mirror of
https://github.com/openmm/openmm
synced 2026-06-03 06:39:48 +09:00
eaf56f96bc
* Correct AmoebaAngleTorsion in test_Amoeba18Nucleic of TestForceField * Update processTinkerForceField to handle latest .prm Tinker files * Update amoeba2018 XML files * Update amoeba2013 XML files * Update amoeba2009 XML files * Adapt addTorTor to new format in the .prm files * Fix TorsionTorsion * Also update the total energy in test_Amoeba18Nucleic * Update amoebabio18.prm * Fix nucleic acid test energies * Correct AmoebaAngleTorsionForce params * Add new addTorTor to TinkerFiles * Revert unit fix * Change to .pdb file which Tinker likes * Update test_Amoeba18BPTI * Remove trailing zeros from XML files * Leave trailing zeros only on 2018 ff * New element names in 2018 * More digits for surfaceAreaFactor * More digits for surfaceAreaFactor * More digits * Remove debugging print * Add support to 2009 and 2013 AMOEBA ffs to processTinkerForceField.py * Add FF specific residues XML files * Delete old residuesFinal.xml * Update AMOEBA XML ffs * Update FFs * Fix some formatting issues * Fix "." in scientific notation * Remove old assertions
7165 lines
429 KiB
Promela
7165 lines
429 KiB
Promela
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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-2018
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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 0.8
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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 2018 AMOEBA biopolymer force field, with contents
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combined from the 2013 AMOEBA protein parameters and the 2017 AMOEBA nucleic
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acid parameters as described in the two articles listed immediately below:
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Y. Shi, Z. Xia, J. Zhang, R. Best, J. W. Ponder and P. Ren, "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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C. Zhang, C. Lu, Z. Jing, C. Wu, J.-P. Piquemal, J. W. Ponder and P. Ren,
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"AMOEBA Polarizable Atomic Multipole Force Field for Nucleic Acids",
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J. Chem. Theory Comput., 14, 2084-2108 (2018)
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R. A. Corrigan, G. Qi, A. C. Thiel, J. R. Lynn, B. D. Walker, T. L. Casavant,
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L. Lagardere, J.-P. Piquemal, J. W. Ponder, P. Ren and M. J. Schnieders,
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"Implicit Solvents for the Polarizable Atomic Multipole AMOEBA Force Field",
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J. Chem. Theory Comput., 17, 2323-2341 (2021)
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##################################################
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## ##
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## AMOEBA Biopolymer 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 Carbonyl Oxygen ##
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## 34 Carboxylic Acid Hydroxyl Oxygen ##
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## 35 Carboxylic Acid Hydrogen ##
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## 36 Lysine/Ornithine Gamma Carbon ##
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## 37 Ammonium Nitrogen ##
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## 38 Ammonium 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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## 43-64 Nucleotide Bases (ACGTU) ##
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## 65-74 Ribose Sugar Ring ##
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## 75-83 Deoxyribose Sugar Ring ##
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## 84-89 DNA/RNA Terminal Groups ##
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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 14.007 3
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atom 2 2 CA "Glycine CA" 6 12.011 4
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atom 3 3 C "Glycine C" 6 12.011 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 15.999 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 14.007 3
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atom 8 7 CA "Alanine CA" 6 12.011 4
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atom 9 3 C "Alanine C" 6 12.011 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 15.999 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 12.011 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 12.011 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 12.011 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 12.011 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 12.011 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 12.011 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 12.011 4
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atom 26 6 H "Isoleucine HB" 1 1.008 1
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atom 27 8 C "Isoleucine CG1" 6 12.011 4
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atom 28 9 H "Isoleucine HG1" 1 1.008 1
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atom 29 8 C "Isoleucine CG2" 6 12.011 4
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atom 30 9 H "Isoleucine HG2" 1 1.008 1
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atom 31 8 C "Isoleucine CD" 6 12.011 4
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atom 32 9 H "Isoleucine HD" 1 1.008 1
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atom 33 8 C "Serine CB" 6 12.011 4
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atom 34 9 H "Serine HB" 1 1.008 1
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atom 35 10 OH "Serine OG" 8 15.999 2
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atom 36 11 HO "Serine HG" 1 1.008 1
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atom 37 7 C "Threonine CB" 6 12.011 4
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atom 38 6 H "Threonine HB" 1 1.008 1
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atom 39 10 OH "Threonine OG1" 8 15.999 2
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atom 40 11 HO "Threonine HG1" 1 1.008 1
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atom 41 8 C "Threonine CG2" 6 12.011 4
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atom 42 9 H "Threonine HG2" 1 1.008 1
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atom 43 8 C "Cysteine CB" 6 12.011 4
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atom 44 9 H "Cysteine HB" 1 1.008 1
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atom 45 12 SH "Cysteine SG" 16 32.066 2
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atom 46 13 HS "Cysteine HG" 1 1.008 1
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atom 47 12 SS "Cystine SG" 16 32.066 2
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atom 48 7 CA "Cysteine Anion CA" 6 12.011 4
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atom 49 14 S "Cysteine Anion S-" 16 32.066 1
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atom 50 15 N "Proline N" 7 14.007 3
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atom 51 7 CA "Proline CA" 6 12.011 4
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atom 52 3 C "Proline C" 6 12.011 3
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atom 53 5 O "Proline O" 8 15.999 1
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atom 54 6 H "Proline HA" 1 1.008 1
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atom 55 16 C "Proline CB" 6 12.011 4
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atom 56 9 H "Proline HB" 1 1.008 1
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atom 57 16 C "Proline CG" 6 12.011 4
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atom 58 9 H "Proline HG" 1 1.008 1
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atom 59 16 C "Proline CD" 6 12.011 4
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atom 60 6 H "Proline HD" 1 1.008 1
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atom 61 8 C "Phenylalanine CB" 6 12.011 4
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atom 62 9 H "Phenylalanine HB" 1 1.008 1
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atom 63 17 C "Phenylalanine CG" 6 12.011 3
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atom 64 17 C "Phenylalanine CD" 6 12.011 3
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atom 65 18 H "Phenylalanine HD" 1 1.008 1
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atom 66 17 C "Phenylalanine CE" 6 12.011 3
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atom 67 18 H "Phenylalanine HE" 1 1.008 1
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atom 68 17 C "Phenylalanine CZ" 6 12.011 3
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atom 69 18 H "Phenylalanine HZ" 1 1.008 1
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atom 70 8 C "Tyrosine CB" 6 12.011 4
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atom 71 9 H "Tyrosine HB" 1 1.008 1
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atom 72 17 C "Tyrosine CG" 6 12.011 3
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atom 73 17 C "Tyrosine CD" 6 12.011 3
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atom 74 18 H "Tyrosine HD" 1 1.008 1
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atom 75 17 C "Tyrosine CE" 6 12.011 3
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atom 76 18 H "Tyrosine HE" 1 1.008 1
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atom 77 17 C "Tyrosine CZ" 6 12.011 3
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atom 78 19 OH "Tyrosine OH" 8 15.999 2
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atom 79 20 HO "Tyrosine HH" 1 1.008 1
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atom 80 8 C "Tyrosine Anion CB" 6 12.011 4
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atom 81 9 H "Tyrosine Anion HB" 1 1.008 1
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atom 82 17 C "Tyrosine Anion CG" 6 12.011 3
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atom 83 17 C "Tyrosine Anion CD" 6 12.011 3
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atom 84 18 H "Tyrosine Anion HD" 1 1.008 1
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atom 85 17 C "Tyrosine Anion CE" 6 12.011 3
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atom 86 18 H "Tyrosine Anion HE" 1 1.008 1
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atom 87 17 C "Tyrosine Anion CZ" 6 12.011 3
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atom 88 21 O- "Tyrosine Anion O-" 8 15.999 1
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atom 89 8 C "Tryptophan CB" 6 12.011 4
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atom 90 9 H "Tryptophan HB" 1 1.008 1
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atom 91 22 C "Tryptophan CG" 6 12.011 3
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atom 92 22 C "Tryptophan CD1" 6 12.011 3
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atom 93 23 H "Tryptophan HD1" 1 1.008 1
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atom 94 22 C "Tryptophan CD2" 6 12.011 3
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atom 95 24 N "Tryptophan NE1" 7 14.007 3
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atom 96 25 HN "Tryptophan HE1" 1 1.008 1
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atom 97 22 C "Tryptophan CE2" 6 12.011 3
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atom 98 22 C "Tryptophan CE3" 6 12.011 3
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atom 99 23 H "Tryptophan HE3" 1 1.008 1
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atom 100 22 C "Tryptophan CZ2" 6 12.011 3
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atom 101 23 H "Tryptophan HZ2" 1 1.008 1
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atom 102 22 C "Tryptophan CZ3" 6 12.011 3
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atom 103 23 H "Tryptophan HZ3" 1 1.008 1
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atom 104 22 C "Tryptophan CH2" 6 12.011 3
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atom 105 23 H "Tryptophan HH2" 1 1.008 1
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atom 106 8 C "Histidine (+) CB" 6 12.011 4
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atom 107 9 H "Histidine (+) HB" 1 1.008 1
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atom 108 26 C "Histidine (+) CG" 6 12.011 3
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atom 109 24 N "Histidine (+) ND1" 7 14.007 3
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atom 110 25 HN "Histidine (+) HD1" 1 1.008 1
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atom 111 26 C "Histidine (+) CD2" 6 12.011 3
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atom 112 27 H "Histidine (+) HD2" 1 1.008 1
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atom 113 28 C "Histidine (+) CE1" 6 12.011 3
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atom 114 27 H "Histidine (+) HE1" 1 1.008 1
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atom 115 24 N "Histidine (+) NE2" 7 14.007 3
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atom 116 25 HN "Histidine (+) HE2" 1 1.008 1
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atom 117 8 C "Histidine (HD) CB" 6 12.011 4
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atom 118 9 H "Histidine (HD) HB" 1 1.008 1
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atom 119 26 C "Histidine (HD) CG" 6 12.011 3
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atom 120 24 N "Histidine (HD) ND1" 7 14.007 3
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atom 121 25 HN "Histidine (HD) HD1" 1 1.008 1
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atom 122 26 C "Histidine (HD) CD2" 6 12.011 3
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atom 123 27 H "Histidine (HD) HD2" 1 1.008 1
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atom 124 28 C "Histidine (HD) CE1" 6 12.011 3
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atom 125 27 H "Histidine (HD) HE1" 1 1.008 1
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atom 126 29 N "Histidine (HD) NE2" 7 14.007 2
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atom 127 8 C "Histidine (HE) CB" 6 12.011 4
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atom 128 9 H "Histidine (HE) HB" 1 1.008 1
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atom 129 26 C "Histidine (HE) CG" 6 12.011 3
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atom 130 29 N "Histidine (HE) ND1" 7 14.007 2
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atom 131 26 C "Histidine (HE) CD2" 6 12.011 3
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atom 132 27 H "Histidine (HE) HD2" 1 1.008 1
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atom 133 28 C "Histidine (HE) CE1" 6 12.011 3
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atom 134 27 H "Histidine (HE) HE1" 1 1.008 1
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atom 135 24 N "Histidine (HE) NE2" 7 14.007 3
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atom 136 25 HN "Histidine (HE) HE2" 1 1.008 1
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atom 137 8 C "Aspartate CB" 6 12.011 4
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atom 138 9 H "Aspartate HB" 1 1.008 1
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atom 139 30 C "Aspartate CG" 6 12.011 3
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atom 140 31 O "Aspartate OD" 8 15.999 1
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atom 141 8 C "Aspartic Acid CB" 6 12.011 4
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atom 142 9 H "Aspartic Acid HB" 1 1.008 1
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atom 143 32 C "Aspartic Acid CG" 6 12.011 3
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atom 144 33 O "Aspartic Acid OD1" 8 15.999 1
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atom 145 34 OH "Aspartic Acid OD2" 8 15.999 2
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atom 146 35 HO "Aspartic Acid HD2" 1 1.008 1
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atom 147 8 C "Asparagine CB" 6 12.011 4
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atom 148 9 H "Asparagine HB" 1 1.008 1
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atom 149 3 C "Asparagine CG" 6 12.011 3
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atom 150 5 O "Asparagine OD1" 8 15.999 1
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atom 151 1 N "Asparagine ND2" 7 14.007 3
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atom 152 4 HN "Asparagine HD2" 1 1.008 1
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atom 153 8 C "Glutamate CB" 6 12.011 4
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atom 154 9 H "Glutamate HB" 1 1.008 1
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atom 155 8 C "Glutamate CG" 6 12.011 4
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atom 156 9 H "Glutamate HG" 1 1.008 1
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atom 157 30 C "Glutamate CD" 6 12.011 3
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atom 158 31 O "Glutamate OE" 8 15.999 1
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atom 159 8 C "Glutamic Acid CB" 6 12.011 4
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atom 160 9 H "Glutamic Acid HB" 1 1.008 1
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atom 161 8 C "Glutamic Acid CG" 6 12.011 4
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atom 162 9 H "Glutamic Acid HG" 1 1.008 1
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atom 163 32 C "Glutamic Acid CD" 6 12.011 3
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atom 164 33 O "Glutamic Acid OE1" 8 15.999 1
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atom 165 34 O "Glutamic Acid OE2" 8 15.999 2
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atom 166 35 H "Glutamic Acid HE2" 1 1.008 1
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atom 167 8 C "Glutamine CB" 6 12.011 4
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atom 168 9 H "Glutamine HB" 1 1.008 1
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atom 169 8 C "Glutamine CG" 6 12.011 4
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atom 170 9 H "Glutamine HG" 1 1.008 1
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atom 171 3 C "Glutamine CD" 6 12.011 3
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atom 172 5 O "Glutamine OE1" 8 15.999 1
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atom 173 1 N "Glutamine NE2" 7 14.007 3
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atom 174 4 HN "Glutamine HE2" 1 1.008 1
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atom 175 8 C "Methionine CB" 6 12.011 4
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atom 176 9 H "Methionine HB" 1 1.008 1
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atom 177 8 C "Methionine CG" 6 12.011 4
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atom 178 9 H "Methionine HG" 1 1.008 1
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atom 179 12 S "Methionine SD" 16 32.066 2
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atom 180 8 C "Methionine CE" 6 12.011 4
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atom 181 9 H "Methionine HE" 1 1.008 1
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atom 182 8 C "Lysine CB" 6 12.011 4
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atom 183 9 H "Lysine HB" 1 1.008 1
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atom 184 36 C "Lysine CG" 6 12.011 4
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atom 185 9 H "Lysine HG" 1 1.008 1
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atom 186 8 C "Lysine CD" 6 12.011 4
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atom 187 9 H "Lysine HD" 1 1.008 1
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atom 188 8 C "Lysine CE" 6 12.011 4
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atom 189 9 H "Lysine HE" 1 1.008 1
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atom 190 37 N "Lysine NZ" 7 14.007 4
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atom 191 38 HN "Lysine HN" 1 1.008 1
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atom 192 8 C "Lysine (Neutral) CB" 6 12.011 4
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atom 193 9 H "Lysine (Neutral) HB" 1 1.008 1
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atom 194 36 C "Lysine (Neutral) CG" 6 12.011 4
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atom 195 9 H "Lysine (Neutral) HG" 1 1.008 1
