -0.00470
|
|
0.30396
|
|
0.00000 -0.42103
|
|
-0.22422 0.00000 0.11707
|
|
multipole 169 168 166 0.24079
|
|
-0.02916 0.00000 -0.07474
|
|
-0.05892
|
|
0.00000 -0.07642
|
|
-0.01164 0.00000 0.13534
|
|
multipole 170 8 172 -0.12108
|
|
0.20829 0.00000 0.25236
|
|
0.20153
|
|
0.00000 -0.62121
|
|
-0.31273 0.00000 0.41968
|
|
multipole 171 170 8 0.05947
|
|
-0.00523 0.00000 -0.09278
|
|
-0.00153
|
|
0.00000 0.01003
|
|
0.11637 0.00000 -0.00850
|
|
multipole 172 170 174 -0.14858
|
|
0.36021 0.00000 0.30124
|
|
0.02345
|
|
0.00000 -0.56744
|
|
0.02425 0.00000 0.54399
|
|
multipole 173 172 174 0.09679
|
|
0.03329 0.00000 -0.09671
|
|
0.39142
|
|
0.00000 -0.06880
|
|
0.00874 0.00000 -0.32262
|
|
multipole 174 176 175 0.76960
|
|
0.30627 0.00000 -0.09362
|
|
0.21156
|
|
0.00000 -0.39797
|
|
0.03345 0.00000 0.18641
|
|
multipole 175 174 176 -0.72950
|
|
-0.03688 0.00000 -0.16002
|
|
-0.27527
|
|
0.00000 0.26973
|
|
0.01067 0.00000 0.00554
|
|
multipole 176 174 175 -0.38020
|
|
0.09353 0.00000 0.22182
|
|
-0.15418
|
|
0.00000 -0.46630
|
|
0.22562 0.00000 0.62048
|
|
multipole 177 176 174 0.18368
|
|
-0.03978 0.00000 -0.31735
|
|
0.10703
|
|
0.00000 0.19471
|
|
-0.10853 0.00000 -0.30174
|
|
multipole 178 8 180 -0.02949
|
|
0.25798 0.00000 0.20067
|
|
0.18156
|
|
0.00000 -0.53649
|
|
-0.23437 0.00000 0.35493
|
|
multipole 179 178 180 0.06373
|
|
0.02199 0.00000 -0.08918
|
|
-0.00122
|
|
0.00000 0.01893
|
|
0.07446 0.00000 -0.01771
|
|
multipole 180 182 178 -0.07285
|
|
0.10294 0.00000 -0.14760
|
|
0.07610
|
|
0.00000 0.00950
|
|
-0.40971 0.00000 -0.08560
|
|
multipole 181 180 182 0.00251
|
|
0.00920 0.00000 -0.06833
|
|
0.06767
|
|
0.00000 -0.04966
|
|
0.05119 0.00000 -0.01801
|
|
multipole 182 180 183 0.06969
|
|
0.45487 0.00000 0.40067
|
|
1.23884
|
|
0.00000 -2.84799
|
|
-0.97916 0.00000 1.60915
|
|
multipole 183 182 180 -0.15553
|
|
0.07637 0.00000 0.05437
|
|
-0.24774
|
|
0.00000 0.25322
|
|
0.17760 0.00000 -0.00548
|
|
multipole 184 183 182 0.04194
|
|
0.01008 0.00000 -0.10323
|
|
0.07224
|
|
0.00000 -0.02305
|
|
-0.03128 0.00000 -0.04919
|
|
multipole 185 8 187 0.01417
|
|
0.14321 0.00000 0.20704
|
|
0.30355
|
|
0.00000 -0.78336
|
|
-0.49884 0.00000 0.47981
|
|
multipole 186 185 187 0.06168
|
|
0.01034 0.00000 -0.06926
|
|
-0.00481
|
|
0.00000 -0.01041
|
|
0.00120 0.00000 0.01522
|
|
multipole 187 189 185 -0.14658
|
|
0.07407 0.00000 0.27751
|
|
-0.00731
|
|
0.00000 -0.45713
|
|
-0.03370 0.00000 0.46444
|
|
multipole 188 187 188 0.07914
|
|
-0.02214 0.00000 -0.05705
|
|
-0.01403
|
|
0.00000 -0.00903
|
|
-0.01009 0.00000 0.02306
|
|
multipole 189 191 187 -0.12517
|
|
0.10322 0.00000 0.30901
|
|
-0.01151
|
|
0.00000 -0.54904
|
|
-0.16768 0.00000 0.56055
|
|
multipole 190 189 190 0.07947
|
|
-0.01804 0.00000 -0.05617
|
|
-0.00416
|
|
0.00000 -0.02346
|
|
-0.00980 0.00000 0.02762
|
|
multipole 191 193 189 -0.00637
|
|
0.14897 0.00000 0.45848
|
|
-0.16613
|
|
0.00000 -0.75850
|
|
-0.13391 0.00000 0.92463
|
|
multipole 192 191 192 0.10424
|
|
-0.02167 0.00000 -0.06885
|
|
0.00577
|
|
0.00000 -0.00847
|
|
-0.00310 0.00000 0.00270
|
|
multipole 193 191 194 0.10679
|
|
0.00000 0.00000 0.12676
|
|
-0.16979
|
|
0.00000 -0.13104
|
|
0.03239 0.00000 0.30083
|
|
multipole 194 193 191 0.19274
|
|
0.03789 0.00000 -0.14079
|
|
0.01248
|
|
0.00000 -0.00338
|
|
0.01511 0.00000 -0.00910
|
|
multipole 195 8 197 0.01417
|
|
0.14321 0.00000 0.20704
|
|
0.30355
|
|
0.00000 -0.78336
|
|
-0.49884 0.00000 0.47981
|
|
multipole 196 195 197 0.06168
|
|
0.01034 0.00000 -0.06926
|
|
-0.00481
|
|
0.00000 -0.01041
|
|
0.00120 0.00000 0.01522
|
|
multipole 197 195 199 -0.23796
|
|
0.19414 0.00000 0.14744
|
|
0.14341
|
|
0.00000 -0.47693
|
|
-0.11332 0.00000 0.33352
|
|
multipole 198 197 198 0.07914
|
|
-0.02214 0.00000 -0.05705
|
|
-0.01403
|
|
0.00000 -0.00903
|
|
-0.01009 0.00000 0.02306
|
|
multipole 199 197 201 -0.11624
|
|
0.21269 0.00000 0.09089
|
|
0.20210
|
|
0.00000 -0.39596
|
|
-0.20937 0.00000 0.19386
|
|
multipole 200 199 200 0.05672
|
|
-0.01831 0.00000 -0.07935
|
|
0.15924
|
|
0.00000 -0.06424
|
|
0.10917 0.00000 -0.09500
|
|
multipole 201 203 199 0.11242
|
|
0.21133 0.00000 0.33886
|
|
0.02196
|
|
0.00000 -0.48911
|
|
-0.25303 0.00000 0.46715
|
|
multipole 202 201 202 0.02390
|
|
0.01872 0.00000 -0.12033
|
|
0.09851
|
|
0.00000 0.11826
|
|
0.07069 0.00000 -0.21677
|
|
multipole 203 201 -204 -204 -0.30941
|
|
0.33655 0.00000 0.15544
|
|
-0.89694
|
|
0.00000 0.57332
|
|
-0.40985 0.00000 0.32362
|
|
multipole 204 203 201 0.08213
|
|
-0.02480 0.00000 -0.10241
|
|
-0.09247
|
|
0.00000 -0.02510
|
|
0.06165 0.00000 0.11757
|
|
multipole 205 8 207 -0.05810
|
|
0.20447 0.00000 0.22675
|
|
0.15418
|
|
0.00000 -0.61290
|
|
-0.20381 0.00000 0.45872
|
|
multipole 206 205 207 0.07332
|
|
0.02865 0.00000 -0.07066
|
|
-0.01727
|
|
0.00000 0.05136
|
|
-0.02048 0.00000 -0.03409
|
|
multipole 207 205 209 -0.12460
|
|
0.34262 0.00000 0.10892
|
|
0.29827
|
|
0.00000 -0.61801
|
|
-0.41083 0.00000 0.31974
|
|
multipole 208 207 208 0.10013
|
|
-0.02406 0.00000 -0.04574
|
|
0.04356
|
|
0.00000 0.04278
|
|
0.03604 0.00000 -0.08634
|
|
multipole 209 207 211 -0.00504
|
|
0.31217 0.00000 0.12183
|
|
0.63851
|
|
0.00000 -0.60326
|
|
-0.42746 0.00000 -0.03525
|
|
multipole 210 209 210 0.06386
|
|
0.00521 0.00000 -0.12606
|
|
0.06805
|
|
0.00000 0.12031
|
|
0.04448 0.00000 -0.18836
|
|
multipole 211 209 213 -0.26789
|
|
-0.17032 0.00000 0.38423
|
|
0.13132
|
|
0.00000 -0.85952
|
|
0.18957 0.00000 0.72820
|
|
multipole 212 211 213 0.14895
|
|
-0.02053 0.00000 -0.19388
|
|
0.07464
|
|
0.00000 0.03688
|
|
0.08593 0.00000 -0.11152
|
|
multipole 213 -214 -214 0.90680
|
|
0.00412 0.00000 0.01818
|
|
-0.11120
|
|
0.00000 0.07010
|
|
-0.02109 0.00000 0.04110
|
|
multipole 214 213 214 -0.30169
|
|
-0.00168 0.00000 -0.24721
|
|
0.43113
|
|
0.00000 -0.69170
|
|
-0.07379 0.00000 0.26057
|
|
multipole 215 214 213 0.14969
|
|
0.01642 0.00000 -0.22002
|
|
0.17410
|
|
0.00000 -0.03308
|
|
-0.02767 0.00000 -0.14102
|
|
multipole 216 8 218 0.01417
|
|
0.14321 0.00000 0.20704
|
|
0.30355
|
|
0.00000 -0.78336
|
|
-0.49884 0.00000 0.47981
|
|
multipole 217 216 218 0.06168
|
|
0.01034 0.00000 -0.06926
|
|
-0.00481
|
|
0.00000 -0.01041
|
|
0.00120 0.00000 0.01522
|
|
multipole 218 220 216 -0.12127
|
|
0.10322 0.00000 0.30901
|
|
-0.01151
|
|
0.00000 -0.54904
|
|
-0.16768 0.00000 0.56055
|
|
multipole 219 218 219 0.08337
|
|
-0.01804 0.00000 -0.05617
|
|
-0.00416
|
|
0.00000 -0.02346
|
|
-0.00980 0.00000 0.02762
|
|
multipole 220 222 218 -0.00637
|
|
0.14897 0.00000 0.45848
|
|
-0.16613
|
|
0.00000 -0.75850
|
|
-0.13391 0.00000 0.92463
|
|
multipole 221 220 221 0.10424
|
|
-0.02167 0.00000 -0.06885
|
|
0.00577
|
|
0.00000 -0.00847
|
|
-0.00310 0.00000 0.00270
|
|
multipole 222 220 223 0.10679
|
|
0.00000 0.00000 0.12676
|
|
-0.16979
|
|
0.00000 -0.13104
|
|
0.03239 0.00000 0.30083
|
|
multipole 223 222 220 0.19274
|
|
0.03789 0.00000 -0.14079
|
|
0.01248
|
|
0.00000 -0.00338
|
|
0.01511 0.00000 -0.00910
|
|
multipole 224 226 227 -0.19495
|
|
-0.05933 0.00000 0.30647
|
|
-0.12000
|
|
0.00000 -0.18289
|
|
0.06006 0.00000 0.30289
|
|
multipole 225 224 226 0.07797
|
|
-0.00148 0.00000 -0.10232
|
|
0.00077
|
|
0.00000 -0.01358
|
|
0.00508 0.00000 0.01281
|
|
multipole 226 227 224 0.70656
|
|
-0.28625 0.00000 0.40485
|
|
0.09631
|
|
0.00000 -0.19283
|
|
0.05482 0.00000 0.09652
|
|
multipole 227 226 224 -0.74615
|
|
0.10832 0.00000 -0.15915
|
|
-0.51576
|
|
0.00000 0.23754
|
|
0.12638 0.00000 0.27822
|
|
multipole 228 -229 -229 -0.25887
|
|
0.00000 0.00000 0.11888
|
|
0.60320
|
|
0.00000 -0.68404
|
|
-0.03938 0.00000 0.08084
|
|
multipole 229 228 229 0.12975
|
|
0.00964 0.00000 -0.17930
|
|
0.02173
|
|
0.00000 -0.03357
|
|
0.00745 0.00000 0.01184
|
|
multipole 230 232 231 -0.27516
|
|
0.12868 0.00000 0.29428
|
|
0.13167
|
|
0.00000 -0.77946
|
|
-0.26698 0.00000 0.64779
|
|
multipole 231 230 232 0.12524
|
|
0.04469 0.00000 -0.11589
|
|
0.03867
|
|
0.00000 -0.05683
|
|
0.02734 0.00000 0.01816
|
|
multipole 232 230 231 -0.00902
|
|
0.04962 0.00000 0.26123
|
|
-0.42853
|
|
0.00000 -0.34055
|
|
0.01113 0.00000 0.76908
|
|
multipole 233 232 230 0.05319
|
|
-0.00200 0.00000 -0.11501
|
|
0.00409
|
|
0.00000 -0.00544
|
|
-0.00819 0.00000 0.00135
|
|
multipole 234 2 235 0.11164
|
|
0.00000 0.00000 0.13883
|
|
-0.17000
|
|
0.00000 -0.34475
|
|
-0.01419 0.00000 0.51475
|
|
multipole 234 8 235 0.11164
|
|
0.00000 0.00000 0.13883
|
|
-0.17000
|
|
0.00000 -0.34475
|
|
-0.01419 0.00000 0.51475
|
|
multipole 234 33 235 0.11164
|
|
0.00000 0.00000 0.13883
|
|
-0.17000
|
|
0.00000 -0.34475
|
|
-0.01419 0.00000 0.51475
|
|
multipole 234 44 235 0.11164
|
|
0.00000 0.00000 0.13883
|
|
-0.17000
|
|
0.00000 -0.34475
|
|
-0.01419 0.00000 0.51475
|
|
multipole 235 234 2 0.21240
|
|
0.00000 0.00000 -0.12490
|
|
0.03622
|
|
0.00000 -0.01437
|
|
0.00000 0.00000 -0.02185
|
|
multipole 235 234 8 0.21240
|
|
0.00000 0.00000 -0.12490
|
|
0.03622
|
|
0.00000 -0.01437
|
|
0.00000 0.00000 -0.02185
|
|
multipole 235 234 33 0.21240
|
|
0.00000 0.00000 -0.12490
|
|
0.03622
|
|
0.00000 -0.01437
|
|
0.00000 0.00000 -0.02185
|
|
multipole 235 234 44 0.21240
|
|
0.00000 0.00000 -0.12490
|
|
0.03622
|
|
0.00000 -0.01437
|
|
0.00000 0.00000 -0.02185
|
|
multipole 236 2 -237 -237 -0.29203
|
|
0.39162 0.00000 0.29820
|
|
-0.82241
|
|
0.00000 0.30190
|
|
-0.26688 0.00000 0.52051
|
|
multipole 236 8 -237 -237 -0.29203
|
|
0.39162 0.00000 0.29820
|
|
-0.82241
|
|
0.00000 0.30190
|
|
-0.26688 0.00000 0.52051
|
|
multipole 236 33 -237 -237 -0.29203
|
|
0.39162 0.00000 0.29820
|
|
-0.82241
|
|
0.00000 0.30190
|
|
-0.26688 0.00000 0.52051
|
|
multipole 236 44 -237 -237 -0.29203
|
|
0.39162 0.00000 0.29820
|
|
-0.82241
|
|
0.00000 0.30190
|
|
-0.26688 0.00000 0.52051
|
|
multipole 237 236 237 0.09729
|
|
-0.02365 0.00000 -0.07786
|
|
-0.02419
|
|
0.00000 -0.00850
|
|
-0.00527 0.00000 0.03269
|
|
multipole 238 -239 -239 1.02669
|
|
0.00000 0.00000 -0.06887
|
|
0.36390
|
|
0.00000 -0.45669
|
|
0.00000 0.00000 0.09279
|
|
multipole 239 238 239 -0.90443
|
|
0.19119 0.00000 -0.19259
|
|
-0.45071
|
|
0.00000 0.24406
|
|
0.16925 0.00000 0.20665
|
|
multipole 240 241 2 0.90327
|
|
-0.07798 0.00000 0.05629
|
|
0.20073
|
|
0.00000 -0.34953
|
|
0.34032 0.00000 0.14880
|
|
multipole 240 241 8 0.90327
|
|
-0.07798 0.00000 0.05629
|
|
0.20073
|
|
0.00000 -0.34953
|
|
0.34032 0.00000 0.14880
|
|
multipole 240 241 33 0.90327
|
|
-0.07798 0.00000 0.05629
|
|
0.20073
|
|
0.00000 -0.34953
|
|
0.34032 0.00000 0.14880
|
|
multipole 240 241 44 0.90327
|
|
-0.07798 0.00000 0.05629
|
|
0.20073
|
|
0.00000 -0.34953
|
|
0.34032 0.00000 0.14880
|
|
multipole 241 240 2 -0.65062
|
|
-0.01381 0.00000 -0.15899
|
|
-0.50252
|
|
0.00000 0.31170
|
|
-0.01833 0.00000 0.19082
|
|
multipole 241 240 8 -0.65062
|
|
-0.01381 0.00000 -0.15899
|
|
-0.50252
|
|
0.00000 0.31170
|
|
-0.01833 0.00000 0.19082
|
|
multipole 241 240 33 -0.65062
|
|
-0.01381 0.00000 -0.15899
|
|
-0.50252
|
|
0.00000 0.31170
|
|
-0.01833 0.00000 0.19082
|
|
multipole 241 240 44 -0.65062
|
|
-0.01381 0.00000 -0.15899
|
|
-0.50252
|
|
0.00000 0.31170
|
|
-0.01833 0.00000 0.19082
|
|
multipole 242 240 243 -0.47859
|
|
0.29403 0.00000 -0.07342
|
|
0.32137
|
|
0.00000 -0.37927
|
|
-0.15981 0.00000 0.05790
|
|
multipole 243 242 240 0.24567
|
|
-0.01982 0.00000 -0.07068
|
|
-0.05831
|
|
0.00000 -0.07908
|
|
-0.01391 0.00000 0.13739
|
|
multipole 244 246 250 0.07219
|
|
0.28913 0.00000 0.29472
|
|
0.20132
|
|
0.00000 -0.54286
|
|
0.05155 0.00000 0.34154
|
|
multipole 245 244 245 0.23262
|
|
-0.02789 0.00000 -0.04288
|
|
0.00231
|
|
0.00000 0.03311
|
|
-0.02313 0.00000 -0.03542
|
|
multipole 246 244 247 -0.16428
|
|
0.16276 0.20457 0.47894
|
|
-0.28250
|
|
-0.26022 -0.34943
|
|
0.25272 -0.20303 0.63193
|
|
multipole 247 248 246 0.93900
|
|
0.00000 0.00000 0.32359
|
|
0.14171
|
|
0.00000 -0.31370
|
|
0.03825 0.00000 0.17199
|
|
multipole 248 247 246 -0.74794
|
|
0.02444 0.00000 -0.13267
|
|
-0.59982
|
|
0.00000 0.24285
|
|
-0.01926 0.00000 0.35697
|
|
multipole 249 246 58 0.12611
|
|
0.01772 0.00000 0.00501
|
|
0.02059
|
|
0.00000 -0.01260
|
|
0.01759 0.00000 -0.00799
|
|
multipole 250 60 244 -0.04567
|
|
0.56406 0.00000 0.09733
|
|
0.69818
|
|
0.00000 -0.78665
|
|
-0.18468 0.00000 0.08847
|
|
multipole 251 250 244 0.10559
|
|
-0.01503 0.00000 -0.07122
|
|
0.00434
|
|
0.00000 -0.00248
|
|
-0.01523 0.00000 -0.00186
|
|
multipole 252 256 253 -0.12218
|
|
0.03811 0.00000 -0.08600
|
|
0.62317
|
|
0.00000 -1.19258
|
|
0.19520 0.00000 0.56941
|
|
multipole 253 257 252 0.10618
|
|
0.14960 0.00000 -0.12837
|
|
0.37561
|
|
0.00000 -1.08479
|
|
-0.08751 0.00000 0.70918
|
|
multipole 254 255 260 0.03294
|
|
-0.03102 0.00000 0.00884
|
|
0.54936
|
|
0.00000 -1.16758
|
|
-0.21224 0.00000 0.61822
|
|
multipole 255 256 254 -0.29610
|
|
0.61528 0.00000 0.42732
|
|
0.23662
|
|
0.00000 -0.71274
|
|
-0.59516 0.00000 0.47612
|
|
multipole 256 255 252 0.12091
|
|
0.29466 0.00000 0.04441
|
|
0.57178
|
|
0.00000 -0.97127
|
|
0.05984 0.00000 0.39949
|
|
multipole 257 258 253 -0.28556
|
|
0.65052 0.00000 0.32181
|
|
0.12041
|
|
0.00000 -0.70422
|
|
-0.73445 0.00000 0.58381
|
|
multipole 258 259 257 0.09440
|
|
0.17177 0.00000 0.08338
|
|
0.42911
|
|
0.00000 -0.89289
|
|
-0.05831 0.00000 0.46378
|
|
multipole 259 260 258 -0.30504
|
|
0.51018 0.00000 0.44518
|
|
-0.10277
|
|
0.00000 -0.67553
|
|
-0.76206 0.00000 0.77830
|
|
multipole 260 259 262 0.11701
|
|
-0.02847 0.00000 -0.01015
|
|
0.48527
|
|
0.00000 -0.91170
|
|
0.00027 0.00000 0.42643
|
|
multipole 261 258 259 0.10987
|
|
0.00260 0.00000 0.16138
|
|
-0.00401
|
|
0.00000 -0.14100
|
|
-0.00062 0.00000 0.14501
|
|
multipole 262 260 263 -0.28195
|
|
0.00000 0.00000 0.28691
|
|
0.77307
|
|
0.00000 -1.54614
|
|
0.00000 0.00000 0.77307
|
|
multipole 263 262 260 0.23408
|
|
0.03256 0.00000 0.10841
|
|
0.00094
|
|
0.00000 -0.15824
|
|
-0.00749 0.00000 0.15730
|
|
multipole 264 262 260 0.23408
|
|
0.03256 0.00000 0.10841
|
|
0.00094
|
|
0.00000 -0.15824
|
|
-0.00749 0.00000 0.15730
|
|
multipole 265 256 252 0.12346
|
|
0.00882 0.00000 0.15889
|
|
-0.01175
|
|
0.00000 -0.14419
|
|
0.01352 0.00000 0.15594
|
|
multipole 266 267 271 -0.12896
|
|
-0.11355 0.00000 0.02174
|
|
0.67152
|
|
0.00000 -1.21177
|
|
-0.10266 0.00000 0.54025
|
|
multipole 267 272 268 0.25555
|
|
-0.14070 0.00000 -0.03554
|
|
0.26985
|
|
-0.00001 -0.69302
|
|
-0.03330 0.00000 0.42317
|
|
multipole 268 267 269 -0.29612
|
|
0.53921 0.00000 0.28660
|
|
-0.04511
|
|
0.00000 -0.75164
|
|
-0.89326 0.00000 0.79675
|
|
multipole 269 268 273 0.10206
|
|
0.01957 0.00000 0.12801
|
|
0.47115
|
|
0.00000 -0.89630
|
|
-0.01741 0.00000 0.42515
|
|
multipole 270 269 271 -0.08445
|
|
0.15647 0.00000 0.19000
|
|
0.70078
|
|
0.00000 -1.36350
|
|
0.01622 0.00000 0.66272
|
|
multipole 271 266 270 0.09191
|
|
0.09270 0.00000 0.29758
|
|
0.55799
|
|
0.00000 -1.06685
|
|
-0.02963 0.00000 0.50886
|
|
multipole 272 267 266 -0.42963
|
|
-0.05223 0.00000 0.54613
|
|
-0.69717
|
|
0.00000 -0.34383
|
|
0.07116 0.00000 1.04100
|
|
multipole 273 269 274 -0.28291
|
|
0.00000 0.00000 0.25147
|
|
0.76777
|
|
0.00000 -1.53554
|
|
0.00000 0.00000 0.76777
|
|
multipole 274 273 269 0.22172
|
|
0.03599 0.00000 0.11263
|
|
-0.00271
|
|
0.00000 -0.15749
|
|
0.00206 0.00000 0.16020
|
|
multipole 275 273 269 0.22172
|
|
0.03599 0.00000 0.11263
|
|
-0.00271
|
|
0.00000 -0.15749
|
|
0.00206 0.00000 0.16020
|
|
multipole 276 270 269 0.09969
|
|
0.02298 0.00000 0.17496
|
|
0.00319
|
|
0.00000 -0.16978
|
|
-0.00323 0.00000 0.16659
|
|
multipole 277 271 266 0.11152
|
|
0.02437 0.00000 0.17240
|
|
-0.00098
|
|
0.00000 -0.14128
|
|
0.00098 0.00000 0.14226
|
|
multipole 278 282 279 -0.12123
|
|
0.03277 0.00000 -0.10629
|
|
0.63111
|
|
0.00000 -1.19809
|
|
0.19068 0.00000 0.56698
|
|
multipole 279 283 278 0.11988
|
|
0.19633 0.00000 -0.06061
|
|
0.38997
|
|
0.00000 -1.12316
|
|
-0.07428 0.00000 0.73319
|
|
multipole 280 281 286 0.05939
|
|
-0.10783 0.00000 0.02921
|
|
0.63397
|
|
0.00000 -1.23333
|
|
-0.17725 0.00000 0.59936
|
|
multipole 281 282 280 -0.25427
|
|
0.59171 0.00000 0.39016
|
|
0.15889
|
|
0.00000 -0.73445
|
|
-0.53511 0.00000 0.57556
|
|
multipole 282 281 278 0.05900
|
|
0.29666 0.00000 0.03459
|
|
0.59303
|
|
0.00000 -1.00768
|
|
0.05948 0.00000 0.41465
|
|
multipole 283 284 279 -0.32183
|
|
0.57617 0.00000 0.41136
|
|
0.04364
|
|
0.00000 -0.79668
|
|
-0.81270 0.00000 0.75304
|
|
multipole 284 283 285 0.16650
|
|
0.04683 0.00000 0.10382
|
|
0.42221
|
|
0.00000 -0.84366
|
|
0.03151 0.00000 0.42145
|
|
multipole 285 286 284 -0.20681
|
|
0.13302 0.00000 0.01206
|
|
0.66907
|
|
0.00000 -1.32924
|
|
-0.20370 0.00000 0.66017
|
|
multipole 286 291 285 0.22596
|
|
0.01495 0.00000 -0.07785
|
|
0.18997
|
|
0.00000 -0.72984
|
|
0.02836 0.00000 0.53987
|
|
multipole 287 285 286 0.25827
|
|
-0.01369 0.00000 0.11644
|
|
0.02819
|
|
0.00000 -0.12664
|
|
-0.01016 0.00000 0.09845
|
|
multipole 288 284 289 -0.30237
|
|
0.00000 0.00000 0.28852
|
|
0.63383
|
|
0.00000 -1.56322
|
|
0.00000 0.00000 0.92939
|
|
multipole 289 288 284 0.22815
|
|
0.03988 0.00000 0.11016
|
|
-0.00150
|
|
0.00000 -0.16140
|
|
0.00075 0.00000 0.16290
|
|
multipole 290 288 284 0.22815
|
|
0.03988 0.00000 0.11016
|
|
-0.00150
|
|
0.00000 -0.16140
|
|
0.00075 0.00000 0.16290
|
|
multipole 291 286 285 -0.37776
|
|
-0.06443 0.00000 0.49534
|
|
-0.70985
|
|
0.00000 -0.26340
|
|
0.02536 0.00000 0.97325
|
|
multipole 292 282 278 0.12107
|
|
0.01058 0.00000 0.15550
|
|
-0.00871
|
|
0.00000 -0.14972
|
|
0.01430 0.00000 0.15843
|
|
multipole 293 294 298 -0.15031
|
|
-0.09046 0.00000 0.02457
|
|
0.65601
|
|
0.00000 -1.24652
|
|
-0.08497 0.00000 0.59051
|
|
multipole 294 299 293 0.25814
|
|
0.18207 0.00000 -0.10742
|
|
0.22241
|
|
0.00000 -0.69573
|
|
0.00586 0.00000 0.47332
|
|
multipole 295 294 296 -0.18494
|
|
0.09040 0.00000 0.07592
|
|
0.52488
|
|
0.00000 -1.31753
|
|
-0.14409 0.00000 0.79265
|
|
multipole 296 301 295 0.20468
|
|
-0.03331 0.00000 -0.08396
|
|
0.22917
|
|
0.00000 -0.73017
|
|
-0.00765 0.00000 0.50100
|
|
multipole 297 296 298 -0.10776
|
|
-0.07708 0.00000 0.02024
|
|
0.69315
|
|
0.00000 -1.22595
|
|
-0.07168 0.00000 0.53280
|
|
multipole 298 293 297 0.02014
|
|
0.13147 0.00000 0.23798
|
|
0.52729
|
|
0.00000 -1.10293
|
|
-0.13608 0.00000 0.57564
|
|
multipole 299 294 293 -0.42656
|
|
-0.00821 0.00000 0.52363
|
|
-0.76229
|
|
0.00000 -0.32575
|
|
0.04661 0.00000 1.08804
|
|
multipole 300 295 294 0.27344
|
|
0.00655 0.00000 0.12419
|
|
0.02392
|
|
0.00000 -0.12278
|
|
-0.00027 0.00000 0.09886
|
|
multipole 301 296 295 -0.40427
|
|
0.01291 0.00000 0.51762
|
|
-0.81344
|
|
0.00000 -0.24421
|
|
-0.00636 0.00000 1.05765
|
|
multipole 302 297 303 -0.09928
|
|
0.00000 0.00000 0.16142
|
|
-0.10106
|
|
0.00000 -0.10106
|
|
0.00000 0.00000 0.20212
|
|
multipole 303 302 297 0.12786
|
|
0.04661 0.00000 0.13652
|
|
-0.04143
|
|
0.00000 -0.10340
|
|
-0.01205 0.00000 0.14483
|
|
multipole 304 298 293 0.11524
|
|
0.01748 0.00000 0.18372
|
|
0.01572
|
|
0.00000 -0.13911
|
|
-0.00351 0.00000 0.12339
|
|
multipole 305 306 310 -0.11970
|
|
-0.12748 0.00000 0.03261
|
|
0.65308
|
|
0.00000 -1.23647
|
|
-0.08490 0.00000 0.58339
|
|
multipole 306 311 305 0.26026
|
|
0.18047 0.00000 -0.06071
|
|
0.22206
|
|
0.00000 -0.68694
|
|
0.00805 0.00000 0.46488
|
|
multipole 307 306 308 -0.18804
|
|
0.05643 0.00000 0.09035
|
|
0.51668
|
|
0.00000 -1.31595
|
|
-0.14138 0.00000 0.79927
|
|
multipole 308 313 307 0.20160
|
|
0.08304 0.00000 -0.05600
|
|
0.14871
|
|
0.00000 -0.69528
|
|
-0.00421 0.00000 0.54657
|
|
multipole 309 308 310 -0.05028
|
|
0.13971 0.00000 0.11658
|
|
0.72742
|
|
0.00000 -1.30088
|
|
-0.08699 0.00000 0.57346
|
|
multipole 310 305 309 0.07568
|
|
0.05068 0.00000 0.30269
|
|
0.54514
|
|
0.00000 -1.07260
|
|
-0.06180 0.00000 0.52746
|
|
multipole 311 306 305 -0.42057
|
|
-0.00798 0.00000 0.50266
|
|
-0.76279
|
|
0.00000 -0.31846
|
|
0.04824 0.00000 1.08125
|
|
multipole 312 307 306 0.27376
|
|
0.00919 0.00000 0.09970
|
|
0.02355
|
|
0.00000 -0.12300
|
|
-0.00028 0.00000 0.09945
|
|
multipole 313 308 307 -0.38720
|
|
-0.00599 0.00000 0.48268
|
|
-0.77753
|
|
0.00000 -0.22144
|
|
0.03766 0.00000 0.99897
|
|
multipole 314 309 308 0.12060
|
|
0.01488 0.00000 0.14584
|
|
-0.00132
|
|
0.00000 -0.16042
|
|
-0.01362 0.00000 0.16174
|
|
multipole 315 310 305 0.11599
|
|
0.02971 0.00000 0.15040
|
|
-0.00005
|
|
0.00000 -0.14202
|
|
0.00241 0.00000 0.14207
|
|
multipole 316 378 317 -0.52467
|
|
0.48068 0.00000 -0.09996
|
|
0.36295
|
|
0.00000 -0.87560
|
|
-0.49890 0.00000 0.51265
|
|
multipole 317 320 318 0.05049
|
|
0.00000 0.00000 0.33253
|
|
-0.07256
|
|
0.00000 -0.07256
|
|
0.00000 0.00000 0.14512
|
|
multipole 318 317 319 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 319 317 318 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 320 325 321 0.10423
|
|
-0.13285 0.00000 0.29667
|
|
-0.05793
|
|
0.00000 0.00086
|
|
0.08206 0.00000 0.05707
|
|
multipole 321 320 322 0.13028
|
|
0.01734 0.00000 0.19825
|
|
-0.05326
|
|
0.00000 -0.01234
|
|
-0.00361 0.00000 0.06560
|
|
multipole 322 323 320 -0.40197
|
|
0.54028 0.00000 0.40904
|
|
0.35989
|
|
0.00000 -1.06741
|
|
-0.40034 0.00000 0.70752
|
|
multipole 323 324 327 0.06316
|
|
0.28383 0.00000 -0.13756
|
|
0.02849
|
|
0.00000 0.17299
|
|
0.01391 0.00000 -0.20148
|
|
multipole 324 323 322 0.18443
|
|
0.01626 0.00000 0.20540
|
|
-0.04301
|
|
0.00000 -0.01489
|
|
-0.01787 0.00000 0.05790
|
|
multipole 325 327 320 0.10143
|
|
-0.37871 0.00000 -0.13798
|
|
0.13330
|
|
0.00000 -0.04778
|
|
0.10936 0.00000 -0.08552
|
|
multipole 326 325 327 0.11227
|
|
-0.01614 0.00000 0.20173
|
|
-0.05953
|
|
0.00000 -0.00856
|
|
0.00915 0.00000 0.06809
|
|
multipole 327 329 328 0.06213
|
|
-0.32405 0.00000 -0.06050
|
|
-0.05803
|
|
0.00000 -0.15345
|
|
0.14580 0.00000 0.21148
|
|
multipole 328 327 329 0.11711
|
|
-0.00447 0.00000 0.19801
|
|
-0.00750
|
|
0.00000 -0.04433
|
|
-0.00421 0.00000 0.05183
|
|
multipole 329 327 330 -0.47891
|
|
0.13592 0.00000 0.42081
|
|
0.35793
|
|
0.00000 -1.07684
|
|
-0.39656 0.00000 0.71891
|
|
multipole 330 329 327 0.32469
|
|
0.02934 0.00000 0.13804
|
|
0.00130
|
|
0.00000 -0.09712
|
|
-0.01165 0.00000 0.09582
|
|
multipole 331 378 325 -0.53467
|
|
0.21061 0.00000 0.49486