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atom 196 8 C "Lysine (Neutral) CD" 6 12.011 4
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atom 197 9 H "Lysine (Neutral) HD" 1 1.008 1
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atom 198 8 C "Lysine (Neutral) CE" 6 12.011 4
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atom 199 9 H "Lysine (Neutral) HE" 1 1.008 1
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atom 200 37 N "Lysine (Neutral) NZ" 7 14.007 3
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atom 201 38 HN "Lysine (Neutral) HN" 1 1.008 1
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atom 202 8 C "Arginine CB" 6 12.011 4
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atom 203 9 H "Arginine HB" 1 1.008 1
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atom 204 8 C "Arginine CG" 6 12.011 4
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atom 205 9 H "Arginine HG" 1 1.008 1
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atom 206 8 C "Arginine CD" 6 12.011 4
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atom 207 9 H "Arginine HD" 1 1.008 1
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atom 208 1 N "Arginine NE" 7 14.007 3
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atom 209 4 HN "Arginine HE" 1 1.008 1
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atom 210 39 C "Arginine CZ" 6 12.011 3
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atom 211 1 N "Arginine NH" 7 14.007 3
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atom 212 4 HN "Arginine HH" 1 1.008 1
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atom 213 8 C "Ornithine CB" 6 12.011 4
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atom 214 9 H "Ornithine HB" 1 1.008 1
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atom 215 36 C "Ornithine CG" 6 12.011 4
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atom 216 9 H "Ornithine HG" 1 1.008 1
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atom 217 8 C "Ornithine CD" 6 12.011 4
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atom 218 9 H "Ornithine HD" 1 1.008 1
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atom 219 37 N "Ornithine NE" 7 14.007 4
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atom 220 38 HN "Ornithine HE" 1 1.008 1
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atom 221 40 C "Acetyl Cap CH3" 6 12.011 4
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atom 222 6 H "Acetyl Cap H3C" 1 1.008 1
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atom 223 3 C "Acetyl Cap C" 6 12.011 3
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atom 224 5 O "Acetyl Cap O" 8 15.999 1
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atom 225 1 N "Amide Cap NH2" 7 14.007 3
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atom 226 4 HN "Amide Cap H2N" 1 1.008 1
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atom 227 1 N "N-MeAmide Cap N" 7 14.007 3
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atom 228 4 HN "N-MeAmide Cap HN" 1 1.008 1
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atom 229 40 C "N-MeAmide Cap CH3" 6 12.011 4
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atom 230 6 H "N-MeAmide Cap H3C" 1 1.008 1
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atom 231 41 N "N-Terminal NH3+" 7 14.007 4
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atom 232 42 H "N-Terminal H3N+" 1 1.008 1
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atom 233 30 C "C-Terminal COO-" 6 12.011 3
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atom 234 31 O "C-Terminal COO-" 8 15.999 1
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|
atom 235 32 C "C-Terminal COOH C=O" 6 12.011 3
|
|
atom 236 33 O "C-Terminal COOH O=C" 8 15.999 1
|
|
atom 237 34 OH "C-Terminal COOH OH" 8 15.999 2
|
|
atom 238 35 HO "C-Terminal COOH HO" 1 1.008 1
|
|
atom 239 41 N "N-Terminal PRO NH2+" 7 14.007 4
|
|
atom 240 42 HN "N-Terminal PRO H2N+" 1 1.008 1
|
|
atom 241 7 CA "N-Terminal PRO CA" 6 12.011 4
|
|
atom 242 3 C "N-Terminal PRO C" 6 12.011 3
|
|
atom 243 5 O "N-Terminal PRO O" 8 15.999 1
|
|
atom 244 6 H "N-Terminal PRO HA" 1 1.008 1
|
|
atom 245 16 C "N-Terminal PRO CD" 6 12.011 4
|
|
atom 246 6 H "N-Terminal PRO HD" 1 1.008 1
|
|
atom 247 43 C "Adenine C4" 6 12.011 3
|
|
atom 248 44 C "Adenine C8" 6 12.011 3
|
|
atom 249 45 C "Adenine C6" 6 12.011 3
|
|
atom 250 43 C "Adenine C5" 6 12.011 3
|
|
atom 251 46 N "Adenine N9 RNA" 7 14.007 3
|
|
atom 252 46 N "Adenine N9 DNA" 7 14.007 3
|
|
atom 253 47 N "Adenine N6" 7 14.007 3
|
|
atom 254 48 C "Adenine C2" 6 12.011 3
|
|
atom 255 49 N "Adenine N7" 7 14.007 2
|
|
atom 256 50 N "Adenine N3" 7 14.007 2
|
|
atom 257 50 N "Adenine N1" 7 14.007 2
|
|
atom 258 51 H "Adenine H8" 1 1.008 1
|
|
atom 259 52 H "Adenine H2" 1 1.008 1
|
|
atom 260 53 H "Adenine H61" 1 1.008 1
|
|
atom 261 54 N "Cytosine N1 RNA" 7 14.007 3
|
|
atom 262 54 N "Cytosine N1 DNA" 7 14.007 3
|
|
atom 263 55 C "Cytosine C5" 6 12.011 3
|
|
atom 264 47 N "Cytosine N4" 7 14.007 3
|
|
atom 265 48 C "Cytosine C6" 6 12.011 3
|
|
atom 266 56 C "Cytosine C2" 6 12.011 3
|
|
atom 267 45 C "Cytosine C4" 6 12.011 3
|
|
atom 268 50 N "Cytosine N3" 7 14.007 2
|
|
atom 269 57 H "Cytosine H5" 1 1.008 1
|
|
atom 270 58 O "Cytosine O2" 8 15.999 1
|
|
atom 271 51 H "Cytosine H6" 1 1.008 1
|
|
atom 272 53 H "Cytosine H41" 1 1.008 1
|
|
atom 273 59 C "Guanine C2" 6 12.011 3
|
|
atom 274 56 C "Guanine C6" 6 12.011 3
|
|
atom 275 43 C "Guanine C4" 6 12.011 3
|
|
atom 276 44 C "Guanine C8" 6 12.011 3
|
|
atom 277 54 N "Guanine N1" 7 14.007 3
|
|
atom 278 47 N "Guanine N2" 7 14.007 3
|
|
atom 279 43 C "Guanine C5" 6 12.011 3
|
|
atom 280 60 N "Guanine N9 RNA" 7 14.007 3
|
|
atom 281 60 N "Guanine N9 DNA" 7 14.007 3
|
|
atom 282 49 N "Guanine N7" 7 14.007 2
|
|
atom 283 50 N "Guanine N3" 7 14.007 2
|
|
atom 284 61 H "Guanine H1" 1 1.008 1
|
|
atom 285 58 O "Guanine O6" 8 15.999 1
|
|
atom 286 51 H "Guanine H8" 1 1.008 1
|
|
atom 287 53 H "Guanine H21" 1 1.008 1
|
|
atom 288 62 C "Thymine C7" 6 12.011 4
|
|
atom 289 48 C "Thymine C5" 6 12.011 3
|
|
atom 290 56 C "Thymine C4" 6 12.011 3
|
|
atom 291 48 C "Thymine C6" 6 12.011 3
|
|
atom 292 63 N "Thymine N1" 7 14.007 3
|
|
atom 293 54 N "Thymine N3" 7 14.007 3
|
|
atom 294 56 C "Thymine C2" 6 12.011 3
|
|
atom 295 64 H "Thymine H7" 1 1.008 1
|
|
atom 296 58 O "Thymine O2" 8 15.999 1
|
|
atom 297 51 H "Thymine H6" 1 1.008 1
|
|
atom 298 58 O "Thymine O4" 8 15.999 1
|
|
atom 299 61 H "Thymine H3" 1 1.008 1
|
|
atom 300 56 C "Uracil C2" 6 12.011 3
|
|
atom 301 48 C "Uracil C6" 6 12.011 3
|
|
atom 302 56 C "Uracil C4" 6 12.011 3
|
|
atom 303 54 N "Uracil N3" 7 14.007 3
|
|
atom 304 63 N "Uracil N1" 7 14.007 3
|
|
atom 305 48 C "Uracil C5" 6 12.011 3
|
|
atom 306 61 H "Uracil H3" 1 1.008 1
|
|
atom 307 52 H "Uracil H5" 1 1.008 1
|
|
atom 308 58 O "Uracil O2" 8 15.999 1
|
|
atom 309 58 O "Uracil O4" 8 15.999 1
|
|
atom 310 51 H "Uracil H6" 1 1.008 1
|
|
atom 311 65 O "Ribose O4'" 8 15.999 2
|
|
atom 312 66 C "Ribose C4'" 6 12.011 4
|
|
atom 313 67 H "Ribose H4'" 1 1.008 1
|
|
atom 314 68 C "Ribose C1'" 6 12.011 4
|
|
atom 315 67 H "Ribose H1'" 1 1.008 1
|
|
atom 316 68 C "Ribose C2'" 6 12.011 4
|
|
atom 317 67 H "Ribose H2'1" 1 1.008 1
|
|
atom 318 68 C "Ribose C3'" 6 12.011 4
|
|
atom 319 67 H "Ribose H3'" 1 1.008 1
|
|
atom 320 69 O "Ribose O2'" 8 15.999 2
|
|
atom 321 70 H "Ribose HO'2" 1 1.008 1
|
|
atom 322 71 O "Ribose O3'" 8 15.999 2
|
|
atom 323 70 H "Ribose HO'3" 1 1.008 1
|
|
atom 324 72 C "Ribose C5'" 6 12.011 4
|
|
atom 325 73 H "Ribose H5'" 1 1.008 1
|
|
atom 326 74 O "Ribose O5'" 8 15.999 2
|
|
atom 327 70 H "Ribose HO'5" 1 1.008 1
|
|
atom 328 75 C "Deoxyribose C4'" 6 12.011 4
|
|
atom 329 76 C "Deoxyribose C3'" 6 12.011 4
|
|
atom 330 76 C "Deoxyribose C2'" 6 12.011 4
|
|
atom 331 76 C "Deoxyribose C1'" 6 12.011 4
|
|
atom 332 77 O "Deoxyribose O4'" 8 15.999 2
|
|
atom 333 78 H "Deoxyribose H2'1" 1 1.008 1
|
|
atom 334 78 H "Deoxyribose H1'" 1 1.008 1
|
|
atom 335 78 H "Deoxyribose H3'" 1 1.008 1
|
|
atom 336 78 H "Deoxyribose H4'" 1 1.008 1
|
|
atom 337 79 C "Deoxyribose C5'" 6 12.011 4
|
|
atom 338 80 O "Deoxyribose O3'" 8 15.999 2
|
|
atom 339 81 H "Deoxyribose HO'3" 1 1.008 1
|
|
atom 340 82 H "Deoxyribose H5'1" 1 1.008 1
|
|
atom 341 83 O "Deoxyribose O5'" 8 15.999 2
|
|
atom 342 81 H "Deoxyribose HO'5" 1 1.008 1
|
|
atom 343 84 P "Phosphodiester P" 15 30.974 4
|
|
atom 344 85 O "Phosphodiester OP" 8 15.999 1
|
|
atom 345 86 O "R-5'-Hydroxyl O5'T" 8 15.999 2
|
|
atom 346 87 O "R-3'-Hydroxyl O3'T" 8 15.999 2
|
|
atom 347 88 O "D-3'-Hydroxyl O3'T" 8 15.999 2
|
|
atom 348 89 O "D-5'-Hydroxyl O5'T" 8 15.999 2
|
|
atom 349 90 O "AMOEBA Water O" 8 15.999 2
|
|
atom 350 91 H "AMOEBA Water H" 1 1.008 1
|
|
atom 351 92 Li+ "Lithium Ion Li+" 3 6.941 0
|
|
atom 352 93 Na+ "Sodium Ion Na+" 11 22.990 0
|
|
atom 353 94 K+ "Potassium Ion K+" 19 39.098 0
|
|
atom 354 95 Rb+ "Rubidium Ion Rb+" 37 85.468 0
|
|
atom 355 96 Cs+ "Cesium Ion Cs+" 55 132.905 0
|
|
atom 356 97 Be2 "Beryllium Ion Be+2" 4 9.012 0
|
|
atom 357 98 Mg2 "Magnesium Ion Mg+2" 12 24.305 0
|
|
atom 358 99 Ca2 "Calcium Ion Ca+2" 20 40.078 0
|
|
atom 359 100 Sr2 "Strontium Ion Sr+2" 38 87.620 0
|
|
atom 360 101 Ba2 "Barium Ion Ba+2" 56 137.330 0
|
|
atom 361 102 Zn2 "Zinc Ion Zn+2" 30 65.380 0
|
|
atom 362 103 F- "Fluoride Ion F-" 9 18.998 0
|
|
atom 363 104 Cl- "Chloride Ion Cl-" 17 35.453 0
|
|
atom 364 105 Br- "Bromide Ion Br-" 35 79.904 0
|
|
atom 365 106 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 4.0050 0.3550
|
|
vdw 14 4.2000 0.3550
|
|
vdw 13 3.0000 0.0265 0.980
|
|
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 3.5500 0.0950
|
|
vdw 32 3.8200 0.1060
|
|
vdw 33 3.3000 0.1120
|
|
vdw 34 3.4050 0.1100
|
|
vdw 35 2.6550 0.0150 0.910
|
|
vdw 36 3.8200 0.1010
|
|
vdw 37 3.8100 0.1050
|
|
vdw 38 2.4800 0.0130 0.910
|
|
vdw 39 3.6500 0.1010
|
|
vdw 40 3.8200 0.1010
|
|
vdw 41 3.7600 0.1050
|
|
vdw 42 2.7000 0.0200 0.910
|
|
vdw 43 3.7200 0.1120
|
|
vdw 44 3.7400 0.1060
|
|
vdw 45 3.7200 0.1060
|
|
vdw 46 3.7000 0.1270
|
|
vdw 47 3.6000 0.1240
|
|
vdw 48 3.7400 0.1060
|
|
vdw 49 3.6400 0.1270
|
|
vdw 50 3.6400 0.1270
|
|
vdw 51 2.9500 0.0290 0.920
|
|
vdw 52 3.0800 0.0290 0.920
|
|
vdw 53 2.6500 0.0200 0.880
|
|
vdw 54 3.7000 0.1270
|
|
vdw 55 3.7900 0.1060
|
|
vdw 56 3.7200 0.0950
|
|
vdw 57 3.0500 0.0290 0.910
|
|
vdw 58 3.3500 0.1290
|
|
vdw 59 3.7200 0.1060
|
|
vdw 60 3.7000 0.1270
|
|
vdw 61 2.6500 0.0200 0.890
|
|
vdw 62 3.8000 0.1010
|
|
vdw 63 3.7000 0.1270
|
|
vdw 64 2.9000 0.0250 0.910
|
|
vdw 65 3.4050 0.1120
|
|
vdw 66 3.8200 0.1010
|
|
vdw 67 2.8900 0.0240 0.920
|
|
vdw 68 3.8200 0.1010
|
|
vdw 69 3.4050 0.1120
|
|
vdw 70 2.6550 0.0135 0.910
|
|
vdw 71 3.4500 0.1080
|
|
vdw 72 3.8200 0.1010
|
|
vdw 73 2.9400 0.0240 0.920
|
|
vdw 74 3.4500 0.1080
|
|
vdw 75 3.8200 0.1010
|
|
vdw 76 3.8200 0.1010
|
|
vdw 77 3.4050 0.1120
|
|
vdw 78 2.8900 0.0240 0.920
|
|
vdw 79 3.8200 0.1010
|
|
vdw 80 3.4500 0.1080
|
|
vdw 81 2.6550 0.0135 0.910
|
|
vdw 82 2.9400 0.0240 0.920
|
|
vdw 83 3.4500 0.1080
|
|
vdw 84 4.4500 0.3000
|
|
vdw 85 3.4000 0.1100
|
|
vdw 86 3.4050 0.1120
|
|
vdw 87 3.4050 0.1120
|
|
vdw 88 3.4050 0.1120
|
|
vdw 89 3.4050 0.1120
|
|
vdw 90 3.4050 0.1100
|
|
vdw 91 2.6550 0.0135 0.910
|
|
vdw 92 2.2000 0.0660
|
|
vdw 93 2.9550 0.2800
|
|
vdw 94 3.6800 0.3500
|
|
vdw 95 3.9000 0.3800
|
|
vdw 96 4.1400 0.4200
|
|
vdw 97 1.8800 0.0910
|
|
vdw 98 2.9000 0.2800
|
|
vdw 99 3.5900 0.3500
|
|
vdw 100 3.8700 0.3850
|
|
vdw 101 4.2000 0.4200
|
|
vdw 102 2.6800 0.2220
|
|
vdw 103 3.4300 0.2500
|
|
vdw 104 4.1200 0.3400
|
|
vdw 105 4.3200 0.4300
|
|
vdw 106 4.6100 0.5200
|
|
|
|
|
|
#####################################
|
|
## ##
|
|
## Van der Waals Pair Parameters ##
|
|
## ##
|
|
#####################################
|
|
|
|
|
|
vdwpair 4 31 3.1000 0.0400
|
|
vdwpair 5 98 3.0000 0.1530
|
|
vdwpair 5 99 3.2700 0.1750
|
|
vdwpair 5 102 2.8900 0.1750
|
|
vdwpair 14 102 3.8810 0.1330
|
|
vdwpair 21 102 2.7920 0.1330
|
|
vdwpair 31 102 2.5190 0.1330
|
|
vdwpair 37 102 2.6120 0.1330
|
|
vdwpair 49 93 3.3870 0.2400
|
|
vdwpair 49 94 3.6760 0.2900
|
|
vdwpair 49 98 3.4250 0.2150
|
|
vdwpair 50 93 3.3870 0.2400
|
|
vdwpair 50 94 3.6760 0.2900
|
|
vdwpair 50 98 3.4250 0.2150
|
|
vdwpair 58 98 3.2130 0.1820
|
|
vdwpair 94 104 4.2360 0.1512
|
|
vdwpair 94 105 4.3790 0.1664
|
|
vdwpair 94 106 4.6360 0.1720
|
|
vdwpair 95 104 4.3150 0.1859
|
|
vdwpair 95 105 4.4480 0.2068
|
|
vdwpair 95 106 4.6900 0.2145
|
|
vdwpair 96 104 4.3450 0.2894
|
|
vdwpair 96 105 4.4750 0.3307
|
|
vdwpair 96 106 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 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 32 345.00 1.5090
|
|
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 32 345.00 1.5090
|
|
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 14 215.80 1.8130
|
|
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 32 345.00 1.5090
|
|
bond 8 36 323.00 1.5250
|
|
bond 8 37 381.30 1.4480
|
|
bond 9 16 341.00 1.1120
|
|
bond 9 36 341.00 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 32 33 705.00 1.2255
|
|
bond 32 34 431.60 1.3498
|
|
bond 34 35 514.40 0.9737
|
|
bond 37 38 461.90 1.0150
|
|
bond 41 42 461.90 1.0150
|
|
bond 43 43 268.00 1.4040
|
|
bond 43 45 340.00 1.4060
|
|
bond 43 46 340.00 1.3700
|
|
bond 43 49 460.00 1.3720
|
|
bond 43 50 340.00 1.3500
|
|
bond 43 56 340.00 1.4370
|
|
bond 43 60 340.00 1.3700
|
|
bond 44 46 400.00 1.3620
|
|
bond 44 49 478.00 1.3350
|
|
bond 44 51 420.00 1.0760
|
|
bond 44 60 400.00 1.3620
|
|
bond 45 47 420.00 1.3550
|
|
bond 45 50 400.00 1.3260
|
|
bond 45 55 390.00 1.4200
|
|
bond 46 68 390.00 1.4320
|
|
bond 46 76 390.00 1.4320
|
|
bond 47 53 540.00 1.0040
|
|
bond 47 59 420.00 1.3610
|
|
bond 48 48 420.00 1.3530
|
|
bond 48 50 400.00 1.3340
|
|
bond 48 51 405.00 1.0810
|
|
bond 48 52 405.00 1.0810
|
|
bond 48 54 400.00 1.3420
|
|
bond 48 55 390.00 1.3810
|
|
bond 48 56 420.00 1.4450
|
|
bond 48 62 360.00 1.4930
|
|
bond 48 63 400.00 1.3420
|
|
bond 50 56 478.00 1.3690
|
|
bond 50 59 400.00 1.3100
|
|
bond 54 56 325.00 1.3970
|
|
bond 54 59 400.00 1.3660
|
|
bond 54 61 512.00 1.0110
|
|
bond 54 68 360.00 1.4150
|
|
bond 54 76 360.00 1.4150
|
|
bond 55 57 408.00 1.0800
|
|
bond 56 58 530.00 1.2240
|
|
bond 56 63 325.00 1.3970
|
|
bond 60 68 390.00 1.4320
|
|
bond 60 76 390.00 1.4320
|
|
bond 61 63 512.00 1.0110
|
|
bond 62 64 384.00 1.0870
|
|
bond 63 68 360.00 1.4150
|
|
bond 63 76 360.00 1.4150
|
|
bond 65 66 384.00 1.4320
|
|
bond 65 68 384.00 1.4140
|
|
bond 66 67 389.50 1.0920
|
|
bond 66 68 320.00 1.5100
|
|
bond 66 72 380.00 1.5020
|
|
bond 67 68 389.50 1.0920
|
|
bond 68 68 320.00 1.5100
|
|
bond 68 69 384.00 1.4100
|
|
bond 68 71 384.00 1.4100
|
|
bond 68 87 384.00 1.4100
|
|
bond 69 70 615.50 0.9710
|
|
bond 70 71 615.50 0.9710
|
|
bond 70 74 615.50 0.9710
|
|
bond 70 86 615.50 0.9710
|
|
bond 70 87 615.50 0.9710
|
|
bond 71 84 320.00 1.6060
|
|
bond 72 73 398.50 1.0920
|
|
bond 72 74 484.00 1.4100
|
|
bond 72 86 484.00 1.4100
|
|
bond 74 84 320.00 1.6060
|
|
bond 75 76 320.00 1.5100
|
|
bond 75 77 384.00 1.4320
|
|
bond 75 78 389.50 1.0920
|
|
bond 75 79 380.00 1.5020
|
|
bond 76 76 320.00 1.5100
|
|
bond 76 77 384.00 1.4140
|
|
bond 76 78 389.50 1.0920
|
|
bond 76 80 384.00 1.4100
|
|
bond 76 88 384.00 1.4100
|
|
bond 79 82 398.50 1.0920
|
|
bond 79 83 484.00 1.4100
|
|
bond 79 89 484.00 1.4100
|
|
bond 80 81 615.50 0.9710
|
|
bond 80 84 320.00 1.6060
|
|
bond 81 83 615.50 0.9710
|
|
bond 81 88 615.50 0.9710
|
|
bond 81 89 615.50 0.9710
|
|
bond 83 84 320.00 1.6060
|
|
bond 84 85 700.00 1.4960
|
|
bond 90 91 556.85 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 39 52.50 120.40
|
|
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 1 2 32 61.00 109.60
|
|
angle 3 2 6 39.00 109.50
|
|
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 32 39.00 109.50
|
|
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 1 7 32 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 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 32 39.00 109.50
|
|
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 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 32 58.00 110.60
|
|
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 14 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 32 47.60 110.60
|
|
angle 7 8 36 48.20 109.50 110.20 111.00
|
|
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 32 47.60 110.60
|
|
angle 8 8 36 48.20 109.50 110.20 111.00
|
|
angle 8 8 37 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 14 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 32 39.00 109.50
|
|
angle 9 8 36 42.00 110.70
|
|
angle 9 8 37 59.00 109.30
|
|
angle 36 8 37 56.10 109.50
|
|
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 27 38.10 122.50
|
|
anglep 24 26 29 28.80 111.50
|
|
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 7 30 31 80.00 122.40
|
|
anglep 8 30 31 80.00 122.40
|
|
anglep 8 30 33 80.00 122.40
|
|
anglep 8 30 34 111.50 110.30
|
|
anglep 31 30 31 57.60 134.00
|
|
anglep 2 32 33 80.00 122.40
|
|
anglep 2 32 34 80.00 122.40
|
|
anglep 7 32 33 80.00 122.40
|
|
anglep 7 32 34 80.00 122.40
|
|
anglep 8 32 33 80.00 122.40
|
|
anglep 8 32 34 111.50 110.30
|
|
anglep 33 32 34 122.30 121.50
|
|
angle 30 34 35 49.60 108.70
|
|
angle 32 34 35 49.60 108.70
|
|
angle 8 36 8 48.20 109.50 110.20 111.00
|
|
angle 8 36 9 42.00 110.70
|
|
angle 9 36 9 40.00 107.80
|
|
angle 8 37 38 43.20 110.90
|
|
angle 38 37 38 43.50 107.00
|
|
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 43 43 45 42.00 115.90
|
|
anglep 43 43 46 60.00 105.88
|
|
anglep 43 43 49 60.00 111.38
|
|
anglep 43 43 50 60.00 128.40
|
|
anglep 43 43 56 42.00 118.49
|
|
anglep 43 43 60 60.00 105.88
|
|
anglep 45 43 49 90.00 132.47
|
|
anglep 46 43 50 90.00 126.37
|
|
anglep 49 43 56 90.00 130.37
|
|
anglep 50 43 60 90.00 126.37
|
|
anglep 46 44 49 130.00 113.18
|
|
anglep 46 44 51 41.00 121.27
|
|
anglep 49 44 51 40.00 124.53
|
|
anglep 49 44 60 130.00 113.18
|
|
anglep 51 44 60 41.00 121.27
|
|
anglep 43 45 47 32.00 122.40
|
|
anglep 43 45 50 60.00 119.30
|
|
anglep 47 45 50 135.00 118.00
|
|
anglep 47 45 55 32.00 119.50
|
|
anglep 50 45 55 60.00 122.50
|
|
anglep 43 46 44 42.00 107.20
|
|
anglep 43 46 68 48.00 126.48
|
|
anglep 43 46 76 48.00 126.48
|
|
anglep 44 46 68 58.00 125.40
|
|
anglep 44 46 76 58.00 125.40
|
|
angle 45 47 53 41.50 120.00
|
|
angle 53 47 53 19.50 120.00
|
|
angle 53 47 59 41.50 120.00
|
|
anglep 48 48 51 32.50 121.46
|
|
anglep 48 48 52 32.50 121.46
|
|
anglep 48 48 54 130.00 123.56
|
|
anglep 48 48 56 130.00 118.99
|
|
anglep 48 48 62 28.00 123.52
|
|
anglep 48 48 63 130.00 123.56
|
|
anglep 50 48 50 135.00 127.90
|
|
anglep 50 48 52 41.20 116.07
|
|
anglep 50 48 55 60.00 123.28
|
|
anglep 51 48 54 40.00 115.75
|
|
anglep 51 48 55 32.50 121.49
|
|
anglep 51 48 63 40.00 115.75
|
|
anglep 52 48 56 32.50 116.87
|
|
anglep 54 48 55 130.00 120.74
|
|
anglep 55 48 63 130.00 120.74
|
|
anglep 56 48 62 28.00 118.28
|
|
angle 43 49 44 128.00 103.47
|
|
angle 43 50 48 128.00 110.86
|
|
angle 43 50 59 128.00 111.66
|
|
angle 45 50 48 128.00 118.67
|
|
angle 45 50 56 128.00 120.30
|
|
angle 48 50 48 128.00 117.03
|
|
anglep 48 54 56 80.00 123.84
|
|
anglep 48 54 61 32.80 120.00
|
|
anglep 48 54 68 52.00 116.20
|
|
anglep 48 54 76 52.00 116.20
|
|
anglep 56 54 56 125.00 128.52
|
|
anglep 56 54 59 80.00 127.19
|
|
anglep 56 54 61 43.50 114.97
|
|
anglep 56 54 68 48.00 119.00
|
|
anglep 56 54 76 48.00 119.00
|
|
anglep 59 54 61 32.80 119.77
|
|
anglep 45 55 48 112.00 116.50
|
|
anglep 45 55 55 112.00 118.66
|
|
anglep 45 55 57 37.60 121.50
|
|
anglep 47 55 55 32.00 120.63
|
|
anglep 48 55 48 112.00 116.90
|
|
anglep 48 55 57 37.60 120.47
|
|
anglep 43 56 54 45.00 109.14
|
|
anglep 43 56 58 85.00 131.17
|
|
anglep 43 56 63 45.00 109.14
|
|
anglep 48 56 54 45.00 113.34
|
|
anglep 48 56 58 85.00 126.37
|
|
anglep 48 56 63 45.00 113.34
|
|
anglep 50 56 54 60.00 117.24
|
|
anglep 50 56 58 135.00 124.73
|
|
anglep 54 56 54 60.00 113.94
|
|
anglep 54 56 58 60.00 120.00
|
|
anglep 54 56 63 60.00 113.94
|
|
anglep 58 56 63 60.00 120.00
|
|
anglep 63 56 63 60.00 113.94
|
|
anglep 47 59 50 135.00 119.25
|
|
anglep 47 59 54 32.00 117.10
|
|
anglep 47 59 63 32.00 117.10
|
|
anglep 50 59 54 60.00 123.65
|
|
anglep 43 60 44 42.00 107.20
|
|
anglep 43 60 68 48.00 126.48
|
|
anglep 43 60 76 48.00 126.48
|
|
anglep 44 60 68 58.00 125.40
|
|
anglep 44 60 76 58.00 125.40
|
|
angle 48 62 64 61.40 110.61
|
|
angle 64 62 64 34.50 109.06
|
|
anglep 48 63 56 80.00 123.84
|
|
anglep 48 63 61 32.80 120.00
|
|
anglep 48 63 68 52.00 116.20
|
|
anglep 48 63 76 52.00 116.20
|
|
anglep 56 63 56 125.00 128.52
|
|
anglep 56 63 61 43.50 114.97
|
|
anglep 56 63 68 48.00 119.00
|
|
anglep 56 63 76 48.00 119.00
|
|
angle 66 65 68 88.25 109.90
|
|
angle 65 66 67 54.50 108.50
|
|
angle 65 66 68 87.95 105.30
|
|
angle 65 66 72 64.50 109.20
|
|
angle 67 66 68 38.00 109.25
|
|
angle 67 66 72 39.40 108.50
|
|