|
|
0.30847
|
|
0.00000 -1.03109
|
|
-0.35505 0.00000 0.72262
|
|
multipole 332 378 333 -0.52467
|
|
0.48068 0.00000 -0.09996
|
|
0.36295
|
|
0.00000 -0.87560
|
|
-0.49890 0.00000 0.51265
|
|
multipole 333 336 334 0.05049
|
|
0.00000 0.00000 0.33253
|
|
-0.07256
|
|
0.00000 -0.07256
|
|
0.00000 0.00000 0.14512
|
|
multipole 334 333 335 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 335 333 334 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 336 341 337 0.10423
|
|
-0.13285 0.00000 0.29667
|
|
-0.05793
|
|
0.00000 0.00086
|
|
0.08206 0.00000 0.05707
|
|
multipole 337 336 338 0.13028
|
|
0.01734 0.00000 0.19825
|
|
-0.05326
|
|
0.00000 -0.01234
|
|
-0.00361 0.00000 0.06560
|
|
multipole 338 339 336 -0.40197
|
|
0.54028 0.00000 0.40904
|
|
0.35989
|
|
0.00000 -1.06741
|
|
-0.40034 0.00000 0.70752
|
|
multipole 339 340 343 0.06316
|
|
0.28383 0.00000 -0.13756
|
|
0.02849
|
|
0.00000 0.17299
|
|
0.01391 0.00000 -0.20148
|
|
multipole 340 339 338 0.18443
|
|
0.01626 0.00000 0.20540
|
|
-0.04301
|
|
0.00000 -0.01489
|
|
-0.01787 0.00000 0.05790
|
|
multipole 341 343 336 0.10143
|
|
-0.37871 0.00000 -0.13798
|
|
0.13330
|
|
0.00000 -0.04778
|
|
0.10936 0.00000 -0.08552
|
|
multipole 342 341 343 0.11227
|
|
-0.01614 0.00000 0.20173
|
|
-0.05953
|
|
0.00000 -0.00856
|
|
0.00915 0.00000 0.06809
|
|
multipole 343 345 344 0.06213
|
|
-0.32405 0.00000 -0.06050
|
|
-0.05803
|
|
0.00000 -0.15345
|
|
0.14580 0.00000 0.21148
|
|
multipole 344 343 345 0.11711
|
|
-0.00447 0.00000 0.19801
|
|
-0.00750
|
|
0.00000 -0.04433
|
|
-0.00421 0.00000 0.05183
|
|
multipole 345 343 346 -0.47891
|
|
0.13592 0.00000 0.42081
|
|
0.35793
|
|
0.00000 -1.07684
|
|
-0.39656 0.00000 0.71891
|
|
multipole 346 345 343 0.32469
|
|
0.02934 0.00000 0.13804
|
|
0.00130
|
|
0.00000 -0.09712
|
|
-0.01165 0.00000 0.09582
|
|
multipole 347 378 341 -0.53467
|
|
0.21061 0.00000 0.49486
|
|
0.30847
|
|
0.00000 -1.03109
|
|
-0.35505 0.00000 0.72262
|
|
multipole 348 390 349 -0.52467
|
|
0.48068 0.00000 -0.09996
|
|
0.36295
|
|
0.00000 -0.87560
|
|
-0.49890 0.00000 0.51265
|
|
multipole 349 352 350 0.00960
|
|
0.00000 0.00000 0.32394
|
|
-0.07147
|
|
0.00000 -0.07147
|
|
0.00000 0.00000 0.14294
|
|
multipole 350 349 351 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 351 349 350 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 352 353 357 0.15826
|
|
0.24623 0.00000 -0.21242
|
|
0.08205
|
|
0.00000 -0.00618
|
|
0.03696 0.00000 -0.07587
|
|
multipole 353 352 354 0.12800
|
|
0.02154 0.00000 0.20007
|
|
-0.05590
|
|
0.00000 -0.00935
|
|
-0.00576 0.00000 0.06525
|
|
multipole 354 355 352 -0.38842
|
|
0.55727 0.00000 0.37834
|
|
0.35493
|
|
0.00000 -1.07262
|
|
-0.43151 0.00000 0.71769
|
|
multipole 355 354 359 0.06720
|
|
0.26362 0.00000 0.03922
|
|
0.05443
|
|
0.00000 -0.09570
|
|
0.15343 0.00000 0.04127
|
|
multipole 356 355 354 0.12287
|
|
0.02353 0.00000 0.19270
|
|
-0.05515
|
|
0.00000 -0.01305
|
|
-0.02241 0.00000 0.06820
|
|
multipole 357 352 359 0.07060
|
|
0.28362 0.00000 0.21969
|
|
0.09901
|
|
0.00000 0.02642
|
|
0.14299 0.00000 -0.12543
|
|
multipole 358 357 352 0.10297
|
|
-0.00352 0.00000 0.21211
|
|
-0.04895
|
|
0.00000 -0.01013
|
|
-0.01963 0.00000 0.05908
|
|
multipole 359 357 355 -0.10232
|
|
0.30155 0.00000 0.23708
|
|
0.03425
|
|
0.00000 -0.14123
|
|
0.16905 0.00000 0.10698
|
|
multipole 360 359 357 0.10225
|
|
0.01188 0.00000 0.17915
|
|
-0.03150
|
|
0.00000 -0.06341
|
|
0.00371 0.00000 0.09491
|
|
multipole 361 359 357 0.09833
|
|
0.02571 0.00000 0.16920
|
|
-0.03368
|
|
0.00000 -0.08428
|
|
0.00819 0.00000 0.11796
|
|
multipole 362 390 357 -0.53467
|
|
0.48068 0.00000 -0.09996
|
|
0.36295
|
|
0.00000 -0.87560
|
|
-0.49890 0.00000 0.51265
|
|
multipole 363 390 364 -0.52467
|
|
0.48068 0.00000 -0.09996
|
|
0.36295
|
|
0.00000 -0.87560
|
|
-0.49890 0.00000 0.51265
|
|
multipole 364 367 365 0.00960
|
|
0.00000 0.00000 0.32394
|
|
-0.07147
|
|
0.00000 -0.07147
|
|
0.00000 0.00000 0.14294
|
|
multipole 365 364 366 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 366 364 365 0.07556
|
|
0.03873 0.00000 0.14751
|
|
-0.08294
|
|
0.00000 -0.01783
|
|
-0.01217 0.00000 0.10077
|
|
multipole 367 368 372 0.15826
|
|
0.24623 0.00000 -0.21242
|
|
0.08205
|
|
0.00000 -0.00618
|
|
0.03696 0.00000 -0.07587
|
|
multipole 368 367 369 0.12800
|
|
0.02154 0.00000 0.20007
|
|
-0.05590
|
|
0.00000 -0.00935
|
|
-0.00576 0.00000 0.06525
|
|
multipole 369 370 367 -0.38842
|
|
0.55727 0.00000 0.37834
|
|
0.35493
|
|
0.00000 -1.07262
|
|
-0.43151 0.00000 0.71769
|
|
multipole 370 369 374 0.06720
|
|
0.26362 0.00000 0.03922
|
|
0.05443
|
|
0.00000 -0.09570
|
|
0.15343 0.00000 0.04127
|
|
multipole 371 370 369 0.12287
|
|
0.02353 0.00000 0.19270
|
|
-0.05515
|
|
0.00000 -0.01305
|
|
-0.02241 0.00000 0.06820
|
|
multipole 372 367 374 0.07060
|
|
0.28362 0.00000 0.21969
|
|
0.09901
|
|
0.00000 0.02642
|
|
0.14299 0.00000 -0.12543
|
|
multipole 373 372 367 0.10297
|
|
-0.00352 0.00000 0.21211
|
|
-0.04895
|
|
0.00000 -0.01013
|
|
-0.01963 0.00000 0.05908
|
|
multipole 374 372 370 -0.10232
|
|
0.30155 0.00000 0.23708
|
|
0.03425
|
|
0.00000 -0.14123
|
|
0.16905 0.00000 0.10698
|
|
multipole 375 374 372 0.10225
|
|
0.01188 0.00000 0.17915
|
|
-0.03150
|
|
0.00000 -0.06341
|
|
0.00371 0.00000 0.09491
|
|
multipole 376 374 372 0.09833
|
|
0.02571 0.00000 0.16920
|
|
-0.03368
|
|
0.00000 -0.08428
|
|
0.00819 0.00000 0.11796
|
|
multipole 377 390 372 -0.53467
|
|
0.48068 0.00000 -0.09996
|
|
0.36295
|
|
0.00000 -0.87560
|
|
-0.49890 0.00000 0.51265
|
|
multipole 378 379 -379 0.90070
|
|
0.00000 0.00000 -0.38892
|
|
0.04278
|
|
0.00000 0.04278
|
|
0.00000 0.00000 -0.08556
|
|
multipole 379 378 379 -0.62196
|
|
-0.02485 0.00000 0.23676
|
|
-0.53745
|
|
0.00000 -0.44509
|
|
-0.09945 0.00000 0.98254
|
|
multipole 380 317 381 -0.53491
|
|
0.20945 0.00000 0.45595
|
|
0.31894
|
|
0.00000 -0.99741
|
|
-0.33409 0.00000 0.67847
|
|
multipole 380 333 381 -0.53491
|
|
0.20945 0.00000 0.45595
|
|
0.31894
|
|
0.00000 -0.99741
|
|
-0.33409 0.00000 0.67847
|
|
multipole 381 380 333 0.34636
|
|
0.05168 0.00000 0.21326
|
|
-0.04514
|
|
0.00000 -0.08116
|
|
-0.01807 0.00000 0.12630
|
|
multipole 381 380 317 0.34636
|
|
0.05168 0.00000 0.21326
|
|
-0.04514
|
|
0.00000 -0.08116
|
|
-0.01807 0.00000 0.12630
|
|
multipole 382 383 317 -0.58166
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 382 383 333 -0.58166
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 383 382 384 1.02369
|
|
0.00000 0.00000 -0.21311
|
|
-0.08100
|
|
0.00000 -0.08100
|
|
0.00000 0.00000 0.16200
|
|
multipole 384 383 382 -0.87686
|
|
-0.08747 0.00000 0.03991
|
|
-0.45917
|
|
0.00000 -0.64191
|
|
0.17008 0.00000 1.10108
|
|
multipole 385 325 386 -0.50819
|
|
0.18120 0.00000 0.42418
|
|
0.28893
|
|
0.00000 -1.01628
|
|
-0.48824 0.00000 0.72735
|
|
multipole 385 341 386 -0.50819
|
|
0.18120 0.00000 0.42418
|
|
0.28893
|
|
0.00000 -1.01628
|
|
-0.48824 0.00000 0.72735
|
|
multipole 386 385 325 0.29418
|
|
0.02971 0.00000 0.13453
|
|
-0.01165
|
|
0.00000 -0.09373
|
|
0.01341 0.00000 0.10538
|
|
multipole 386 385 341 0.29418
|
|
0.02971 0.00000 0.13453
|
|
-0.01165
|
|
0.00000 -0.09373
|
|
0.01341 0.00000 0.10538
|
|
multipole 387 388 325 -0.60712
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 387 388 341 -0.60712
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 388 387 389 1.02369
|
|
0.00000 0.00000 -0.21311
|
|
-0.08100
|
|
0.00000 -0.08100
|
|
0.00000 0.00000 0.16200
|
|
multipole 389 388 387 -0.87686
|
|
-0.08747 0.00000 0.03991
|
|
-0.45917
|
|
0.00000 -0.64191
|
|
0.17008 0.00000 1.10108
|
|
multipole 390 -391 -391 0.90070
|
|
0.00000 0.00000 -0.38892
|
|
0.04278
|
|
0.00000 0.04278
|
|
0.00000 0.00000 -0.08556
|
|
multipole 391 390 391 -0.62196
|
|
-0.02485 0.00000 0.23676
|
|
-0.53745
|
|
0.00000 -0.44509
|
|
-0.09945 0.00000 0.98254
|
|
multipole 392 349 393 -0.53491
|
|
0.20945 0.00000 0.45595
|
|
0.31894
|
|
0.00000 -0.99741
|
|
-0.33409 0.00000 0.67847
|
|
multipole 392 364 393 -0.53491
|
|
0.20945 0.00000 0.45595
|
|
0.31894
|
|
0.00000 -0.99741
|
|
-0.33409 0.00000 0.67847
|
|
multipole 393 392 349 0.34636
|
|
0.05168 0.00000 0.21326
|
|
-0.04514
|
|
0.00000 -0.08116
|
|
-0.01807 0.00000 0.12630
|
|
multipole 393 392 364 0.34636
|
|
0.05168 0.00000 0.21326
|
|
-0.04514
|
|
0.00000 -0.08116
|
|
-0.01807 0.00000 0.12630
|
|
multipole 394 395 349 -0.58166
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 394 395 364 -0.58166
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 395 394 396 1.02369
|
|
0.00000 0.00000 -0.21311
|
|
-0.08100
|
|
0.00000 -0.08100
|
|
0.00000 0.00000 0.16200
|
|
multipole 396 395 394 -0.87686
|
|
-0.08747 0.00000 0.03991
|
|
-0.45917
|
|
0.00000 -0.64191
|
|
0.17008 0.00000 1.10108
|
|
multipole 397 357 398 -0.50819
|
|
0.18120 0.00000 0.42418
|
|
0.28893
|
|
0.00000 -1.01628
|
|
-0.48824 0.00000 0.72735
|
|
multipole 397 372 398 -0.50819
|
|
0.18120 0.00000 0.42418
|
|
0.28893
|
|
0.00000 -1.01628
|
|
-0.48824 0.00000 0.72735
|
|
multipole 398 397 357 0.29418
|
|
0.02971 0.00000 0.13453
|
|
-0.01165
|
|
0.00000 -0.09373
|
|
0.01341 0.00000 0.10538
|
|
multipole 398 397 372 0.29418
|
|
0.02971 0.00000 0.13453
|
|
-0.01165
|
|
0.00000 -0.09373
|
|
0.01341 0.00000 0.10538
|
|
multipole 399 400 357 -0.60712
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 399 400 372 -0.60712
|
|
0.26215 0.00000 0.04328
|
|
0.24279
|
|
0.00000 -0.44387
|
|
-0.22260 0.00000 0.20108
|
|
multipole 400 399 401 1.02369
|
|
0.00000 0.00000 -0.21311
|
|
-0.08100
|
|
0.00000 -0.08100
|
|
0.00000 0.00000 0.16200
|
|
multipole 401 400 399 -0.87686
|
|
-0.08747 0.00000 0.03991
|
|
-0.45917
|
|
0.00000 -0.64191
|
|
0.17008 0.00000 1.10108
|
|
multipole 402 -403 -403 -0.51966
|
|
0.00000 0.00000 0.14279
|
|
0.37928
|
|
0.00000 -0.41809
|
|
0.00000 0.00000 0.03881
|
|
multipole 403 402 403 0.25983
|
|
-0.03859 0.00000 -0.05818
|
|
-0.03673
|
|
0.00000 -0.10739
|
|
-0.00203 0.00000 0.14412
|
|
multipole 404 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 405 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 406 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 407 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 408 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 409 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 410 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 411 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 412 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 413 0 0 -1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 414 0 0 -1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 415 0 0 -1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 416 0 0 -1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
|
|
|
|
########################################
|
|
## ##
|
|
## Dipole Polarizability Parameters ##
|
|
## ##
|
|
########################################
|
|
|
|
|
|
polarize 1 1.0730 0.3900 3 4 9 55 226 247
|
|
polarize 2 1.3340 0.3900 6
|
|
polarize 3 1.3340 0.3900 1 5 7 53 228 230
|
|
polarize 4 0.4960 0.3900 1
|
|
polarize 5 0.8370 0.3900 3
|
|
polarize 6 0.4960 0.3900 2
|
|
polarize 7 1.0730 0.3900 3 9 10 55 226 247
|
|
polarize 8 1.3340 0.3900 12
|
|
polarize 9 1.3340 0.3900 1 7 11 53 228 230
|
|
polarize 10 0.4960 0.3900 7
|
|
polarize 11 0.8370 0.3900 9
|
|
polarize 12 0.4960 0.3900 8 33 44
|
|
polarize 13 1.3340 0.3900 14
|
|
polarize 14 0.4960 0.3900 13
|
|
polarize 15 1.3340 0.3900 16
|
|
polarize 16 0.4960 0.3900 15
|
|
polarize 17 1.3340 0.3900 18
|
|
polarize 18 0.4960 0.3900 17
|
|
polarize 19 1.3340 0.3900 20
|
|
polarize 20 0.4960 0.3900 19
|
|
polarize 21 1.3340 0.3900 22
|
|
polarize 22 0.4960 0.3900 21
|
|
polarize 23 1.3340 0.3900 24
|
|
polarize 24 0.4960 0.3900 23
|
|
polarize 25 1.3340 0.3900 26
|
|
polarize 26 0.4960 0.3900 25
|
|
polarize 27 1.3340 0.3900 28
|
|
polarize 28 0.4960 0.3900 27
|
|
polarize 29 1.3340 0.3900 30
|
|
polarize 30 0.4960 0.3900 29
|
|
polarize 31 1.3340 0.3900 32
|
|
polarize 32 0.4960 0.3900 31
|
|
polarize 33 1.3340 0.3900 12
|
|
polarize 34 1.3340 0.3900 35 36
|
|
polarize 35 0.4960 0.3900 34
|
|
polarize 36 0.8340 0.3900 34 37
|
|
polarize 37 0.4960 0.3900 36
|
|
polarize 38 1.3340 0.3900 39 42
|
|
polarize 39 0.4960 0.3900 38
|
|
polarize 40 1.3340 0.3900 41
|
|
polarize 41 0.4960 0.3900 40
|
|
polarize 42 0.8340 0.3900 38 43
|
|
polarize 43 0.4960 0.3900 42
|
|
polarize 44 1.3340 0.3900 12
|
|
polarize 45 1.3340 0.3900 46 47 49
|
|
polarize 46 0.4960 0.3900 45
|
|
polarize 47 3.3000 0.3900 45 48
|
|
polarize 48 0.4960 0.3900 47
|
|
polarize 49 3.3000 0.3900 45 49
|
|
polarize 50 1.3340 0.3900 51 52
|
|
polarize 51 0.4960 0.3900 50
|
|
polarize 52 3.3000 0.3900 50
|
|
polarize 53 1.0730 0.3900 3 9 55 62 226 247
|
|
polarize 54 1.3340 0.3900 57
|
|
polarize 55 1.3340 0.3900 1 7 53 56 228 230
|
|
polarize 56 0.8370 0.3900 55
|
|
polarize 57 0.4960 0.3900 54
|
|
polarize 58 1.3340 0.3900 59
|
|
polarize 59 0.4960 0.3900 58
|
|
polarize 60 1.3340 0.3900 61
|
|
polarize 61 0.4960 0.3900 60
|
|
polarize 62 1.3340 0.3900 53 63
|
|
polarize 63 0.4960 0.3900 62
|
|
polarize 64 1.3340 0.3900 65
|
|
polarize 65 0.4960 0.3900 64
|
|
polarize 66 1.7500 0.3900 67
|
|
polarize 67 1.7500 0.3900 66 68 69
|
|
polarize 68 0.6960 0.3900 67
|
|
polarize 69 1.7500 0.3900 67 70 71
|
|
polarize 70 0.6960 0.3900 69
|
|
polarize 71 1.7500 0.3900 69 72
|
|
polarize 72 0.6960 0.3900 71
|
|
polarize 73 1.3340 0.3900 74
|
|
polarize 74 0.4960 0.3900 73
|
|
polarize 75 1.7500 0.3900 76
|
|
polarize 76 1.7500 0.3900 75 77 78
|
|
polarize 77 0.6960 0.3900 76
|
|
polarize 78 1.7500 0.3900 76 79 80
|
|
polarize 79 0.6960 0.3900 78
|
|
polarize 80 1.7500 0.3900 78 81
|
|
polarize 81 0.8730 0.3900 80 82
|
|
polarize 82 0.4960 0.3900 81
|
|
polarize 83 1.3340 0.3900 84
|
|
polarize 84 0.4960 0.3900 83
|
|
polarize 85 1.7500 0.3900 86
|
|
polarize 86 1.7500 0.3900 85 87 88
|
|
polarize 87 0.6960 0.3900 86
|
|
polarize 88 1.7500 0.3900 86 89 90
|
|
polarize 89 0.6960 0.3900 88
|
|
polarize 90 1.7500 0.3900 88 91
|
|
polarize 91 0.8370 0.3900 90
|
|
polarize 92 1.3340 0.3900 93
|
|
polarize 93 0.4960 0.3900 92
|
|
polarize 94 1.7500 0.3900 95 97
|
|
polarize 95 1.7500 0.3900 94 96 98
|
|
polarize 96 0.6960 0.3900 95
|
|
polarize 97 1.7500 0.3900 94 100 101
|
|
polarize 98 1.0730 0.3900 95 99 100
|
|
polarize 99 0.4960 0.3900 98
|
|
polarize 100 1.7500 0.3900 97 98 103
|
|
polarize 101 1.7500 0.3900 97 102 105
|
|
polarize 102 0.6960 0.3900 101
|
|
polarize 103 1.7500 0.3900 100 104 107
|
|
polarize 104 0.6960 0.3900 103
|
|
polarize 105 1.7500 0.3900 101 106 107
|
|
polarize 106 0.6960 0.3900 105
|
|
polarize 107 1.7500 0.3900 103 105 108
|
|
polarize 108 0.6960 0.3900 107
|
|
polarize 109 1.3340 0.3900 110
|
|
polarize 110 0.4960 0.3900 109
|
|
polarize 111 1.7500 0.3900 112 114
|
|
polarize 112 1.0730 0.3900 111 113 116
|
|
polarize 113 0.4960 0.3900 112
|
|
polarize 114 1.7500 0.3900 111 115 118
|
|
polarize 115 0.6960 0.3900 114
|
|
polarize 116 1.7500 0.3900 112 117 118
|
|
polarize 117 0.6960 0.3900 116
|
|
polarize 118 1.0730 0.3900 114 116 119
|
|
polarize 119 0.4960 0.3900 118
|
|
polarize 120 1.3340 0.3900 121
|
|
polarize 121 0.4960 0.3900 120
|
|
polarize 122 1.7500 0.3900 123 125
|
|
polarize 123 1.0730 0.3900 122 124 127
|
|
polarize 124 0.4960 0.3900 123
|
|
polarize 125 1.7500 0.3900 122 126 129
|
|
polarize 126 0.6960 0.3900 125
|
|
polarize 127 1.7500 0.3900 123 128 129
|
|
polarize 128 0.6960 0.3900 127
|
|
polarize 129 1.0730 0.3900 125 127
|
|
polarize 130 1.3340 0.3900 131
|
|
polarize 131 0.4960 0.3900 130
|
|
polarize 132 1.7500 0.3900 133 134
|
|
polarize 133 1.0730 0.3900 132 136
|
|
polarize 134 1.7500 0.3900 132 135 138
|
|
polarize 135 0.6960 0.3900 134
|
|
polarize 136 1.7500 0.3900 133 137 138
|
|
polarize 137 0.6960 0.3900 136
|
|
polarize 138 1.0730 0.3900 134 136 139
|
|
polarize 139 0.4960 0.3900 138
|
|
polarize 140 1.3340 0.3900 141
|
|
polarize 141 0.4960 0.3900 140
|
|
polarize 142 1.3340 0.3900 143
|
|
polarize 143 0.8370 0.3900 142
|
|
polarize 144 1.3340 0.3900 145
|
|
polarize 145 0.4960 0.3900 144
|
|
polarize 146 1.3340 0.3900 147 148
|
|
polarize 147 0.8370 0.3900 146
|
|
polarize 148 0.8370 0.3900 146 149
|
|
polarize 149 0.4960 0.3900 148
|
|
polarize 150 1.3340 0.3900 151
|
|
polarize 151 0.4960 0.3900 150
|
|
polarize 152 1.3340 0.3900 153 154
|
|
polarize 153 0.8340 0.3900 152
|
|
polarize 154 1.0730 0.3900 152 155
|
|
polarize 155 0.4960 0.3900 154
|
|
polarize 156 1.3340 0.3900 157
|
|
polarize 157 0.4960 0.3900 156
|
|
polarize 158 1.3340 0.3900 159
|
|
polarize 159 0.4960 0.3900 158
|
|
polarize 160 1.3340 0.3900 161
|
|
polarize 161 0.8370 0.3900 160
|
|
polarize 162 1.3340 0.3900 163
|
|
polarize 163 0.4960 0.3900 162
|
|
polarize 164 1.3340 0.3900 165
|
|
polarize 165 0.4960 0.3900 164
|
|
polarize 166 1.3340 0.3900 167 168
|
|
polarize 167 0.8370 0.3900 166
|
|
polarize 168 0.8370 0.3900 166 169
|
|
polarize 169 0.4960 0.3900 168
|
|
polarize 170 1.3340 0.3900 171
|
|
polarize 171 0.4960 0.3900 170
|
|
polarize 172 1.3340 0.3900 173
|
|
polarize 173 0.4960 0.3900 172
|
|
polarize 174 1.3340 0.3900 175 176
|
|
polarize 175 0.8340 0.3900 174
|
|
polarize 176 1.0730 0.3900 174 177
|
|
polarize 177 0.4960 0.3900 176
|
|
polarize 178 1.3340 0.3900 179
|
|
polarize 179 0.4960 0.3900 178
|
|
polarize 180 1.3340 0.3900 181 182
|
|
polarize 181 0.4960 0.3900 180
|
|
polarize 182 3.3000 0.3900 180 183
|
|
polarize 183 1.3340 0.3900 182 184
|
|
polarize 184 0.4960 0.3900 183
|
|
polarize 185 1.3340 0.3900 186
|
|
polarize 186 0.4960 0.3900 185
|
|
polarize 187 1.3340 0.3900 188
|
|
polarize 188 0.4960 0.3900 187
|
|
polarize 189 1.3340 0.3900 190
|
|
polarize 190 0.4960 0.3900 189
|
|
polarize 191 1.3340 0.3900 192
|
|
polarize 192 0.4960 0.3900 191
|
|
polarize 193 1.0730 0.3900 194
|
|
polarize 195 1.3340 0.3900 196
|
|
polarize 196 0.4960 0.3900 195
|
|
polarize 197 1.3340 0.3900 198
|
|
polarize 198 0.4960 0.3900 197
|
|
polarize 194 0.4960 0.3900 193
|
|
polarize 199 1.3340 0.3900 200
|
|
polarize 200 0.4960 0.3900 199
|
|
polarize 201 1.3340 0.3900 202 203
|
|
polarize 202 0.4960 0.3900 201
|
|
polarize 203 1.0730 0.3900 201 204
|
|
polarize 204 0.4960 0.3900 203
|
|
polarize 205 1.3340 0.3900 206
|
|
polarize 206 0.4960 0.3900 205
|
|
polarize 207 1.3340 0.3900 208
|
|
polarize 208 0.4960 0.3900 207
|
|
polarize 209 1.3340 0.3900 210 211
|
|
polarize 210 0.4960 0.3900 209
|
|
polarize 211 1.0730 0.3900 209 212 213
|
|
polarize 212 0.4960 0.3900 211
|
|
polarize 213 1.3340 0.3900 211 214
|
|
polarize 214 1.0730 0.3900 213 215
|
|
polarize 215 0.4960 0.3900 214
|
|
polarize 216 1.3340 0.3900 217
|
|
polarize 217 0.4960 0.3900 216
|
|
polarize 218 1.3340 0.3900 219
|
|
polarize 219 0.4960 0.3900 218
|
|
polarize 220 1.3340 0.3900 221
|
|
polarize 221 0.4960 0.3900 220
|
|
polarize 222 1.0730 0.3900 223
|
|
polarize 223 0.4960 0.3900 222
|
|
polarize 224 1.3340 0.3900 225
|
|
polarize 225 0.4960 0.3900 224
|
|
polarize 226 1.3340 0.3900 1 7 53 227
|
|
polarize 227 0.8370 0.3900 226
|
|
polarize 228 1.0730 0.3900 3 9 55 229 247
|
|
polarize 229 0.4960 0.3900 228
|
|
polarize 230 1.0730 0.3900 3 9 55 231 247
|
|
polarize 231 0.4960 0.3900 230
|
|
polarize 232 1.3340 0.3900 233
|
|
polarize 233 0.4960 0.3900 232
|
|
polarize 234 1.0730 0.3900 235
|
|
polarize 235 0.4960 0.3900 234
|
|
polarize 236 1.0730 0.3900 237
|
|
polarize 237 0.4960 0.3900 236
|
|
polarize 238 1.3340 0.3900 239
|
|
polarize 239 0.8370 0.3900 238
|
|
polarize 240 1.3340 0.3900 241 242
|
|
polarize 241 0.8370 0.3900 240
|
|
polarize 242 0.8370 0.3900 240 243
|
|
polarize 243 0.4960 0.3900 242
|
|
polarize 244 1.0730 0.3900 245
|
|
polarize 245 0.4960 0.3900 244
|
|
polarize 246 1.3340 0.3900 249
|
|
polarize 247 1.3340 0.3900 1 7 53 228 230 248
|
|
polarize 248 0.8370 0.3900 247
|
|
polarize 249 0.4960 0.3900 246
|
|
polarize 250 1.3340 0.3900 251
|
|
polarize 251 0.4960 0.3900 250
|
|
polarize 252 1.0730 0.3900 253 256
|
|
polarize 253 1.7500 0.3900 252 254 257
|
|
polarize 254 1.7500 0.3900 253 255 260
|
|
polarize 255 1.0730 0.3900 254 256
|
|
polarize 256 1.7500 0.3900 252 255 265
|
|
polarize 257 1.0730 0.3900 253 258
|
|
polarize 258 1.7500 0.3900 257 259 261
|
|
polarize 259 1.0730 0.3900 258 260
|
|
polarize 260 1.7500 0.3900 254 259
|
|
polarize 261 0.6960 0.3900 258
|
|
polarize 262 1.0730 0.3900 263 264
|
|
polarize 263 0.4960 0.3900 262
|
|
polarize 264 0.4960 0.3900 262
|
|
polarize 265 0.6960 0.3900 256
|
|
polarize 266 1.0730 0.3900 267 271
|
|
polarize 267 1.7500 0.3900 266 268 272
|
|
polarize 268 1.0730 0.3900 267 269
|
|
polarize 269 1.7500 0.3900 268 270
|
|
polarize 270 1.7500 0.3900 269 271 276
|
|
polarize 271 1.7500 0.3900 266 270 277
|
|
polarize 272 0.8370 0.3900 267
|
|
polarize 273 1.0730 0.3900 274 275
|
|
polarize 274 0.4960 0.3900 273
|
|
polarize 275 0.4960 0.3900 273
|
|
polarize 276 0.6960 0.3900 270
|
|
polarize 277 0.6960 0.3900 271
|
|
polarize 278 1.0730 0.3900 279 282
|
|
polarize 279 1.7500 0.3900 278 280 283
|
|
polarize 280 1.7500 0.3900 279 281 286
|
|
polarize 281 1.0730 0.3900 280 282
|
|
polarize 282 1.7500 0.3900 278 281 292
|
|
polarize 283 1.0730 0.3900 279 284
|
|
polarize 284 1.7500 0.3900 283 285
|
|
polarize 285 1.0730 0.3900 284 286 287
|
|
polarize 286 1.7500 0.3900 280 285 291
|
|
polarize 287 0.6960 0.3900 285
|
|
polarize 288 1.0730 0.3900 289 290
|
|
polarize 289 0.4960 0.3900 288
|
|
polarize 290 0.4960 0.3900 288
|
|
polarize 291 0.8370 0.3900 286
|
|
polarize 292 0.6960 0.3900 282
|
|
polarize 293 1.0730 0.3900 294 298
|
|
polarize 294 1.7500 0.3900 293 295 299
|
|
polarize 295 1.0730 0.3900 294 296 300
|
|
polarize 296 1.7500 0.3900 295 297 301
|
|
polarize 297 1.7500 0.3900 296 298
|
|
polarize 298 1.7500 0.3900 293 297 304
|
|
polarize 299 0.8370 0.3900 294
|
|
polarize 300 0.6960 0.3900 295
|
|
polarize 301 0.8370 0.3900 296
|
|
polarize 302 1.3340 0.3900 303
|
|
polarize 303 0.4960 0.3900 302
|
|
polarize 304 0.6960 0.3900 298
|
|
polarize 305 1.0730 0.3900 306 310
|
|
polarize 306 1.7500 0.3900 305 307 311
|
|
polarize 307 1.0730 0.3900 306 308 312
|
|
polarize 308 1.7500 0.3900 307 309 313