angle 68 66 72 50.50 115.00
|
|
angle 46 68 65 49.34 106.60
|
|
angle 46 68 67 54.78 106.60
|
|
angle 46 68 68 87.95 112.80
|
|
angle 54 68 65 49.34 106.60
|
|
angle 54 68 67 54.78 106.60
|
|
angle 54 68 68 87.95 112.80
|
|
angle 60 68 65 49.34 106.60
|
|
angle 60 68 67 54.78 106.60
|
|
angle 60 68 68 87.95 112.80
|
|
angle 63 68 65 49.34 106.60
|
|
angle 63 68 67 54.78 106.60
|
|
angle 63 68 68 87.95 112.80
|
|
angle 65 68 67 54.50 110.62
|
|
angle 65 68 68 87.95 106.58
|
|
angle 66 68 67 38.00 111.30
|
|
angle 66 68 68 60.30 102.10
|
|
angle 66 68 71 87.25 109.50
|
|
angle 66 68 87 87.25 109.50
|
|
angle 67 68 68 38.00 111.65
|
|
angle 67 68 69 54.20 109.90
|
|
angle 67 68 71 54.20 111.30
|
|
angle 67 68 87 54.20 111.30
|
|
angle 68 68 68 60.40 101.70
|
|
angle 68 68 69 86.54 110.85
|
|
angle 68 68 71 87.95 108.25
|
|
angle 68 68 87 87.95 108.25
|
|
angle 68 69 70 63.26 104.70
|
|
angle 68 71 70 64.50 107.65
|
|
angle 68 71 84 78.00 110.00
|
|
angle 66 72 73 37.35 108.65
|
|
angle 66 72 74 75.40 108.30
|
|
angle 66 72 86 75.40 108.30
|
|
angle 73 72 73 34.20 108.38
|
|
angle 73 72 74 51.75 110.80
|
|
angle 73 72 86 51.75 110.80
|
|
angle 70 74 72 64.50 107.65
|
|
angle 72 74 84 78.00 110.00
|
|
angle 76 75 77 87.95 105.30
|
|
angle 76 75 78 38.00 109.25
|
|
angle 76 75 79 50.50 115.00
|
|
angle 77 75 78 54.50 108.50
|
|
angle 77 75 79 64.50 109.20
|
|
angle 78 75 79 39.40 108.50
|
|
angle 46 76 76 87.95 112.80
|
|
angle 46 76 77 49.34 106.60
|
|
angle 46 76 78 54.78 106.60
|
|
angle 54 76 76 87.95 112.80
|
|
angle 54 76 77 49.34 106.60
|
|
angle 54 76 78 54.78 106.60
|
|
angle 60 76 76 87.95 112.80
|
|
angle 60 76 77 49.34 106.60
|
|
angle 60 76 78 54.78 106.60
|
|
angle 63 76 76 87.95 112.80
|
|
angle 63 76 77 49.34 106.60
|
|
angle 63 76 78 54.78 106.60
|
|
angle 75 76 76 60.30 102.10
|
|
angle 75 76 78 38.00 111.30
|
|
angle 75 76 80 87.25 109.50
|
|
angle 75 76 88 87.25 109.50
|
|
angle 76 76 76 60.40 101.70
|
|
angle 76 76 77 87.95 106.58
|
|
angle 76 76 78 38.00 111.65
|
|
angle 76 76 80 87.95 110.50
|
|
angle 76 76 88 87.95 110.50
|
|
angle 77 76 78 54.50 110.62
|
|
angle 78 76 78 26.23 109.30
|
|
angle 78 76 80 54.20 111.30
|
|
angle 78 76 88 54.20 111.30
|
|
angle 75 77 76 88.25 109.90
|
|
angle 75 79 82 37.35 108.65
|
|
angle 75 79 83 75.40 108.30
|
|
angle 75 79 89 75.40 108.30
|
|
angle 82 79 82 34.20 108.38
|
|
angle 82 79 83 51.75 110.80
|
|
angle 82 79 89 51.75 110.80
|
|
angle 76 80 81 64.50 107.65
|
|
angle 76 80 84 78.00 110.00
|
|
angle 79 83 81 64.50 107.65
|
|
angle 79 83 84 78.00 110.00
|
|
angle 71 84 74 64.00 98.40
|
|
angle 71 84 85 90.00 108.80
|
|
angle 74 84 85 90.00 108.80
|
|
angle 80 84 83 64.00 98.40
|
|
angle 80 84 85 90.00 108.80
|
|
angle 83 84 85 90.00 108.80
|
|
angle 85 84 85 125.00 122.90
|
|
angle 70 86 72 64.50 107.65
|
|
angle 68 87 70 64.50 107.65
|
|
angle 76 88 81 64.50 107.65
|
|
angle 79 89 81 64.50 107.65
|
|
angle 91 90 91 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 4 1 40 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 1 2 32 18.70 18.70
|
|
strbnd 3 2 6 11.50 11.50
|
|
strbnd 3 2 41 18.70 18.70
|
|
strbnd 6 2 30 11.50 11.50
|
|
strbnd 6 2 32 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 1 7 32 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 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 32 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 32 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 14 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 32 18.70 18.70
|
|
strbnd 7 8 36 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 32 18.70 18.70
|
|
strbnd 8 8 36 18.70 18.70
|
|
strbnd 8 8 37 18.70 18.70
|
|
strbnd 9 8 10 11.50 11.50
|
|
strbnd 9 8 12 11.50 11.50
|
|
strbnd 9 8 14 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 32 11.50 11.50
|
|
strbnd 9 8 36 11.50 11.50
|
|
strbnd 9 8 37 11.50 11.50
|
|
strbnd 36 8 37 18.70 18.70
|
|
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 27 11.50 11.50
|
|
strbnd 24 26 29 18.70 18.70
|
|
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 7 30 31 18.70 18.70
|
|
strbnd 8 30 31 18.70 18.70
|
|
strbnd 8 30 33 18.70 18.70
|
|
strbnd 8 30 34 18.70 18.70
|
|
strbnd 31 30 31 18.70 18.70
|
|
strbnd 2 32 33 18.70 18.70
|
|
strbnd 2 32 34 18.70 18.70
|
|
strbnd 7 32 33 18.70 18.70
|
|
strbnd 7 32 34 18.70 18.70
|
|
strbnd 8 32 33 18.70 18.70
|
|
strbnd 8 32 34 18.70 18.70
|
|
strbnd 33 32 34 18.70 18.70
|
|
strbnd 8 36 8 18.70 18.70
|
|
strbnd 8 36 9 11.50 11.50
|
|
strbnd 9 36 9 11.50 11.50
|
|
strbnd 8 37 38 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 43 43 45 18.70 18.70
|
|
strbnd 43 43 46 18.70 18.70
|
|
strbnd 43 43 49 18.70 18.70
|
|
strbnd 43 43 50 18.70 18.70
|
|
strbnd 43 43 56 18.70 18.70
|
|
strbnd 43 43 60 18.70 18.70
|
|
strbnd 45 43 49 18.70 18.70
|
|
strbnd 46 43 50 18.70 18.70
|
|
strbnd 49 43 56 18.70 18.70
|
|
strbnd 50 43 60 18.70 18.70
|
|
strbnd 46 44 49 18.70 18.70
|
|
strbnd 46 44 51 11.50 11.50
|
|
strbnd 49 44 51 11.50 11.50
|
|
strbnd 49 44 60 18.70 18.70
|
|
strbnd 51 44 60 11.50 11.50
|
|
strbnd 43 45 47 18.70 18.70
|
|
strbnd 43 45 50 18.70 18.70
|
|
strbnd 47 45 50 18.70 18.70
|
|
strbnd 47 45 55 18.70 18.70
|
|
strbnd 50 45 55 18.70 18.70
|
|
strbnd 43 46 44 14.40 14.40
|
|
strbnd 43 46 68 14.40 14.40
|
|
strbnd 43 46 76 14.40 14.40
|
|
strbnd 44 46 68 14.40 14.40
|
|
strbnd 44 46 76 14.40 14.40
|
|
strbnd 45 47 53 4.30 4.30
|
|
strbnd 53 47 53 4.30 4.30
|
|
strbnd 53 47 59 4.30 4.30
|
|
strbnd 48 48 51 11.50 11.50
|
|
strbnd 48 48 52 18.70 18.70
|
|
strbnd 48 48 54 18.70 18.70
|
|
strbnd 48 48 56 18.70 18.70
|
|
strbnd 48 48 62 18.70 18.70
|
|
strbnd 48 48 63 18.70 18.70
|
|
strbnd 50 48 50 18.70 18.70
|
|
strbnd 50 48 52 18.70 18.70
|
|
strbnd 50 48 55 18.70 18.70
|
|
strbnd 51 48 54 11.50 11.50
|
|
strbnd 51 48 55 11.50 11.50
|
|
strbnd 51 48 63 11.50 11.50
|
|
strbnd 52 48 56 18.70 18.70
|
|
strbnd 54 48 55 18.70 18.70
|
|
strbnd 55 48 63 18.70 18.70
|
|
strbnd 56 48 62 18.70 18.70
|
|
strbnd 43 49 44 14.40 14.40
|
|
strbnd 43 50 48 14.40 14.40
|
|
strbnd 43 50 59 14.40 14.40
|
|
strbnd 45 50 48 14.40 14.40
|
|
strbnd 45 50 56 14.40 14.40
|
|
strbnd 48 50 48 14.40 14.40
|
|
strbnd 48 54 56 14.40 14.40
|
|
strbnd 48 54 61 4.30 4.30
|
|
strbnd 48 54 68 14.40 14.40
|
|
strbnd 48 54 76 14.40 14.40
|
|
strbnd 56 54 56 7.20 7.20
|
|
strbnd 56 54 59 7.20 7.20
|
|
strbnd 56 54 61 4.30 4.30
|
|
strbnd 56 54 68 14.40 14.40
|
|
strbnd 56 54 76 14.40 14.40
|
|
strbnd 59 54 61 4.30 4.30
|
|
strbnd 45 55 48 18.70 18.70
|
|
strbnd 45 55 55 18.70 18.70
|
|
strbnd 45 55 57 18.70 18.70
|
|
strbnd 47 55 55 18.70 18.70
|
|
strbnd 48 55 48 18.70 18.70
|
|
strbnd 48 55 57 18.70 18.70
|
|
strbnd 43 56 54 18.70 18.70
|
|
strbnd 43 56 58 18.70 18.70
|
|
strbnd 43 56 63 18.70 18.70
|
|
strbnd 48 56 54 18.70 18.70
|
|
strbnd 48 56 58 18.70 18.70
|
|
strbnd 48 56 63 18.70 18.70
|
|
strbnd 50 56 54 18.70 18.70
|
|
strbnd 50 56 58 18.70 18.70
|
|
strbnd 54 56 54 18.70 18.70
|
|
strbnd 54 56 58 18.70 18.70
|
|
strbnd 54 56 63 18.70 18.70
|
|
strbnd 58 56 63 18.70 18.70
|
|
strbnd 63 56 63 18.70 18.70
|
|
strbnd 47 59 50 18.70 18.70
|
|
strbnd 47 59 54 18.70 18.70
|
|
strbnd 47 59 63 18.70 18.70
|
|
strbnd 50 59 54 18.70 18.70
|
|
strbnd 43 60 44 14.40 14.40
|
|
strbnd 43 60 68 14.40 14.40
|
|
strbnd 43 60 76 14.40 14.40
|
|
strbnd 44 60 68 14.40 14.40
|
|
strbnd 44 60 76 14.40 14.40
|
|
strbnd 48 62 64 11.50 11.50
|
|
strbnd 64 62 64 11.50 11.50
|
|
strbnd 48 63 56 7.20 7.20
|
|
strbnd 48 63 61 4.30 4.30
|
|
strbnd 48 63 68 14.40 14.40
|
|
strbnd 48 63 76 14.40 14.40
|
|
strbnd 56 63 56 18.70 18.70
|
|
strbnd 56 63 61 4.30 4.30
|
|
strbnd 56 63 68 14.40 14.40
|
|
strbnd 56 63 76 14.40 14.40
|
|
strbnd 65 66 67 11.50 11.50
|
|
strbnd 65 66 68 18.70 18.70
|
|
strbnd 65 66 72 18.70 18.70
|
|
strbnd 67 66 68 11.50 11.50
|
|
strbnd 67 66 72 11.50 11.50
|
|
strbnd 68 66 69 18.70 18.70
|
|
strbnd 68 66 72 18.70 18.70
|
|
strbnd 46 68 65 18.70 18.70
|
|
strbnd 46 68 67 11.50 11.50
|
|
strbnd 46 68 68 18.70 18.70
|
|
strbnd 54 68 65 18.70 18.70
|
|
strbnd 54 68 67 11.50 11.50
|
|
strbnd 54 68 68 18.70 18.70
|
|
strbnd 60 68 65 18.70 18.70
|
|
strbnd 60 68 67 11.50 11.50
|
|
strbnd 60 68 68 18.70 18.70
|
|
strbnd 63 68 65 18.70 18.70
|
|
strbnd 63 68 67 11.50 11.50
|
|
strbnd 63 68 68 18.70 18.70
|
|
strbnd 65 68 67 11.50 11.50
|
|
strbnd 65 68 68 18.70 18.70
|
|
strbnd 66 68 67 11.50 11.50
|
|
strbnd 66 68 68 18.70 18.70
|
|
strbnd 66 68 71 18.70 18.70
|
|
strbnd 66 68 87 18.70 18.70
|
|
strbnd 67 68 68 11.50 11.50
|
|
strbnd 67 68 69 11.50 11.50
|
|
strbnd 67 68 71 11.50 11.50
|
|
strbnd 67 68 87 11.50 11.50
|
|
strbnd 68 68 68 18.70 18.70
|
|
strbnd 68 68 69 18.70 18.70
|
|
strbnd 68 68 71 18.70 18.70
|
|
strbnd 68 68 87 18.70 18.70
|
|
strbnd 66 72 73 11.50 11.50
|
|
strbnd 66 72 74 18.70 18.70
|
|
strbnd 66 72 86 18.70 18.70
|
|
strbnd 73 72 74 11.50 11.50
|
|
strbnd 73 72 86 11.50 11.50
|
|
strbnd 72 74 84 14.40 14.40
|
|
strbnd 76 75 77 18.70 18.70
|
|
strbnd 76 75 78 11.50 11.50
|
|
strbnd 76 75 79 18.70 18.70
|
|
strbnd 77 75 78 11.50 11.50
|
|
strbnd 77 75 79 18.70 18.70
|
|
strbnd 78 75 79 11.50 11.50
|
|
strbnd 46 76 76 18.70 18.70
|
|
strbnd 46 76 77 18.70 18.70
|
|
strbnd 46 76 78 11.50 11.50
|
|
strbnd 54 76 76 18.70 18.70
|
|
strbnd 54 76 77 18.70 18.70
|
|
strbnd 54 76 78 11.50 11.50
|
|
strbnd 60 76 76 18.70 18.70
|
|
strbnd 60 76 77 18.70 18.70
|
|
strbnd 60 76 78 11.50 11.50
|
|
strbnd 63 76 76 18.70 18.70
|
|
strbnd 63 76 77 18.70 18.70
|
|
strbnd 63 76 78 11.50 11.50
|
|
strbnd 75 76 76 18.70 18.70
|
|
strbnd 75 76 78 11.50 11.50
|
|
strbnd 75 76 80 18.70 18.70
|
|
strbnd 75 76 88 18.70 18.70
|
|
strbnd 76 76 76 18.70 18.70
|
|
strbnd 76 76 77 18.70 18.70
|
|
strbnd 76 76 78 11.50 11.50
|
|
strbnd 76 76 80 18.70 18.70
|
|
strbnd 76 76 88 18.70 18.70
|
|
strbnd 77 76 78 11.50 11.50
|
|
strbnd 78 76 80 11.50 11.50
|
|
strbnd 78 76 88 11.50 11.50
|
|
strbnd 75 79 82 11.50 11.50
|
|
strbnd 75 79 83 18.70 18.70
|
|
strbnd 75 79 89 18.70 18.70
|
|
strbnd 82 79 83 11.50 11.50
|
|
strbnd 82 79 89 11.50 11.50
|
|
strbnd 79 83 84 14.40 14.40
|
|
|
|
|
|
###############################
|
|
## ##
|
|
## Urey-Bradley Parameters ##
|
|
## ##
|
|
###############################
|
|
|
|
|
|
ureybrad 91 90 91 -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 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 2 32 0 0 121.60
|
|
opbend 7 32 0 0 121.60
|
|
opbend 8 32 0 0 121.60
|
|
opbend 33 32 0 0 118.70
|
|
opbend 34 32 0 0 133.10
|
|
opbend 1 39 0 0 14.40
|
|
opbend 43 43 45 49 7.94
|
|
opbend 43 43 46 50 5.87
|
|
opbend 43 43 49 56 6.92
|
|
opbend 43 43 50 60 5.87
|
|
opbend 45 43 43 49 7.94
|
|
opbend 46 43 43 50 5.87
|
|
opbend 49 43 43 45 7.94
|
|
opbend 49 43 43 56 6.92
|
|
opbend 50 43 43 46 5.87
|
|
opbend 50 43 43 60 5.87
|
|
opbend 56 43 43 49 6.92
|
|
opbend 60 43 43 50 5.87
|
|
opbend 46 44 49 51 8.88
|
|
opbend 49 44 46 51 8.88
|
|
opbend 49 44 51 60 8.88
|
|
opbend 51 44 46 49 8.88
|
|
opbend 51 44 49 60 8.88
|
|
opbend 60 44 49 51 8.88
|
|
opbend 43 45 47 50 12.74
|
|
opbend 47 45 43 50 12.74
|
|
opbend 47 45 50 55 12.54
|
|
opbend 50 45 43 47 12.74
|
|
opbend 50 45 47 55 12.54
|
|
opbend 55 45 47 50 12.54
|
|
opbend 43 46 44 68 8.11
|
|
opbend 43 46 44 76 8.11
|
|
opbend 44 46 43 68 8.11
|
|
opbend 44 46 43 76 8.11
|
|
opbend 68 46 43 44 8.11
|
|
opbend 76 46 43 44 8.11
|
|
opbend 48 48 51 54 13.05
|
|
opbend 48 48 51 63 13.05
|
|
opbend 48 48 52 56 9.28
|
|
opbend 48 48 56 62 8.50
|
|
opbend 50 48 50 52 5.91
|
|
opbend 51 48 48 54 13.05
|
|
opbend 51 48 48 63 13.05
|
|
opbend 51 48 54 55 10.31
|
|
opbend 51 48 55 63 10.31
|
|
opbend 52 48 48 56 9.28
|
|
opbend 52 48 50 50 10.96
|
|
opbend 54 48 48 51 13.05
|
|
opbend 54 48 51 55 10.31
|
|
opbend 55 48 51 54 10.31
|
|
opbend 55 48 51 63 10.31
|
|
opbend 56 48 48 52 9.28
|
|
opbend 56 48 48 62 8.50
|
|
opbend 62 48 48 56 8.50
|
|
opbend 63 48 48 51 13.05
|
|
opbend 63 48 51 55 10.31
|
|
opbend 48 54 56 68 2.17
|
|
opbend 48 54 56 76 2.17
|
|
opbend 56 54 48 68 2.17
|
|
opbend 56 54 48 76 2.17
|
|
opbend 56 54 56 61 7.47
|
|
opbend 56 54 59 61 7.05
|
|
opbend 59 54 56 61 7.05
|
|
opbend 61 54 56 56 7.47
|
|
opbend 61 54 56 59 7.05
|
|
opbend 68 54 48 56 2.17
|
|
opbend 76 54 48 56 2.17
|
|
opbend 45 55 48 57 10.23
|
|
opbend 45 55 48 57 10.23
|
|
opbend 48 55 45 57 10.23
|
|
opbend 48 55 45 57 10.23
|
|
opbend 48 55 48 57 10.34
|
|
opbend 57 55 45 48 10.23
|
|
opbend 57 55 45 48 10.23
|
|
opbend 57 55 48 48 13.17
|
|
opbend 43 56 54 58 13.16
|
|
opbend 43 56 58 63 13.16
|
|
opbend 48 56 54 58 12.64
|
|
opbend 48 56 58 63 12.64
|
|
opbend 50 56 54 58 12.62
|
|
opbend 50 56 58 63 12.62
|
|
opbend 54 56 43 58 13.16
|
|
opbend 54 56 48 58 12.64
|
|
opbend 54 56 50 58 12.62
|
|
opbend 54 56 54 58 7.50
|
|
opbend 54 56 58 63 7.50
|
|
opbend 58 56 43 54 70.16
|
|
opbend 58 56 43 63 70.16
|
|
opbend 58 56 48 54 70.64
|
|
opbend 58 56 48 63 70.64
|
|
opbend 58 56 50 54 70.62
|
|
opbend 58 56 50 63 70.62
|
|
opbend 58 56 54 54 71.00
|
|
opbend 58 56 54 63 71.00
|
|
opbend 58 56 54 63 71.00
|
|
opbend 58 56 63 63 71.00
|
|
opbend 63 56 43 58 13.16
|
|
opbend 63 56 48 58 12.64
|
|
opbend 63 56 50 58 12.62
|
|
opbend 63 56 54 58 7.50
|
|
opbend 63 56 58 63 7.50
|
|
opbend 47 59 50 54 12.45
|
|
opbend 47 59 50 63 12.45
|
|
opbend 50 59 47 54 12.45
|
|
opbend 50 59 47 63 12.45
|
|
opbend 54 59 47 50 12.45
|
|
opbend 63 59 47 50 12.45
|
|
opbend 43 60 44 68 8.11
|
|
opbend 43 60 44 76 8.11
|
|
opbend 44 60 43 68 8.11
|
|
opbend 44 60 43 76 8.11
|
|
opbend 68 60 43 44 8.11
|
|
opbend 76 60 43 44 8.11
|
|
opbend 48 63 56 68 2.17
|
|
opbend 48 63 56 76 2.17
|
|
opbend 56 63 48 68 2.17
|
|
opbend 56 63 48 76 2.17
|
|
opbend 56 63 56 61 7.47
|
|
opbend 56 63 59 61 7.05
|
|
opbend 59 63 56 61 7.05
|
|
opbend 61 63 56 56 7.47
|
|
opbend 61 63 56 59 7.05
|
|
opbend 68 63 48 56 2.17
|
|
opbend 76 63 48 56 2.17
|
|
|
|
|
|
############################
|
|
## ##
|
|
## Torsional Parameters ##
|
|
## ##
|
|
############################
|
|
|
|
|
|
torsion 3 1 2 3 -3.805 0.0 1 1.646 180.0 2 1.239 0.0 3
|
|
torsion 3 1 2 6 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 3 1 2 30 -0.856 0.0 1 0.048 180.0 2 -1.842 0.0 3
|
|
torsion 3 1 2 32 -6.037 0.0 1 -0.396 180.0 2 2.176 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 4 1 2 32 0.000 0.0 1 0.000 180.0 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 -1.407 0.0 1 -0.068 180.0 2 0.000 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 2.576 0.0 1 1.011 180.0 2 0.825 0.0 3
|
|
torsion 3 1 7 8 2.576 0.0 1 1.011 180.0 2 0.825 0.0 3
|
|
torsion 3 1 7 30 -0.856 0.0 1 0.048 180.0 2 -1.842 0.0 3
|
|
torsion 3 1 7 32 -2.296 0.0 1 -0.249 180.0 2 -0.097 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 7 32 0.000 0.0 1 0.000 180.0 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 39 1 8 8 -0.150 0.0 1 0.550 180.0 2 -0.450 0.0 3
|
|
torsion 39 1 8 9 0.000 0.0 1 0.000 180.0 2 -0.126 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 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 1 2 3 1 -2.411 0.0 1 -0.587 180.0 2 0.493 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 3.400 180.0 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 1 2 32 33 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 2 32 34 -0.523 0.0 1 3.984 180.0 2 0.545 0.0 3
|
|
torsion 6 2 32 33 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 6 2 32 34 0.000 0.0 1 0.000 180.0 2 0.000 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 -0.495 0.0 1 3.000 180.0 2 -0.792 0.0 3
|
|
torsion 1 3 7 6 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 3 7 7 0.929 0.0 1 0.328 180.0 2 0.000 0.0 3
|
|
torsion 1 3 7 8 0.929 0.0 1 0.328 180.0 2 0.000 0.0 3
|
|
torsion 1 3 7 15 0.476 0.0 1 1.100 180.0 2 -0.160 0.0 3
|
|
torsion 1 3 7 16 0.000 0.0 1 0.000 180.0 2 0.000 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 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 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 3 8 8 1.780 0.0 1 1.100 180.0 2 -1.270 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 0.000 0.0 1 0.000 180.0 2 0.000 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 0.000 0.0 3
|
|
torsion 1 7 7 8 0.800 0.0 1 1.000 180.0 2 0.500 0.0 3
|
|
torsion 1 7 7 10 -1.500 0.0 1 0.720 180.0 2 1.260 0.0 3
|
|
torsion 3 7 7 6 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 3 7 7 8 0.650 0.0 1 1.025 180.0 2 0.120 0.0 3
|
|
torsion 3 7 7 10 -3.490 0.0 1 2.340 180.0 2 0.000 0.0 3
|
|
torsion 6 7 7 6 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 6 7 7 8 0.000 0.0 1 0.000 180.0 2 0.000 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 0.000 0.0 3
|
|
torsion 6 7 7 41 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 8 7 7 30 0.650 0.0 1 1.025 180.0 2 0.120 0.0 3
|
|
torsion 8 7 7 41 0.800 0.0 1 1.000 180.0 2 0.500 0.0 3
|
|
torsion 10 7 7 29 -3.490 0.0 1 2.340 180.0 2 0.000 0.0 3
|
|
torsion 10 7 7 30 -3.490 0.0 1 2.340 180.0 2 0.000 0.0 3
|
|
torsion 10 7 7 41 -1.500 0.0 1 0.720 180.0 2 1.260 0.0 3
|
|
torsion 1 7 8 3 -0.933 0.0 1 -0.929 180.0 2 0.153 0.0 3
|
|
torsion 1 7 8 7 0.902 0.0 1 0.520 180.0 2 1.000 0.0 3
|
|
torsion 1 7 8 8 -2.280 0.0 1 0.970 180.0 2 3.700 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 0.630 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 12 -0.160 0.0 1 1.080 180.0 2 -1.520 0.0 3
|
|
torsion 1 7 8 14 -6.170 0.0 1 1.440 180.0 2 0.760 0.0 3
|
|
torsion 1 7 8 17 -1.470 0.0 1 1.530 180.0 2 0.260 0.0 3
|
|
torsion 1 7 8 22 -1.000 0.0 1 0.100 180.0 2 1.150 0.0 3
|
|
torsion 1 7 8 26 0.730 0.0 1 1.780 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 30 -2.900 0.0 1 1.800 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 32 -4.150 0.0 1 2.060 180.0 2 0.000 0.0 3
|
|
torsion 1 7 8 36 -0.500 0.0 1 0.800 180.0 2 -1.110 0.0 3
|
|
torsion 3 7 8 3 -0.911 0.0 1 3.500 180.0 2 -0.198 0.0 3
|
|
torsion 3 7 8 7 0.740 0.0 1 0.270 180.0 2 -1.316 0.0 3
|
|
torsion 3 7 8 8 0.160 0.0 1 1.655 180.0 2 -2.520 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 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 12 -1.010 0.0 1 1.230 180.0 2 1.000 0.0 3
|
|
torsion 3 7 8 14 -5.680 0.0 1 3.000 180.0 2 1.000 0.0 3
|
|
torsion 3 7 8 17 1.020 0.0 1 1.150 180.0 2 -0.300 0.0 3
|
|
torsion 3 7 8 22 0.700 0.0 1 1.800 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 26 -0.660 0.0 1 0.200 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 30 -6.950 0.0 1 -1.150 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 32 1.000 0.0 1 -0.130 180.0 2 0.000 0.0 3
|
|
torsion 3 7 8 36 -1.810 0.0 1 0.150 180.0 2 1.000 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 14 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 32 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 6 7 8 36 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 7 7 8 8 -0.640 0.0 1 0.360 180.0 2 -0.089 0.0 3
|
|
torsion 7 7 8 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 8 7 8 7 -0.083 0.0 1 -0.045 180.0 2 -0.120 0.0 3
|
|
torsion 8 7 8 8 -0.640 0.0 1 0.360 180.0 2 -0.089 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 0.000 0.0 1 0.000 180.0 2 0.100 0.0 3
|
|
torsion 30 7 8 7 0.740 0.0 1 0.270 180.0 2 -1.316 0.0 3
|
|
torsion 30 7 8 8 1.190 0.0 1 0.520 180.0 2 0.520 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 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 12 -1.010 0.0 1 1.230 180.0 2 1.000 0.0 3
|
|
torsion 30 7 8 14 -5.680 0.0 1 3.000 180.0 2 1.000 0.0 3
|
|
torsion 30 7 8 17 1.020 0.0 1 1.150 180.0 2 -0.300 0.0 3
|
|
torsion 30 7 8 22 0.700 0.0 1 1.800 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 26 -0.660 0.0 1 0.200 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 30 -2.450 0.0 1 1.688 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 32 1.000 0.0 1 -0.130 180.0 2 0.000 0.0 3
|
|
torsion 30 7 8 36 -1.810 0.0 1 0.150 180.0 2 1.000 0.0 3
|
|
torsion 32 7 8 9 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 41 7 8 3 -3.000 0.0 1 0.500 180.0 2 0.100 0.0 3
|
|
torsion 41 7 8 7 0.902 0.0 1 0.520 180.0 2 1.000 0.0 3
|
|
torsion 41 7 8 8 -0.513 0.0 1 0.568 180.0 2 -0.750 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 0.630 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 12 -0.160 0.0 1 1.080 180.0 2 -1.520 0.0 3
|
|
torsion 41 7 8 14 -6.170 0.0 1 1.440 180.0 2 0.760 0.0 3
|
|
torsion 41 7 8 17 -1.470 0.0 1 1.530 180.0 2 0.260 0.0 3
|
|
torsion 41 7 8 22 -1.000 0.0 1 0.100 180.0 2 1.150 0.0 3
|
|
torsion 41 7 8 26 0.730 0.0 1 1.780 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 30 -4.150 0.0 1 2.060 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 32 -3.400 0.0 1 0.900 180.0 2 0.000 0.0 3
|
|
torsion 41 7 8 36 -0.500 0.0 1 0.800 180.0 2 -1.110 0.0 3
|
|
torsion 6 7 10 11 0.000 0.0 1 0.000 180.0 2 0.250 0.0 3
|
|
torsion 7 7 10 11 -0.266 0.0 1 -0.910 180.0 2 0.322 0.0 3
|
|
torsion 8 7 10 11 -0.266 0.0 1 -0.910 180.0 2 0.322 0.0 3
|
|