|
|
polarize 309 1.7500 0.3900 308 310 314
|
|
polarize 310 1.7500 0.3900 305 309 315
|
|
polarize 311 0.8370 0.3900 306
|
|
polarize 312 0.4960 0.3900 307
|
|
polarize 313 0.8370 0.3900 308
|
|
polarize 314 0.6960 0.3900 309
|
|
polarize 315 0.6960 0.3900 310
|
|
polarize 316 0.8370 0.3900 378
|
|
polarize 317 1.3340 0.3900 318 319
|
|
polarize 318 0.4960 0.3900 317
|
|
polarize 319 0.4960 0.3900 317
|
|
polarize 320 1.3340 0.3900 321
|
|
polarize 321 0.4960 0.3900 320
|
|
polarize 322 0.8370 0.3900
|
|
polarize 323 1.3340 0.3900 324
|
|
polarize 324 0.4960 0.3900 323
|
|
polarize 325 1.3340 0.3900 326
|
|
polarize 326 0.4960 0.3900 325
|
|
polarize 327 1.3340 0.3900 328 329 330
|
|
polarize 328 0.4960 0.3900 327
|
|
polarize 329 1.3340 0.3900 327 330
|
|
polarize 330 0.4960 0.3900 329
|
|
polarize 331 0.8370 0.3900 378
|
|
polarize 332 0.8370 0.3900 378
|
|
polarize 333 1.3340 0.3900 334 335
|
|
polarize 334 0.4960 0.3900 333
|
|
polarize 335 0.4960 0.3900 333
|
|
polarize 336 1.3340 0.3900 337
|
|
polarize 337 0.4960 0.3900 336
|
|
polarize 338 0.8370 0.3900
|
|
polarize 339 1.3340 0.3900 340
|
|
polarize 340 0.4960 0.3900 339
|
|
polarize 341 1.3340 0.3900 342
|
|
polarize 342 0.4960 0.3900 341
|
|
polarize 343 1.3340 0.3900 344 345 346
|
|
polarize 344 0.4960 0.3900 343
|
|
polarize 345 1.3340 0.3900 343 346
|
|
polarize 346 0.4960 0.3900 345
|
|
polarize 347 0.8370 0.3900 378
|
|
polarize 348 0.8370 0.3900 390
|
|
polarize 349 1.3340 0.3900 350 351
|
|
polarize 350 0.4960 0.3900 349
|
|
polarize 351 0.4960 0.3900 349
|
|
polarize 352 1.3340 0.3900 353
|
|
polarize 353 0.4960 0.3900 352
|
|
polarize 354 0.8370 0.3900
|
|
polarize 355 1.3340 0.3900 356
|
|
polarize 356 0.4960 0.3900 355
|
|
polarize 357 1.3340 0.3900 358
|
|
polarize 358 0.4960 0.3900 357
|
|
polarize 359 1.3340 0.3900 360 361
|
|
polarize 360 0.4960 0.3900 359
|
|
polarize 361 0.4960 0.3900 359
|
|
polarize 362 0.8370 0.3900 390
|
|
polarize 363 0.8370 0.3900 390
|
|
polarize 364 1.3340 0.3900 365 366
|
|
polarize 365 0.4960 0.3900 364
|
|
polarize 366 0.4960 0.3900 364
|
|
polarize 367 1.3340 0.3900 368
|
|
polarize 368 0.4960 0.3900 367
|
|
polarize 369 0.8370 0.3900
|
|
polarize 370 1.3340 0.3900 371
|
|
polarize 371 0.4960 0.3900 370
|
|
polarize 372 1.3340 0.3900 373
|
|
polarize 373 0.4960 0.3900 372
|
|
polarize 374 1.3340 0.3900 375 376
|
|
polarize 375 0.4960 0.3900 374
|
|
polarize 376 0.4960 0.3900 374
|
|
polarize 377 0.8370 0.3900 390
|
|
polarize 378 1.8280 0.3900 316 331 332 347 379
|
|
polarize 379 0.8370 0.3900 378
|
|
polarize 380 0.8370 0.3900 381
|
|
polarize 381 0.4960 0.3900 380
|
|
polarize 382 0.8370 0.3900
|
|
polarize 383 1.8280 0.3900 384
|
|
polarize 384 0.8370 0.3900 383
|
|
polarize 385 0.8370 0.3900 386
|
|
polarize 386 0.4960 0.3900 385
|
|
polarize 387 0.8370 0.3900
|
|
polarize 388 1.8280 0.3900 389
|
|
polarize 389 0.8370 0.3900 388
|
|
polarize 390 1.8280 0.3900 348 362 363 377 391
|
|
polarize 391 0.8370 0.3900 390
|
|
polarize 392 0.8370 0.3900 393
|
|
polarize 393 0.4960 0.3900 392
|
|
polarize 394 0.8370 0.3900
|
|
polarize 395 1.8280 0.3900 396
|
|
polarize 396 0.8370 0.3900 395
|
|
polarize 397 0.8370 0.3900 398
|
|
polarize 398 0.4960 0.3900 397
|
|
polarize 399 0.8370 0.3900
|
|
polarize 400 1.8280 0.3900 401
|
|
polarize 401 0.8370 0.3900 400
|
|
polarize 402 0.8370 0.3900 403
|
|
polarize 403 0.4960 0.3900 402
|
|
polarize 404 0.0280 0.3900
|
|
polarize 405 0.1200 0.3900
|
|
polarize 406 0.7800 0.3900
|
|
polarize 407 1.3500 0.3900
|
|
polarize 408 2.2600 0.3900
|
|
polarize 409 0.0100 0.0650
|
|
polarize 410 0.0800 0.0952
|
|
polarize 411 0.5500 0.1585
|
|
polarize 412 0.2600 0.2096
|
|
polarize 413 1.3500 0.3900
|
|
polarize 414 4.0000 0.3900
|
|
polarize 415 5.6500 0.3900
|
|
polarize 416 7.2500 0.3900
|
|
|
|
|
|
########################################
|
|
## ##
|
|
## Biopolymer Atom Type Conversions ##
|
|
## ##
|
|
########################################
|
|
|
|
|
|
biotype 1 N "Glycine" 1
|
|
biotype 2 CA "Glycine" 2
|
|
biotype 3 C "Glycine" 3
|
|
biotype 4 HN "Glycine" 4
|
|
biotype 5 O "Glycine" 5
|
|
biotype 6 HA "Glycine" 6
|
|
biotype 7 N "Alanine" 7
|
|
biotype 8 CA "Alanine" 8
|
|
biotype 9 C "Alanine" 9
|
|
biotype 10 HN "Alanine" 10
|
|
biotype 11 O "Alanine" 11
|
|
biotype 12 HA "Alanine" 12
|
|
biotype 13 CB "Alanine" 13
|
|
biotype 14 HB "Alanine" 14
|
|
biotype 15 N "Valine" 7
|
|
biotype 16 CA "Valine" 8
|
|
biotype 17 C "Valine" 9
|
|
biotype 18 HN "Valine" 10
|
|
biotype 19 O "Valine" 11
|
|
biotype 20 HA "Valine" 12
|
|
biotype 21 CB "Valine" 15
|
|
biotype 22 HB "Valine" 16
|
|
biotype 23 CG1 "Valine" 17
|
|
biotype 24 HG1 "Valine" 18
|
|
biotype 25 CG2 "Valine" 17
|
|
biotype 26 HG2 "Valine" 18
|
|
biotype 27 N "Leucine" 7
|
|
biotype 28 CA "Leucine" 8
|
|
biotype 29 C "Leucine" 9
|
|
biotype 30 HN "Leucine" 10
|
|
biotype 31 O "Leucine" 11
|
|
biotype 32 HA "Leucine" 12
|
|
biotype 33 CB "Leucine" 19
|
|
biotype 34 HB "Leucine" 20
|
|
biotype 35 CG "Leucine" 21
|
|
biotype 36 HG "Leucine" 22
|
|
biotype 37 CD1 "Leucine" 23
|
|
biotype 38 HD1 "Leucine" 24
|
|
biotype 39 CD2 "Leucine" 23
|
|
biotype 40 HD2 "Leucine" 24
|
|
biotype 41 N "Isoleucine" 7
|
|
biotype 42 CA "Isoleucine" 8
|
|
biotype 43 C "Isoleucine" 9
|
|
biotype 44 HN "Isoleucine" 10
|
|
biotype 45 O "Isoleucine" 11
|
|
biotype 46 HA "Isoleucine" 12
|
|
biotype 47 CB "Isoleucine" 25
|
|
biotype 48 HB "Isoleucine" 26
|
|
biotype 49 CG1 "Isoleucine" 29
|
|
biotype 50 HG1 "Isoleucine" 30
|
|
biotype 51 CG2 "Isoleucine" 27
|
|
biotype 52 HG2 "Isoleucine" 28
|
|
biotype 53 CD "Isoleucine" 31
|
|
biotype 54 HD "Isoleucine" 32
|
|
biotype 55 N "Serine" 7
|
|
biotype 56 CA "Serine" 33
|
|
biotype 57 C "Serine" 9
|
|
biotype 58 HN "Serine" 10
|
|
biotype 59 O "Serine" 11
|
|
biotype 60 HA "Serine" 12
|
|
biotype 61 CB "Serine" 34
|
|
biotype 62 HB "Serine" 35
|
|
biotype 63 OG "Serine" 36
|
|
biotype 64 HG "Serine" 37
|
|
biotype 65 N "Threonine" 7
|
|
biotype 66 CA "Threonine" 33
|
|
biotype 67 C "Threonine" 9
|
|
biotype 68 HN "Threonine" 10
|
|
biotype 69 O "Threonine" 11
|
|
biotype 70 HA "Threonine" 12
|
|
biotype 71 CB "Threonine" 38
|
|
biotype 72 HB "Threonine" 39
|
|
biotype 73 OG1 "Threonine" 42
|
|
biotype 74 HG1 "Threonine" 43
|
|
biotype 75 CG2 "Threonine" 40
|
|
biotype 76 HG2 "Threonine" 41
|
|
biotype 77 N "Cysteine (SH)" 7
|
|
biotype 78 CA "Cysteine (SH)" 44
|
|
biotype 79 C "Cysteine (SH)" 9
|
|
biotype 80 HN "Cysteine (SH)" 10
|
|
biotype 81 O "Cysteine (SH)" 11
|
|
biotype 82 HA "Cysteine (SH)" 12
|
|
biotype 83 CB "Cysteine (SH)" 45
|
|
biotype 84 HB "Cysteine (SH)" 46
|
|
biotype 85 SG "Cysteine (SH)" 47
|
|
biotype 86 HG "Cysteine (SH)" 48
|
|
biotype 87 N "Cystine (SS)" 7
|
|
biotype 88 CA "Cystine (SS)" 44
|
|
biotype 89 C "Cystine (SS)" 9
|
|
biotype 90 HN "Cystine (SS)" 10
|
|
biotype 91 O "Cystine (SS)" 11
|
|
biotype 92 HA "Cystine (SS)" 12
|
|
biotype 93 CB "Cystine (SS)" 45
|
|
biotype 94 HB "Cystine (SS)" 46
|
|
biotype 95 SG "Cystine (SS)" 49
|
|
biotype 96 N "Cysteine (S-)" 7
|
|
biotype 97 CA "Cysteine (S-)" 44
|
|
biotype 98 C "Cysteine (S-)" 9
|
|
biotype 99 HN "Cysteine (S-)" 10
|
|
biotype 100 O "Cysteine (S-)" 11
|
|
biotype 101 HA "Cysteine (S-)" 12
|
|
biotype 102 CB "Cysteine (S-)" 50
|
|
biotype 103 HB "Cysteine (S-)" 51
|
|
biotype 104 SG "Cysteine (S-)" 52
|
|
biotype 105 N "Proline" 53
|
|
biotype 106 CA "Proline" 54
|
|
biotype 107 C "Proline" 55
|
|
biotype 108 O "Proline" 56
|
|
biotype 109 HA "Proline" 57
|
|
biotype 110 CB "Proline" 58
|
|
biotype 111 HB "Proline" 59
|
|
biotype 112 CG "Proline" 60
|
|
biotype 113 HG "Proline" 61
|
|
biotype 114 CD "Proline" 62
|
|
biotype 115 HD "Proline" 63
|
|
biotype 116 N "Phenylalanine" 7
|
|
biotype 117 CA "Phenylalanine" 8
|
|
biotype 118 C "Phenylalanine" 9
|
|
biotype 119 HN "Phenylalanine" 10
|
|
biotype 120 O "Phenylalanine" 11
|
|
biotype 121 HA "Phenylalanine" 12
|
|
biotype 122 CB "Phenylalanine" 64
|
|
biotype 123 HB "Phenylalanine" 65
|
|
biotype 124 CG "Phenylalanine" 66
|
|
biotype 125 CD "Phenylalanine" 67
|
|
biotype 126 HD "Phenylalanine" 68
|
|
biotype 127 CE "Phenylalanine" 69
|
|
biotype 128 HE "Phenylalanine" 70
|
|
biotype 129 CZ "Phenylalanine" 71
|
|
biotype 130 HZ "Phenylalanine" 72
|
|
biotype 131 N "Tyrosine" 7
|
|
biotype 132 CA "Tyrosine" 8
|
|
biotype 133 C "Tyrosine" 9
|
|
biotype 134 HN "Tyrosine" 10
|
|
biotype 135 O "Tyrosine" 11
|
|
biotype 136 HA "Tyrosine" 12
|
|
biotype 137 CB "Tyrosine" 73
|
|
biotype 138 HB "Tyrosine" 74
|
|
biotype 139 CG "Tyrosine" 75
|
|
biotype 140 CD "Tyrosine" 76
|
|
biotype 141 HD "Tyrosine" 77
|
|
biotype 142 CE "Tyrosine" 78
|
|
biotype 143 HE "Tyrosine" 79
|
|
biotype 144 CZ "Tyrosine" 80
|
|
biotype 145 OH "Tyrosine" 81
|
|
biotype 146 HH "Tyrosine" 82
|
|
biotype 147 N "Tyrosine (O-)" 7
|
|
biotype 148 CA "Tyrosine (O-)" 8
|
|
biotype 149 C "Tyrosine (O-)" 9
|
|
biotype 150 HN "Tyrosine (O-)" 10
|
|
biotype 151 O "Tyrosine (O-)" 11
|
|
biotype 152 HA "Tyrosine (O-)" 12
|
|
biotype 153 CB "Tyrosine (O-)" 83
|
|
biotype 154 HB "Tyrosine (O-)" 84
|
|
biotype 155 CG "Tyrosine (O-)" 85
|
|
biotype 156 CD "Tyrosine (O-)" 86
|
|
biotype 157 HD "Tyrosine (O-)" 87
|
|
biotype 158 CE "Tyrosine (O-)" 88
|
|
biotype 159 HE "Tyrosine (O-)" 89
|
|
biotype 160 CZ "Tyrosine (O-)" 90
|
|
biotype 161 OH "Tyrosine (O-)" 91
|
|
biotype 162 N "Tryptophan" 7
|
|
biotype 163 CA "Tryptophan" 8
|
|
biotype 164 C "Tryptophan" 9
|
|
biotype 165 HN "Tryptophan" 10
|
|
biotype 166 O "Tryptophan" 11
|
|
biotype 167 HA "Tryptophan" 12
|
|
biotype 168 CB "Tryptophan" 92
|
|
biotype 169 HB "Tryptophan" 93
|
|
biotype 170 CG "Tryptophan" 94
|
|
biotype 171 CD1 "Tryptophan" 95
|
|
biotype 172 HD1 "Tryptophan" 96
|
|
biotype 173 CD2 "Tryptophan" 97
|
|
biotype 174 NE1 "Tryptophan" 98
|
|
biotype 175 HE1 "Tryptophan" 99
|
|
biotype 176 CE2 "Tryptophan" 100
|
|
biotype 177 CE3 "Tryptophan" 101
|
|
biotype 178 HE3 "Tryptophan" 102
|
|
biotype 179 CZ2 "Tryptophan" 103
|
|
biotype 180 HZ2 "Tryptophan" 104
|
|
biotype 181 CZ3 "Tryptophan" 105
|
|
biotype 182 HZ3 "Tryptophan" 106
|
|
biotype 183 CH2 "Tryptophan" 107
|
|
biotype 184 HH2 "Tryptophan" 108
|
|
biotype 185 N "Histidine (+)" 7
|
|
biotype 186 CA "Histidine (+)" 8
|
|
biotype 187 C "Histidine (+)" 9
|
|
biotype 188 HN "Histidine (+)" 10
|
|
biotype 189 O "Histidine (+)" 11
|
|
biotype 190 HA "Histidine (+)" 12
|
|
biotype 191 CB "Histidine (+)" 109
|
|
biotype 192 HB "Histidine (+)" 110
|
|
biotype 193 CG "Histidine (+)" 111
|
|
biotype 194 ND1 "Histidine (+)" 112
|
|
biotype 195 HD1 "Histidine (+)" 113
|
|
biotype 196 CD2 "Histidine (+)" 114
|
|
biotype 197 HD2 "Histidine (+)" 115
|
|
biotype 198 CE1 "Histidine (+)" 116
|
|
biotype 199 HE1 "Histidine (+)" 117
|
|
biotype 200 NE2 "Histidine (+)" 118
|
|
biotype 201 HE2 "Histidine (+)" 119
|
|
biotype 202 N "Histidine (HD)" 7
|
|
biotype 203 CA "Histidine (HD)" 8
|
|
biotype 204 C "Histidine (HD)" 9
|
|
biotype 205 HN "Histidine (HD)" 10
|
|
biotype 206 O "Histidine (HD)" 11
|
|
biotype 207 HA "Histidine (HD)" 12
|
|
biotype 208 CB "Histidine (HD)" 120
|
|
biotype 209 HB "Histidine (HD)" 121
|
|
biotype 210 CG "Histidine (HD)" 122
|
|
biotype 211 ND1 "Histidine (HD)" 123
|
|
biotype 212 HD1 "Histidine (HD)" 124
|
|
biotype 213 CD2 "Histidine (HD)" 125
|
|
biotype 214 HD2 "Histidine (HD)" 126
|
|
biotype 215 CE1 "Histidine (HD)" 127
|
|
biotype 216 HE1 "Histidine (HD)" 128
|
|
biotype 217 NE2 "Histidine (HD)" 129
|
|
biotype 218 N "Histidine (HE)" 7
|
|
biotype 219 CA "Histidine (HE)" 8
|
|
biotype 220 C "Histidine (HE)" 9
|
|
biotype 221 HN "Histidine (HE)" 10
|
|
biotype 222 O "Histidine (HE)" 11
|
|
biotype 223 HA "Histidine (HE)" 12
|
|
biotype 224 CB "Histidine (HE)" 130
|
|
biotype 225 HB "Histidine (HE)" 131
|
|
biotype 226 CG "Histidine (HE)" 132
|
|
biotype 227 ND1 "Histidine (HE)" 133
|
|
biotype 228 CD2 "Histidine (HE)" 134
|
|
biotype 229 HD2 "Histidine (HE)" 135
|
|
biotype 230 CE1 "Histidine (HE)" 136
|
|
biotype 231 HE1 "Histidine (HE)" 137
|
|
biotype 232 NE2 "Histidine (HE)" 138
|
|
biotype 233 HE2 "Histidine (HE)" 139
|
|
biotype 234 N "Aspartic Acid" 7
|
|
biotype 235 CA "Aspartic Acid" 8
|
|
biotype 236 C "Aspartic Acid" 9
|
|
biotype 237 HN "Aspartic Acid" 10
|
|
biotype 238 O "Aspartic Acid" 11
|
|
biotype 239 HA "Aspartic Acid" 12
|
|
biotype 240 CB "Aspartic Acid" 140
|
|
biotype 241 HB "Aspartic Acid" 141
|
|
biotype 242 CG "Aspartic Acid" 142
|
|
biotype 243 OD "Aspartic Acid" 143
|
|
biotype 244 N "Aspartic Acid (COOH)" 7
|
|
biotype 245 CA "Aspartic Acid (COOH)" 8
|
|
biotype 246 C "Aspartic Acid (COOH)" 9
|
|
biotype 247 HN "Aspartic Acid (COOH)" 10
|
|
biotype 248 O "Aspartic Acid (COOH)" 11
|
|
biotype 249 HA "Aspartic Acid (COOH)" 12
|
|
biotype 250 CB "Aspartic Acid (COOH)" 144
|
|
biotype 251 HB "Aspartic Acid (COOH)" 145
|
|
biotype 252 CG "Aspartic Acid (COOH)" 146
|
|
biotype 253 OD1 "Aspartic Acid (COOH)" 147
|
|
biotype 254 OD2 "Aspartic Acid (COOH)" 148
|
|
biotype 255 HD2 "Aspartic Acid (COOH)" 149
|
|
biotype 256 N "Asparagine" 7
|
|
biotype 257 CA "Asparagine" 8
|
|
biotype 258 C "Asparagine" 9
|
|
biotype 259 HN "Asparagine" 10
|
|
biotype 260 O "Asparagine" 11
|
|
biotype 261 HA "Asparagine" 12
|
|
biotype 262 CB "Asparagine" 150
|
|
biotype 263 HB "Asparagine" 151
|
|
biotype 264 CG "Asparagine" 152
|
|
biotype 265 OD1 "Asparagine" 153
|
|
biotype 266 ND2 "Asparagine" 154
|
|
biotype 267 HD2 "Asparagine" 155
|
|
biotype 268 N "Glutamic Acid" 7
|
|
biotype 269 CA "Glutamic Acid" 8
|
|
biotype 270 C "Glutamic Acid" 9
|
|
biotype 271 HN "Glutamic Acid" 10
|
|
biotype 272 O "Glutamic Acid" 11
|
|
biotype 273 HA "Glutamic Acid" 12
|
|
biotype 274 CB "Glutamic Acid" 156
|
|
biotype 275 HB "Glutamic Acid" 157
|
|
biotype 276 CG "Glutamic Acid" 158
|
|
biotype 277 HG "Glutamic Acid" 159
|
|
biotype 278 CD "Glutamic Acid" 160
|
|
biotype 279 OE "Glutamic Acid" 161
|
|
biotype 280 N "Glutamic Acid (COOH)" 7
|
|
biotype 281 CA "Glutamic Acid (COOH)" 8
|
|
biotype 282 C "Glutamic Acid (COOH)" 9
|
|
biotype 283 HN "Glutamic Acid (COOH)" 10
|
|
biotype 284 O "Glutamic Acid (COOH)" 11
|
|
biotype 285 HA "Glutamic Acid (COOH)" 12
|
|
biotype 286 CB "Glutamic Acid (COOH)" 162
|
|
biotype 287 HB "Glutamic Acid (COOH)" 163
|
|
biotype 288 CG "Glutamic Acid (COOH)" 164
|
|
biotype 289 HG "Glutamic Acid (COOH)" 165
|
|
biotype 290 CD "Glutamic Acid (COOH)" 166
|
|
biotype 291 OE1 "Glutamic Acid (COOH)" 167
|
|
biotype 292 OE2 "Glutamic Acid (COOH)" 168
|
|
biotype 293 HE2 "Glutamic Acid (COOH)" 169
|
|
biotype 294 N "Glutamine" 7
|
|
biotype 295 CA "Glutamine" 8
|
|
biotype 296 C "Glutamine" 9
|
|
biotype 297 HN "Glutamine" 10
|
|
biotype 298 O "Glutamine" 11
|
|
biotype 299 HA "Glutamine" 12
|
|
biotype 300 CB "Glutamine" 170
|
|
biotype 301 HB "Glutamine" 171
|
|
biotype 302 CG "Glutamine" 172
|
|
biotype 303 HG "Glutamine" 173
|
|
biotype 304 CD "Glutamine" 174
|
|
biotype 305 OE1 "Glutamine" 175
|
|
biotype 306 NE2 "Glutamine" 176
|
|
biotype 307 HE2 "Glutamine" 177
|
|
biotype 308 N "Methionine" 7
|
|
biotype 309 CA "Methionine" 8
|
|
biotype 310 C "Methionine" 9
|
|
biotype 311 HN "Methionine" 10
|
|
biotype 312 O "Methionine" 11
|
|
biotype 313 HA "Methionine" 12
|
|
biotype 314 CB "Methionine" 178
|
|
biotype 315 HB "Methionine" 179
|
|
biotype 316 CG "Methionine" 180
|
|
biotype 317 HG "Methionine" 181
|
|
biotype 318 SD "Methionine" 182
|
|
biotype 319 CE "Methionine" 183
|
|
biotype 320 HE "Methionine" 184
|
|
biotype 321 N "Lysine" 7
|
|
biotype 322 CA "Lysine" 8
|
|
biotype 323 C "Lysine" 9
|
|
biotype 324 HN "Lysine" 10
|
|
biotype 325 O "Lysine" 11
|
|
biotype 326 HA "Lysine" 12
|
|
biotype 327 CB "Lysine" 185
|
|
biotype 328 HB "Lysine" 186
|
|
biotype 329 CG "Lysine" 187
|
|
biotype 330 HG "Lysine" 188
|
|
biotype 331 CD "Lysine" 189
|
|
biotype 332 HD "Lysine" 190
|
|
biotype 333 CE "Lysine" 191
|
|
biotype 334 HE "Lysine" 192
|
|
biotype 335 NZ "Lysine" 193
|
|
biotype 336 HZ "Lysine" 194
|
|
biotype 337 N "Lysine (NH2)" 7
|
|
biotype 338 CA "Lysine (NH2)" 8
|
|
biotype 339 C "Lysine (NH2)" 9
|
|
biotype 340 HN "Lysine (NH2)" 10
|
|
biotype 341 O "Lysine (NH2)" 11
|
|
biotype 342 HA "Lysine (NH2)" 12
|
|
biotype 343 CB "Lysine (NH2)" 195
|
|
biotype 344 HB "Lysine (NH2)" 196
|
|
biotype 345 CG "Lysine (NH2)" 197
|
|
biotype 346 HG "Lysine (NH2)" 198
|
|
biotype 347 CD "Lysine (NH2)" 199
|
|
biotype 348 HD "Lysine (NH2)" 200
|
|
biotype 349 CE "Lysine (NH2)" 201
|
|
biotype 350 HE "Lysine (NH2)" 202
|
|
biotype 351 NZ "Lysine (NH2)" 203
|
|
biotype 352 HZ "Lysine (NH2)" 204
|
|
biotype 353 N "Arginine" 7
|
|
biotype 354 CA "Arginine" 8
|
|
biotype 355 C "Arginine" 9
|
|
biotype 356 HN "Arginine" 10
|
|
biotype 357 O "Arginine" 11
|
|
biotype 358 HA "Arginine" 12
|
|
biotype 359 CB "Arginine" 205
|
|
biotype 360 HB "Arginine" 206
|
|
biotype 361 CG "Arginine" 207
|
|
biotype 362 HG "Arginine" 208
|
|
biotype 363 CD "Arginine" 209
|
|
biotype 364 HD "Arginine" 210
|
|
biotype 365 NE "Arginine" 211
|
|
biotype 366 HE "Arginine" 212
|
|
biotype 367 CZ "Arginine" 213
|
|
biotype 368 NH "Arginine" 214
|
|
biotype 369 HH "Arginine" 215
|
|
biotype 370 N "Ornithine" 7
|
|
biotype 371 CA "Ornithine" 8
|
|
biotype 372 C "Ornithine" 9
|
|
biotype 373 HN "Ornithine" 10
|
|
biotype 374 O "Ornithine" 11
|
|
biotype 375 HA "Ornithine" 12
|
|
biotype 376 CB "Ornithine" 216
|
|
biotype 377 HB "Ornithine" 217
|
|
biotype 378 CG "Ornithine" 218
|
|
biotype 379 HG "Ornithine" 219
|
|
biotype 380 CD "Ornithine" 220
|
|
biotype 381 HD "Ornithine" 221
|
|
biotype 382 NE "Ornithine" 222
|
|
biotype 383 HE "Ornithine" 223
|
|
biotype 384 N "MethylAlanine (AIB)" -1
|
|
biotype 385 CA "MethylAlanine (AIB)" -1
|
|
biotype 386 C "MethylAlanine (AIB)" -1
|
|
biotype 387 HN "MethylAlanine (AIB)" -1
|
|
biotype 388 O "MethylAlanine (AIB)" -1
|
|
biotype 389 CB "MethylAlanine (AIB)" -1
|
|
biotype 390 HB "MethylAlanine (AIB)" -1
|
|
biotype 391 N "Pyroglutamic Acid" -1
|
|
biotype 392 CA "Pyroglutamic Acid" -1
|
|
biotype 393 C "Pyroglutamic Acid" -1
|
|
biotype 394 HN "Pyroglutamic Acid" -1
|
|
biotype 395 O "Pyroglutamic Acid" -1
|
|
biotype 396 HA "Pyroglutamic Acid" -1
|
|
biotype 397 CB "Pyroglutamic Acid" -1
|
|
biotype 398 HB "Pyroglutamic Acid" -1
|
|
biotype 399 CG "Pyroglutamic Acid" -1
|
|
biotype 400 HG "Pyroglutamic Acid" -1
|
|
biotype 401 CD "Pyroglutamic Acid" -1
|
|
biotype 402 OE "Pyroglutamic Acid" -1
|
|
biotype 403 N "N-Terminal GLY" 234
|
|
biotype 404 CA "N-Terminal GLY" 2
|
|
biotype 405 C "N-Terminal GLY" 3
|
|
biotype 406 HN "N-Terminal GLY" 235
|
|
biotype 407 O "N-Terminal GLY" 5
|
|
biotype 408 HA "N-Terminal GLY" 6
|
|
biotype 409 N "N-Terminal ALA" 234
|
|
biotype 410 CA "N-Terminal ALA" 8
|
|
biotype 411 C "N-Terminal ALA" 9
|
|
biotype 412 HN "N-Terminal ALA" 235
|
|
biotype 413 O "N-Terminal ALA" 11
|
|
biotype 414 HA "N-Terminal ALA" 12
|
|
biotype 415 N "N-Terminal VAL" 234
|
|
biotype 416 CA "N-Terminal VAL" 8
|
|
biotype 417 C "N-Terminal VAL" 9
|
|
biotype 418 HN "N-Terminal VAL" 235
|
|
biotype 419 O "N-Terminal VAL" 11
|
|
biotype 420 HA "N-Terminal VAL" 12
|
|
biotype 421 N "N-Terminal LEU" 234
|
|
biotype 422 CA "N-Terminal LEU" 8
|
|
biotype 423 C "N-Terminal LEU" 9
|
|
biotype 424 HN "N-Terminal LEU" 235
|
|
biotype 425 O "N-Terminal LEU" 11
|
|
biotype 426 HA "N-Terminal LEU" 12
|
|
biotype 427 N "N-Terminal ILE" 234
|
|
biotype 428 CA "N-Terminal ILE" 8
|
|
biotype 429 C "N-Terminal ILE" 9
|
|
biotype 430 HN "N-Terminal ILE" 235
|
|
biotype 431 O "N-Terminal ILE" 11
|
|
biotype 432 HA "N-Terminal ILE" 12
|
|
biotype 433 N "N-Terminal SER" 234
|
|
biotype 434 CA "N-Terminal SER" 33
|
|
biotype 435 C "N-Terminal SER" 9
|
|
biotype 436 HN "N-Terminal SER" 235
|
|
biotype 437 O "N-Terminal SER" 11
|
|
biotype 438 HA "N-Terminal SER" 12
|
|
biotype 439 N "N-Terminal THR" 234
|
|
biotype 440 CA "N-Terminal THR" 33
|
|
biotype 441 C "N-Terminal THR" 9
|
|
biotype 442 HN "N-Terminal THR" 235
|
|
biotype 443 O "N-Terminal THR" 11
|
|
biotype 444 HA "N-Terminal THR" 12
|
|
biotype 445 N "N-Terminal CYS (SH)" 234
|
|
biotype 446 CA "N-Terminal CYS (SH)" 44
|
|
biotype 447 C "N-Terminal CYS (SH)" 9
|
|
biotype 448 HN "N-Terminal CYS (SH)" 235
|
|
biotype 449 O "N-Terminal CYS (SH)" 11
|
|
biotype 450 HA "N-Terminal CYS (SH)" 12
|
|
biotype 451 N "N-Terminal CYX (SS)" 234
|
|
biotype 452 CA "N-Terminal CYX (SS)" 44
|
|
biotype 453 C "N-Terminal CYX (SS)" 9
|
|
biotype 454 HN "N-Terminal CYX (SS)" 235
|
|
biotype 455 O "N-Terminal CYX (SS)" 11
|
|
biotype 456 HA "N-Terminal CYX (SS)" 12
|
|
biotype 457 N "N-Terminal CYD (S-)" 234
|
|
biotype 458 CA "N-Terminal CYD (S-)" 44
|
|
biotype 459 C "N-Terminal CYD (S-)" 9
|
|
biotype 460 HN "N-Terminal CYD (S-)" 235
|
|
biotype 461 O "N-Terminal CYD (S-)" 11
|
|
biotype 462 HA "N-Terminal CYD (S-)" 12
|
|
biotype 463 N "N-Terminal PRO" 244
|
|
biotype 464 CA "N-Terminal PRO" 246
|
|
biotype 465 C "N-Terminal PRO" 247
|
|
biotype 466 HN "N-Terminal PRO" 245
|
|
biotype 467 O "N-Terminal PRO" 248
|
|
biotype 468 HA "N-Terminal PRO" 249
|
|
biotype 469 CD "N-Terminal PRO" 250
|
|
biotype 470 HD "N-Terminal PRO" 251
|
|
biotype 471 N "N-Terminal PHE" 234
|
|
biotype 472 CA "N-Terminal PHE" 8
|
|
biotype 473 C "N-Terminal PHE" 9
|
|
biotype 474 HN "N-Terminal PHE" 235
|
|
biotype 475 O "N-Terminal PHE" 11
|
|
biotype 476 HA "N-Terminal PHE" 12
|
|
biotype 477 N "N-Terminal TYR" 234
|
|
biotype 478 CA "N-Terminal TYR" 8
|
|
biotype 479 C "N-Terminal TYR" 9
|
|
biotype 480 HN "N-Terminal TYR" 235
|
|
biotype 481 O "N-Terminal TYR" 11
|
|
biotype 482 HA "N-Terminal TYR" 12
|
|
biotype 483 N "N-Terminal TYD (O-)" 234
|
|
biotype 484 CA "N-Terminal TYD (O-)" 8
|
|
biotype 485 C "N-Terminal TYD (O-)" 9
|
|
biotype 486 HN "N-Terminal TYD (O-)" 235
|
|
biotype 487 O "N-Terminal TYD (O-)" 11
|
|
biotype 488 HA "N-Terminal TYD (O-)" 12
|
|
biotype 489 N "N-Terminal TRP" 234
|
|
biotype 490 CA "N-Terminal TRP" 8
|
|
biotype 491 C "N-Terminal TRP" 9
|
|
biotype 492 HN "N-Terminal TRP" 235
|
|
biotype 493 O "N-Terminal TRP" 11
|
|
biotype 494 HA "N-Terminal TRP" 12
|
|
biotype 495 N "N-Terminal HIS (+)" 234