torsion 3 7 15 3 0.000 0.0 1 0.000 180.0 2 0.030 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 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 16 7 15 16 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 30 7 15 3 0.000 0.0 1 0.000 180.0 2 0.030 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 1.660 0.0 1 0.000 180.0 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 1.660 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 41 7 16 9 0.000 0.0 1 0.000 180.0 2 0.180 0.0 3
|
|
torsion 41 7 16 16 1.660 0.0 1 0.000 180.0 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 6 7 30 31 -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 8 7 30 31 0.000 0.0 1 -0.489 180.0 2 0.000 0.0 3
|
|
torsion 15 7 30 31 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 16 7 30 31 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 1 7 32 33 0.000 0.0 1 -0.136 180.0 2 0.000 0.0 3
|
|
torsion 1 7 32 34 0.000 0.0 1 1.645 180.0 2 0.000 0.0 3
|
|
torsion 6 7 32 33 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 6 7 32 34 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 8 7 32 33 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 8 7 32 34 0.000 0.0 1 0.000 180.0 2 0.000 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 0.000 0.0 1 3.000 180.0 2 0.000 0.0 3
|
|
torsion 1 8 8 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 3 8 8 7 0.750 0.0 1 -1.240 180.0 2 -0.190 0.0 3
|
|
torsion 3 8 8 9 0.000 0.0 1 0.000 180.0 2 0.380 0.0 3
|
|
torsion 7 8 8 8 -1.100 0.0 1 -1.150 180.0 2 0.000 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 -0.500 0.0 1 -0.310 180.0 2 -1.290 0.0 3
|
|
torsion 7 8 8 30 -2.500 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 7 8 8 32 1.000 0.0 1 1.000 180.0 2 0.500 0.0 3
|
|
torsion 8 8 8 9 0.000 0.0 1 0.000 180.0 2 0.341 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 1.300 0.0 3
|
|
torsion 9 8 8 32 0.000 0.0 1 0.000 180.0 2 0.300 0.0 3
|
|
torsion 9 8 8 36 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 9 8 8 37 0.000 0.0 1 0.000 180.0 2 0.374 0.0 3
|
|
torsion 36 8 8 37 -0.800 0.0 1 1.064 180.0 2 0.000 0.0 3
|
|
torsion 7 8 10 11 3.000 0.0 1 -1.000 180.0 2 0.000 0.0 3
|
|
torsion 9 8 10 11 0.000 0.0 1 0.000 180.0 2 0.250 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 0.042 0.0 1 -0.091 180.0 2 0.068 0.0 3
|
|
torsion 8 8 12 8 -1.250 0.0 1 0.170 180.0 2 0.509 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 0.343 0.0 3
|
|
torsion 7 8 17 17 0.000 0.0 1 -0.574 180.0 2 0.000 0.0 3
|
|
torsion 9 8 17 17 0.000 0.0 1 0.000 180.0 2 0.000 0.0 3
|
|
torsion 7 8 22 22 0.000 0.0 1 -0.450 180.0 2 0.000 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 -2.000 0.0 1 0.000 180.0 2 1.000 0.0 3
|
|
torsion 7 8 26 26 0.350 0.0 1 0.280 180.0 2 0.000 0.0 3
|
|
torsion 7 8 26 29 -1.520 0.0 1 0.000 180.0 2 0.000 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 1.700 180.0 2 0.000 0.0 3
|
|
torsion 8 8 30 31 0.000 0.0 1 1.460 180.0 2 0.000 0.0 3
|
|
torsion 9 8 30 31 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 7 8 32 33 -0.092 0.0 1 1.124 180.0 2 0.435 0.0 3
|
|
torsion 7 8 32 34 0.677 0.0 1 1.020 180.0 2 0.163 0.0 3
|
|
torsion 8 8 32 33 0.000 0.0 1 0.800 180.0 2 0.000 0.0 3
|
|
torsion 8 8 32 34 0.000 0.0 1 0.800 180.0 2 0.000 0.0 3
|
|
torsion 9 8 32 33 -0.154 0.0 1 0.044 180.0 2 -0.086 0.0 3
|
|
torsion 9 8 32 34 0.250 0.0 1 0.850 180.0 2 0.000 0.0 3
|
|
torsion 7 8 36 8 1.000 0.0 1 0.070 180.0 2 -1.220 0.0 3
|
|
torsion 7 8 36 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 8 8 36 8 0.000 0.0 1 0.000 180.0 2 -1.000 0.0 3
|
|
torsion 8 8 36 9 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 9 8 36 8 0.000 0.0 1 0.000 180.0 2 0.341 0.0 3
|
|
torsion 9 8 36 9 0.000 0.0 1 0.000 180.0 2 0.299 0.0 3
|
|
torsion 37 8 36 8 -0.800 0.0 1 1.064 180.0 2 0.000 0.0 3
|
|
torsion 37 8 36 9 0.000 0.0 1 0.000 180.0 2 0.374 0.0 3
|
|
torsion 8 8 37 38 0.000 0.0 1 0.000 180.0 2 -0.110 0.0 3
|
|
torsion 9 8 37 38 0.000 0.0 1 -0.081 180.0 2 0.370 0.0 3
|
|
torsion 36 8 37 38 0.000 0.0 1 0.000 180.0 2 -0.110 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 -2.000 0.0 1 -0.500 180.0 2 0.000 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 -2.201 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 2.300 180.0 2 0.000 0.0 3
|
|
torsion 8 22 22 22 -0.610 0.0 1 4.212 180.0 2 0.000 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 32 34 35 0.000 0.0 1 5.390 180.0 2 1.230 0.0 3
|
|
torsion 7 32 34 35 0.000 0.0 1 5.390 180.0 2 1.230 0.0 3
|
|
torsion 8 32 34 35 0.000 0.0 1 5.390 180.0 2 1.230 0.0 3
|
|
torsion 33 32 34 35 -1.200 0.0 1 5.390 180.0 2 0.400 0.0 3
|
|
torsion 45 43 43 46 0.000 0.0 1 3.696 180.0 2 0.000 0.0 3
|
|
torsion 45 43 43 50 0.000 0.0 1 3.584 180.0 2 0.000 0.0 3
|
|
torsion 46 43 43 49 0.000 0.0 1 3.810 180.0 2 0.000 0.0 3
|
|
torsion 46 43 43 56 0.000 0.0 1 3.595 180.0 2 0.000 0.0 3
|
|
torsion 49 43 43 50 0.000 0.0 1 2.777 180.0 2 0.000 0.0 3
|
|
torsion 49 43 43 60 0.000 0.0 1 12.635 180.0 2 0.000 0.0 3
|
|
torsion 50 43 43 56 0.000 0.0 1 3.540 180.0 2 0.000 0.0 3
|
|
torsion 56 43 43 60 0.000 0.0 1 3.595 180.0 2 0.000 0.0 3
|
|
torsion 43 43 45 47 0.000 0.0 1 9.885 180.0 2 0.000 0.0 3
|
|
torsion 43 43 45 50 0.000 0.0 1 4.256 180.0 2 0.000 0.0 3
|
|
torsion 49 43 45 47 0.000 0.0 1 3.777 180.0 2 0.000 0.0 3
|
|
torsion 49 43 45 50 0.000 0.0 1 3.776 180.0 2 0.000 0.0 3
|
|
torsion 43 43 46 44 0.000 0.0 1 14.189 180.0 2 0.000 0.0 3
|
|
torsion 43 43 46 68 0.000 0.0 1 3.551 180.0 2 0.000 0.0 3
|
|
torsion 43 43 46 76 0.000 0.0 1 3.551 180.0 2 0.000 0.0 3
|
|
torsion 50 43 46 44 0.000 0.0 1 3.031 180.0 2 0.000 0.0 3
|
|
torsion 50 43 46 68 0.000 0.0 1 2.502 180.0 2 0.000 0.0 3
|
|
torsion 50 43 46 76 0.000 0.0 1 2.502 180.0 2 0.000 0.0 3
|
|
torsion 43 43 49 44 0.000 0.0 1 20.157 180.0 2 0.000 0.0 3
|
|
torsion 45 43 49 44 0.000 0.0 1 3.485 180.0 2 0.000 0.0 3
|
|
torsion 56 43 49 44 0.000 0.0 1 3.441 180.0 2 0.000 0.0 3
|
|
torsion 43 43 50 48 0.000 0.0 1 10.504 180.0 2 0.000 0.0 3
|
|
torsion 43 43 50 59 0.000 0.0 1 7.861 180.0 2 0.000 0.0 3
|
|
torsion 46 43 50 48 0.000 0.0 1 11.410 180.0 2 0.000 0.0 3
|
|
torsion 60 43 50 59 0.000 0.0 1 13.900 180.0 2 0.000 0.0 3
|
|
torsion 43 43 56 54 0.000 0.0 1 7.980 180.0 2 0.000 0.0 3
|
|
torsion 43 43 56 58 0.000 0.0 1 6.051 180.0 2 0.000 0.0 3
|
|
torsion 43 43 56 63 0.000 0.0 1 7.980 180.0 2 0.000 0.0 3
|
|
torsion 49 43 56 54 0.000 0.0 1 3.810 180.0 2 0.000 0.0 3
|
|
torsion 49 43 56 58 0.000 0.0 1 3.810 180.0 2 0.000 0.0 3
|
|
torsion 49 43 56 63 0.000 0.0 1 3.810 180.0 2 0.000 0.0 3
|
|
torsion 43 43 60 44 0.000 0.0 1 14.189 180.0 2 0.000 0.0 3
|
|
torsion 43 43 60 68 0.000 0.0 1 3.551 180.0 2 0.000 0.0 3
|
|
torsion 43 43 60 76 0.000 0.0 1 3.551 180.0 2 0.000 0.0 3
|
|
torsion 50 43 60 44 0.000 0.0 1 3.031 180.0 2 0.000 0.0 3
|
|
torsion 50 43 60 68 0.000 0.0 1 2.502 180.0 2 0.000 0.0 3
|
|
torsion 50 43 60 76 0.000 0.0 1 2.502 180.0 2 0.000 0.0 3
|
|
torsion 49 44 46 43 0.000 0.0 1 26.463 180.0 2 0.000 0.0 3
|
|
torsion 49 44 46 68 0.000 0.0 1 3.014 180.0 2 0.000 0.0 3
|
|
torsion 49 44 46 76 0.000 0.0 1 3.014 180.0 2 0.000 0.0 3
|
|
torsion 51 44 46 43 0.000 0.0 1 3.590 180.0 2 0.000 0.0 3
|
|
torsion 51 44 46 68 0.000 0.0 1 2.075 180.0 2 0.000 0.0 3
|
|
torsion 51 44 46 76 0.000 0.0 1 2.075 180.0 2 0.000 0.0 3
|
|
torsion 46 44 49 43 0.000 0.0 1 26.315 180.0 2 0.000 0.0 3
|
|
torsion 51 44 49 43 0.000 0.0 1 7.650 180.0 2 0.000 0.0 3
|
|
torsion 60 44 49 43 0.000 0.0 1 26.315 180.0 2 0.000 0.0 3
|
|
torsion 49 44 60 43 0.000 0.0 1 26.463 180.0 2 0.000 0.0 3
|
|
torsion 49 44 60 68 0.000 0.0 1 3.014 180.0 2 0.000 0.0 3
|
|
torsion 49 44 60 76 0.000 0.0 1 3.014 180.0 2 0.000 0.0 3
|
|
torsion 51 44 60 43 0.000 0.0 1 3.590 180.0 2 0.000 0.0 3
|
|
torsion 51 44 60 68 0.000 0.0 1 2.075 180.0 2 0.000 0.0 3
|
|
torsion 51 44 60 76 0.000 0.0 1 2.075 180.0 2 0.000 0.0 3
|
|
torsion 43 45 47 53 0.000 0.0 1 1.885 180.0 2 0.000 0.0 3
|
|
torsion 50 45 47 53 0.000 0.0 1 0.622 180.0 2 0.000 0.0 3
|
|
torsion 55 45 47 53 0.000 0.0 1 2.075 180.0 2 0.000 0.0 3
|
|
torsion 43 45 50 48 0.000 0.0 1 9.537 180.0 2 0.000 0.0 3
|
|
torsion 47 45 50 48 0.000 0.0 1 11.976 180.0 2 0.000 0.0 3
|
|
torsion 47 45 50 56 0.000 0.0 1 17.562 180.0 2 0.000 0.0 3
|
|
torsion 55 45 50 56 0.000 0.0 1 3.856 180.0 2 0.000 0.0 3
|
|
torsion 47 45 55 48 0.000 0.0 1 4.702 180.0 2 0.000 0.0 3
|
|
torsion 47 45 55 57 0.000 0.0 1 4.163 180.0 2 0.000 0.0 3
|
|
torsion 50 45 55 48 0.000 0.0 1 8.735 180.0 2 0.000 0.0 3
|
|
torsion 50 45 55 57 0.000 0.0 1 4.043 180.0 2 0.000 0.0 3
|
|
torsion 43 46 68 65 0.871 0.0 1 -0.939 180.0 2 2.324 0.0 3
|
|
torsion 43 46 68 67 -0.200 0.0 1 -0.272 180.0 2 0.741 0.0 3
|
|
torsion 43 46 68 68 -0.661 0.0 1 0.186 180.0 2 -1.167 0.0 3
|
|
torsion 44 46 68 65 -1.147 0.0 1 -1.082 180.0 2 -0.750 0.0 3
|
|
torsion 44 46 68 67 0.108 0.0 1 -0.262 180.0 2 -0.427 0.0 3
|
|
torsion 44 46 68 68 0.233 0.0 1 0.289 180.0 2 2.754 0.0 3
|
|
torsion 43 46 76 76 -0.221 0.0 1 1.258 180.0 2 0.971 0.0 3
|
|
torsion 43 46 76 77 0.648 0.0 1 -0.088 180.0 2 -0.233 0.0 3
|
|
torsion 43 46 76 78 1.075 0.0 1 -0.251 180.0 2 0.302 0.0 3
|
|
torsion 44 46 76 76 -1.675 0.0 1 -0.401 180.0 2 1.310 0.0 3
|
|
torsion 44 46 76 77 -0.771 0.0 1 -0.276 180.0 2 1.758 0.0 3
|
|
torsion 44 46 76 78 -0.237 0.0 1 1.294 180.0 2 -0.128 0.0 3
|
|
torsion 53 47 59 50 0.000 0.0 1 1.303 180.0 2 0.000 0.0 3
|
|
torsion 53 47 59 54 0.000 0.0 1 1.071 180.0 2 0.000 0.0 3
|
|
torsion 51 48 48 52 0.000 0.0 1 3.699 180.0 2 0.000 0.0 3
|
|
torsion 51 48 48 56 0.000 0.0 1 3.682 180.0 2 0.000 0.0 3
|
|
torsion 51 48 48 62 0.000 0.0 1 4.026 180.0 2 0.000 0.0 3
|
|
torsion 52 48 48 63 0.000 0.0 1 3.941 180.0 2 0.000 0.0 3
|
|
torsion 56 48 48 63 0.000 0.0 1 3.925 180.0 2 0.000 0.0 3
|
|
torsion 62 48 48 63 0.000 0.0 1 10.272 180.0 2 0.000 0.0 3
|
|
torsion 50 48 50 43 0.000 0.0 1 7.259 180.0 2 0.000 0.0 3
|
|
torsion 50 48 50 45 0.000 0.0 1 7.710 180.0 2 0.000 0.0 3
|
|
torsion 52 48 50 43 0.000 0.0 1 14.604 180.0 2 0.000 0.0 3
|
|
torsion 52 48 50 45 0.000 0.0 1 13.794 180.0 2 0.000 0.0 3
|
|
torsion 48 48 54 68 0.000 0.0 1 3.925 180.0 2 0.000 0.0 3
|
|
torsion 48 48 54 76 0.000 0.0 1 3.925 180.0 2 0.000 0.0 3
|
|
torsion 51 48 54 56 0.000 0.0 1 5.896 180.0 2 0.000 0.0 3
|
|
torsion 51 48 54 68 0.000 0.0 1 4.904 180.0 2 0.000 0.0 3
|
|
torsion 51 48 54 76 0.000 0.0 1 4.904 180.0 2 0.000 0.0 3
|
|
torsion 55 48 54 56 0.000 0.0 1 3.971 180.0 2 0.000 0.0 3
|
|
torsion 55 48 54 68 0.000 0.0 1 6.856 180.0 2 0.000 0.0 3
|
|
torsion 55 48 54 76 0.000 0.0 1 6.856 180.0 2 0.000 0.0 3
|
|
torsion 51 48 55 45 0.000 0.0 1 4.730 180.0 2 0.000 0.0 3
|
|
torsion 51 48 55 57 0.000 0.0 1 3.311 180.0 2 0.000 0.0 3
|
|
torsion 54 48 55 45 0.000 0.0 1 8.884 180.0 2 0.000 0.0 3
|
|
torsion 54 48 55 57 0.000 0.0 1 5.035 180.0 2 0.000 0.0 3
|
|
torsion 63 48 55 57 0.000 0.0 1 5.035 180.0 2 0.000 0.0 3
|
|
torsion 48 48 56 54 0.000 0.0 1 3.890 180.0 2 0.000 0.0 3
|
|
torsion 48 48 56 58 0.000 0.0 1 3.872 180.0 2 0.000 0.0 3
|
|
torsion 48 48 56 63 0.000 0.0 1 3.890 180.0 2 0.000 0.0 3
|
|
torsion 52 48 56 54 0.000 0.0 1 9.149 180.0 2 0.000 0.0 3
|
|
torsion 52 48 56 58 0.000 0.0 1 4.789 180.0 2 0.000 0.0 3
|
|
torsion 62 48 56 54 0.000 0.0 1 9.439 180.0 2 0.000 0.0 3
|
|
torsion 62 48 56 58 0.000 0.0 1 4.645 180.0 2 0.000 0.0 3
|
|
torsion 62 48 56 63 0.000 0.0 1 9.439 180.0 2 0.000 0.0 3
|
|
torsion 48 48 62 64 0.000 0.0 1 2.400 180.0 2 0.000 0.0 3
|
|
torsion 56 48 62 64 0.000 0.0 1 0.283 180.0 2 0.494 0.0 3
|
|
torsion 48 48 63 56 0.000 0.0 1 7.148 180.0 2 0.000 0.0 3
|
|
torsion 48 48 63 68 0.000 0.0 1 3.925 180.0 2 0.000 0.0 3
|
|
torsion 48 48 63 76 0.000 0.0 1 3.925 180.0 2 0.000 0.0 3
|
|
torsion 51 48 63 56 0.000 0.0 1 5.896 180.0 2 0.000 0.0 3
|
|
torsion 51 48 63 68 0.000 0.0 1 4.904 180.0 2 0.000 0.0 3
|
|
torsion 51 48 63 76 0.000 0.0 1 4.904 180.0 2 0.000 0.0 3
|
|
torsion 55 48 63 56 0.000 0.0 1 3.971 180.0 2 0.000 0.0 3
|
|
torsion 55 48 63 68 0.000 0.0 1 6.856 180.0 2 0.000 0.0 3
|
|
torsion 55 48 63 76 0.000 0.0 1 6.856 180.0 2 0.000 0.0 3
|
|
torsion 45 50 56 54 0.000 0.0 1 3.798 180.0 2 0.000 0.0 3
|
|
torsion 45 50 56 58 0.000 0.0 1 17.613 180.0 2 0.000 0.0 3
|
|
torsion 43 50 59 47 0.000 0.0 1 16.908 180.0 2 0.000 0.0 3
|
|
torsion 43 50 59 54 0.000 0.0 1 4.852 180.0 2 0.000 0.0 3
|
|
torsion 48 54 56 50 0.000 0.0 1 3.774 180.0 2 0.000 0.0 3
|
|
torsion 48 54 56 58 0.000 0.0 1 3.231 180.0 2 0.000 0.0 3
|
|
torsion 56 54 56 48 0.000 0.0 1 3.659 180.0 2 0.000 0.0 3
|
|
torsion 56 54 56 58 0.000 0.0 1 3.572 180.0 2 0.000 0.0 3
|
|
torsion 56 54 56 63 0.000 0.0 1 3.511 180.0 2 0.000 0.0 3
|
|
torsion 59 54 56 43 0.000 0.0 1 3.649 180.0 2 0.000 0.0 3
|
|
torsion 59 54 56 58 0.000 0.0 1 3.730 180.0 2 0.000 0.0 3
|
|
torsion 61 54 56 43 0.000 0.0 1 3.812 180.0 2 0.000 0.0 3
|
|
torsion 61 54 56 48 0.000 0.0 1 3.666 180.0 2 0.000 0.0 3
|
|
torsion 61 54 56 58 0.000 0.0 1 10.490 180.0 2 0.000 0.0 3
|
|
torsion 61 54 56 63 0.000 0.0 1 3.869 180.0 2 0.000 0.0 3
|
|
torsion 68 54 56 50 0.000 0.0 1 4.295 180.0 2 0.000 0.0 3
|
|
torsion 68 54 56 54 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 68 54 56 58 0.000 0.0 1 10.374 180.0 2 0.000 0.0 3
|
|
torsion 68 54 56 63 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 76 54 56 50 0.000 0.0 1 4.295 180.0 2 0.000 0.0 3
|
|
torsion 76 54 56 54 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 76 54 56 58 0.000 0.0 1 10.374 180.0 2 0.000 0.0 3
|
|
torsion 76 54 56 63 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 56 54 59 47 0.000 0.0 1 3.924 180.0 2 0.000 0.0 3
|
|
torsion 56 54 59 50 0.000 0.0 1 3.854 180.0 2 0.000 0.0 3
|
|
torsion 61 54 59 47 0.000 0.0 1 3.777 180.0 2 0.000 0.0 3
|
|
torsion 61 54 59 50 0.000 0.0 1 3.928 180.0 2 0.000 0.0 3
|
|
torsion 48 54 68 65 -2.316 0.0 1 0.596 180.0 2 -0.493 0.0 3
|
|
torsion 48 54 68 67 1.107 0.0 1 -0.142 180.0 2 -0.178 0.0 3
|
|
torsion 48 54 68 68 -2.163 0.0 1 0.794 180.0 2 1.420 0.0 3
|
|
torsion 56 54 68 65 3.068 0.0 1 0.722 180.0 2 1.339 0.0 3
|
|
torsion 56 54 68 67 -0.988 0.0 1 -0.186 180.0 2 0.346 0.0 3
|
|
torsion 56 54 68 68 2.890 0.0 1 0.880 180.0 2 -0.605 0.0 3
|
|
torsion 48 54 76 76 0.819 0.0 1 3.809 180.0 2 -0.110 0.0 3
|
|
torsion 48 54 76 77 -3.184 0.0 1 -2.234 180.0 2 0.000 0.0 3
|
|
torsion 48 54 76 78 -0.480 0.0 1 -0.684 180.0 2 -0.281 0.0 3
|
|
torsion 56 54 76 76 0.044 0.0 1 0.571 180.0 2 -0.102 0.0 3
|
|
torsion 56 54 76 77 4.300 0.0 1 -1.454 180.0 2 -0.052 0.0 3
|
|
torsion 56 54 76 78 -0.945 0.0 1 2.121 180.0 2 0.337 0.0 3
|
|
torsion 43 56 63 61 0.000 0.0 1 3.812 180.0 2 0.000 0.0 3
|
|
torsion 48 56 63 56 0.000 0.0 1 3.659 180.0 2 0.000 0.0 3
|
|
torsion 50 56 63 48 0.000 0.0 1 3.774 180.0 2 0.000 0.0 3
|
|
torsion 50 56 63 68 0.000 0.0 1 4.295 180.0 2 0.000 0.0 3
|
|
torsion 50 56 63 76 0.000 0.0 1 4.295 180.0 2 0.000 0.0 3
|
|
torsion 54 56 63 48 0.000 0.0 1 3.856 180.0 2 0.000 0.0 3
|
|
torsion 54 56 63 68 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 54 56 63 76 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 58 56 63 48 0.000 0.0 1 3.231 180.0 2 0.000 0.0 3
|
|
torsion 58 56 63 56 0.000 0.0 1 3.572 180.0 2 0.000 0.0 3
|
|
torsion 58 56 63 61 0.000 0.0 1 10.490 180.0 2 0.000 0.0 3
|
|
torsion 58 56 63 68 0.000 0.0 1 10.374 180.0 2 0.000 0.0 3
|
|
torsion 58 56 63 76 0.000 0.0 1 10.374 180.0 2 0.000 0.0 3
|
|
torsion 63 56 63 68 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 63 56 63 76 0.000 0.0 1 3.986 180.0 2 0.000 0.0 3
|
|
torsion 43 60 68 65 0.871 0.0 1 -0.939 180.0 2 2.324 0.0 3
|
|
torsion 43 60 68 67 -0.200 0.0 1 -0.272 180.0 2 0.741 0.0 3
|
|
torsion 43 60 68 68 -0.661 0.0 1 0.186 180.0 2 -1.167 0.0 3
|
|
torsion 44 60 68 65 -1.147 0.0 1 -1.082 180.0 2 -0.750 0.0 3
|
|
torsion 44 60 68 67 0.108 0.0 1 -0.262 180.0 2 -0.427 0.0 3
|
|
torsion 44 60 68 68 0.233 0.0 1 0.289 180.0 2 2.754 0.0 3
|
|
torsion 43 60 76 76 -0.221 0.0 1 1.258 180.0 2 0.971 0.0 3
|
|
torsion 43 60 76 77 0.648 0.0 1 -0.088 180.0 2 -0.233 0.0 3
|
|
torsion 43 60 76 78 1.075 0.0 1 -0.251 180.0 2 0.302 0.0 3
|
|
torsion 44 60 76 76 -1.675 0.0 1 -0.401 180.0 2 1.310 0.0 3
|
|
torsion 44 60 76 77 -0.771 0.0 1 -0.276 180.0 2 1.758 0.0 3
|
|
torsion 44 60 76 78 -0.237 0.0 1 1.294 180.0 2 -0.128 0.0 3
|
|
torsion 48 63 68 65 -2.316 0.0 1 0.596 180.0 2 -0.493 0.0 3
|
|
torsion 48 63 68 67 1.107 0.0 1 -0.142 180.0 2 -0.178 0.0 3
|
|
torsion 48 63 68 68 -2.163 0.0 1 0.794 180.0 2 1.420 0.0 3
|
|
torsion 56 63 68 65 3.068 0.0 1 0.722 180.0 2 1.339 0.0 3
|
|
torsion 56 63 68 67 -0.988 0.0 1 -0.186 180.0 2 0.346 0.0 3
|
|
torsion 56 63 68 68 2.890 0.0 1 0.880 180.0 2 -0.605 0.0 3
|
|
torsion 48 63 76 76 0.819 0.0 1 3.809 180.0 2 0.604 0.0 3
|
|
torsion 48 63 76 77 -3.184 0.0 1 -2.234 180.0 2 0.000 0.0 3
|
|
torsion 48 63 76 78 -0.480 0.0 1 -0.684 180.0 2 -0.282 0.0 3
|
|
torsion 56 63 76 76 0.044 0.0 1 0.571 180.0 2 -0.516 0.0 3
|
|
torsion 56 63 76 77 4.300 0.0 1 -1.454 180.0 2 -0.052 0.0 3
|
|
torsion 56 63 76 78 -0.945 0.0 1 2.121 180.0 2 0.337 0.0 3
|
|
torsion 68 65 66 67 -0.161 0.0 1 -0.026 180.0 2 0.277 0.0 3
|
|
torsion 68 65 66 68 -0.563 0.0 1 0.770 180.0 2 -0.322 0.0 3
|
|
torsion 68 65 66 72 -0.791 0.0 1 -0.829 180.0 2 1.101 0.0 3
|
|
torsion 66 65 68 46 0.245 0.0 1 -0.367 180.0 2 0.305 0.0 3
|
|
torsion 66 65 68 54 -0.444 0.0 1 -1.457 180.0 2 1.051 0.0 3
|
|
torsion 66 65 68 60 0.245 0.0 1 -0.367 180.0 2 0.305 0.0 3
|
|
torsion 66 65 68 63 -0.444 0.0 1 -1.457 180.0 2 1.051 0.0 3
|
|
torsion 66 65 68 67 -0.135 0.0 1 0.678 180.0 2 0.846 0.0 3
|
|
torsion 66 65 68 68 -0.320 0.0 1 -0.209 180.0 2 0.318 0.0 3
|
|
torsion 65 66 68 67 -0.182 0.0 1 -0.745 180.0 2 0.727 0.0 3
|
|
torsion 65 66 68 68 -0.702 0.0 1 -0.307 180.0 2 2.879 0.0 3
|
|
torsion 65 66 68 71 1.164 0.0 1 0.732 180.0 2 -0.836 0.0 3
|
|
torsion 65 66 68 87 1.164 0.0 1 0.732 180.0 2 -0.836 0.0 3
|
|
torsion 67 66 68 67 0.081 0.0 1 -0.066 180.0 2 0.422 0.0 3
|
|
torsion 67 66 68 68 -0.190 0.0 1 -0.101 180.0 2 0.543 0.0 3
|
|
torsion 67 66 68 71 0.006 0.0 1 -0.170 180.0 2 -0.168 0.0 3
|
|
torsion 67 66 68 87 0.006 0.0 1 -0.170 180.0 2 -0.168 0.0 3
|
|
torsion 72 66 68 67 -0.265 0.0 1 0.360 180.0 2 -0.039 0.0 3
|
|
torsion 72 66 68 68 -0.483 0.0 1 -1.984 180.0 2 0.091 0.0 3
|
|
torsion 72 66 68 71 1.090 0.0 1 3.549 180.0 2 -1.833 0.0 3
|
|
torsion 72 66 68 87 1.090 0.0 1 3.549 180.0 2 -1.833 0.0 3
|
|
torsion 65 66 72 73 0.000 0.0 1 0.257 180.0 2 0.096 0.0 3
|
|
torsion 65 66 72 74 1.333 0.0 1 -1.311 180.0 2 0.000 0.0 3
|
|
torsion 65 66 72 86 1.333 0.0 1 -1.311 180.0 2 0.000 0.0 3
|
|
torsion 67 66 72 73 0.000 0.0 1 0.000 180.0 2 0.133 0.0 3
|
|
torsion 67 66 72 74 0.000 0.0 1 0.287 180.0 2 0.132 0.0 3
|
|
torsion 67 66 72 86 0.000 0.0 1 0.287 180.0 2 0.132 0.0 3
|
|
torsion 68 66 72 73 0.000 0.0 1 0.000 180.0 2 0.136 0.0 3
|
|
torsion 68 66 72 74 -0.401 0.0 1 0.496 180.0 2 2.714 0.0 3
|
|
torsion 68 66 72 86 -0.401 0.0 1 0.496 180.0 2 2.714 0.0 3
|
|
torsion 46 68 68 67 -0.125 0.0 1 0.021 180.0 2 -0.086 0.0 3
|
|
torsion 46 68 68 68 -1.702 0.0 1 0.379 180.0 2 0.262 0.0 3
|
|
torsion 46 68 68 69 0.677 0.0 1 0.358 180.0 2 1.781 0.0 3
|
|
torsion 54 68 68 67 0.151 0.0 1 -0.318 180.0 2 0.229 0.0 3
|
|
torsion 54 68 68 68 1.331 0.0 1 -0.470 180.0 2 -0.535 0.0 3
|
|
torsion 54 68 68 69 -1.812 0.0 1 1.755 180.0 2 0.933 0.0 3
|
|
torsion 60 68 68 67 -0.125 0.0 1 0.021 180.0 2 -0.086 0.0 3
|
|
torsion 60 68 68 68 -1.702 0.0 1 0.379 180.0 2 0.262 0.0 3
|
|
torsion 60 68 68 69 0.677 0.0 1 0.358 180.0 2 1.781 0.0 3
|
|
torsion 63 68 68 67 0.151 0.0 1 -0.318 180.0 2 0.229 0.0 3
|
|
torsion 63 68 68 68 1.331 0.0 1 -0.470 180.0 2 -0.535 0.0 3
|
|
torsion 63 68 68 69 -1.812 0.0 1 1.755 180.0 2 0.933 0.0 3
|
|
torsion 65 68 68 67 0.005 0.0 1 0.133 180.0 2 -0.244 0.0 3
|
|
torsion 65 68 68 68 -0.734 0.0 1 0.779 180.0 2 -1.058 0.0 3
|
|
torsion 65 68 68 69 0.016 0.0 1 -0.949 180.0 2 0.636 0.0 3
|
|
torsion 66 68 68 67 0.155 0.0 1 0.097 180.0 2 0.148 0.0 3
|
|
torsion 66 68 68 68 -0.940 0.0 1 1.490 180.0 2 -1.143 0.0 3
|
|
torsion 66 68 68 69 -1.280 0.0 1 0.457 180.0 2 0.975 0.0 3
|
|
torsion 67 68 68 67 -0.244 0.0 1 -0.103 180.0 2 0.537 0.0 3
|
|
torsion 67 68 68 68 -0.090 0.0 1 -0.366 180.0 2 0.190 0.0 3
|
|
torsion 67 68 68 69 0.360 0.0 1 -1.026 180.0 2 0.826 0.0 3
|
|
torsion 67 68 68 71 -0.163 0.0 1 0.092 180.0 2 0.174 0.0 3
|
|
torsion 67 68 68 87 -0.163 0.0 1 0.092 180.0 2 0.174 0.0 3
|
|
torsion 68 68 68 71 0.600 0.0 1 -0.511 180.0 2 -1.857 0.0 3
|
|
torsion 68 68 68 87 0.600 0.0 1 -0.511 180.0 2 -1.857 0.0 3
|
|
torsion 69 68 68 71 0.044 0.0 1 -1.208 180.0 2 1.530 0.0 3
|
|
torsion 69 68 68 87 0.044 0.0 1 -1.208 180.0 2 1.530 0.0 3
|
|
torsion 67 68 69 70 0.320 0.0 1 -0.343 180.0 2 0.264 0.0 3
|
|
torsion 68 68 69 70 -1.051 0.0 1 2.670 180.0 2 0.052 0.0 3
|
|
torsion 66 68 71 84 0.060 0.0 1 1.996 180.0 2 3.820 0.0 3
|
|
torsion 67 68 71 84 4.441 0.0 1 -1.148 180.0 2 -2.262 0.0 3
|
|
torsion 68 68 71 84 -5.421 0.0 1 0.856 180.0 2 -2.090 0.0 3
|
|
torsion 66 68 87 70 0.477 0.0 1 -0.199 180.0 2 0.652 0.0 3
|
|
torsion 67 68 87 70 0.950 0.0 1 1.111 180.0 2 0.075 0.0 3
|
|
torsion 68 68 87 70 -1.807 0.0 1 -0.383 180.0 2 -0.263 0.0 3
|
|
torsion 68 71 84 74 -4.666 0.0 1 6.282 180.0 2 0.996 0.0 3
|
|
torsion 68 71 84 85 -6.338 0.0 1 6.788 180.0 2 0.370 0.0 3
|
|
torsion 66 72 74 84 0.000 0.0 1 1.905 180.0 2 0.000 0.0 3
|
|
torsion 73 72 74 84 0.000 0.0 1 0.000 180.0 2 0.120 0.0 3
|
|
torsion 66 72 86 70 -0.863 0.0 1 1.141 180.0 2 -1.090 0.0 3
|
|
torsion 73 72 86 70 0.403 0.0 1 -0.303 180.0 2 0.428 0.0 3
|
|
torsion 72 74 84 71 -4.666 0.0 1 6.282 180.0 2 0.996 0.0 3
|
|
torsion 72 74 84 85 -6.338 0.0 1 6.788 180.0 2 0.370 0.0 3
|
|
torsion 77 75 76 76 -0.484 0.0 1 0.023 180.0 2 0.416 0.0 3
|
|
torsion 77 75 76 78 -0.562 0.0 1 -0.153 180.0 2 0.720 0.0 3
|
|
torsion 77 75 76 80 0.386 0.0 1 -0.247 180.0 2 0.617 0.0 3
|
|
torsion 77 75 76 88 0.386 0.0 1 -0.247 180.0 2 0.617 0.0 3
|
|
torsion 78 75 76 76 -0.150 0.0 1 0.032 180.0 2 0.114 0.0 3
|
|
torsion 78 75 76 78 -0.056 0.0 1 -0.283 180.0 2 0.428 0.0 3
|
|
torsion 78 75 76 80 -0.367 0.0 1 -0.153 180.0 2 0.277 0.0 3
|
|
torsion 78 75 76 88 -0.367 0.0 1 -0.153 180.0 2 0.277 0.0 3
|
|
torsion 79 75 76 76 -0.609 0.0 1 -1.399 180.0 2 -0.326 0.0 3
|
|
torsion 79 75 76 78 -0.340 0.0 1 -0.204 180.0 2 0.030 0.0 3
|
|
torsion 79 75 76 80 0.354 0.0 1 0.507 180.0 2 -0.226 0.0 3
|
|
torsion 79 75 76 88 0.354 0.0 1 0.507 180.0 2 -0.226 0.0 3
|
|
torsion 76 75 77 76 0.285 0.0 1 -1.512 180.0 2 -0.212 0.0 3
|
|
torsion 78 75 77 76 -1.461 0.0 1 1.145 180.0 2 0.303 0.0 3
|
|
torsion 79 75 77 76 0.058 0.0 1 0.000 180.0 2 0.048 0.0 3
|
|
torsion 76 75 79 82 0.000 0.0 1 0.000 180.0 2 0.194 0.0 3
|
|
torsion 76 75 79 83 -0.434 0.0 1 0.630 180.0 2 2.364 0.0 3
|
|
torsion 76 75 79 89 -0.434 0.0 1 0.630 180.0 2 2.364 0.0 3
|
|
torsion 77 75 79 82 0.000 0.0 1 0.607 180.0 2 0.028 0.0 3
|
|
torsion 77 75 79 83 0.456 0.0 1 -1.166 180.0 2 0.000 0.0 3
|
|
torsion 77 75 79 89 0.456 0.0 1 -1.166 180.0 2 0.000 0.0 3
|
|
torsion 78 75 79 82 0.000 0.0 1 0.000 180.0 2 0.326 0.0 3
|
|
torsion 78 75 79 83 0.000 0.0 1 0.654 180.0 2 0.154 0.0 3
|
|
torsion 78 75 79 89 0.000 0.0 1 0.654 180.0 2 0.154 0.0 3
|
|
torsion 46 76 76 76 -0.583 0.0 1 -0.616 180.0 2 0.411 0.0 3
|
|
torsion 46 76 76 78 0.499 0.0 1 -1.065 180.0 2 -0.019 0.0 3
|
|
torsion 54 76 76 76 3.366 0.0 1 -2.257 180.0 2 -1.299 0.0 3
|
|
torsion 54 76 76 78 1.119 0.0 1 -0.552 180.0 2 1.140 0.0 3
|
|
torsion 60 76 76 76 -0.583 0.0 1 -0.616 180.0 2 0.411 0.0 3
|
|
torsion 60 76 76 78 0.499 0.0 1 -1.065 180.0 2 -0.019 0.0 3
|
|
torsion 63 76 76 76 3.366 0.0 1 -2.257 180.0 2 -1.299 0.0 3
|
|
torsion 63 76 76 78 1.119 0.0 1 -0.552 180.0 2 1.140 0.0 3
|
|
torsion 75 76 76 76 -0.545 0.0 1 0.230 180.0 2 0.306 0.0 3
|
|
torsion 75 76 76 78 0.036 0.0 1 -1.454 180.0 2 0.014 0.0 3
|
|
torsion 76 76 76 77 0.068 0.0 1 -1.039 180.0 2 -0.102 0.0 3
|
|
torsion 76 76 76 78 -0.464 0.0 1 0.159 180.0 2 0.896 0.0 3
|
|
torsion 76 76 76 80 -0.354 0.0 1 0.007 180.0 2 0.129 0.0 3
|
|
torsion 76 76 76 88 -0.354 0.0 1 0.007 180.0 2 0.129 0.0 3
|
|
torsion 77 76 76 78 -0.886 0.0 1 0.249 180.0 2 -1.124 0.0 3
|
|
torsion 78 76 76 78 -0.758 0.0 1 0.104 180.0 2 0.868 0.0 3
|
|
torsion 78 76 76 80 -0.569 0.0 1 0.086 180.0 2 -0.337 0.0 3
|
|
torsion 78 76 76 88 -0.569 0.0 1 0.086 180.0 2 -0.337 0.0 3
|
|
torsion 46 76 77 75 -0.201 0.0 1 -0.654 180.0 2 -0.791 0.0 3
|
|
torsion 54 76 77 75 -0.209 0.0 1 1.352 180.0 2 -2.522 0.0 3
|
|
torsion 60 76 77 75 -0.201 0.0 1 -0.654 180.0 2 -0.791 0.0 3
|
|
torsion 63 76 77 75 -0.209 0.0 1 1.352 180.0 2 -2.522 0.0 3
|
|
torsion 76 76 77 75 0.774 0.0 1 -2.681 180.0 2 0.498 0.0 3
|
|
torsion 78 76 77 75 -1.252 0.0 1 1.892 180.0 2 0.059 0.0 3
|
|
torsion 75 76 80 84 -1.164 0.0 1 0.505 180.0 2 0.239 0.0 3
|
|
torsion 76 76 80 84 -1.502 0.0 1 0.223 180.0 2 0.056 0.0 3
|
|
torsion 78 76 80 84 0.897 0.0 1 -0.136 180.0 2 0.147 0.0 3
|
|
torsion 75 76 88 81 0.138 0.0 1 0.401 180.0 2 0.438 0.0 3
|
|
torsion 76 76 88 81 -0.727 0.0 1 -0.708 180.0 2 0.974 0.0 3
|
|
torsion 78 76 88 81 -0.263 0.0 1 -0.458 180.0 2 0.409 0.0 3
|
|
torsion 75 79 83 84 -0.690 0.0 1 0.000 180.0 2 -0.148 0.0 3
|
|
torsion 82 79 83 84 0.000 0.0 1 0.000 180.0 2 0.120 0.0 3
|
|
torsion 75 79 89 81 -1.207 0.0 1 -1.651 180.0 2 -0.176 0.0 3
|
|
torsion 82 79 89 81 0.659 0.0 1 0.975 180.0 2 -0.414 0.0 3
|
|
torsion 76 80 84 83 -4.666 0.0 1 6.282 180.0 2 0.996 0.0 3
|
|
torsion 76 80 84 85 -6.338 0.0 1 6.788 180.0 2 0.370 0.0 3
|
|
torsion 79 83 84 80 -4.666 0.0 1 6.282 180.0 2 0.996 0.0 3
|
|
torsion 79 83 84 85 -6.338 0.0 1 6.788 180.0 2 0.370 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 43 4.00
|
|
pitors 43 45 4.00
|
|
pitors 43 46 6.00
|
|
pitors 43 56 3.00
|
|
pitors 43 60 6.00
|
|
pitors 44 46 6.00
|
|
pitors 44 60 6.00
|
|
pitors 45 47 6.00
|
|
pitors 45 55 4.00
|
|
pitors 47 59 4.00
|
|
pitors 48 48 4.00
|
|
pitors 48 54 3.00
|
|
pitors 48 55 4.00
|
|
pitors 48 56 3.00
|
|
pitors 48 63 3.00
|
|
pitors 54 56 3.00
|
|
pitors 54 59 3.00
|
|
pitors 56 63 3.00
|
|
pitors 59 63 3.00
|
|
|
|
|
|
##################################
|
|
## ##
|
|
## Stretch-Torsion Parameters ##
|
|
## ##
|
|
##################################
|
|
|
|
|
|
strtors 44 46 68 65 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 44 46 76 77 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 48 54 68 65 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 48 54 76 77 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 44 60 68 65 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 44 60 76 77 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 48 63 68 65 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 48 63 76 77 0.000 0.000 1.500 0.000 0.000 -4.000 0.000 0.000 5.200
|
|
strtors 68 71 84 74 0.000 0.000 0.000 0.000 1.814 0.000 -4.254 0.000 0.000
|
|
strtors 72 74 84 71 0.000 0.000 0.000 0.000 1.814 0.000 -4.254 0.000 0.000
|
|
strtors 76 80 84 83 0.000 0.000 0.000 0.000 1.814 0.000 -4.254 0.000 0.000
|
|
strtors 79 83 84 80 0.000 0.000 0.000 0.000 1.814 0.000 -4.254 0.000 0.000
|
|
|
|
|
|
################################
|
|
## ##
|
|
## Angle-Torsion Parameters ##
|
|
## ##
|
|
################################
|
|
|
|
|
|
angtors 44 46 68 65 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 44 46 76 77 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 48 54 68 65 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 48 54 76 77 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 44 60 68 65 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 44 60 76 77 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 48 63 68 65 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 48 63 76 77 0.802 0.000 -3.323 0.000 0.000 -0.630
|
|
angtors 68 71 84 85 0.000 0.000 -0.630 0.000 -6.646 0.000
|
|
angtors 72 74 84 85 0.000 0.000 -0.630 0.000 -6.646 0.000
|
|
angtors 76 80 84 85 0.000 0.000 -0.630 0.000 -6.646 0.000
|
|
angtors 79 83 84 85 0.000 0.000 -0.630 0.000 -6.646 0.000
|
|
|
|
|
|
##################################
|
|
## ##
|
|
## Torsion-Torsion Parameters ##
|
|
## ##
|
|
##################################
|
|
|
|
|
|
tortors 3 1 2 3 1 25 25
|
|
-180.0 -180.0 -0.41030 -180.0 -165.0 -0.41413 -180.0 -150.0 -0.34547
|
|
-180.0 -135.0 0.11457 -180.0 -120.0 0.94012 -180.0 -105.0 1.95487
|
|
-180.0 -90.0 2.74331 -180.0 -75.0 2.77751 -180.0 -60.0 1.75943
|
|
-180.0 -45.0 -0.27385 -180.0 -30.0 -2.58364 -180.0 -15.0 -4.27536
|
|
-180.0 0.0 -4.22230 -180.0 15.0 -4.27526 -180.0 30.0 -2.58364
|
|
-180.0 45.0 -0.27385 -180.0 60.0 1.75943 -180.0 75.0 2.77761
|
|
-180.0 90.0 2.74331 -180.0 105.0 1.95497 -180.0 120.0 0.94002
|
|
-180.0 135.0 0.11457 -180.0 150.0 -0.34547 -180.0 165.0 -0.41413
|
|
-180.0 180.0 -0.41030 -165.0 -180.0 -0.67838 -165.0 -165.0 -0.90052
|
|
-165.0 -150.0 -0.91119 -165.0 -135.0 -0.35767 -165.0 -120.0 0.68619
|
|
-165.0 -105.0 1.89156 -165.0 -90.0 2.74719 -165.0 -75.0 2.93260
|
|
-165.0 -60.0 1.79376 -165.0 -45.0 -0.26642 -165.0 -30.0 -2.46195
|
|
-165.0 -15.0 -3.60137 -165.0 0.0 -5.04625 -165.0 15.0 -4.46238
|
|
-165.0 30.0 -2.68532 -165.0 45.0 -0.39460 -165.0 60.0 1.51071
|
|
-165.0 75.0 2.53125 -165.0 90.0 2.58198 -165.0 105.0 1.97933
|
|
-165.0 120.0 1.14392 -165.0 135.0 0.39970 -165.0 150.0 -0.09173
|
|
-165.0 165.0 -0.38834 -165.0 180.0 -0.67838 -150.0 -180.0 -1.32284
|
|
-150.0 -165.0 -1.68618 -150.0 -150.0 -1.61128 -150.0 -135.0 -0.86749
|
|
-150.0 -120.0 0.39856 -150.0 -105.0 1.74844 -150.0 -90.0 2.65974
|
|
-150.0 -75.0 2.55866 -150.0 -60.0 1.47445 -150.0 -45.0 -0.36210
|
|
-150.0 -30.0 -2.03519 -150.0 -15.0 -4.68528 -150.0 0.0 -5.41586
|
|
-150.0 15.0 -4.67044 -150.0 30.0 -2.88548 -150.0 45.0 -0.69448
|
|
-150.0 60.0 1.18267 -150.0 75.0 2.18987 -150.0 90.0 2.27845
|
|
-150.0 105.0 1.65296 -150.0 120.0 0.94220 -150.0 135.0 0.30326
|
|
-150.0 150.0 -0.34336 -150.0 165.0 -0.85965 -150.0 180.0 -1.32284
|
|
-135.0 -180.0 -2.35817 -135.0 -165.0 -2.64483 -135.0 -150.0 -2.39523
|
|
-135.0 -135.0 -1.46100 -135.0 -120.0 -0.12378 -135.0 -105.0 1.09827
|
|
-135.0 -90.0 1.59315 -135.0 -75.0 1.67411 -135.0 -60.0 0.86891
|
|
-135.0 -45.0 -0.41066 -135.0 -30.0 -3.32323 -135.0 -15.0 -5.26619
|
|
-135.0 0.0 -5.74456 -135.0 15.0 -4.95535 -135.0 30.0 -3.21036
|
|
-135.0 45.0 -1.07442 -135.0 60.0 0.71371 -135.0 75.0 1.60144
|
|
-135.0 90.0 1.55961 -135.0 105.0 1.13219 -135.0 120.0 0.42439
|
|
-135.0 135.0 -0.26169 -135.0 150.0 -1.09788 -135.0 165.0 -1.80556
|
|
-135.0 180.0 -2.35817 -120.0 -180.0 -3.54199 -120.0 -165.0 -3.73864
|
|
-120.0 -150.0 -3.36374 -120.0 -135.0 -2.41372 -120.0 -120.0 -1.19823
|
|
-120.0 -105.0 -0.23826 -120.0 -90.0 0.44790 -120.0 -75.0 0.59458
|
|
-120.0 -60.0 0.19601 -120.0 -45.0 -1.56700 -120.0 -30.0 -4.15184
|
|
-120.0 -15.0 -5.75171 -120.0 0.0 -6.10583 -120.0 15.0 -5.30069
|
|
-120.0 30.0 -3.61554 -120.0 45.0 -1.56505 -120.0 60.0 -0.01095
|
|
-120.0 75.0 0.70386 -120.0 90.0 0.62829 -120.0 105.0 0.25289
|
|
-120.0 120.0 -0.45731 -120.0 135.0 -1.38411 -120.0 150.0 -2.21872
|
|
-120.0 165.0 -3.01099 -120.0 180.0 -3.54199 -105.0 -180.0 -4.74648
|
|
-105.0 -165.0 -4.87747 -105.0 -150.0 -4.51571 -105.0 -135.0 -3.62454
|
|
-105.0 -120.0 -2.58368 -105.0 -105.0 -1.44395 -105.0 -90.0 -0.60009
|
|
-105.0 -75.0 -0.17181 -105.0 -60.0 -0.17426 -105.0 -45.0 -2.58412
|
|
-105.0 -30.0 -4.81605 -105.0 -15.0 -6.18609 -105.0 0.0 -6.42560
|
|
-105.0 15.0 -5.59602 -105.0 30.0 -4.04096 -105.0 45.0 -2.42000
|
|
-105.0 60.0 -1.08681 -105.0 75.0 -0.43657 -105.0 90.0 -0.40231
|
|
-105.0 105.0 -0.79043 -105.0 120.0 -1.58770 -105.0 135.0 -2.57323
|
|
-105.0 150.0 -3.43923 -105.0 165.0 -4.24252 -105.0 180.0 -4.74648
|
|
-90.0 -180.0 -5.73614 -90.0 -165.0 -5.89392 -90.0 -150.0 -5.59097
|
|
-90.0 -135.0 -4.73673 -90.0 -120.0 -3.50628 -90.0 -105.0 -2.34446
|
|
-90.0 -90.0 -1.24738 -90.0 -75.0 -0.48079 -90.0 -60.0 -1.15692
|
|
-90.0 -45.0 -3.31258 -90.0 -30.0 -5.26121 -90.0 -15.0 -6.40257
|
|
-90.0 0.0 -6.50266 -90.0 15.0 -5.75823 -90.0 30.0 -4.67162
|
|
-90.0 45.0 -3.23377 -90.0 60.0 -1.77710 -90.0 75.0 -1.06238
|
|
-90.0 90.0 -1.11458 -90.0 105.0 -1.75760 -90.0 120.0 -2.45287
|
|
-90.0 135.0 -3.48022 -90.0 150.0 -4.47202 -90.0 165.0 -5.26258
|
|
-90.0 180.0 -5.73614 -75.0 -180.0 -6.35918 -75.0 -165.0 -6.55928
|
|
-75.0 -150.0 -6.28648 -75.0 -135.0 -5.35985 -75.0 -120.0 -3.94292
|
|
-75.0 -105.0 -2.46809 -75.0 -90.0 -1.04633 -75.0 -75.0 0.13385
|
|
-75.0 -60.0 -1.49008 -75.0 -45.0 -3.48890 -75.0 -30.0 -5.15227
|
|
-75.0 -15.0 -5.99165 -75.0 0.0 -6.06098 -75.0 15.0 -5.72479
|
|
-75.0 30.0 -4.69688 -75.0 45.0 -3.16790 -75.0 60.0 -1.64228
|
|
-75.0 75.0 -0.95978 -75.0 90.0 -1.08320 -75.0 105.0 -2.00163
|
|
-75.0 120.0 -3.08135 -75.0 135.0 -4.14746 -75.0 150.0 -5.11368
|
|
-75.0 165.0 -5.87160 -75.0 180.0 -6.35918 -60.0 -180.0 -6.35328
|
|
-60.0 -165.0 -6.49751 -60.0 -150.0 -4.83329 -60.0 -135.0 -4.95241
|
|
-60.0 -120.0 -3.11264 -60.0 -105.0 -1.05326 -60.0 -90.0 0.58385
|
|
-60.0 -75.0 0.58100 -60.0 -60.0 -1.04413 -60.0 -45.0 -2.82064
|
|
-60.0 -30.0 -4.04692 -60.0 -15.0 -4.68897 -60.0 0.0 -5.05604
|
|
-60.0 15.0 -4.85236 -60.0 30.0 -3.84373 -60.0 45.0 -2.11507
|
|
-60.0 60.0 -0.72835 -60.0 75.0 0.19866 -60.0 90.0 -0.28428
|
|
-60.0 105.0 -1.39335 -60.0 120.0 -2.90997 -60.0 135.0 -4.15255
|
|
-60.0 150.0 -5.15707 -60.0 165.0 -5.89147 -60.0 180.0 -6.35328
|
|
-45.0 -180.0 -5.25542 -45.0 -165.0 -5.22067 -45.0 -150.0 -4.62413
|
|
-45.0 -135.0 -2.94717 -45.0 -120.0 -0.39145 -45.0 -105.0 1.58629
|
|
-45.0 -90.0 2.52552 -45.0 -75.0 1.59048 -45.0 -60.0 0.12852
|
|
-45.0 -45.0 -1.15606 -45.0 -30.0 -2.03450 -45.0 -15.0 -2.79424
|
|
-45.0 0.0 -3.40770 -45.0 15.0 -3.22837 -45.0 30.0 -2.00765
|
|
-45.0 45.0 -0.23679 -45.0 60.0 1.34478 -45.0 75.0 1.98173
|
|
-45.0 90.0 1.48393 -45.0 105.0 0.01966 -45.0 120.0 -1.83307
|
|
-45.0 135.0 -3.31494 -45.0 150.0 -4.32002 -45.0 165.0 -4.96362
|
|
-45.0 180.0 -5.25542 -30.0 -180.0 -3.16646 -30.0 -165.0 -2.94954
|
|
-30.0 -150.0 -1.82424 -30.0 -135.0 1.07212 -30.0 -120.0 2.74127
|
|
-30.0 -105.0 3.35587 -30.0 -90.0 3.38653 -30.0 -75.0 2.74299
|
|
-30.0 -60.0 1.88655 -30.0 -45.0 1.17974 -30.0 -30.0 0.38805
|
|
-30.0 -15.0 -0.88273 -30.0 0.0 -1.55029 -30.0 15.0 -1.33903
|
|
-30.0 30.0 -0.06654 -30.0 45.0 1.82415 -30.0 60.0 3.44050
|
|
-30.0 75.0 4.24483 -30.0 90.0 3.46788 -30.0 105.0 1.68837
|
|
-30.0 120.0 -0.33944 -30.0 135.0 -1.78936 -30.0 150.0 -2.63712
|
|
-30.0 165.0 -3.08291 -30.0 180.0 -3.16646 -15.0 -180.0 -1.09098
|
|
-15.0 -165.0 -0.08376 -15.0 -150.0 1.19531 -15.0 -135.0 1.77725
|
|
-15.0 -120.0 2.72433 -15.0 -105.0 3.45811 -15.0 -90.0 3.96283
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0.0 0.0 0.07505 0.0 15.0 0.73245 0.0 30.0 2.31188
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0.0 45.0 4.30295 0.0 60.0 5.75134 0.0 75.0 5.44049
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180.0 0.0 -4.22230 180.0 15.0 -4.27526 180.0 30.0 -2.58364
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180.0 180.0 -0.41030
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|
|
tortors 3 1 2 32 34 25 25
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-180.0 -180.0 -0.41030 -180.0 -165.0 -0.41413 -180.0 -150.0 -0.34547
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-15.0 -75.0 4.08945 -15.0 -60.0 3.95852 -15.0 -45.0 3.56251
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-15.0 15.0 0.05777 -15.0 30.0 1.55486 -15.0 45.0 3.60759
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-15.0 60.0 5.31247 -15.0 75.0 5.94623 -15.0 90.0 4.70554
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-15.0 105.0 2.74754 -15.0 120.0 1.05732 -15.0 135.0 -0.05629
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-15.0 150.0 -0.72643 -15.0 165.0 -1.02648 -15.0 180.0 -1.09098
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0.0 -180.0 1.38787 0.0 -165.0 0.32603 0.0 -150.0 0.65267
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0.0 -135.0 1.29409 0.0 -120.0 2.15560 0.0 -105.0 3.26537
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0.0 -90.0 4.49297 0.0 -75.0 5.44049 0.0 -60.0 5.75134
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0.0 -45.0 4.30355 0.0 -30.0 2.31228 0.0 -15.0 0.73235
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0.0 0.0 0.07505 0.0 15.0 0.73245 0.0 30.0 2.31188
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0.0 45.0 4.30295 0.0 60.0 5.75134 0.0 75.0 5.44049
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0.0 90.0 4.49327 0.0 105.0 3.26537 0.0 120.0 2.15560
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0.0 135.0 1.29409 0.0 150.0 0.43227 0.0 165.0 0.32603
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0.0 180.0 1.38787 15.0 -180.0 -1.09098 15.0 -165.0 -1.02648
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15.0 -105.0 2.74774 15.0 -90.0 4.70534 15.0 -75.0 5.94623
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15.0 -60.0 5.31247 15.0 -45.0 3.60759 15.0 -30.0 1.55486
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15.0 -15.0 0.05777 15.0 0.0 -0.34966 15.0 15.0 0.42655
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15.0 30.0 1.95817 15.0 45.0 3.56251 15.0 60.0 3.95862
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|
15.0 75.0 4.08935 15.0 90.0 3.96283 15.0 105.0 3.45811
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15.0 120.0 2.72433 15.0 135.0 1.77725 15.0 150.0 1.19521
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15.0 165.0 -0.08376 15.0 180.0 -1.09098 30.0 -180.0 -3.16646
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30.0 60.0 1.88655 30.0 75.0 2.74299 30.0 90.0 3.38653
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|
30.0 105.0 3.35587 30.0 120.0 2.73567 30.0 135.0 1.07212
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|
30.0 150.0 -1.82424 30.0 165.0 -2.94954 30.0 180.0 -3.16646
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60.0 165.0 -6.49751 60.0 180.0 -6.35328 75.0 -180.0 -6.36063
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90.0 0.0 -6.50276 90.0 15.0 -6.40257 90.0 30.0 -5.26121
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90.0 45.0 -3.31258 90.0 60.0 -1.15692 90.0 75.0 -0.48069
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120.0 60.0 0.19601 120.0 75.0 0.59458 120.0 90.0 0.44790
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135.0 -45.0 -1.07442 135.0 -30.0 -3.21036 135.0 -15.0 -4.95535
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135.0 0.0 -5.74466 135.0 15.0 -5.26619 135.0 30.0 -3.32353
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|
135.0 45.0 -0.41066 135.0 60.0 0.86911 135.0 75.0 1.67401
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|
135.0 90.0 1.59315 135.0 105.0 1.09817 135.0 120.0 -0.12378
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|
135.0 135.0 -1.46090 135.0 150.0 -2.39523 135.0 165.0 -2.64493
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|
135.0 180.0 -2.35817 150.0 -180.0 -1.32284 150.0 -165.0 -0.85965
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|
150.0 -150.0 -0.34336 150.0 -135.0 0.30336 150.0 -120.0 0.94220
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150.0 -105.0 1.65296 150.0 -90.0 2.27845 150.0 -75.0 2.18997
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150.0 -60.0 1.18267 150.0 -45.0 -0.69448 150.0 -30.0 -2.88548
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150.0 -15.0 -4.67044 150.0 0.0 -5.41586 150.0 15.0 -4.68528
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|
150.0 30.0 -2.03519 150.0 45.0 -0.36210 150.0 60.0 1.47445
|
|
150.0 75.0 2.55876 150.0 90.0 2.65974 150.0 105.0 1.74844
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|
150.0 120.0 0.39856 150.0 135.0 -0.86739 150.0 150.0 -1.61138
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150.0 165.0 -1.68618 150.0 180.0 -1.32284 165.0 -180.0 -0.67848
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165.0 -165.0 -0.38834 165.0 -150.0 -0.09173 165.0 -135.0 0.39970
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|
165.0 -120.0 1.14392 165.0 -105.0 1.97933 165.0 -90.0 2.58188
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|
165.0 -75.0 2.53115 165.0 -60.0 1.51071 165.0 -45.0 -0.39460
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165.0 -30.0 -2.68532 165.0 -15.0 -4.46238 165.0 0.0 -5.04645
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|
165.0 15.0 -3.60147 165.0 30.0 -2.46185 165.0 45.0 -0.26642
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|
165.0 60.0 1.79366 165.0 75.0 2.93260 165.0 90.0 2.74719
|
|
165.0 105.0 1.89146 165.0 120.0 0.68619 165.0 135.0 -0.35767
|
|
165.0 150.0 -0.91119 165.0 165.0 -0.90052 165.0 180.0 -0.67848
|
|
180.0 -180.0 -0.41030 180.0 -165.0 -0.41413 180.0 -150.0 -0.34547
|
|
180.0 -135.0 0.11457 180.0 -120.0 0.94012 180.0 -105.0 1.95487
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|
180.0 -90.0 2.74331 180.0 -75.0 2.77751 180.0 -60.0 1.75943
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|
180.0 -45.0 -0.27385 180.0 -30.0 -2.58364 180.0 -15.0 -4.27536
|
|
180.0 0.0 -4.22230 180.0 15.0 -4.27526 180.0 30.0 -2.58364
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|
180.0 45.0 -0.27385 180.0 60.0 1.75943 180.0 75.0 2.77761
|
|
180.0 90.0 2.74331 180.0 105.0 1.95497 180.0 120.0 0.94002
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|
180.0 135.0 0.11457 180.0 150.0 -0.34547 180.0 165.0 -0.41413
|
|
180.0 180.0 -0.41030
|
|
|
|
tortors 3 1 2 3 15 25 25
|
|
-180.0 -180.0 -0.41030 -180.0 -165.0 -0.41413 -180.0 -150.0 -0.34547
|
|
-180.0 -135.0 0.11457 -180.0 -120.0 0.94012 -180.0 -105.0 1.95487
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|
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|
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|
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-165.0 -150.0 -0.91119 -165.0 -135.0 -0.35767 -165.0 -120.0 0.68619
|
|
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|
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|
|
-165.0 30.0 -2.68532 -165.0 45.0 -0.39460 -165.0 60.0 1.51071
|
|
-165.0 75.0 2.53125 -165.0 90.0 2.58198 -165.0 105.0 1.97933
|
|
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-150.0 -120.0 0.39856 -150.0 -105.0 1.74844 -150.0 -90.0 2.65974
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|
|