|
|
biotype 496 CA "N-Terminal HIS (+)" 8
|
|
biotype 497 C "N-Terminal HIS (+)" 9
|
|
biotype 498 HN "N-Terminal HIS (+)" 235
|
|
biotype 499 O "N-Terminal HIS (+)" 11
|
|
biotype 500 HA "N-Terminal HIS (+)" 12
|
|
biotype 501 N "N-Terminal HIS (HD)" 234
|
|
biotype 502 CA "N-Terminal HIS (HD)" 8
|
|
biotype 503 C "N-Terminal HIS (HD)" 9
|
|
biotype 504 HN "N-Terminal HIS (HD)" 235
|
|
biotype 505 O "N-Terminal HIS (HD)" 11
|
|
biotype 506 HA "N-Terminal HIS (HD)" 12
|
|
biotype 507 N "N-Terminal HIS (HE)" 234
|
|
biotype 508 CA "N-Terminal HIS (HE)" 8
|
|
biotype 509 C "N-Terminal HIS (HE)" 9
|
|
biotype 510 HN "N-Terminal HIS (HE)" 235
|
|
biotype 511 O "N-Terminal HIS (HE)" 11
|
|
biotype 512 HA "N-Terminal HIS (HE)" 12
|
|
biotype 513 N "N-Terminal ASP" 234
|
|
biotype 514 CA "N-Terminal ASP" 8
|
|
biotype 515 C "N-Terminal ASP" 9
|
|
biotype 516 HN "N-Terminal ASP" 235
|
|
biotype 517 O "N-Terminal ASP" 11
|
|
biotype 518 HA "N-Terminal ASP" 12
|
|
biotype 519 N "N-Terminal ASH (COOH)" 234
|
|
biotype 520 CA "N-Terminal ASH (COOH)" 8
|
|
biotype 521 C "N-Terminal ASH (COOH)" 9
|
|
biotype 522 HN "N-Terminal ASH (COOH)" 235
|
|
biotype 523 O "N-Terminal ASH (COOH)" 11
|
|
biotype 524 HA "N-Terminal ASH (COOH)" 12
|
|
biotype 525 N "N-Terminal ASN" 234
|
|
biotype 526 CA "N-Terminal ASN" 8
|
|
biotype 527 C "N-Terminal ASN" 9
|
|
biotype 528 HN "N-Terminal ASN" 235
|
|
biotype 529 O "N-Terminal ASN" 11
|
|
biotype 530 HA "N-Terminal ASN" 12
|
|
biotype 531 N "N-Terminal GLU" 234
|
|
biotype 532 CA "N-Terminal GLU" 8
|
|
biotype 533 C "N-Terminal GLU" 9
|
|
biotype 534 HN "N-Terminal GLU" 235
|
|
biotype 535 O "N-Terminal GLU" 11
|
|
biotype 536 HA "N-Terminal GLU" 12
|
|
biotype 537 N "N-Terminal GLH (COOH)" 234
|
|
biotype 538 CA "N-Terminal GLH (COOH)" 8
|
|
biotype 539 C "N-Terminal GLH (COOH)" 9
|
|
biotype 540 HN "N-Terminal GLH (COOH)" 235
|
|
biotype 541 O "N-Terminal GLH (COOH)" 11
|
|
biotype 542 HA "N-Terminal GLH (COOH)" 12
|
|
biotype 543 N "N-Terminal GLN" 234
|
|
biotype 544 CA "N-Terminal GLN" 8
|
|
biotype 545 C "N-Terminal GLN" 9
|
|
biotype 546 HN "N-Terminal GLN" 235
|
|
biotype 547 O "N-Terminal GLN" 11
|
|
biotype 548 HA "N-Terminal GLN" 12
|
|
biotype 549 N "N-Terminal MET" 234
|
|
biotype 550 CA "N-Terminal MET" 8
|
|
biotype 551 C "N-Terminal MET" 9
|
|
biotype 552 HN "N-Terminal MET" 235
|
|
biotype 553 O "N-Terminal MET" 11
|
|
biotype 554 HA "N-Terminal MET" 12
|
|
biotype 555 N "N-Terminal LYS" 234
|
|
biotype 556 CA "N-Terminal LYS" 8
|
|
biotype 557 C "N-Terminal LYS" 9
|
|
biotype 558 HN "N-Terminal LYS" 235
|
|
biotype 559 O "N-Terminal LYS" 11
|
|
biotype 560 HA "N-Terminal LYS" 12
|
|
biotype 561 N "N-Terminal LYD (NH2)" 234
|
|
biotype 562 CA "N-Terminal LYD (NH2)" 8
|
|
biotype 563 C "N-Terminal LYD (NH2)" 9
|
|
biotype 564 HN "N-Terminal LYD (NH2)" 235
|
|
biotype 565 O "N-Terminal LYD (NH2)" 11
|
|
biotype 566 HA "N-Terminal LYD (NH2)" 12
|
|
biotype 567 N "N-Terminal ARG" 234
|
|
biotype 568 CA "N-Terminal ARG" 8
|
|
biotype 569 C "N-Terminal ARG" 9
|
|
biotype 570 HN "N-Terminal ARG" 235
|
|
biotype 571 O "N-Terminal ARG" 11
|
|
biotype 572 HA "N-Terminal ARG" 12
|
|
biotype 573 N "N-Terminal ORN" 234
|
|
biotype 574 CA "N-Terminal ORN" 8
|
|
biotype 575 C "N-Terminal ORN" 9
|
|
biotype 576 HN "N-Terminal ORN" 235
|
|
biotype 577 O "N-Terminal ORN" 11
|
|
biotype 578 HA "N-Terminal ORN" 12
|
|
biotype 579 N "N-Terminal AIB" -1
|
|
biotype 580 CA "N-Terminal AIB" -1
|
|
biotype 581 C "N-Terminal AIB" -1
|
|
biotype 582 HN "N-Terminal AIB" -1
|
|
biotype 583 O "N-Terminal AIB" -1
|
|
biotype 584 N "C-Terminal GLY" 1
|
|
biotype 585 CA "C-Terminal GLY" 2
|
|
biotype 586 C "C-Terminal GLY" 238
|
|
biotype 587 HN "C-Terminal GLY" 4
|
|
biotype 588 OXT "C-Terminal GLY" 239
|
|
biotype 589 HA "C-Terminal GLY" 6
|
|
biotype 590 N "C-Terminal ALA" 7
|
|
biotype 591 CA "C-Terminal ALA" 8
|
|
biotype 592 C "C-Terminal ALA" 238
|
|
biotype 593 HN "C-Terminal ALA" 10
|
|
biotype 594 OXT "C-Terminal ALA" 239
|
|
biotype 595 HA "C-Terminal ALA" 12
|
|
biotype 596 N "C-Terminal VAL" 7
|
|
biotype 597 CA "C-Terminal VAL" 8
|
|
biotype 598 C "C-Terminal VAL" 238
|
|
biotype 599 HN "C-Terminal VAL" 10
|
|
biotype 600 OXT "C-Terminal VAL" 239
|
|
biotype 601 HA "C-Terminal VAL" 12
|
|
biotype 602 N "C-Terminal LEU" 7
|
|
biotype 603 CA "C-Terminal LEU" 8
|
|
biotype 604 C "C-Terminal LEU" 238
|
|
biotype 605 HN "C-Terminal LEU" 10
|
|
biotype 606 OXT "C-Terminal LEU" 239
|
|
biotype 607 HA "C-Terminal LEU" 12
|
|
biotype 608 N "C-Terminal ILE" 7
|
|
biotype 609 CA "C-Terminal ILE" 8
|
|
biotype 610 C "C-Terminal ILE" 238
|
|
biotype 611 HN "C-Terminal ILE" 10
|
|
biotype 612 OXT "C-Terminal ILE" 239
|
|
biotype 613 HA "C-Terminal ILE" 12
|
|
biotype 614 N "C-Terminal SER" 7
|
|
biotype 615 CA "C-Terminal SER" 33
|
|
biotype 616 C "C-Terminal SER" 238
|
|
biotype 617 HN "C-Terminal SER" 10
|
|
biotype 618 OXT "C-Terminal SER" 239
|
|
biotype 619 HA "C-Terminal SER" 12
|
|
biotype 620 N "C-Terminal THR" 7
|
|
biotype 621 CA "C-Terminal THR" 33
|
|
biotype 622 C "C-Terminal THR" 238
|
|
biotype 623 HN "C-Terminal THR" 10
|
|
biotype 624 OXT "C-Terminal THR" 239
|
|
biotype 625 HA "C-Terminal THR" 12
|
|
biotype 626 N "C-Terminal CYS (SH)" 7
|
|
biotype 627 CA "C-Terminal CYS (SH)" 44
|
|
biotype 628 C "C-Terminal CYS (SH)" 238
|
|
biotype 629 HN "C-Terminal CYS (SH)" 10
|
|
biotype 630 OXT "C-Terminal CYS (SH)" 239
|
|
biotype 631 HA "C-Terminal CYS (SH)" 12
|
|
biotype 632 N "C-Terminal CYX (SS)" 7
|
|
biotype 633 CA "C-Terminal CYX (SS)" 44
|
|
biotype 634 C "C-Terminal CYX (SS)" 238
|
|
biotype 635 HN "C-Terminal CYX (SS)" 10
|
|
biotype 636 OXT "C-Terminal CYX (SS)" 239
|
|
biotype 637 HA "C-Terminal CYX (SS)" 12
|
|
biotype 638 N "C-Terminal CYD (S-)" 7
|
|
biotype 639 CA "C-Terminal CYD (S-)" 44
|
|
biotype 640 C "C-Terminal CYD (S-)" 238
|
|
biotype 641 HN "C-Terminal CYD (S-)" 10
|
|
biotype 642 OXT "C-Terminal CYD (S-)" 239
|
|
biotype 643 HA "C-Terminal CYD (S-)" 12
|
|
biotype 644 N "C-Terminal PRO" 53
|
|
biotype 645 CA "C-Terminal PRO" 54
|
|
biotype 646 C "C-Terminal PRO" 238
|
|
biotype 647 OXT "C-Terminal PRO" 239
|
|
biotype 648 HA "C-Terminal PRO" 57
|
|
biotype 649 N "C-Terminal PHE" 7
|
|
biotype 650 CA "C-Terminal PHE" 8
|
|
biotype 651 C "C-Terminal PHE" 238
|
|
biotype 652 HN "C-Terminal PHE" 10
|
|
biotype 653 OXT "C-Terminal PHE" 239
|
|
biotype 654 HA "C-Terminal PHE" 12
|
|
biotype 655 N "C-Terminal TYR" 7
|
|
biotype 656 CA "C-Terminal TYR" 8
|
|
biotype 657 C "C-Terminal TYR" 238
|
|
biotype 658 HN "C-Terminal TYR" 10
|
|
biotype 659 OXT "C-Terminal TYR" 239
|
|
biotype 660 HA "C-Terminal TYR" 12
|
|
biotype 661 N "C-Terminal TYD (O-)" 7
|
|
biotype 662 CA "C-Terminal TYD (O-)" 8
|
|
biotype 663 C "C-Terminal TYD (O-)" 238
|
|
biotype 664 HN "C-Terminal TYD (O-)" 10
|
|
biotype 665 OXT "C-Terminal TYD (O-)" 239
|
|
biotype 666 HA "C-Terminal TYD (O-)" 12
|
|
biotype 667 N "C-Terminal TRP" 7
|
|
biotype 668 CA "C-Terminal TRP" 8
|
|
biotype 669 C "C-Terminal TRP" 238
|
|
biotype 670 HN "C-Terminal TRP" 10
|
|
biotype 671 OXT "C-Terminal TRP" 239
|
|
biotype 672 HA "C-Terminal TRP" 12
|
|
biotype 673 N "C-Terminal HIS (+)" 7
|
|
biotype 674 CA "C-Terminal HIS (+)" 8
|
|
biotype 675 C "C-Terminal HIS (+)" 238
|
|
biotype 676 HN "C-Terminal HIS (+)" 10
|
|
biotype 677 OXT "C-Terminal HIS (+)" 239
|
|
biotype 678 HA "C-Terminal HIS (+)" 12
|
|
biotype 679 N "C-Terminal HIS (HD)" 7
|
|
biotype 680 CA "C-Terminal HIS (HD)" 8
|
|
biotype 681 C "C-Terminal HIS (HD)" 238
|
|
biotype 682 HN "C-Terminal HIS (HD)" 10
|
|
biotype 683 OXT "C-Terminal HIS (HD)" 239
|
|
biotype 684 HA "C-Terminal HIS (HD)" 12
|
|
biotype 685 N "C-Terminal HIS (HE)" 7
|
|
biotype 686 CA "C-Terminal HIS (HE)" 8
|
|
biotype 687 C "C-Terminal HIS (HE)" 238
|
|
biotype 688 HN "C-Terminal HIS (HE)" 10
|
|
biotype 689 OXT "C-Terminal HIS (HE)" 239
|
|
biotype 690 HA "C-Terminal HIS (HE)" 12
|
|
biotype 691 N "C-Terminal ASP" 7
|
|
biotype 692 CA "C-Terminal ASP" 8
|
|
biotype 693 C "C-Terminal ASP" 238
|
|
biotype 694 HN "C-Terminal ASP" 10
|
|
biotype 695 OXT "C-Terminal ASP" 239
|
|
biotype 696 HA "C-Terminal ASP" 12
|
|
biotype 697 N "C-Terminal ASH (COOH)" 7
|
|
biotype 698 CA "C-Terminal ASH (COOH)" 8
|
|
biotype 699 C "C-Terminal ASH (COOH)" 238
|
|
biotype 700 HN "C-Terminal ASH (COOH)" 10
|
|
biotype 701 OXT "C-Terminal ASH (COOH)" 239
|
|
biotype 702 HA "C-Terminal ASH (COOH)" 12
|
|
biotype 703 N "C-Terminal ASN" 7
|
|
biotype 704 CA "C-Terminal ASN" 8
|
|
biotype 705 C "C-Terminal ASN" 238
|
|
biotype 706 HN "C-Terminal ASN" 10
|
|
biotype 707 OXT "C-Terminal ASN" 239
|
|
biotype 708 HA "C-Terminal ASN" 12
|
|
biotype 709 N "C-Terminal GLU" 7
|
|
biotype 710 CA "C-Terminal GLU" 8
|
|
biotype 711 C "C-Terminal GLU" 238
|
|
biotype 712 HN "C-Terminal GLU" 10
|
|
biotype 713 OXT "C-Terminal GLU" 239
|
|
biotype 714 HA "C-Terminal GLU" 12
|
|
biotype 715 N "C-Terminal GLH (COOH)" 7
|
|
biotype 716 CA "C-Terminal GLH (COOH)" 8
|
|
biotype 717 C "C-Terminal GLH (COOH)" 238
|
|
biotype 718 HN "C-Terminal GLH (COOH)" 10
|
|
biotype 719 OXT "C-Terminal GLH (COOH)" 239
|
|
biotype 720 HA "C-Terminal GLH (COOH)" 12
|
|
biotype 721 N "C-Terminal GLN" 7
|
|
biotype 722 CA "C-Terminal GLN" 8
|
|
biotype 723 C "C-Terminal GLN" 238
|
|
biotype 724 HN "C-Terminal GLN" 10
|
|
biotype 725 OXT "C-Terminal GLN" 239
|
|
biotype 726 HA "C-Terminal GLN" 12
|
|
biotype 727 N "C-Terminal MET" 7
|
|
biotype 728 CA "C-Terminal MET" 8
|
|
biotype 729 C "C-Terminal MET" 238
|
|
biotype 730 HN "C-Terminal MET" 10
|
|
biotype 731 OXT "C-Terminal MET" 239
|
|
biotype 732 HA "C-Terminal MET" 12
|
|
biotype 733 N "C-Terminal LYS" 7
|
|
biotype 734 CA "C-Terminal LYS" 8
|
|
biotype 735 C "C-Terminal LYS" 238
|
|
biotype 736 HN "C-Terminal LYS" 10
|
|
biotype 737 OXT "C-Terminal LYS" 239
|
|
biotype 738 HA "C-Terminal LYS" 12
|
|
biotype 739 N "C-Terminal LYD (NH2)" 7
|
|
biotype 740 CA "C-Terminal LYD (NH2)" 8
|
|
biotype 741 C "C-Terminal LYD (NH2)" 238
|
|
biotype 742 HN "C-Terminal LYD (NH2)" 10
|
|
biotype 743 OXT "C-Terminal LYD (NH2)" 239
|
|
biotype 744 HA "C-Terminal LYD (NH2)" 12
|
|
biotype 745 N "C-Terminal ARG" 7
|
|
biotype 746 CA "C-Terminal ARG" 8
|
|
biotype 747 C "C-Terminal ARG" 238
|
|
biotype 748 HN "C-Terminal ARG" 10
|
|
biotype 749 OXT "C-Terminal ARG" 239
|
|
biotype 750 HA "C-Terminal ARG" 12
|
|
biotype 751 N "C-Terminal ORN" 7
|
|
biotype 752 CA "C-Terminal ORN" 8
|
|
biotype 753 C "C-Terminal ORN" 238
|
|
biotype 754 HN "C-Terminal ORN" 10
|
|
biotype 755 OXT "C-Terminal ORN" 239
|
|
biotype 756 HA "C-Terminal ORN" 12
|
|
biotype 757 N "C-Terminal AIB" -1
|
|
biotype 758 CA "C-Terminal AIB" -1
|
|
biotype 759 C "C-Terminal AIB" -1
|
|
biotype 760 HN "C-Terminal AIB" -1
|
|
biotype 761 OXT "C-Terminal AIB" -1
|
|
biotype 762 N "Deprotonated N-Terminus" 236
|
|
biotype 763 H "Deprotonated N-Terminus" 237
|
|
biotype 764 C "Formyl N-Terminus" -1
|
|
biotype 765 H "Formyl N-Terminus" -1
|
|
biotype 766 O "Formyl N-Terminus" -1
|
|