-90.0 45.0 -3.23377 -90.0 60.0 -1.77710 -90.0 75.0 -1.06238
|
|
-90.0 90.0 -1.11458 -90.0 105.0 -1.75760 -90.0 120.0 -2.45287
|
|
-90.0 135.0 -3.48022 -90.0 150.0 -4.47202 -90.0 165.0 -5.26258
|
|
-90.0 180.0 -5.73614 -75.0 -180.0 -6.35918 -75.0 -165.0 -6.55928
|
|
-75.0 -150.0 -6.28648 -75.0 -135.0 -5.35985 -75.0 -120.0 -3.94292
|
|
-75.0 -105.0 -2.46809 -75.0 -90.0 -1.04633 -75.0 -75.0 0.13385
|
|
-75.0 -60.0 -1.49008 -75.0 -45.0 -3.48890 -75.0 -30.0 -5.15227
|
|
-75.0 -15.0 -5.99165 -75.0 0.0 -6.06098 -75.0 15.0 -5.72479
|
|
-75.0 30.0 -4.69688 -75.0 45.0 -3.16790 -75.0 60.0 -1.64228
|
|
-75.0 75.0 -0.95978 -75.0 90.0 -1.08320 -75.0 105.0 -2.00163
|
|
-75.0 120.0 -3.08135 -75.0 135.0 -4.14746 -75.0 150.0 -5.11368
|
|
-75.0 165.0 -5.87160 -75.0 180.0 -6.35918 -60.0 -180.0 -6.35328
|
|
-60.0 -165.0 -6.49751 -60.0 -150.0 -4.83329 -60.0 -135.0 -4.95241
|
|
-60.0 -120.0 -3.11264 -60.0 -105.0 -1.05326 -60.0 -90.0 0.58385
|
|
-60.0 -75.0 0.58100 -60.0 -60.0 -1.04413 -60.0 -45.0 -2.82064
|
|
-60.0 -30.0 -4.04692 -60.0 -15.0 -4.68897 -60.0 0.0 -5.05604
|
|
-60.0 15.0 -4.85236 -60.0 30.0 -3.84373 -60.0 45.0 -2.11507
|
|
-60.0 60.0 -0.72835 -60.0 75.0 0.19866 -60.0 90.0 -0.28428
|
|
-60.0 105.0 -1.39335 -60.0 120.0 -2.90997 -60.0 135.0 -4.15255
|
|
-60.0 150.0 -5.15707 -60.0 165.0 -5.89147 -60.0 180.0 -6.35328
|
|
-45.0 -180.0 -5.25542 -45.0 -165.0 -5.22067 -45.0 -150.0 -4.62413
|
|
-45.0 -135.0 -2.94717 -45.0 -120.0 -0.39145 -45.0 -105.0 1.58629
|
|
-45.0 -90.0 2.52552 -45.0 -75.0 1.59048 -45.0 -60.0 0.12852
|
|
-45.0 -45.0 -1.15606 -45.0 -30.0 -2.03450 -45.0 -15.0 -2.79424
|
|
-45.0 0.0 -3.40770 -45.0 15.0 -3.22837 -45.0 30.0 -2.00765
|
|
-45.0 45.0 -0.23679 -45.0 60.0 1.34478 -45.0 75.0 1.98173
|
|
-45.0 90.0 1.48393 -45.0 105.0 0.01966 -45.0 120.0 -1.83307
|
|
-45.0 135.0 -3.31494 -45.0 150.0 -4.32002 -45.0 165.0 -4.96362
|
|
-45.0 180.0 -5.25542 -30.0 -180.0 -3.16646 -30.0 -165.0 -2.94954
|
|
-30.0 -150.0 -1.82424 -30.0 -135.0 1.07212 -30.0 -120.0 2.74127
|
|
-30.0 -105.0 3.35587 -30.0 -90.0 3.38653 -30.0 -75.0 2.74299
|
|
-30.0 -60.0 1.88655 -30.0 -45.0 1.17974 -30.0 -30.0 0.38805
|
|
-30.0 -15.0 -0.88273 -30.0 0.0 -1.55029 -30.0 15.0 -1.33903
|
|
-30.0 30.0 -0.06654 -30.0 45.0 1.82415 -30.0 60.0 3.44050
|
|
-30.0 75.0 4.24483 -30.0 90.0 3.46788 -30.0 105.0 1.68837
|
|
-30.0 120.0 -0.33944 -30.0 135.0 -1.78936 -30.0 150.0 -2.63712
|
|
-30.0 165.0 -3.08291 -30.0 180.0 -3.16646 -15.0 -180.0 -1.09098
|
|
-15.0 -165.0 -0.08376 -15.0 -150.0 1.19531 -15.0 -135.0 1.77725
|
|
-15.0 -120.0 2.72433 -15.0 -105.0 3.45811 -15.0 -90.0 3.96283
|
|
-15.0 -75.0 4.08945 -15.0 -60.0 3.95852 -15.0 -45.0 3.56251
|
|
-15.0 -30.0 1.96687 -15.0 -15.0 0.42755 -15.0 0.0 -0.29366
|
|
-15.0 15.0 0.05777 -15.0 30.0 1.55486 -15.0 45.0 3.60759
|
|
-15.0 60.0 5.31247 -15.0 75.0 5.94623 -15.0 90.0 4.70554
|
|
-15.0 105.0 2.74754 -15.0 120.0 1.05732 -15.0 135.0 -0.05629
|
|
-15.0 150.0 -0.72643 -15.0 165.0 -1.02648 -15.0 180.0 -1.09098
|
|
0.0 -180.0 1.38787 0.0 -165.0 0.32603 0.0 -150.0 0.65267
|
|
0.0 -135.0 1.29409 0.0 -120.0 2.15560 0.0 -105.0 3.26537
|
|
0.0 -90.0 4.49297 0.0 -75.0 5.44049 0.0 -60.0 5.75134
|
|
0.0 -45.0 4.30355 0.0 -30.0 2.31228 0.0 -15.0 0.73235
|
|
0.0 0.0 0.07505 0.0 15.0 0.73245 0.0 30.0 2.31188
|
|
0.0 45.0 4.30295 0.0 60.0 5.75134 0.0 75.0 5.44049
|
|
0.0 90.0 4.49327 0.0 105.0 3.26537 0.0 120.0 2.15560
|
|
0.0 135.0 1.29409 0.0 150.0 0.43227 0.0 165.0 0.32603
|
|
0.0 180.0 1.38787 15.0 -180.0 -1.09098 15.0 -165.0 -1.02648
|
|
15.0 -150.0 -0.72633 15.0 -135.0 -0.05629 15.0 -120.0 1.05732
|
|
15.0 -105.0 2.74774 15.0 -90.0 4.70534 15.0 -75.0 5.94623
|
|
15.0 -60.0 5.31247 15.0 -45.0 3.60759 15.0 -30.0 1.55486
|
|
15.0 -15.0 0.05777 15.0 0.0 -0.34966 15.0 15.0 0.42655
|
|
15.0 30.0 1.95817 15.0 45.0 3.56251 15.0 60.0 3.95862
|
|
15.0 75.0 4.08935 15.0 90.0 3.96283 15.0 105.0 3.45811
|
|
15.0 120.0 2.72433 15.0 135.0 1.77725 15.0 150.0 1.19521
|
|
15.0 165.0 -0.08376 15.0 180.0 -1.09098 30.0 -180.0 -3.16646
|
|
30.0 -165.0 -3.08291 30.0 -150.0 -2.63732 30.0 -135.0 -1.78936
|
|
30.0 -120.0 -0.33944 30.0 -105.0 1.68837 30.0 -90.0 3.46788
|
|
30.0 -75.0 4.24483 30.0 -60.0 3.44060 30.0 -45.0 1.82415
|
|
30.0 -30.0 -0.06654 30.0 -15.0 -1.33943 30.0 0.0 -1.55069
|
|
30.0 15.0 -0.88283 30.0 30.0 0.38855 30.0 45.0 1.17974
|
|
30.0 60.0 1.88655 30.0 75.0 2.74299 30.0 90.0 3.38653
|
|
30.0 105.0 3.35587 30.0 120.0 2.73567 30.0 135.0 1.07212
|
|
30.0 150.0 -1.82424 30.0 165.0 -2.94954 30.0 180.0 -3.16646
|
|
45.0 -180.0 -5.25542 45.0 -165.0 -4.96362 45.0 -150.0 -4.32002
|
|
45.0 -135.0 -3.31494 45.0 -120.0 -1.83317 45.0 -105.0 0.01966
|
|
45.0 -90.0 1.48393 45.0 -75.0 1.98183 45.0 -60.0 1.34478
|
|
45.0 -45.0 -0.23679 45.0 -30.0 -2.00755 45.0 -15.0 -3.22837
|
|
45.0 0.0 -3.40780 45.0 15.0 -2.79424 45.0 30.0 -2.03450
|
|
45.0 45.0 -1.15606 45.0 60.0 0.12792 45.0 75.0 1.59048
|
|
45.0 90.0 2.52482 45.0 105.0 1.58629 45.0 120.0 -0.51565
|
|
45.0 135.0 -2.94717 45.0 150.0 -4.62413 45.0 165.0 -5.22077
|
|
45.0 180.0 -5.25542 60.0 -180.0 -6.35328 60.0 -165.0 -5.89147
|
|
60.0 -150.0 -5.24397 60.0 -135.0 -4.15255 60.0 -120.0 -2.90987
|
|
60.0 -105.0 -1.39335 60.0 -90.0 -0.28428 60.0 -75.0 0.19866
|
|
60.0 -60.0 -0.72835 60.0 -45.0 -2.11507 60.0 -30.0 -3.84363
|
|
60.0 -15.0 -4.85236 60.0 0.0 -5.05604 60.0 15.0 -4.68897
|
|
60.0 30.0 -4.04682 60.0 45.0 -2.82064 60.0 60.0 -1.04403
|
|
60.0 75.0 0.58100 60.0 90.0 0.58385 60.0 105.0 -1.05326
|
|
60.0 120.0 -3.11264 60.0 135.0 -4.95241 60.0 150.0 -6.11149
|
|
60.0 165.0 -6.49751 60.0 180.0 -6.35328 75.0 -180.0 -6.36063
|
|
75.0 -165.0 -5.87160 75.0 -150.0 -5.11358 75.0 -135.0 -4.14746
|
|
75.0 -120.0 -3.08145 75.0 -105.0 -2.00163 75.0 -90.0 -1.08330
|
|
75.0 -75.0 -0.95978 75.0 -60.0 -1.64238 75.0 -45.0 -3.16780
|
|
75.0 -30.0 -4.69688 75.0 -15.0 -5.72489 75.0 0.0 -6.06088
|
|
75.0 15.0 -5.99165 75.0 30.0 -5.15227 75.0 45.0 -3.48890
|
|
75.0 60.0 -1.49008 75.0 75.0 0.13385 75.0 90.0 -1.04633
|
|
75.0 105.0 -2.46809 75.0 120.0 -3.94292 75.0 135.0 -5.35985
|
|
75.0 150.0 -6.28648 75.0 165.0 -6.55928 75.0 180.0 -6.36063
|
|
90.0 -180.0 -5.73614 90.0 -165.0 -5.26258 90.0 -150.0 -4.47212
|
|
90.0 -135.0 -3.48022 90.0 -120.0 -2.45277 90.0 -105.0 -1.75770
|
|
90.0 -90.0 -1.11458 90.0 -75.0 -1.06248 90.0 -60.0 -1.77690
|
|
90.0 -45.0 -3.23377 90.0 -30.0 -4.67162 90.0 -15.0 -5.75813
|
|
90.0 0.0 -6.50276 90.0 15.0 -6.40257 90.0 30.0 -5.26121
|
|
90.0 45.0 -3.31258 90.0 60.0 -1.15692 90.0 75.0 -0.48069
|
|
90.0 90.0 -1.24738 90.0 105.0 -2.34446 90.0 120.0 -3.50628
|
|
90.0 135.0 -4.73673 90.0 150.0 -5.59097 90.0 165.0 -5.89392
|
|
90.0 180.0 -5.73614 105.0 -180.0 -4.74648 105.0 -165.0 -4.24252
|
|
105.0 -150.0 -3.43923 105.0 -135.0 -2.57323 105.0 -120.0 -1.58770
|
|
105.0 -105.0 -0.79043 105.0 -90.0 -0.40231 105.0 -75.0 -0.43657
|
|
105.0 -60.0 -1.08681 105.0 -45.0 -2.42000 105.0 -30.0 -4.04096
|
|
105.0 -15.0 -5.59602 105.0 0.0 -6.42560 105.0 15.0 -6.18609
|
|
105.0 30.0 -4.81605 105.0 45.0 -2.58412 105.0 60.0 -0.17426
|
|
105.0 75.0 -0.17171 105.0 90.0 -0.60009 105.0 105.0 -1.44395
|
|
105.0 120.0 -2.58378 105.0 135.0 -3.62454 105.0 150.0 -4.51581
|
|
105.0 165.0 -4.87737 105.0 180.0 -4.74648 120.0 -180.0 -3.54199
|
|
120.0 -165.0 -3.01099 120.0 -150.0 -2.21872 120.0 -135.0 -1.38411
|
|
120.0 -120.0 -0.45731 120.0 -105.0 0.25289 120.0 -90.0 0.62829
|
|
120.0 -75.0 0.70386 120.0 -60.0 -0.01095 120.0 -45.0 -1.56505
|
|
120.0 -30.0 -3.61554 120.0 -15.0 -5.30079 120.0 0.0 -6.10583
|
|
120.0 15.0 -5.75161 120.0 30.0 -4.15184 120.0 45.0 -1.56700
|
|
120.0 60.0 0.19601 120.0 75.0 0.59458 120.0 90.0 0.44790
|
|
120.0 105.0 -0.23836 120.0 120.0 -1.19823 120.0 135.0 -2.41382
|
|
120.0 150.0 -3.36364 120.0 165.0 -3.73864 120.0 180.0 -3.54199
|
|
135.0 -180.0 -2.35817 135.0 -165.0 -1.80556 135.0 -150.0 -1.09788
|
|
135.0 -135.0 -0.26179 135.0 -120.0 0.42439 135.0 -105.0 1.13229
|
|
135.0 -90.0 1.55961 135.0 -75.0 1.60144 135.0 -60.0 0.71371
|
|
135.0 -45.0 -1.07442 135.0 -30.0 -3.21036 135.0 -15.0 -4.95535
|
|
135.0 0.0 -5.74466 135.0 15.0 -5.26619 135.0 30.0 -3.32353
|
|
135.0 45.0 -0.41066 135.0 60.0 0.86911 135.0 75.0 1.67401
|
|
135.0 90.0 1.59315 135.0 105.0 1.09817 135.0 120.0 -0.12378
|
|
135.0 135.0 -1.46090 135.0 150.0 -2.39523 135.0 165.0 -2.64493
|
|
135.0 180.0 -2.35817 150.0 -180.0 -1.32284 150.0 -165.0 -0.85965
|
|
150.0 -150.0 -0.34336 150.0 -135.0 0.30336 150.0 -120.0 0.94220
|
|
150.0 -105.0 1.65296 150.0 -90.0 2.27845 150.0 -75.0 2.18997
|
|
150.0 -60.0 1.18267 150.0 -45.0 -0.69448 150.0 -30.0 -2.88548
|
|
150.0 -15.0 -4.67044 150.0 0.0 -5.41586 150.0 15.0 -4.68528
|
|
150.0 30.0 -2.03519 150.0 45.0 -0.36210 150.0 60.0 1.47445
|
|
150.0 75.0 2.55876 150.0 90.0 2.65974 150.0 105.0 1.74844
|
|
150.0 120.0 0.39856 150.0 135.0 -0.86739 150.0 150.0 -1.61138
|
|
150.0 165.0 -1.68618 150.0 180.0 -1.32284 165.0 -180.0 -0.67848
|
|
165.0 -165.0 -0.38834 165.0 -150.0 -0.09173 165.0 -135.0 0.39970
|
|
165.0 -120.0 1.14392 165.0 -105.0 1.97933 165.0 -90.0 2.58188
|
|
165.0 -75.0 2.53115 165.0 -60.0 1.51071 165.0 -45.0 -0.39460
|
|
165.0 -30.0 -2.68532 165.0 -15.0 -4.46238 165.0 0.0 -5.04645
|
|
165.0 15.0 -3.60147 165.0 30.0 -2.46185 165.0 45.0 -0.26642
|
|
165.0 60.0 1.79366 165.0 75.0 2.93260 165.0 90.0 2.74719
|
|
165.0 105.0 1.89146 165.0 120.0 0.68619 165.0 135.0 -0.35767
|
|
165.0 150.0 -0.91119 165.0 165.0 -0.90052 165.0 180.0 -0.67848
|
|
180.0 -180.0 -0.41030 180.0 -165.0 -0.41413 180.0 -150.0 -0.34547
|
|
180.0 -135.0 0.11457 180.0 -120.0 0.94012 180.0 -105.0 1.95487
|
|
180.0 -90.0 2.74331 180.0 -75.0 2.77751 180.0 -60.0 1.75943
|
|
180.0 -45.0 -0.27385 180.0 -30.0 -2.58364 180.0 -15.0 -4.27536
|
|
180.0 0.0 -4.22230 180.0 15.0 -4.27526 180.0 30.0 -2.58364
|
|
180.0 45.0 -0.27385 180.0 60.0 1.75943 180.0 75.0 2.77761
|
|
180.0 90.0 2.74331 180.0 105.0 1.95497 180.0 120.0 0.94002
|
|
180.0 135.0 0.11457 180.0 150.0 -0.34547 180.0 165.0 -0.41413
|
|
180.0 180.0 -0.41030
|
|
|
|
|
|
###################################
|
|
## ##
|
|
## Atomic Multipole Parameters ##
|
|
## ##
|
|
###################################
|
|
|
|
|
|
multipole 1 2 4 -0.22483
|
|
0.12482 0.00000 0.32382
|
|
0.10689
|
|
0.00000 -0.84021
|
|
-0.14175 0.00000 0.73332
|
|
multipole 2 1 3 -0.09722
|
|
0.29356 0.00000 0.16702
|
|
0.08444
|
|
0.00000 -0.32288
|
|
-0.24845 0.00000 0.23844
|
|
multipole 2 1 233 -0.31113
|
|
0.29356 0.00000 0.16702
|
|
0.08444
|
|
0.00000 -0.32288
|
|
-0.24845 0.00000 0.23844
|
|
multipole 2 1 235 -0.18217
|
|
0.30273 0.00000 0.14966
|
|
-0.00540
|
|
0.00000 -0.58515
|
|
-0.15734 0.00000 0.59055
|
|
multipole 2 231 3 -0.06142
|
|
0.15310 0.00000 0.58485
|
|
-1.10051
|
|
0.00000 -0.52551
|
|
-0.23601 0.00000 1.62602
|
|
multipole 3 5 2 0.79586
|
|
-0.13770 0.00000 0.29742
|
|
0.14120
|
|
0.00000 -0.29053
|
|
0.00632 0.00000 0.14933
|
|
multipole 4 1 2 0.13964
|
|
0.00855 0.00000 -0.12105
|
|
0.00073
|
|
0.00000 -0.01705
|
|
-0.03619 0.00000 0.01632
|
|
multipole 5 3 2 -0.76219
|
|
0.02701 0.00000 -0.11735
|
|
-0.52988
|
|
0.00000 0.17528
|
|
0.04451 0.00000 0.35460
|
|
multipole 6 2 6 0.07437
|
|
0.01314 0.00000 -0.06475
|
|
0.08205
|
|
0.00000 0.01765
|
|
0.00706 0.00000 -0.09970
|
|
multipole 7 8 10 -0.15418
|
|
0.09038 0.00000 0.44023
|
|
0.11417
|
|
0.00000 -1.09602
|
|
-0.18333 0.00000 0.98185
|
|
multipole 7 48 10 -0.14115
|
|
0.12232 0.00000 0.52872
|
|
-0.43015
|
|
0.00000 -0.90054
|
|
-0.20486 0.00000 1.33069
|
|
multipole 8 7 9 12 -0.17302
|
|
0.20245 0.00000 0.14886
|
|
-0.19394
|
|
0.00000 -0.38164
|
|
-0.02856 0.00000 0.57558
|
|
multipole 8 7 233 12 -0.36199
|
|
-0.12137 0.00000 0.18627
|
|
-0.91798
|
|
0.00000 0.05376
|
|
0.15506 0.00000 0.86422
|
|
multipole 8 7 235 12 -0.11441
|
|
0.20245 0.00000 0.14886
|
|
-0.19394
|
|
0.00000 -0.38164
|
|
-0.02856 0.00000 0.57558
|
|
multipole 8 231 9 12 0.04440
|
|
0.09865 0.00000 0.46297
|
|
-1.02943
|
|
0.00000 -0.69704
|
|
-0.49818 0.00000 1.72647
|
|
multipole 9 11 8 0.81010
|
|
-0.03747 0.00000 0.23377
|
|
0.31967
|
|
0.00000 -0.32818
|
|
-0.03412 0.00000 0.00851
|
|
multipole 9 11 48 0.85003
|
|
-0.02491 0.00000 0.25777
|
|
0.45171
|
|
0.00000 -0.12926
|
|
-0.10936 0.00000 -0.32245
|
|
multipole 10 7 8 0.12044
|
|
-0.00442 0.00000 -0.13836
|
|
0.03666
|
|
0.00000 0.02185
|
|
-0.10048 0.00000 -0.05851
|
|
multipole 10 7 48 0.12637
|
|
-0.02506 0.00000 -0.11601
|
|
0.15583
|
|
0.00000 0.22096
|
|
0.19740 0.00000 -0.37679
|
|
multipole 11 9 8 -0.75149
|
|
-0.00495 0.00000 -0.15871
|
|
-0.53066
|
|
0.00000 0.27820
|
|
0.10276 0.00000 0.25246
|
|
multipole 11 9 48 -0.77014
|
|
0.03419 0.00000 -0.15399
|
|
-0.55689
|
|
0.00000 -0.04221
|
|
0.10937 0.00000 0.59910
|
|
multipole 12 8 13 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 15 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 19 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 25 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 33 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 37 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 43 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 61 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 70 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 80 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 89 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 106 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 117 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 127 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 137 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 141 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 147 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 153 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 159 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 167 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 175 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 182 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 192 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 8 202 0.08514
|
|
0.02910 0.00000 0.05267
|
|
0.04149
|
|
0.00000 -0.00658
|
|
-0.00600 0.00000 -0.03491
|
|
multipole 12 48 43 0.07834
|
|
0.07720 0.00000 0.12670
|
|
0.05776
|
|
0.00000 -0.05378
|
|
-0.00817 0.00000 -0.00398
|
|
multipole 13 8 12 -0.15959
|
|
-0.01994 0.00000 0.37655
|
|
-0.25740
|
|
0.00000 -0.29981
|
|
-0.04929 0.00000 0.55721
|
|
multipole 14 13 8 0.07420
|
|
-0.02399 0.00000 -0.11050
|
|
0.00932
|
|
0.00000 0.05597
|
|
-0.06329 0.00000 -0.06529
|
|
multipole 15 16 8 -0.06548
|
|
0.18863 0.00000 -0.25977
|
|
0.38994
|
|
0.00000 0.04868
|
|
-0.23538 0.00000 -0.43862
|
|
multipole 16 15 8 0.07117
|
|
-0.02192 0.00000 -0.09528
|
|
-0.12013
|
|
0.00000 0.08153
|
|
-0.00394 0.00000 0.03860
|
|
multipole 17 15 8 -0.16832
|
|
-0.08635 0.00000 0.33587
|
|
-0.27420
|
|
0.00000 -0.17464
|
|
-0.25682 0.00000 0.44884
|
|
multipole 18 17 15 0.06566
|
|
-0.02088 0.00000 -0.10166
|
|
0.01623
|
|
0.00000 0.04728
|
|
0.00231 0.00000 -0.06351
|
|
multipole 19 8 21 -0.13173
|
|
0.18350 0.00000 0.29386
|
|
0.00999
|
|
0.00000 -0.65954
|
|
-0.21063 0.00000 0.64955
|
|
multipole 20 19 21 0.06916
|
|
0.05664 0.00000 -0.13463
|
|
0.04076
|
|
0.00000 0.11032
|
|
0.10592 0.00000 -0.15108
|
|
multipole 21 22 19 -0.02887
|
|
0.11379 0.00000 -0.33524
|
|
0.32588
|
|
0.00000 0.22134
|
|
-0.11449 0.00000 -0.54722
|
|
multipole 22 21 19 0.08767
|
|
-0.01393 0.00000 -0.07934
|
|
-0.05712
|
|
0.00000 0.16068
|
|
0.00191 0.00000 -0.10356
|
|
multipole 23 21 19 -0.17741
|
|
-0.04820 0.00000 0.27453
|
|
-0.28572
|
|
0.00000 -0.21363
|
|
-0.06394 0.00000 0.49935
|
|
multipole 24 23 21 0.05874
|
|
0.00734 0.00000 -0.09498
|
|
0.04549
|
|
0.00000 0.01789
|
|
0.01922 0.00000 -0.06338
|
|
multipole 25 26 27 -0.08555
|
|
-0.10128 0.00000 -0.23524
|
|
0.20588
|
|
0.00000 0.35986
|
|
-0.06061 0.00000 -0.56574
|
|
multipole 26 25 27 0.08230
|
|
0.04789 0.00000 -0.08924
|
|
0.01057
|
|
0.00000 0.11342
|
|
0.06251 0.00000 -0.12399
|
|
multipole 27 31 25 -0.11939
|
|
0.32104 0.00000 0.10406
|
|
0.26796
|
|
0.00000 -0.55943
|
|
-0.32286 0.00000 0.29147
|
|
multipole 28 27 25 0.07096
|
|
-0.02472 0.00000 -0.08760
|
|
-0.02354
|
|
0.00000 0.07793
|
|
-0.09866 0.00000 -0.05439
|
|
multipole 29 25 27 -0.17217
|
|
0.01336 0.00000 0.38349
|
|
-0.31978
|
|
0.00000 -0.13786
|
|
0.11205 0.00000 0.45764
|
|
multipole 30 29 25 0.06823
|
|
-0.01947 0.00000 -0.09588
|
|
0.04494
|
|
0.00000 0.05530
|
|
0.00419 0.00000 -0.10024
|
|
multipole 31 27 32 -0.16882
|
|
0.02110 0.00000 0.24422
|
|
-0.25302
|
|
0.00000 -0.13559
|
|
0.02868 0.00000 0.38861
|
|
multipole 32 31 27 0.06001
|
|
0.00612 0.00000 -0.10697
|
|
0.03438
|
|
0.00000 0.06956
|
|
-0.03511 0.00000 -0.10394
|
|
multipole 33 8 35 0.16229
|
|
0.22880 0.00000 0.30596
|
|
0.12912
|
|
0.00000 -0.06006
|
|
-0.66812 0.00000 -0.06906
|
|
multipole 34 33 8 0.05600
|
|
-0.14483 0.00000 -0.07492
|
|
-0.00102
|
|
0.00000 -0.06173
|
|
-0.03044 0.00000 0.06275
|
|
multipole 35 36 33 -0.44145
|
|
0.23477 0.00000 0.13825
|
|
0.06803
|
|
0.00000 -0.49343
|
|
-0.14987 0.00000 0.42541
|
|
multipole 36 35 33 0.23017
|
|
-0.12968 0.00000 0.01379
|
|
-0.06824
|
|
0.00000 -0.11228
|
|
-0.08774 0.00000 0.18052
|
|
multipole 37 39 8 0.10834
|
|
0.24982 0.00000 0.27937
|
|
0.08477
|
|
0.00000 -0.58656
|
|
-0.19826 0.00000 0.50179
|
|
multipole 38 37 39 0.06805
|
|
0.02048 0.00000 -0.09220
|
|
-0.00303
|
|
0.00000 -0.01146
|
|
-0.05463 0.00000 0.01449
|
|
multipole 39 40 37 -0.40177
|
|
0.35143 0.00000 0.04331
|
|
0.31002
|
|
0.00000 -0.84324
|
|
-0.38927 0.00000 0.53322
|
|
multipole 40 39 37 0.24568
|
|
-0.10665 0.00000 0.01809
|
|
-0.15372
|
|
0.00000 -0.05391
|
|
0.00480 0.00000 0.20763
|
|
multipole 41 37 42 -0.16081
|
|
-0.01376 0.00000 0.41130
|
|
-0.26001
|
|
0.00000 -0.18818
|
|
-0.12509 0.00000 0.44819
|
|
multipole 42 41 37 0.06784
|
|
-0.05387 0.00000 -0.13358
|
|
0.00765
|
|
0.00000 0.10555
|
|
-0.15569 0.00000 -0.11320
|
|
multipole 43 8 45 -0.30144
|
|
0.07672 0.00000 0.42645
|
|
-0.35442
|
|
0.00000 -0.51033
|
|
-0.35331 0.00000 0.86475
|
|
multipole 43 8 47 -0.30144
|
|
0.07672 0.00000 0.42645
|
|
-0.35442
|
|
0.00000 -0.51033
|
|
-0.35331 0.00000 0.86475
|
|
multipole 43 48 49 -0.08027
|
|
0.13313 0.00000 0.28094
|
|
-0.73267
|
|
0.00000 0.44660
|
|
-0.05681 0.00000 0.28607
|
|
multipole 44 43 8 0.14381
|
|
-0.07645 0.00000 0.01699
|
|
-0.09149
|
|
0.00000 -0.03033
|
|
-0.15284 0.00000 0.12182
|
|
multipole 44 43 48 0.00975
|
|
-0.14579 0.00000 -0.00614
|
|
-0.22868
|
|
0.00000 0.13700
|
|
-0.21056 0.00000 0.09168
|
|
multipole 45 46 43 -0.03264
|
|
0.49460 0.00000 -0.04347
|
|
1.63727
|
|
0.00000 -2.40778
|
|
-0.45566 0.00000 0.77051
|
|
multipole 46 45 43 0.10947
|
|
-0.10504 0.00000 -0.03823
|
|
-0.08656
|
|
0.00000 -0.01943
|
|
-0.23485 0.00000 0.10599
|
|
multipole 47 47 43 0.07683
|
|
0.30088 0.00000 0.27072
|
|
1.04951
|
|
0.00000 -2.57126
|
|
-0.50502 0.00000 1.52175
|
|
multipole 48 7 9 12 -0.23113
|
|
0.27663 0.00000 0.12440
|
|
-0.20625
|
|
0.00000 -0.28389
|
|
0.15574 0.00000 0.49014
|
|
multipole 48 7 233 12 0.60118
|
|
0.27663 0.00000 0.12440
|
|
-0.20625
|
|
0.00000 -0.28389
|
|
0.15574 0.00000 0.49014
|
|
multipole 49 43 48 -0.85155
|
|
0.15871 0.00000 0.56464
|
|
-1.49210
|
|
0.00000 -1.58110
|
|
-0.20334 0.00000 3.07320
|
|
multipole 50 51 59 -0.13558
|
|
0.39735 0.00000 0.41339
|
|
0.27347
|
|
0.00000 -1.36200
|
|
-0.22439 0.00000 1.08853
|
|
multipole 51 50 52 54 -0.26070
|
|
0.08712 0.00000 0.33920
|
|
-0.37488
|
|
0.00000 -0.33230
|
|
0.21154 0.00000 0.70718
|
|
multipole 51 50 233 54 -0.37342
|
|
0.08712 0.00000 0.33920
|
|
-0.37488
|
|
0.00000 -0.33230
|
|
0.21154 0.00000 0.70718
|
|
multipole 52 53 51 0.90470
|
|
0.06004 0.00000 0.25405
|
|
0.35305
|
|
0.00000 -0.30405
|
|
0.20110 0.00000 -0.04900
|
|
multipole 53 52 51 -0.76984
|
|
-0.05467 0.00000 -0.23073
|
|
-0.46593
|
|
0.00000 0.27107
|
|
-0.00005 0.00000 0.19486
|
|
multipole 54 51 55 0.09550
|
|
0.05530 0.00000 0.17764
|
|
-0.07670
|
|
0.00000 -0.13879
|
|
-0.00767 0.00000 0.21549
|
|
multipole 55 51 57 -0.13205
|
|
0.32755 0.00000 0.46077
|
|
0.17752
|
|
0.00000 -0.61073
|
|
-0.35102 0.00000 0.43321
|
|
multipole 55 241 57 -0.12680
|
|
0.31318 0.00000 0.41341
|
|
0.26389
|
|
0.00000 -0.70262
|
|
-0.10425 0.00000 0.43873
|
|
multipole 56 55 51 0.09686
|
|
-0.08812 0.00000 -0.10597
|
|
-0.00614
|
|
0.00000 0.10040
|
|
-0.16651 0.00000 -0.09426
|
|
multipole 56 55 241 0.11510
|
|
0.00090 0.00000 -0.07548
|
|
-0.00989
|
|
0.00000 -0.01502
|
|
0.00444 0.00000 0.02491
|
|
multipole 57 55 59 -0.16591
|
|
0.43907 0.00000 0.23052
|
|
0.21670
|
|
0.00000 -0.57363
|
|
-0.09937 0.00000 0.35693
|
|
multipole 57 55 245 -0.14420
|
|
0.42355 0.00000 0.25235
|
|
0.34755
|
|
0.00000 -0.69761
|
|
-0.08434 0.00000 0.35006
|
|
multipole 58 57 55 0.08886
|
|
-0.00234 0.00000 -0.08982
|
|
0.07325
|
|
0.00000 0.05889
|
|
-0.03278 0.00000 -0.13214
|
|
multipole 58 57 245 0.12121
|
|
-0.00270 0.00000 -0.06030
|
|
-0.00918
|
|
0.00000 -0.01098
|
|
0.00194 0.00000 0.02016
|
|
multipole 59 50 57 -0.03932
|
|
0.17998 0.00000 0.43068
|
|
-0.10117
|
|
0.00000 -0.38138
|
|
0.01443 0.00000 0.48255
|
|
multipole 60 59 50 0.06588
|
|
-0.03733 0.00000 -0.07724
|
|
0.02650
|
|
0.00000 -0.00717
|
|
-0.08958 0.00000 -0.01933
|
|
multipole 61 63 8 -0.11216
|
|
0.38620 0.00000 0.08762
|
|
0.47377
|
|
0.00000 -0.59723
|
|
-0.25956 0.00000 0.12346
|
|
multipole 62 61 63 0.09205
|
|
0.04929 0.00000 -0.11825
|
|
0.02631
|
|
0.00000 0.10410
|
|
0.09871 0.00000 -0.13041
|
|
multipole 63 61 64 -0.04246
|
|
0.01409 0.00000 0.21398
|
|
0.05117
|
|
0.00000 -0.26849
|
|
-0.07370 0.00000 0.21732
|
|
multipole 64 63 66 0.04681
|
|
0.17684 0.00000 0.12228
|
|
0.48702
|
|
0.00000 -0.40448
|
|
0.34751 0.00000 -0.08254
|
|
multipole 65 64 63 0.00023
|
|
-0.01320 0.00000 -0.17110
|
|
0.08705
|
|
0.00000 0.10296
|
|
0.00895 0.00000 -0.19001
|
|
multipole 66 64 68 -0.02656
|
|
-0.02571 0.00000 0.00360
|
|
-0.00110
|
|
0.00000 -0.14275
|
|
-0.09779 0.00000 0.14385
|
|
multipole 67 66 64 0.00719
|
|
0.00137 0.00000 -0.18600
|
|
0.05207
|
|
0.00000 -0.00064
|
|
0.00676 0.00000 -0.05143
|
|
multipole 68 66 66 -0.02866
|
|
-0.02759 0.00000 -0.00699
|
|
-0.01545
|
|
0.00000 -0.19273
|
|
-0.12394 0.00000 0.20818
|
|
multipole 69 68 66 0.00685
|
|
-0.00666 0.00000 -0.18375
|
|
0.05602
|
|
0.00000 -0.00631
|
|
0.00545 0.00000 -0.04971
|
|
multipole 70 72 8 -0.10731
|
|
0.38034 0.00000 0.08372
|
|
0.50724
|
|
0.00000 -0.62647
|
|
-0.18907 0.00000 0.11923
|
|
multipole 71 70 72 0.09011
|
|
0.04522 0.00000 -0.12453
|
|
0.04012
|
|
0.00000 0.06958
|
|
0.07019 0.00000 -0.10970
|
|
multipole 72 70 73 -0.05309
|
|
0.06610 0.00000 0.18549
|
|
0.04921
|
|
0.00000 -0.33224
|
|
-0.11333 0.00000 0.28303
|
|
multipole 73 72 75 0.07134
|
|
0.24299 0.00000 0.14377
|
|
0.57252
|
|
0.00000 -0.47541
|
|
0.42651 0.00000 -0.09711
|
|
multipole 74 73 72 0.00345
|
|
-0.01772 0.00000 -0.17185
|
|
0.14345
|
|
0.00000 0.12181
|
|
0.02031 0.00000 -0.26526
|
|
multipole 75 73 77 -0.12512
|
|
-0.11733 0.00000 0.00000
|
|
0.04101
|
|
0.00000 -0.14140
|
|
-0.08647 0.00000 0.10039
|
|
multipole 76 75 73 0.01090
|
|
0.02337 0.00000 -0.19140
|
|
0.03985
|
|
0.00000 0.06312
|
|
-0.01694 0.00000 -0.10297
|
|
multipole 77 78 75 0.35744
|
|
0.02001 0.00000 0.42701
|
|
-0.19251
|
|
0.00000 -0.38151
|
|
0.27981 0.00000 0.57402
|
|
multipole 78 77 79 -0.46438
|
|
0.19713 0.00000 0.00614
|
|
0.42591
|
|
0.00000 -0.39511
|
|
-0.34625 0.00000 -0.03080
|
|
multipole 79 78 77 0.22899
|
|
-0.06109 0.00000 -0.01309
|
|
-0.11816
|
|
0.00000 -0.15815
|
|
0.04555 0.00000 0.27631
|
|
multipole 80 8 82 -0.14909
|
|
0.11344 0.00000 0.39909
|
|
0.03628
|
|
0.00000 -0.47377
|
|
0.02261 0.00000 0.43749
|
|
multipole 81 80 81 0.07954
|
|
0.01404 0.00000 -0.09182
|
|
0.04405
|
|
0.00000 0.01752
|
|
0.03456 0.00000 -0.06157
|
|
multipole 82 80 83 -0.21590
|
|
0.00000 0.00000 0.19889
|
|
0.43753
|
|
0.00000 -0.84736
|
|
0.00000 0.00000 0.40983
|
|
multipole 83 82 85 -0.04549
|
|
0.32216 0.00000 0.13839
|
|
0.73596
|
|
0.00000 -0.60409
|
|
0.25285 0.00000 -0.13187
|
|
multipole 84 83 82 0.01759
|
|
-0.02121 0.00000 -0.10542
|
|
0.08078
|
|
0.00000 0.10479
|
|
-0.00935 0.00000 -0.18557
|
|
multipole 85 83 87 -0.15892
|
|
0.03729 0.00000 0.15665
|
|
0.59432
|
|
0.00000 -0.78857
|
|
0.29227 0.00000 0.19425
|
|
multipole 86 85 87 -0.03324
|
|
0.03781 0.00000 -0.15021
|
|
0.16274
|
|
0.00000 0.11972
|
|
0.03565 0.00000 -0.28246
|
|
multipole 87 88 85 0.62054
|
|
0.00000 0.00000 0.43281
|
|
0.41363
|
|
0.00000 -0.34255
|
|
0.00000 0.00000 -0.07108
|
|
multipole 88 87 85 -0.91150
|
|
0.00000 0.00000 -0.26161
|
|
-0.27372
|
|
0.00000 0.34305
|
|
0.00000 0.00000 -0.06933
|
|
multipole 89 8 91 -0.16339
|
|
-0.12477 0.00000 0.53121
|
|
-0.30582
|
|
0.00000 -0.43704
|
|
0.40713 0.00000 0.74286
|
|
multipole 90 89 91 0.08819
|
|
0.06555 0.00000 -0.10115
|
|
-0.10247
|
|
0.00000 0.15243
|
|
0.03296 0.00000 -0.04996
|
|
multipole 91 92 94 -0.14846
|
|
-0.32645 0.00000 -0.13851
|
|
0.16205
|
|
0.00000 -0.20283
|
|
0.53464 0.00000 0.04078
|
|
multipole 92 95 91 0.09676
|
|
0.02936 0.00000 0.48291
|
|
-0.05924
|
|
0.00000 -0.39203
|
|
0.57677 0.00000 0.45127
|
|
multipole 93 92 95 0.02989
|
|
-0.00149 0.00000 -0.20147
|
|
-0.02175
|
|
0.00000 0.07153
|
|
0.04234 0.00000 -0.04978
|
|
multipole 94 91 98 0.00548
|
|
0.26321 0.00000 -0.09442
|
|
0.27216
|
|
0.00000 -0.00293
|
|
-0.14493 0.00000 -0.26923
|
|
multipole 95 92 97 -0.03588
|
|
0.13305 0.00000 0.32467
|
|
0.47653
|
|
0.00000 -0.93115
|
|
0.99076 0.00000 0.45462
|
|
multipole 96 95 92 0.08805
|
|
0.00174 0.00000 -0.22101
|
|
0.07562
|
|
0.00000 0.06395
|
|
0.01790 0.00000 -0.13957
|
|
multipole 97 95 100 0.27382
|
|
-0.01350 0.00000 -0.01650
|
|
-0.51808
|
|
0.00000 -0.74455
|
|
-0.04923 0.00000 1.26263
|
|
multipole 98 102 94 -0.20979
|
|
-0.34622 0.00000 0.10170
|
|
-0.36832
|
|
0.00000 0.33475
|
|
0.35509 0.00000 0.03357
|
|
multipole 99 98 102 0.00102
|
|
0.00505 0.00000 -0.17714
|
|
0.06900
|
|
0.00000 0.06904
|
|
-0.03904 0.00000 -0.13804
|
|
multipole 100 104 97 -0.11296
|
|
-0.13812 0.00000 -0.03163
|
|
-0.06766
|
|
0.00000 0.01833
|
|
-0.00493 0.00000 0.04933
|
|
multipole 101 100 104 0.00446
|
|
0.00790 0.00000 -0.18506
|
|
0.03323
|
|
0.00000 0.01707
|
|
-0.02718 0.00000 -0.05030
|
|
multipole 102 98 104 0.06902
|
|
0.27757 0.00000 0.10967
|
|
0.56142
|
|
0.00000 -0.53401
|
|
0.44766 0.00000 -0.02741
|
|
multipole 103 102 98 0.00474
|
|
0.00358 0.00000 -0.18227
|
|
0.04939
|
|
0.00000 0.01436
|
|
0.01490 0.00000 -0.06375
|
|
multipole 104 102 100 -0.01987
|
|
0.02835 0.00000 0.04818
|
|
0.20675
|
|
0.00000 -0.27604
|
|
0.00990 0.00000 0.06929
|
|
multipole 105 104 102 0.00374
|
|
0.00125 0.00000 -0.18390
|
|
0.04446
|
|
0.00000 -0.01545
|
|
-0.01437 0.00000 -0.02901
|
|
multipole 106 8 108 -0.10044
|
|
0.08050 0.00000 0.31541
|
|
-0.04428
|
|
0.00000 -0.57160
|
|
-0.15478 0.00000 0.61588
|
|
multipole 107 106 108 0.11241
|
|
0.00094 0.00000 -0.14233
|
|
0.02742
|
|
0.00000 0.10370
|
|
0.00990 0.00000 -0.13112
|
|
multipole 108 106 109 0.16205
|
|
0.16361 0.00000 0.27606
|
|
0.18556
|
|
0.00000 -0.33531
|
|
-0.34553 0.00000 0.14975
|
|
multipole 109 108 113 -0.10600
|
|
0.06737 0.00000 0.13621
|
|
0.52452
|
|
0.00000 -0.63296
|
|
0.39427 0.00000 0.10844
|
|
multipole 110 109 108 0.20247
|
|
-0.04159 0.00000 -0.13094
|
|
0.01709
|
|
0.00000 -0.01033
|
|
-0.01012 0.00000 -0.00676
|
|
multipole 111 108 115 0.04476
|
|
0.19634 0.00000 -0.22474
|
|
0.58980
|
|
0.00000 -0.17266
|
|
-0.21786 0.00000 -0.41714
|
|
multipole 112 111 115 0.08897
|
|
0.00602 0.00000 -0.21192
|
|
0.01372
|
|
0.00000 0.02533
|
|
0.02467 0.00000 -0.03905
|
|
multipole 113 109 115 0.39335
|
|
0.28599 0.00000 0.15648
|
|
0.09076
|
|
0.00000 -0.28047
|
|
-0.26152 0.00000 0.18971
|
|
multipole 114 113 115 0.09278
|
|
-0.00527 0.00000 -0.23564
|
|
0.04222
|
|
0.00000 -0.00568
|
|
-0.00439 0.00000 -0.03654
|
|
multipole 115 111 113 -0.08186
|
|
-0.06539 0.00000 0.06061
|
|
0.34422
|
|
0.00000 -0.66901
|
|
0.31146 0.00000 0.32479
|
|
multipole 116 115 113 0.14211
|
|
-0.01142 0.00000 -0.24975
|
|
0.05866
|
|
0.00000 -0.00893
|
|
-0.00227 0.00000 -0.04973
|
|
multipole 117 8 119 -0.10846
|
|
0.06915 0.00000 0.34129
|
|
-0.13274
|
|
0.00000 -0.55071
|
|
-0.03813 0.00000 0.68345
|
|
multipole 118 117 119 0.08849
|
|
0.06029 0.00000 -0.13194
|
|
0.02277
|
|
0.00000 0.08141
|
|
0.08284 0.00000 -0.10418
|
|
multipole 119 117 120 0.04660
|
|
0.25752 0.00000 0.19196
|
|
0.36112
|
|
0.00000 -0.48799
|
|
-0.42867 0.00000 0.12687
|
|
multipole 120 119 124 -0.16996
|
|
0.07326 0.00000 0.05464
|
|
0.44029
|
|
0.00000 -0.71866
|
|
0.32632 0.00000 0.27837
|
|
multipole 121 120 124 0.13110
|
|
0.02575 0.00000 -0.14558
|
|
0.00657
|
|
0.00000 -0.01572
|
|
0.00411 0.00000 0.00915
|
|
multipole 122 119 126 0.08866
|
|
0.18994 0.00000 -0.17003
|
|
0.37335
|
|
0.00000 -0.27499
|
|
-0.18897 0.00000 -0.09836
|
|
multipole 123 122 126 0.02049
|
|
0.03210 0.00000 -0.20183
|
|
0.00721
|
|
0.00000 0.04324
|
|
0.00501 0.00000 -0.05045
|
|
multipole 124 120 126 0.34991
|
|
0.30562 0.00000 0.16281
|
|
-0.05686
|
|
0.00000 -0.39010
|
|
-0.16611 0.00000 0.44696
|
|
multipole 125 124 126 0.03404
|
|
0.02495 0.00000 -0.20391
|
|
0.00173
|
|
0.00000 -0.02858
|
|
0.01013 0.00000 0.02685
|
|
multipole 126 122 124 -0.50635
|
|
0.18134 0.00000 0.26499
|
|
-0.07393
|
|
0.00000 -0.04385
|
|
-0.12432 0.00000 0.11778
|
|
multipole 127 8 129 -0.11338
|
|
0.22119 0.00000 0.30702
|
|
-0.06116
|
|
0.00000 -0.60019
|
|
0.03111 0.00000 0.66135
|
|
multipole 128 127 129 0.08990
|
|
0.03505 0.00000 -0.12631
|
|
0.02431
|
|
0.00000 0.08784
|
|
0.08710 0.00000 -0.11215
|
|
multipole 129 127 130 0.20611
|
|
0.29762 0.00000 0.05580
|
|
0.13649
|
|
0.00000 -0.54039
|
|
-0.01448 0.00000 0.40390
|
|
multipole 130 129 133 -0.56975
|
|
0.21589 0.00000 0.18560
|
|
0.00927
|
|
0.00000 -0.03572
|
|
-0.10374 0.00000 0.02645
|
|
multipole 131 129 135 -0.02289
|
|
0.28325 0.00000 -0.15990
|
|
0.65227
|
|
0.00000 -0.37726
|
|
-0.23589 0.00000 -0.27501
|
|
multipole 132 131 135 0.03876
|
|
-0.00320 0.00000 -0.17520
|
|
0.06180
|
|
0.00000 0.00375
|
|
-0.07542 0.00000 -0.06555
|
|
multipole 133 130 135 0.33110
|
|
0.22778 0.00000 0.23060
|
|
0.19791
|
|
0.00000 -0.37320
|
|
-0.38619 0.00000 0.17529
|
|
multipole 134 133 135 0.03651
|
|
-0.02898 0.00000 -0.20060
|
|
0.03456
|
|
0.00000 -0.00906
|
|
-0.01436 0.00000 -0.02550
|
|
multipole 135 131 133 -0.13121
|
|
-0.01623 0.00000 0.07052
|
|
0.22148
|
|
0.00000 -0.71860
|
|
0.21693 0.00000 0.49712
|
|
multipole 136 135 133 0.10796
|
|
0.00816 0.00000 -0.20977
|
|
0.04667
|
|
0.00000 -0.02930
|
|
0.04575 0.00000 -0.01737
|
|
multipole 137 8 139 -0.33682
|
|
-0.09973 0.00000 0.38664
|
|
-0.56710
|
|
0.00000 -0.27996
|
|
0.12769 0.00000 0.84706
|
|
multipole 138 137 139 0.04965
|
|
0.04752 0.00000 -0.13859
|
|
0.11994
|
|
0.00000 0.04796
|
|
0.03771 0.00000 -0.16790
|
|
multipole 139 -140 -140 1.01811
|
|
0.00000 0.00000 -0.15412
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 140 139 140 -0.85879
|
|
0.08949 0.00000 -0.07764
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 141 8 143 -0.17303
|
|
0.44945 0.00000 0.30728
|
|
-0.07251
|
|
0.00000 -0.67903
|
|
0.08175 0.00000 0.75154
|
|
multipole 142 141 143 0.10446
|
|
-0.08174 0.00000 -0.18518
|
|
-0.00080
|
|
0.00000 0.13227
|
|
-0.04979 0.00000 -0.13147
|
|
multipole 143 -144 -145 0.85923
|
|
0.00000 0.00000 0.14630
|
|
0.26732
|
|
0.00000 -0.30726
|
|
0.00000 0.00000 0.03994
|
|
multipole 144 143 145 -0.63514
|
|
-0.04784 0.00000 -0.07224
|
|
-0.41873
|
|
0.00000 0.25275
|
|
-0.15048 0.00000 0.16598
|
|
multipole 145 143 144 -0.43939
|
|
0.21541 0.00000 -0.02221
|
|
0.36981
|
|
0.00000 -0.36139
|
|
-0.26932 0.00000 -0.00842
|
|
multipole 146 145 143 0.24242
|
|
-0.05297 0.00000 -0.03262
|
|
-0.15414
|
|
0.00000 -0.15395
|
|
-0.00414 0.00000 0.30809
|
|
multipole 147 8 149 -0.15914
|
|
0.20696 0.00000 0.39766
|
|
0.04998
|
|
0.00000 -0.56038
|
|
0.16613 0.00000 0.51040
|
|
multipole 148 147 149 0.10149
|
|
0.02977 0.00000 -0.15557
|
|
-0.01454
|
|
0.00000 0.17295
|
|
0.10589 0.00000 -0.15841
|
|
multipole 149 151 150 0.76984
|
|
0.28242 0.00000 -0.15875
|
|
0.01831
|
|
0.00000 -0.16686
|
|
0.09056 0.00000 0.14855
|
|
multipole 150 149 151 -0.74313
|
|
-0.04904 0.00000 -0.17638
|
|
-0.37631
|
|
0.00000 0.37623
|
|
-0.05205 0.00000 0.00008
|
|
multipole 151 149 150 -0.28938
|
|
0.12918 0.00000 -0.08416
|
|
0.48804
|
|
0.00000 -0.69748
|
|
-0.01277 0.00000 0.20944
|
|
multipole 152 151 149 0.14092
|
|
-0.00409 0.00000 -0.17075
|
|
0.00327
|
|
0.00000 -0.00106
|
|
0.19714 0.00000 -0.00221
|
|
multipole 153 8 155 -0.10324
|
|
0.09831 0.00000 0.33772
|
|
0.29786
|
|
0.00000 -0.73875
|
|
-0.12488 0.00000 0.44089
|
|
multipole 154 153 155 0.06492
|
|
0.02097 0.00000 -0.14796
|
|
0.09102
|
|
0.00000 0.12078
|
|
-0.12342 0.00000 -0.21180
|
|
multipole 155 153 157 -0.35416
|
|
-0.08035 0.00000 0.17352
|
|
-0.33142
|
|
0.00000 -0.02713
|
|
0.00000 0.00000 0.35855
|
|
multipole 156 155 157 0.06420
|
|
0.07412 0.00000 -0.09544
|
|
0.40117
|
|
0.00000 -0.10252
|
|
0.00000 0.00000 -0.29865
|
|
multipole 157 -158 -158 1.05691
|
|
0.00000 0.00000 0.00867
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 158 157 158 -0.89737
|
|
-0.03977 0.00000 -0.09456
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 159 8 161 -0.10668
|
|
0.29642 0.00000 0.28365
|
|
0.39855
|
|
0.00000 -0.41154
|
|
0.04273 0.00000 0.01299
|
|
multipole 160 159 8 0.09513
|
|
-0.05887 0.00000 -0.04640
|
|
-0.03611
|
|
0.00000 -0.02016
|
|
-0.01670 0.00000 0.05627
|
|
multipole 161 159 163 -0.23637
|
|
0.34729 0.00000 0.09253
|
|
-0.40537
|
|
0.00000 -0.00346
|
|
-0.52649 0.00000 0.40883
|
|
multipole 162 161 163 0.10600
|
|
-0.20910 0.00000 -0.08841
|
|
-0.14892
|
|
0.00000 0.17218
|
|
-0.34482 0.00000 -0.02326
|
|
multipole 163 -164 -165 0.90086
|
|
0.00000 0.00000 0.15301
|
|
0.12115
|
|
0.00000 0.03649
|
|
0.00828 0.00000 -0.15764
|
|
multipole 164 163 165 -0.60677
|
|
0.02332 0.00000 -0.04031
|
|
-0.46754
|
|
0.00000 0.22363
|
|
0.10574 0.00000 0.24391
|
|
multipole 165 163 164 -0.53100
|
|
0.05936 0.00000 -0.00202
|
|
0.03421
|
|
0.00000 0.00132
|
|
0.18532 0.00000 -0.03553
|
|
multipole 166 165 163 0.24071
|
|
-0.19323 0.00000 -0.29128
|
|
0.07422
|
|
0.00000 0.09278
|
|
-0.19140 0.00000 -0.16700
|
|
multipole 167 8 169 -0.07575
|
|
0.20886 0.00000 0.29708
|
|
0.20862
|
|
0.00000 -0.53751
|
|
-0.38031 0.00000 0.32889
|
|
multipole 168 167 8 0.09458
|
|
-0.04304 0.00000 -0.08810
|
|
-0.17118
|
|
0.00000 0.05903
|
|
0.10731 0.00000 0.11215
|
|
multipole 169 167 171 -0.27255
|
|
0.04245 0.00000 0.29740
|
|
0.02354
|
|
0.00000 -0.03872
|
|
0.02994 0.00000 0.01518
|
|
multipole 170 169 171 0.10149
|
|
0.02977 0.00000 -0.15557
|
|
-0.01454
|
|
0.00000 0.17295
|
|
0.10589 0.00000 -0.15841
|
|
multipole 171 173 172 0.76984
|
|
0.28242 0.00000 -0.15875
|
|
0.01831
|
|
0.00000 -0.16686
|
|
0.09056 0.00000 0.14855
|
|
multipole 172 171 173 -0.74313
|
|
-0.04904 0.00000 -0.17638
|
|
-0.37631
|
|
0.00000 0.37623
|
|
-0.05205 0.00000 0.00008
|
|
multipole 173 171 172 -0.28938
|
|
0.12918 0.00000 -0.08416
|
|
0.48804
|
|
0.00000 -0.69748
|
|
-0.01277 0.00000 0.20944
|
|
multipole 174 173 171 0.14092
|
|
-0.00409 0.00000 -0.17075
|
|
0.00327
|
|
0.00000 -0.00106
|
|
0.19714 0.00000 -0.00221
|
|
multipole 175 8 177 -0.14215
|
|
0.12943 0.00000 0.31867
|
|
0.18924
|
|
0.00000 -0.71964
|
|
-0.21203 0.00000 0.53040
|
|
multipole 176 175 177 0.08383
|
|
0.08229 0.00000 -0.07905
|
|
-0.01759
|
|
0.00000 0.08087
|
|
0.02604 0.00000 -0.06328
|
|
multipole 177 179 175 -0.22038
|
|
0.23726 0.00000 -0.16299
|
|
0.36732
|
|
0.00000 -0.44121
|
|
-0.37426 0.00000 0.07389
|
|
multipole 178 177 179 0.07884
|
|
0.03596 0.00000 -0.06087
|
|
-0.03114
|
|
0.00000 0.01997
|
|
0.06174 0.00000 0.01117
|
|
multipole 179 177 180 0.14780
|
|
0.54807 0.00000 0.51535
|
|
1.30094
|
|
0.00000 -2.99992
|
|
-0.76856 0.00000 1.69898
|
|
multipole 180 179 181 -0.21776
|
|
0.01805 0.00000 0.06009
|
|
-0.28800
|
|
0.00000 0.12124
|
|
-0.18981 0.00000 0.16676
|
|
multipole 181 180 179 0.05672
|
|
0.01469 0.00000 -0.10715
|
|
0.09749
|
|
0.00000 -0.02112
|
|
0.03039 0.00000 -0.07637
|
|
multipole 182 8 184 -0.08975
|
|
0.20388 0.00000 0.25551
|
|
0.08393
|
|
0.00000 -0.69546
|
|
-0.19022 0.00000 0.61153
|
|
multipole 183 182 184 0.08202
|
|
0.03852 0.00000 -0.09266
|
|
0.00460
|
|
0.00000 0.05897
|
|
-0.05937 0.00000 -0.06357
|
|
multipole 184 186 182 -0.21565
|
|
0.30101 0.00000 0.17456
|
|
0.15633
|
|
0.00000 -0.62215
|
|
-0.22099 0.00000 0.46582
|
|
multipole 185 184 185 0.08265
|
|
0.03106 0.00000 -0.09591
|
|
0.04227
|
|
0.00000 0.02301
|
|
0.08405 0.00000 -0.06528
|
|
multipole 186 188 184 -0.02245
|
|
0.22603 0.00000 0.33147
|
|
0.15933
|
|
0.00000 -0.60475
|
|
-0.25158 0.00000 0.44542
|
|
multipole 187 186 187 0.07982
|
|
-0.02778 0.00000 -0.06593
|
|
0.07962
|
|
0.00000 0.06169
|
|
0.09443 0.00000 -0.14131
|
|
multipole 188 190 186 -0.01637
|
|
0.17686 0.00000 0.14050
|
|
-0.14798
|
|
0.00000 -0.81782
|
|
-0.11856 0.00000 0.96580
|
|
multipole 189 188 189 0.09822
|
|
-0.04651 0.00000 -0.07618
|
|
-0.01229
|
|
0.00000 -0.00776
|
|
-0.13903 0.00000 0.02005
|
|
multipole 190 188 191 0.10000
|
|
0.03808 0.00000 0.22325
|
|
-0.22293
|
|
0.00000 -0.22476
|
|
0.00964 0.00000 0.44769
|
|
multipole 191 190 188 0.20727
|
|
0.03469 0.00000 -0.12995
|
|
-0.04317
|
|
0.00000 -0.08341
|
|
0.18046 0.00000 0.12658
|
|
multipole 192 8 194 -0.14610
|
|
0.04867 0.00000 0.34432
|
|
0.09079
|
|
0.00000 -0.55511
|
|
-0.18572 0.00000 0.46432
|
|
multipole 193 192 194 0.06260
|
|
0.02182 0.00000 -0.14723
|
|
0.09446
|
|
0.00000 0.10407
|
|
-0.12330 0.00000 -0.19853
|
|
multipole 194 196 192 -0.13934
|
|
0.20906 0.00000 0.01228
|
|
0.22665
|
|
0.00000 -0.42949
|
|
-0.27135 0.00000 0.20284
|
|
multipole 195 194 195 0.07212
|
|
0.00697 0.00000 -0.07338
|
|
0.14505
|
|
0.00000 -0.06944
|
|
0.16099 0.00000 -0.07561
|
|
multipole 196 198 194 -0.12642
|
|
0.20234 0.00000 0.13874
|
|
0.10501
|
|
0.00000 -0.54234
|
|
-0.24399 0.00000 0.43733
|
|
multipole 197 196 197 0.06261
|
|
-0.00129 0.00000 -0.07060
|
|
0.02999
|
|
0.00000 0.03807
|
|
0.03535 0.00000 -0.06806
|
|
multipole 198 200 196 0.04761
|
|
0.09262 0.00000 -0.03821
|
|
0.29739
|
|
0.00000 -0.34473
|
|
-0.15365 0.00000 0.04734
|
|
multipole 199 198 199 0.02822
|
|
-0.09076 0.00000 -0.01870
|
|
0.06435
|
|
0.00000 -0.07401
|
|
-0.07089 0.00000 0.00966
|
|
multipole 200 198 201 -0.20360
|
|
0.12136 0.00000 0.24914
|
|
-0.14128
|
|
0.00000 -0.79272
|
|
0.08516 0.00000 0.93400
|
|
multipole 201 200 198 0.08988
|
|
0.10885 0.00000 -0.33633
|
|
0.25980
|
|
0.00000 -0.00123
|
|
0.38791 0.00000 -0.25857
|
|
multipole 202 8 204 -0.09097
|
|
0.31208 0.00000 0.34711
|
|
0.26802
|
|
0.00000 -0.71303
|
|
0.08629 0.00000 0.44501
|
|
multipole 203 202 204 0.07770
|
|
-0.02034 0.00000 -0.11842
|
|
-0.07729
|
|
0.00000 0.11869
|
|
-0.15759 0.00000 -0.04140
|
|
multipole 204 202 206 -0.21722
|
|
0.33699 0.00000 0.20660
|
|
0.18535
|
|
0.00000 -0.29250
|
|
-0.24900 0.00000 0.10715
|
|
multipole 205 204 205 0.08258
|
|
0.04941 0.00000 -0.09810
|
|
0.14471
|
|
0.00000 -0.09703
|
|
0.04718 0.00000 -0.04768
|
|
multipole 206 204 208 -0.01121
|
|
0.30142 0.00000 0.15967
|
|
0.51002
|
|
0.00000 -0.64074
|
|
-0.39142 0.00000 0.13072
|
|
multipole 207 206 207 0.07564
|
|
-0.04299 0.00000 -0.06409
|
|
0.03411
|
|
0.00000 0.16042
|
|
0.14615 0.00000 -0.19453
|
|
multipole 208 206 210 -0.27936
|
|
-0.19230 0.00000 0.47650
|
|
0.08293
|
|
0.00000 -0.98827
|
|
0.10755 0.00000 0.90534
|
|
multipole 209 208 210 0.15532
|
|
-0.11954 0.00000 -0.12082
|
|
0.01544
|
|
0.00000 -0.19834
|
|
-0.04507 0.00000 0.18290
|
|
multipole 210 -211 -211 0.98761
|
|
0.00000 0.00000 -0.18100
|
|
-0.19176
|
|
0.00000 -0.18380
|
|
0.00000 0.00000 0.37556
|
|
multipole 211 210 211 -0.29224
|
|
-0.02579 0.00000 -0.18729
|
|
0.46099
|
|
0.00000 -0.80088
|
|
-0.06689 0.00000 0.33989
|
|
multipole 212 211 210 0.15787
|
|
0.00500 0.00000 -0.16579
|
|
0.13325
|
|
0.00000 -0.16718
|
|
-0.06599 0.00000 0.03393
|
|
multipole 213 8 215 -0.08587
|
|
0.20388 0.00000 0.25551
|
|
0.08393
|
|
0.00000 -0.69546
|
|
-0.19022 0.00000 0.61153
|
|
multipole 214 213 215 0.08588
|
|
0.03852 0.00000 -0.09266
|
|
0.00460
|
|
0.00000 0.05897
|
|
-0.05937 0.00000 -0.06357
|
|
multipole 215 217 213 -0.01858
|
|
0.22603 0.00000 0.33147
|
|
0.15933
|
|
0.00000 -0.60475
|
|
-0.25158 0.00000 0.44542
|
|
multipole 216 215 216 0.08368
|
|
-0.02778 0.00000 -0.06593
|
|
0.07962
|
|
0.00000 0.06169
|
|
0.09443 0.00000 -0.14131
|
|
multipole 217 219 215 -0.01249
|
|
0.17686 0.00000 0.14050
|
|
-0.14798
|
|
0.00000 -0.81782
|
|
-0.11856 0.00000 0.96580
|
|
multipole 218 217 218 0.10208
|
|
-0.04651 0.00000 -0.07618
|
|
-0.01229
|
|
0.00000 -0.00776
|
|
-0.13903 0.00000 0.02005
|
|
multipole 219 217 220 0.10000
|
|
0.03808 0.00000 0.22325
|
|
-0.22293
|
|
0.00000 -0.22476
|
|
0.00964 0.00000 0.44769
|
|
multipole 220 219 217 0.20727
|
|
0.03469 0.00000 -0.12995
|
|
-0.04317
|
|
0.00000 -0.08341
|
|
0.18046 0.00000 0.12658
|
|
multipole 221 223 224 -0.19058
|
|
-0.06827 0.00000 0.32517
|
|
-0.13529
|
|
0.00000 -0.15457
|
|
-0.05672 0.00000 0.28986
|
|
multipole 222 221 223 0.07778
|
|
-0.01715 0.00000 -0.10934
|
|
0.05355
|
|
0.00000 0.05042
|
|
-0.02825 0.00000 -0.10397
|
|
multipole 223 224 221 0.68484
|
|
-0.31279 0.00000 0.38571
|
|
0.14709
|
|
0.00000 -0.12737
|
|
0.07287 0.00000 -0.01972
|
|
multipole 224 223 221 -0.72760
|
|
0.09427 0.00000 -0.12507
|
|
-0.42919
|
|
0.00000 0.22290
|
|
0.14497 0.00000 0.20629
|
|
multipole 225 -226 -226 -0.30948
|
|
0.00000 0.00000 0.16462
|
|
0.51606
|
|
0.00000 -0.99579
|
|
0.00000 0.00000 0.47973
|
|
multipole 226 225 226 0.15474
|
|
-0.06307 0.00000 -0.12148
|
|
0.17239
|
|
0.00000 -0.07008
|
|
-0.03484 0.00000 -0.10231
|
|
multipole 227 229 228 -0.26804
|
|
0.11821 0.00000 0.25875
|
|
0.09964
|
|
0.00000 -0.79062
|
|
-0.22323 0.00000 0.69098
|
|
multipole 228 227 229 0.11919
|
|
0.04956 0.00000 -0.09552
|
|
0.10300
|
|
0.00000 -0.00278
|
|
-0.03565 0.00000 -0.10022
|
|
multipole 229 227 228 -0.00970
|
|
0.06190 0.00000 0.26240
|
|
-0.41933
|
|
0.00000 -0.31279
|
|
0.05123 0.00000 0.73212