biotype 767 CH3 "Acetyl N-Terminus" 224
|
|
biotype 768 H "Acetyl N-Terminus" 225
|
|
biotype 769 C "Acetyl N-Terminus" 226
|
|
biotype 770 O "Acetyl N-Terminus" 227
|
|
biotype 771 C "Protonated C-Terminus" 240
|
|
biotype 772 O "Protonated C-Terminus" 241
|
|
biotype 773 OH "Protonated C-Terminus" 242
|
|
biotype 774 HO "Protonated C-Terminus" 243
|
|
biotype 775 N "Amide C-Terminus" 228
|
|
biotype 776 HN "Amide C-Terminus" 229
|
|
biotype 777 N "N-MeAmide C-Terminus" 230
|
|
biotype 778 HN "N-MeAmide C-Terminus" 231
|
|
biotype 779 CH3 "N-MeAmide C-Terminus" 232
|
|
biotype 780 H "N-MeAmide C-Terminus" 233
|
|
biotype 1001 O5* "Adenosine" 332
|
|
biotype 1002 C5* "Adenosine" 333
|
|
biotype 1003 H5*1 "Adenosine" 334
|
|
biotype 1004 H5*2 "Adenosine" 335
|
|
biotype 1005 C4* "Adenosine" 336
|
|
biotype 1006 H4* "Adenosine" 337
|
|
biotype 1007 O4* "Adenosine" 338
|
|
biotype 1008 C1* "Adenosine" 339
|
|
biotype 1009 H1* "Adenosine" 340
|
|
biotype 1010 C3* "Adenosine" 341
|
|
biotype 1011 H3* "Adenosine" 342
|
|
biotype 1012 C2* "Adenosine" 343
|
|
biotype 1013 H2* "Adenosine" 344
|
|
biotype 1014 O2* "Adenosine" 345
|
|
biotype 1015 HO* "Adenosine" 346
|
|
biotype 1016 O3* "Adenosine" 347
|
|
biotype 1017 N9 "Adenosine" 252
|
|
biotype 1018 C4 "Adenosine" 253
|
|
biotype 1019 C5 "Adenosine" 254
|
|
biotype 1020 N7 "Adenosine" 255
|
|
biotype 1021 C8 "Adenosine" 256
|
|
biotype 1022 N3 "Adenosine" 257
|
|
biotype 1023 C2 "Adenosine" 258
|
|
biotype 1024 N1 "Adenosine" 259
|
|
biotype 1025 C6 "Adenosine" 260
|
|
biotype 1026 H2 "Adenosine" 261
|
|
biotype 1027 N6 "Adenosine" 262
|
|
biotype 1028 H61 "Adenosine" 263
|
|
biotype 1029 H62 "Adenosine" 264
|
|
biotype 1030 H8 "Adenosine" 265
|
|
biotype 1031 O5* "Guanosine" 332
|
|
biotype 1032 C5* "Guanosine" 333
|
|
biotype 1033 H5*1 "Guanosine" 334
|
|
biotype 1034 H5*2 "Guanosine" 335
|
|
biotype 1035 C4* "Guanosine" 336
|
|
biotype 1036 H4* "Guanosine" 337
|
|
biotype 1037 O4* "Guanosine" 338
|
|
biotype 1038 C1* "Guanosine" 339
|
|
biotype 1039 H1* "Guanosine" 340
|
|
biotype 1040 C3* "Guanosine" 341
|
|
biotype 1041 H3* "Guanosine" 342
|
|
biotype 1042 C2* "Guanosine" 343
|
|
biotype 1043 H2* "Guanosine" 344
|
|
biotype 1044 O2* "Guanosine" 345
|
|
biotype 1045 HO* "Guanosine" 346
|
|
biotype 1046 O3* "Guanosine" 347
|
|
biotype 1047 N9 "Guanosine" 278
|
|
biotype 1048 C4 "Guanosine" 279
|
|
biotype 1049 C5 "Guanosine" 280
|
|
biotype 1050 N7 "Guanosine" 281
|
|
biotype 1051 C8 "Guanosine" 282
|
|
biotype 1052 N3 "Guanosine" 283
|
|
biotype 1053 C2 "Guanosine" 284
|
|
biotype 1054 N1 "Guanosine" 285
|
|
biotype 1055 C6 "Guanosine" 286
|
|
biotype 1056 H1 "Guanosine" 287
|
|
biotype 1057 N2 "Guanosine" 288
|
|
biotype 1058 H21 "Guanosine" 289
|
|
biotype 1059 H22 "Guanosine" 290
|
|
biotype 1060 O6 "Guanosine" 291
|
|
biotype 1061 H8 "Guanosine" 292
|
|
biotype 1062 O5* "Cytidine" 316
|
|
biotype 1063 C5* "Cytidine" 317
|
|
biotype 1064 H5*1 "Cytidine" 318
|
|
biotype 1065 H5*2 "Cytidine" 319
|
|
biotype 1066 C4* "Cytidine" 320
|
|
biotype 1067 H4* "Cytidine" 321
|
|
biotype 1068 O4* "Cytidine" 322
|
|
biotype 1069 C1* "Cytidine" 323
|
|
biotype 1070 H1* "Cytidine" 324
|
|
biotype 1071 C3* "Cytidine" 325
|
|
biotype 1072 H3* "Cytidine" 326
|
|
biotype 1073 C2* "Cytidine" 327
|
|
biotype 1074 H2* "Cytidine" 328
|
|
biotype 1075 O2* "Cytidine" 329
|
|
biotype 1076 HO* "Cytidine" 330
|
|
biotype 1077 O3* "Cytidine" 331
|
|
biotype 1078 N1 "Cytidine" 266
|
|
biotype 1079 C2 "Cytidine" 267
|
|
biotype 1080 N3 "Cytidine" 268
|
|
biotype 1081 C4 "Cytidine" 269
|
|
biotype 1082 C5 "Cytidine" 270
|
|
biotype 1083 C6 "Cytidine" 271
|
|
biotype 1084 O2 "Cytidine" 272
|
|
biotype 1085 N4 "Cytidine" 273
|
|
biotype 1086 H41 "Cytidine" 274
|
|
biotype 1087 H42 "Cytidine" 275
|
|
biotype 1088 H5 "Cytidine" 276
|
|
biotype 1089 H6 "Cytidine" 277
|
|
biotype 1090 O5* "Uridine" 316
|
|
biotype 1091 C5* "Uridine" 317
|
|
biotype 1092 H5*1 "Uridine" 318
|
|
biotype 1093 H5*2 "Uridine" 319
|
|
biotype 1094 C4* "Uridine" 320
|
|
biotype 1095 H4* "Uridine" 321
|
|
biotype 1096 O4* "Uridine" 322
|
|
biotype 1097 C1* "Uridine" 323
|
|
biotype 1098 H1* "Uridine" 324
|
|
biotype 1099 C3* "Uridine" 325
|
|
biotype 1100 H3* "Uridine" 326
|
|
biotype 1101 C2* "Uridine" 327
|
|
biotype 1102 H2* "Uridine" 328
|
|
biotype 1103 O2* "Uridine" 329
|
|
biotype 1104 HO* "Uridine" 330
|
|
biotype 1105 O3* "Uridine" 331
|
|
biotype 1106 N1 "Uridine" 305
|
|
biotype 1107 C2 "Uridine" 306
|
|
biotype 1108 N3 "Uridine" 307
|
|
biotype 1109 C4 "Uridine" 308
|
|
biotype 1110 C5 "Uridine" 309
|
|
biotype 1111 C6 "Uridine" 310
|
|
biotype 1112 O2 "Uridine" 311
|
|
biotype 1113 H3 "Uridine" 312
|
|
biotype 1114 O4 "Uridine" 313
|
|
biotype 1115 H5 "Uridine" 314
|
|
biotype 1116 H6 "Uridine" 315
|
|
biotype 1117 O5* "Deoxyadenosine" 363
|
|
biotype 1118 C5* "Deoxyadenosine" 364
|
|
biotype 1119 H5*1 "Deoxyadenosine" 365
|
|
biotype 1120 H5*2 "Deoxyadenosine" 366
|
|
biotype 1121 C4* "Deoxyadenosine" 367
|
|
biotype 1122 H4* "Deoxyadenosine" 368
|
|
biotype 1123 O4* "Deoxyadenosine" 369
|
|
biotype 1124 C1* "Deoxyadenosine" 370
|
|
biotype 1125 H1* "Deoxyadenosine" 371
|
|
biotype 1126 C3* "Deoxyadenosine" 372
|
|
biotype 1127 H3* "Deoxyadenosine" 373
|
|
biotype 1128 C2* "Deoxyadenosine" 374
|
|
biotype 1129 H2*1 "Deoxyadenosine" 375
|
|
biotype 1130 H2*2 "Deoxyadenosine" 376
|
|
biotype 1131 O3* "Deoxyadenosine" 377
|
|
biotype 1132 N9 "Deoxyadenosine" 252
|
|
biotype 1133 C4 "Deoxyadenosine" 253
|
|
biotype 1134 C5 "Deoxyadenosine" 254
|
|
biotype 1135 N7 "Deoxyadenosine" 255
|
|
biotype 1136 C8 "Deoxyadenosine" 256
|
|
biotype 1137 N3 "Deoxyadenosine" 257
|
|
biotype 1138 C2 "Deoxyadenosine" 258
|
|
biotype 1139 N1 "Deoxyadenosine" 259
|
|
biotype 1140 C6 "Deoxyadenosine" 260
|
|
biotype 1141 H2 "Deoxyadenosine" 261
|
|
biotype 1142 N6 "Deoxyadenosine" 262
|
|
biotype 1143 H61 "Deoxyadenosine" 263
|
|
biotype 1144 H62 "Deoxyadenosine" 264
|
|
biotype 1145 H8 "Deoxyadenosine" 265
|
|
biotype 1146 O5* "Deoxyguanosine" 363
|
|
biotype 1147 C5* "Deoxyguanosine" 364
|
|
biotype 1148 H5*1 "Deoxyguanosine" 365
|
|
biotype 1149 H5*2 "Deoxyguanosine" 366
|
|
biotype 1150 C4* "Deoxyguanosine" 367
|
|
biotype 1151 H4* "Deoxyguanosine" 368
|
|
biotype 1152 O4* "Deoxyguanosine" 369
|
|
biotype 1153 C1* "Deoxyguanosine" 370
|
|
biotype 1154 H1* "Deoxyguanosine" 371
|
|
biotype 1155 C3* "Deoxyguanosine" 372
|
|
biotype 1156 H3* "Deoxyguanosine" 373
|
|
biotype 1157 C2* "Deoxyguanosine" 374
|
|
biotype 1158 H2*1 "Deoxyguanosine" 375
|
|
biotype 1159 H2*2 "Deoxyguanosine" 376
|
|
biotype 1160 O3* "Deoxyguanosine" 377
|
|
biotype 1161 N9 "Deoxyguanosine" 278
|
|
biotype 1162 C4 "Deoxyguanosine" 279
|
|
biotype 1163 C5 "Deoxyguanosine" 280
|
|
biotype 1164 N7 "Deoxyguanosine" 281
|
|
biotype 1165 C8 "Deoxyguanosine" 282
|
|
biotype 1166 N3 "Deoxyguanosine" 283
|
|
biotype 1167 C2 "Deoxyguanosine" 284
|
|
biotype 1168 N1 "Deoxyguanosine" 285
|
|
biotype 1169 C6 "Deoxyguanosine" 286
|
|
biotype 1170 H1 "Deoxyguanosine" 287
|
|
biotype 1171 N2 "Deoxyguanosine" 288
|
|
biotype 1172 H21 "Deoxyguanosine" 289
|
|
biotype 1173 H22 "Deoxyguanosine" 290
|
|
biotype 1174 O6 "Deoxyguanosine" 291
|
|
biotype 1175 H8 "Deoxyguanosine" 292
|
|
biotype 1176 O5* "Deoxycytidine" 348
|
|
biotype 1177 C5* "Deoxycytidine" 349
|
|
biotype 1178 H5*1 "Deoxycytidine" 350
|
|
biotype 1179 H5*2 "Deoxycytidine" 351
|
|
biotype 1180 C4* "Deoxycytidine" 352
|
|
biotype 1181 H4* "Deoxycytidine" 353
|
|
biotype 1182 O4* "Deoxycytidine" 354
|
|
biotype 1183 C1* "Deoxycytidine" 355
|
|
biotype 1184 H1* "Deoxycytidine" 356
|
|
biotype 1185 C3* "Deoxycytidine" 357
|
|
biotype 1186 H3* "Deoxycytidine" 358
|
|
biotype 1187 C2* "Deoxycytidine" 359
|
|
biotype 1188 H2*1 "Deoxycytidine" 360
|
|
biotype 1189 H2*2 "Deoxycytidine" 361
|
|
biotype 1190 O3* "Deoxycytidine" 362
|
|
biotype 1191 N1 "Deoxycytidine" 266
|
|
biotype 1192 C2 "Deoxycytidine" 267
|
|
biotype 1193 N3 "Deoxycytidine" 268
|
|
biotype 1194 C4 "Deoxycytidine" 269
|
|
biotype 1195 C5 "Deoxycytidine" 270
|
|
biotype 1196 C6 "Deoxycytidine" 271
|
|
biotype 1197 O2 "Deoxycytidine" 272
|
|
biotype 1198 N4 "Deoxycytidine" 273
|
|
biotype 1199 H41 "Deoxycytidine" 274
|
|
biotype 1200 H42 "Deoxycytidine" 275
|
|
biotype 1201 H5 "Deoxycytidine" 276
|
|
biotype 1202 H6 "Deoxycytidine" 277
|
|
biotype 1203 O5* "Deoxythymidine" 348
|
|
biotype 1204 C5* "Deoxythymidine" 349
|
|
biotype 1205 H5*1 "Deoxythymidine" 350
|
|
biotype 1206 H5*2 "Deoxythymidine" 351
|
|
biotype 1207 C4* "Deoxythymidine" 352
|
|
biotype 1208 H4* "Deoxythymidine" 353
|
|
biotype 1209 O4* "Deoxythymidine" 354
|
|
biotype 1210 C1* "Deoxythymidine" 355
|
|
biotype 1211 H1* "Deoxythymidine" 356
|
|
biotype 1212 C3* "Deoxythymidine" 357
|
|
biotype 1213 H3* "Deoxythymidine" 358
|
|
biotype 1214 C2* "Deoxythymidine" 359
|
|
biotype 1215 H2*1 "Deoxythymidine" 360
|
|
biotype 1216 H2*2 "Deoxythymidine" 361
|
|
biotype 1217 O3* "Deoxythymidine" 362
|
|
biotype 1218 N1 "Deoxythymidine" 293
|
|
biotype 1219 C2 "Deoxythymidine" 294
|
|
biotype 1220 N3 "Deoxythymidine" 295
|
|
biotype 1221 C4 "Deoxythymidine" 296
|
|
biotype 1222 C5 "Deoxythymidine" 297
|
|
biotype 1223 C6 "Deoxythymidine" 298
|
|
biotype 1224 O2 "Deoxythymidine" 299
|
|
biotype 1225 H3 "Deoxythymidine" 300
|
|
biotype 1226 O4 "Deoxythymidine" 301
|
|
biotype 1227 C7 "Deoxythymidine" 302
|
|
biotype 1228 H7 "Deoxythymidine" 303
|
|
biotype 1229 H6 "Deoxythymidine" 304
|
|
biotype 1230 P "Phosphodiester RNA" 378
|
|
biotype 1231 OP "Phosphodiester RNA" 379
|
|
biotype 1232 O5* "5'-Hydroxyl RNA" 380
|
|
biotype 1233 H5T "5'-Hydroxyl RNA" 381
|
|
biotype 1234 O5* "5'-Monophosphate OS RNA" 382
|
|
biotype 1235 P "5'-Monophosphate P RNA" 383
|
|
biotype 1236 OP "5'-Monophosphate OP RNA" 384
|
|
biotype 1237 O3* "3'-Hydroxyl RNA" 385
|
|
biotype 1238 H3T "3'-Hydroxyl RNA" 386
|
|
biotype 1239 O3* "3'-Monophosphate OS RNA" 387
|
|
biotype 1240 P "3'-Monophosphate P RNA" 388
|
|
biotype 1241 OP "3'-Monophosphate OP RNA" 389
|
|
biotype 1242 P "Phosphodiester DNA" 390
|
|
biotype 1243 OP "Phosphodiester DNA" 391
|
|
biotype 1244 O5* "5'-Hydroxyl DNA" 392
|
|
biotype 1245 H5T "5'-Hydroxyl DNA" 393
|
|
biotype 1246 O5* "5'-Monophosphate OS DNA" 394
|
|
biotype 1247 P "5'-Monophosphate P DNA" 395
|
|
biotype 1248 OP "5'-Monophosphate OP DNA" 396
|
|
biotype 1249 O3* "3'-Hydroxyl DNA" 397
|
|
biotype 1250 H3T "3'-Hydroxyl DNA" 398
|
|
biotype 1251 O3* "3'-Monophosphate OS DNA" 399
|
|
biotype 1252 P "3'-Monophosphate P DNA" 400
|
|
biotype 1253 OP "3'-Monophosphate OP DNA" 401
|
|
biotype 2001 O "Water" 402
|
|
biotype 2002 H "Water" 403
|
|
biotype 2003 LI "Lithium Ion" 404
|
|
biotype 2004 NA "Sodium Ion" 405
|
|
biotype 2005 K "Potassium Ion" 406
|
|
biotype 2006 RB "Rubidium Ion" 407
|
|
biotype 2007 CS "Cesium Ion" 408
|
|
biotype 2008 MG "Magnesium Ion" 410
|
|
biotype 2009 CA "Calcium Ion" 411
|
|
biotype 2012 F "Fluoride Ion" 413
|
|
biotype 2013 CL "Chloride Ion" 414
|
|
biotype 2014 BR "Bromide Ion" 415
|
|
biotype 2015 I "Iodide Ion" 416
|