|
|
multipole 230 229 227 0.05285
|
|
-0.00218 0.00000 -0.11166
|
|
0.02154
|
|
0.00000 0.04194
|
|
-0.06597 0.00000 -0.06348
|
|
multipole 231 2 232 0.07891
|
|
0.00245 0.00000 0.24784
|
|
-0.48795
|
|
0.00000 -0.41413
|
|
0.01190 0.00000 0.90208
|
|
multipole 231 8 232 0.11164
|
|
0.27906 0.00000 0.31455
|
|
-0.62632
|
|
0.00000 -0.62629
|
|
1.11853 0.00000 1.25261
|
|
multipole 231 48 232 0.11164
|
|
0.27906 0.00000 0.31455
|
|
-0.62632
|
|
0.00000 -0.62629
|
|
1.11853 0.00000 1.25261
|
|
multipole 232 231 2 0.26670
|
|
0.06933 0.00000 0.04172
|
|
-0.17154
|
|
0.00000 -0.07853
|
|
0.07867 0.00000 0.25007
|
|
multipole 232 231 8 0.21240
|
|
0.02872 0.00000 -0.04889
|
|
-0.22692
|
|
0.00000 0.04052
|
|
0.01035 0.00000 0.18640
|
|
multipole 232 231 48 0.21240
|
|
0.00000 0.00000 -0.12490
|
|
0.03622
|
|
0.00000 -0.01437
|
|
0.00000 0.00000 -0.02185
|
|
multipole 233 -234 -234 1.02670
|
|
0.00000 0.00000 -0.04116
|
|
0.39082
|
|
0.00000 -0.32381
|
|
0.00000 0.00000 -0.06701
|
|
multipole 234 233 234 -0.88956
|
|
0.17189 0.00000 -0.22995
|
|
-0.43857
|
|
0.00000 0.34721
|
|
0.38935 0.00000 0.09136
|
|
multipole 235 236 2 0.92336
|
|
-0.20027 0.00000 -0.03856
|
|
0.31193
|
|
0.00000 -0.40576
|
|
0.16648 0.00000 0.09383
|
|
multipole 235 236 8 0.83309
|
|
-0.40323 0.00000 0.21520
|
|
0.22432
|
|
0.00000 -0.07777
|
|
0.17848 0.00000 -0.14655
|
|
multipole 235 236 44 0.83309
|
|
-0.40323 0.00000 0.21520
|
|
0.22432
|
|
0.00000 -0.07777
|
|
0.17848 0.00000 -0.14655
|
|
multipole 236 235 2 -0.58827
|
|
0.04503 0.00000 -0.13615
|
|
-0.44066
|
|
0.00000 0.28331
|
|
0.05541 0.00000 0.15735
|
|
multipole 236 235 8 -0.61662
|
|
0.11446 0.00000 0.01734
|
|
-0.55506
|
|
0.00000 0.08419
|
|
0.16576 0.00000 0.47087
|
|
multipole 236 235 44 -0.61662
|
|
0.11446 0.00000 0.01734
|
|
-0.55506
|
|
0.00000 0.08419
|
|
0.16576 0.00000 0.47087
|
|
multipole 237 235 238 -0.46459
|
|
0.15200 0.00000 0.02356
|
|
0.42562
|
|
0.00000 -0.67227
|
|
-0.48912 0.00000 0.24665
|
|
multipole 238 237 235 0.24812
|
|
-0.03635 0.00000 -0.05034
|
|
-0.06195
|
|
0.00000 -0.06380
|
|
-0.05902 0.00000 0.12575
|
|
multipole 239 241 245 0.07219
|
|
0.28913 0.00000 0.29472
|
|
0.20132
|
|
0.00000 -0.54286
|
|
0.05155 0.00000 0.34154
|
|
multipole 240 239 240 0.23262
|
|
-0.02789 0.00000 -0.04288
|
|
0.00231
|
|
0.00000 0.03311
|
|
-0.02313 0.00000 -0.03542
|
|
multipole 241 239 242 -0.16428
|
|
0.16276 0.20457 0.47894
|
|
-0.28250
|
|
-0.26022 -0.34943
|
|
0.25272 -0.20303 0.63193
|
|
multipole 242 243 241 0.94625
|
|
0.00000 0.00000 0.32359
|
|
0.14171
|
|
0.00000 -0.31370
|
|
0.03825 0.00000 0.17199
|
|
multipole 243 242 241 -0.74794
|
|
0.02444 0.00000 -0.13267
|
|
-0.59982
|
|
0.00000 0.24285
|
|
-0.01926 0.00000 0.35697
|
|
multipole 244 241 55 0.12611
|
|
0.01772 0.00000 0.00501
|
|
0.02059
|
|
0.00000 -0.01260
|
|
0.01759 0.00000 -0.00799
|
|
multipole 245 57 239 -0.04567
|
|
0.56406 0.00000 0.09733
|
|
0.69818
|
|
0.00000 -0.78665
|
|
-0.18468 0.00000 0.08847
|
|
multipole 246 245 239 0.10559
|
|
-0.01503 0.00000 -0.07122
|
|
0.00434
|
|
0.00000 -0.00248
|
|
-0.01523 0.00000 -0.00186
|
|
multipole 247 250 251 0.19705
|
|
0.05235 0.00000 -0.55644
|
|
-0.17689
|
|
0.00000 0.07507
|
|
-0.26977 0.00000 0.10182
|
|
multipole 247 250 252 0.19705
|
|
0.05235 0.00000 -0.55644
|
|
-0.17689
|
|
0.00000 0.07507
|
|
-0.26977 0.00000 0.10182
|
|
multipole 248 251 255 0.35474
|
|
0.27278 0.00000 0.17660
|
|
-0.11495
|
|
0.00000 -0.52849
|
|
-0.24464 0.00000 0.64344
|
|
multipole 248 252 255 0.35474
|
|
0.27278 0.00000 0.17660
|
|
-0.11495
|
|
0.00000 -0.52849
|
|
-0.24464 0.00000 0.64344
|
|
multipole 249 250 253 0.62323
|
|
0.04051 0.00000 -0.40121
|
|
-0.16700
|
|
0.00000 -0.05202
|
|
0.14286 0.00000 0.21902
|
|
multipole 250 247 249 0.11018
|
|
-0.27451 0.00000 -0.16246
|
|
-0.43024
|
|
0.00000 0.15634
|
|
0.11274 0.00000 0.27390
|
|
multipole 251 247 248 -0.16574
|
|
-0.15654 0.00000 -0.29303
|
|
0.81194
|
|
0.00000 -0.31643
|
|
-0.09665 0.00000 -0.49551
|
|
multipole 252 247 248 -0.19177
|
|
-0.15102 0.00000 -0.28082
|
|
1.02852
|
|
0.00000 0.19924
|
|
-0.11670 0.00000 -1.22776
|
|
multipole 253 249 260 -0.30216
|
|
0.00000 0.00000 -0.23479
|
|
-0.18214
|
|
0.00000 -0.18214
|
|
0.00000 0.00000 0.36428
|
|
multipole 254 256 257 0.53583
|
|
0.46262 0.00000 0.23806
|
|
0.30445
|
|
0.00000 -0.30622
|
|
0.27296 0.00000 0.00177
|
|
multipole 255 248 250 -0.50058
|
|
0.27961 0.00000 0.29857
|
|
-0.21774
|
|
0.00000 -0.20902
|
|
-0.22060 0.00000 0.42676
|
|
multipole 256 247 254 -0.59923
|
|
0.25112 0.00000 -0.03017
|
|
0.05684
|
|
0.00000 0.03677
|
|
-0.42077 0.00000 -0.09361
|
|
multipole 257 249 254 -0.68218
|
|
0.26819 0.00000 -0.11771
|
|
-0.22542
|
|
0.00000 0.23562
|
|
-0.49764 0.00000 -0.01020
|
|
multipole 258 248 251 0.03522
|
|
-0.00715 0.00000 -0.19094
|
|
0.12022
|
|
0.00000 -0.00738
|
|
-0.01223 0.00000 -0.11284
|
|
multipole 258 248 252 0.03522
|
|
-0.00715 0.00000 -0.19094
|
|
0.12022
|
|
0.00000 -0.00738
|
|
-0.01223 0.00000 -0.11284
|
|
multipole 259 254 256 0.01012
|
|
0.00378 0.00000 -0.20885
|
|
0.29328
|
|
0.00000 -0.03702
|
|
0.01627 0.00000 -0.25626
|
|
multipole 260 253 249 0.11946
|
|
0.10111 0.00000 -0.36228
|
|
0.30681
|
|
0.00000 0.00962
|
|
0.09733 0.00000 -0.31643
|
|
multipole 261 265 266 -0.24104
|
|
-0.46930 0.00000 -0.00215
|
|
-0.63770
|
|
0.00000 -0.12764
|
|
-0.21639 0.00000 0.76534
|
|
multipole 262 265 266 -0.26707
|
|
-0.43500 0.00000 -0.02543
|
|
-0.80418
|
|
0.00000 -0.16395
|
|
-0.56679 0.00000 0.96813
|
|
multipole 263 265 267 -0.21855
|
|
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|
0.07073
|
|
0.00000 -0.29598
|
|
0.18324 0.00000 0.22525
|
|
multipole 264 267 272 -0.26774
|
|
0.00000 0.00000 -0.14722
|
|
-0.20683
|
|
0.00000 -0.20683
|
|
0.00000 0.00000 0.41366
|
|
multipole 265 261 263 0.21574
|
|
0.02713 0.00000 0.38093
|
|
-0.32457
|
|
0.00000 -0.21073
|
|
0.24767 0.00000 0.53530
|
|
multipole 265 262 263 0.21574
|
|
0.02713 0.00000 0.38093
|
|
-0.32457
|
|
0.00000 -0.21073
|
|
0.24767 0.00000 0.53530
|
|
multipole 266 261 268 0.99441
|
|
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|
|
0.26825
|
|
0.00000 -0.16618
|
|
-0.12141 0.00000 -0.10207
|
|
multipole 266 262 268 0.99441
|
|
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|
|
0.26825
|
|
0.00000 -0.16618
|
|
-0.12141 0.00000 -0.10207
|
|
multipole 267 263 264 0.63287
|
|
0.11720 0.00000 -0.36908
|
|
-0.70790
|
|
0.00000 -0.09015
|
|
0.13248 0.00000 0.79805
|
|
multipole 268 266 267 -0.72673
|
|
0.11437 0.00000 0.27430
|
|
-0.36580
|
|
0.00000 0.16860
|
|
-0.15967 0.00000 0.19720
|
|
multipole 269 263 265 0.03287
|
|
-0.02386 0.00000 -0.16869
|
|
0.19235
|
|
0.00000 -0.04497
|
|
-0.11320 0.00000 -0.14738
|
|
multipole 270 266 261 -0.80802
|
|
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|
|
-0.06093
|
|
0.00000 -0.00808
|
|
-0.25644 0.00000 0.06901
|
|
multipole 270 266 262 -0.80802
|
|
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|
|
-0.06093
|
|
0.00000 -0.00808
|
|
-0.25644 0.00000 0.06901
|
|
multipole 271 265 261 0.01925
|
|
0.00579 0.00000 -0.19218
|
|
0.10120
|
|
0.00000 0.03689
|
|
0.06622 0.00000 -0.13809
|
|
multipole 271 265 262 0.01925
|
|
0.00579 0.00000 -0.19218
|
|
0.10120
|
|
0.00000 0.03689
|
|
0.06622 0.00000 -0.13809
|
|
multipole 272 264 267 0.11117
|
|
0.06785 0.00000 -0.34828
|
|
0.25530
|
|
0.00000 0.00041
|
|
0.07371 0.00000 -0.25571
|
|
multipole 273 277 278 0.81575
|
|
0.07393 0.00000 -0.07697
|
|
-1.62256
|
|
0.00000 0.42511
|
|
0.47701 0.00000 1.19745
|
|
multipole 274 277 279 0.91682
|
|
-0.28939 0.00000 -0.03405
|
|
-0.49481
|
|
0.00000 0.06805
|
|
0.30090 0.00000 0.42676
|
|
multipole 275 279 280 0.25636
|
|
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|
|
-0.02366
|
|
0.00000 -0.11189
|
|
-0.68217 0.00000 0.13555
|
|
multipole 275 279 281 0.25636
|
|
-0.06429 0.00000 -0.39303
|
|
-0.02366
|
|
0.00000 -0.11189
|
|
-0.68217 0.00000 0.13555
|
|
multipole 276 280 282 0.33548
|
|
0.26446 0.00000 0.19054
|
|
-0.14954
|
|
0.00000 -0.63553
|
|
-0.24037 0.00000 0.78507
|
|
multipole 276 281 282 0.33548
|
|
0.26446 0.00000 0.19054
|
|
-0.14954
|
|
0.00000 -0.63553
|
|
-0.24037 0.00000 0.78507
|
|
multipole 277 273 274 -0.46516
|
|
-0.20039 0.00000 -0.02958
|
|
0.18319
|
|
0.00000 -0.31924
|
|
0.55206 0.00000 0.13605
|
|
multipole 278 273 287 -0.34777
|
|
0.00000 0.00000 0.09810
|
|
-0.22674
|
|
0.00000 -0.22674
|
|
0.00000 0.00000 0.45348
|
|
multipole 279 274 275 -0.00139
|
|
-0.34214 0.00000 -0.25452
|
|
0.57109
|
|
0.00000 0.08638
|
|
-0.46661 0.00000 -0.65747
|
|
multipole 280 275 276 -0.13948
|
|
-0.16345 0.00000 -0.28631
|
|
0.81099
|
|
0.00000 -0.38335
|
|
0.22009 0.00000 -0.42764
|
|
multipole 281 275 276 -0.16551
|
|
-0.15213 0.00000 -0.24822
|
|
0.87781
|
|
0.00000 -0.04263
|
|
0.16842 0.00000 -0.83518
|
|
multipole 282 276 279 -0.49075
|
|
0.19750 0.00000 0.34115
|
|
-0.18411
|
|
0.00000 0.02266
|
|
-0.00528 0.00000 0.16145
|
|
multipole 283 273 275 -0.68515
|
|
0.30301 0.00000 0.07467
|
|
0.27482
|
|
0.00000 0.10098
|
|
0.18985 0.00000 -0.37580
|
|
multipole 284 277 273 0.13360
|
|
-0.01556 0.00000 -0.29570
|
|
0.16829
|
|
0.00000 0.14413
|
|
-0.17971 0.00000 -0.31242
|
|
multipole 285 274 277 -0.75414
|
|
-0.02651 0.00000 -0.22256
|
|
-0.25663
|
|
0.00000 0.15963
|
|
-0.07481 0.00000 0.09700
|
|
multipole 286 276 280 0.03471
|
|
0.00549 0.00000 -0.20010
|
|
0.02971
|
|
0.00000 0.08931
|
|
0.04294 0.00000 -0.11902
|
|
multipole 286 276 281 0.03471
|
|
0.00549 0.00000 -0.20010
|
|
0.02971
|
|
0.00000 0.08931
|
|
0.04294 0.00000 -0.11902
|
|
multipole 287 278 273 0.12326
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|
-0.12194 0.00000 -0.40562
|
|
0.04772
|
|
0.00000 0.25205
|
|
-0.10563 0.00000 -0.29977
|
|
multipole 288 289 295 -0.12472
|
|
0.00000 0.00000 0.23414
|
|
-0.16670
|
|
0.00000 -0.16670
|
|
0.00000 0.00000 0.33340
|
|
multipole 289 288 290 -0.32491
|
|
-0.11852 0.00000 0.38086
|
|
0.04438
|
|
0.00000 -0.36513
|
|
0.61277 0.00000 0.32075
|
|
multipole 290 289 293 0.94792
|
|
-0.37385 0.00000 -0.16991
|
|
0.27250
|
|
0.00000 -0.11690
|
|
-0.46630 0.00000 -0.15560
|
|
multipole 291 289 292 0.13457
|
|
0.28512 0.00000 -0.15252
|
|
0.24926
|
|
0.00000 -0.37318
|
|
-0.29476 0.00000 0.12392
|
|
multipole 292 291 294 -0.20596
|
|
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|
|
-0.61284
|
|
0.00000 -0.37546
|
|
-0.25749 0.00000 0.98830
|
|
multipole 293 290 294 -0.37323
|
|
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|
|
0.54796
|
|
0.00000 -0.43130
|
|
0.23181 0.00000 -0.11666
|
|
multipole 294 292 293 0.96217
|
|
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|
|
0.36596
|
|
0.00000 -0.21822
|
|
-0.05615 0.00000 -0.14774
|
|
multipole 295 288 289 0.07468
|
|
0.01065 0.00000 -0.01558
|
|
-0.01394
|
|
0.00000 -0.06177
|
|
0.02095 0.00000 0.07571
|
|
multipole 296 294 292 -0.81528
|
|
-0.05664 0.00000 -0.20927
|
|
-0.13286
|
|
0.00000 0.05238
|
|
-0.06252 0.00000 0.08048
|
|
multipole 297 291 289 0.03316
|
|
0.00796 0.00000 -0.15603
|
|
0.06552
|
|
0.00000 0.00785
|
|
-0.01504 0.00000 -0.07337
|
|
multipole 298 290 289 -0.79250
|
|
-0.09925 0.00000 -0.24004
|
|
-0.27421
|
|
0.00000 0.16551
|
|
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|
|
multipole 299 293 290 0.16411
|
|
0.00839 0.00000 -0.12442
|
|
-0.09057
|
|
0.00000 0.00294
|
|
0.00693 0.00000 0.08763
|
|
multipole 300 303 304 0.96728
|
|
-0.16517 0.00000 -0.11030
|
|
-0.14243
|
|
0.00000 -0.19294
|
|
0.11920 0.00000 0.33537
|
|
multipole 301 304 305 0.20155
|
|
0.10244 0.00000 0.30074
|
|
-0.12081
|
|
0.00000 -0.38422
|
|
-0.06545 0.00000 0.50503
|
|
multipole 302 303 305 0.85168
|
|
-0.22270 0.00000 -0.07763
|
|
-0.00198
|
|
0.00000 -0.01706
|
|
-0.28197 0.00000 0.01904
|
|
multipole 303 300 302 -0.38069
|
|
-0.14505 0.00000 -0.04085
|
|
0.47767
|
|
0.00000 -0.40383
|
|
0.32823 0.00000 -0.07384
|
|
multipole 304 300 301 -0.19639
|
|
-0.16349 0.00000 -0.36007
|
|
0.98907
|
|
0.00000 -1.02460
|
|
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|
|
multipole 305 301 302 -0.30583
|
|
-0.17480 0.00000 -0.07381
|
|
-0.09671
|
|
0.00000 -0.36088
|
|
0.02211 0.00000 0.45759
|
|
multipole 306 303 300 0.16490
|
|
0.00383 0.00000 -0.15117
|
|
0.07794
|
|
0.00000 -0.04305
|
|
0.06224 0.00000 -0.03489
|
|
multipole 307 305 301 0.03819
|
|
-0.01137 0.00000 -0.19659
|
|
0.13645
|
|
0.00000 0.01095
|
|
-0.04797 0.00000 -0.14740
|
|
multipole 308 300 303 -0.80827
|
|
0.04828 0.00000 -0.21537
|
|
-0.20344
|
|
0.00000 0.08236
|
|
0.10174 0.00000 0.12108
|
|
multipole 309 302 303 -0.71662
|
|
-0.03231 0.00000 -0.16721
|
|
-0.47288
|
|
0.00000 0.23591
|
|
-0.01906 0.00000 0.23697
|
|
multipole 310 301 304 0.03960
|
|
-0.00001 0.00000 -0.18599
|
|
0.07673
|
|
0.00000 0.06769
|
|
0.06469 0.00000 -0.14442
|
|
multipole 311 -314 -312 -0.21219
|
|
0.14040 0.00000 0.44294
|
|
1.12348
|
|
0.00000 -0.86617
|
|
0.03072 0.00000 -0.25731
|
|
multipole 312 311 318 -0.04958
|
|
0.13334 0.00000 0.11242
|
|
-0.15679
|
|
0.00000 -0.51619
|
|
0.33627 0.00000 0.67298
|
|
multipole 312 311 346 -0.04958
|
|
0.13334 0.00000 0.11242
|
|
-0.15679
|
|
0.00000 -0.51619
|
|
0.33627 0.00000 0.67298
|
|
multipole 313 312 311 0.05304
|
|
0.02860 0.00000 -0.02198
|
|
-0.05851
|
|
0.00000 0.07881
|
|
-0.01698 0.00000 -0.02030
|
|
multipole 314 311 316 0.22509
|
|
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|
|
-0.08112
|
|
0.00000 -0.47377
|
|
0.09344 0.00000 0.55489
|
|
multipole 315 314 311 0.01372
|
|
-0.00919 0.00000 -0.08228
|
|
-0.07774
|
|
0.00000 0.12514
|
|
-0.03924 0.00000 -0.04740
|
|
multipole 316 320 314 0.03216
|
|
0.10990 0.00000 -0.01958
|
|
0.37889
|
|
0.00000 -0.28717
|
|
-0.17655 0.00000 -0.09172
|
|
multipole 317 316 320 0.02686
|
|
0.00928 0.00000 -0.08296
|
|
0.06542
|
|
0.00000 0.05572
|
|
-0.06717 0.00000 -0.12114
|
|
multipole 318 322 312 0.20366
|
|
0.20594 0.00000 0.09319
|
|
-0.11723
|
|
0.00000 -0.31762
|
|
-0.43984 0.00000 0.43485
|
|
multipole 318 346 312 0.20366
|
|
0.20594 0.00000 0.09319
|
|
-0.11723
|
|
0.00000 -0.31762
|
|
-0.43984 0.00000 0.43485
|
|
multipole 319 318 322 0.05807
|
|
0.02182 0.00000 -0.04741
|
|
-0.01189
|
|
0.00000 0.01995
|
|
0.00147 0.00000 -0.00806
|
|
multipole 319 318 346 0.05807
|
|
0.02182 0.00000 -0.04741
|
|
-0.01189
|
|
0.00000 0.01995
|
|
0.00147 0.00000 -0.00806
|
|
multipole 320 316 321 -0.46715
|
|
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|
|
-0.23660
|
|
0.00000 -0.43315
|
|
-0.40748 0.00000 0.66975
|
|
multipole 321 320 316 0.36314
|
|
0.09447 0.00000 -0.13458
|
|
0.10571
|
|
0.00000 0.03601
|
|
0.09130 0.00000 -0.14172
|
|
multipole 322 318 312 -0.54322
|
|
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|
|
0.25255
|
|
0.00000 -0.62094
|
|
0.53908 0.00000 0.36839
|
|
multipole 323 346 318 0.36509
|
|
-0.03477 0.00000 -0.07061
|
|
0.00668
|
|
0.00000 -0.00878
|
|
-0.03884 0.00000 0.00210
|
|
multipole 324 326 312 0.21472
|
|
0.26025 0.00000 0.34835
|
|
0.07978
|
|
0.00000 -0.45645
|
|
-0.03790 0.00000 0.37667
|
|
multipole 324 345 312 0.21472
|
|
0.26025 0.00000 0.34835
|
|
0.07978
|
|
0.00000 -0.45645
|
|
-0.03790 0.00000 0.37667
|
|
multipole 325 324 326 0.01769
|
|
-0.00317 0.00000 -0.11654
|
|
0.10449
|
|
0.00000 -0.04493
|
|
-0.02925 0.00000 -0.05956
|
|
multipole 325 324 345 0.01769
|
|
-0.00317 0.00000 -0.11654
|
|
0.10449
|
|
0.00000 -0.04493
|
|
-0.02925 0.00000 -0.05956
|
|
multipole 326 324 312 -0.56592
|
|
-0.32270 0.00000 -0.10112
|
|
0.42126
|
|
0.00000 -1.13829
|
|
0.05033 0.00000 0.71703
|
|
multipole 327 345 324 0.36475
|
|
0.00908 0.00000 -0.09922
|
|
0.06175
|
|
0.00000 -0.02643
|
|
0.03413 0.00000 -0.03532
|
|
multipole 328 332 329 -0.04092
|
|
0.09394 0.00000 0.14534
|
|
-0.08972
|
|
0.00000 -0.36979
|
|
0.35252 0.00000 0.45951
|
|
multipole 329 338 328 0.09541
|
|
0.23270 0.00000 0.16242
|
|
-0.08206
|
|
0.00000 -0.24668
|
|
-0.05092 0.00000 0.32874
|
|
multipole 329 347 328 0.09541
|
|
0.23270 0.00000 0.16242
|
|
-0.08206
|
|
0.00000 -0.24668
|
|
-0.05092 0.00000 0.32874
|
|
multipole 330 331 329 -0.16585
|
|
0.34883 0.00000 0.32833
|
|
0.52159
|
|
0.00000 -0.79855
|
|
-0.04388 0.00000 0.27696
|
|
multipole 331 332 330 0.36158
|
|
0.07286 0.00000 0.32523
|
|
0.20365
|
|
0.00000 -0.53379
|
|
-0.16275 0.00000 0.33014
|
|
multipole 332 -331 -328 -0.20726
|
|
0.17196 0.00000 0.47089
|
|
1.34014
|
|
0.00000 -1.03558
|
|
0.09226 0.00000 -0.30456
|
|
multipole 333 330 329 0.07594
|
|
-0.00339 0.00000 -0.12482
|
|
0.03839
|
|
0.00000 0.06287
|
|
-0.06388 0.00000 -0.10126
|
|
multipole 334 331 332 -0.02874
|
|
-0.02540 0.00000 -0.16522
|
|
0.03324
|
|
0.00000 0.05278
|
|
-0.02045 0.00000 -0.08602
|
|
multipole 335 329 338 0.04534
|
|
0.03745 0.00000 -0.06219
|
|
0.05688
|
|
0.00000 0.05897
|
|
0.04350 0.00000 -0.11585
|
|
multipole 335 329 347 0.04534
|
|
0.03745 0.00000 -0.06219
|
|
0.05688
|
|
0.00000 0.05897
|
|
0.04350 0.00000 -0.11585
|
|
multipole 336 328 332 0.06371
|
|
-0.00143 0.00000 0.03820
|
|
-0.07016
|
|
0.00000 -0.02994
|
|
-0.02128 0.00000 0.10010
|
|
multipole 337 341 328 0.20884
|
|
0.23256 0.00000 0.32780
|
|
0.07966
|
|
0.00000 -0.49936
|
|
-0.23651 0.00000 0.41970
|
|
multipole 337 348 328 0.20884
|
|
0.23256 0.00000 0.32780
|
|
0.07966
|
|
0.00000 -0.49936
|
|
-0.23651 0.00000 0.41970
|
|
multipole 338 329 328 -0.53633
|
|
-0.15241 0.00000 0.08515
|
|
-0.15239
|
|
0.00000 -0.52084
|
|
0.11305 0.00000 0.67323
|
|
multipole 339 347 329 0.35299
|
|
-0.02338 0.00000 -0.07709
|
|
0.08385
|
|
0.00000 -0.02966
|
|
-0.02571 0.00000 -0.05419
|
|
multipole 340 337 341 0.01484
|
|
-0.00257 0.00000 -0.14412
|
|
0.09017
|
|
0.00000 0.03078
|
|
-0.02370 0.00000 -0.12095
|
|
multipole 340 337 348 0.01484
|
|
-0.00257 0.00000 -0.14412
|
|
0.09017
|
|
0.00000 0.03078
|
|
-0.02370 0.00000 -0.12095
|
|
multipole 341 337 328 -0.56353
|
|
-0.22239 0.00000 -0.06011
|
|
0.38656
|
|
0.00000 -1.00409
|
|
0.25289 0.00000 0.61753
|
|
multipole 342 348 337 0.36821
|
|
-0.00780 0.00000 -0.05456
|
|
0.01443
|
|
0.00000 -0.02693
|
|
0.00842 0.00000 0.01250
|
|
multipole 343 -326 -322 1.70654
|
|
0.00000 0.00000 -0.01783
|
|
0.54887
|
|
0.00000 -0.40394
|
|
0.00000 0.00000 -0.14493
|
|
multipole 343 -341 -338 1.70654
|
|
0.00000 0.00000 -0.01783
|
|
0.54887
|
|
0.00000 -0.40394
|
|
0.00000 0.00000 -0.14493
|
|
multipole 344 343 344 -0.97486
|
|
0.00176 0.00000 -0.07975
|
|
-0.17391
|
|
0.00000 -0.19149
|
|
-0.01158 0.00000 0.36540
|
|
multipole 345 -324 -327 -0.55194
|
|
-0.28854 0.00000 0.13115
|
|
0.52394
|
|
0.00000 -0.49611
|
|
-0.53329 0.00000 -0.02783
|
|
multipole 346 -318 -323 -0.53022
|
|
-0.30181 0.00000 0.07347
|
|
0.67028
|
|
0.00000 -0.55976
|
|
-0.27623 0.00000 -0.11052
|
|
multipole 347 -329 -339 -0.51852
|
|
-0.33062 0.00000 0.16496
|
|
0.59735
|
|
0.00000 -0.64156
|
|
-0.24661 0.00000 0.04421
|
|
multipole 348 -337 -342 -0.54572
|
|
-0.35421 0.00000 0.09483
|
|
0.77382
|
|
0.00000 -0.63430
|
|
-0.30271 0.00000 -0.13952
|
|
multipole 349 -350 -350 -0.51966
|
|
0.00000 0.00000 0.14279
|
|
0.37928
|
|
0.00000 -0.41809
|
|
0.00000 0.00000 0.03881
|
|
multipole 350 349 350 0.25983
|
|
-0.03859 0.00000 -0.05818
|
|
-0.03673
|
|
0.00000 -0.10739
|
|
-0.00203 0.00000 0.14412
|
|
multipole 351 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 352 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 353 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 354 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 355 0 0 1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 356 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 357 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 358 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 359 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 360 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 361 0 0 2.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 362 0 0 -1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 363 0 0 -1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 364 0 0 -1.00000
|
|
0.00000 0.00000 0.00000
|
|
0.00000
|
|
0.00000 0.00000
|
|
0.00000 0.00000 0.00000
|
|
multipole 365 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 52 223 242
|
|
polarize 2 1.3340 0.3900 6
|
|
polarize 3 1.3340 0.3900 1 5 7 50 225 227
|
|
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 52 223 242
|
|
polarize 8 1.3340 0.3900 12
|
|
polarize 9 1.3340 0.3900 1 7 11 50 225 227
|
|
polarize 10 0.4960 0.3900 7
|
|
polarize 11 0.8370 0.3900 9
|
|
polarize 12 0.4960 0.3900 8 48
|
|
polarize 13 1.3340 0.3900 14
|
|
polarize 14 0.4960 0.3900 13
|
|
polarize 15 1.3340 0.3900 16 17
|
|
polarize 16 0.4960 0.3900 15
|
|
polarize 17 1.3340 0.3900 15 18
|
|
polarize 18 0.4960 0.3900 17
|
|
polarize 19 1.3340 0.3900 20 21
|
|
polarize 20 0.4960 0.3900 19
|
|
polarize 21 1.3340 0.3900 19 22 23
|
|
polarize 22 0.4960 0.3900 21
|
|
polarize 23 1.3340 0.3900 21 24
|
|
polarize 24 0.4960 0.3900 23
|
|
polarize 25 1.3340 0.3900 26 29
|
|
polarize 26 0.4960 0.3900 25
|
|
polarize 27 1.3340 0.3900 28 31
|
|
polarize 28 0.4960 0.3900 27
|
|
polarize 29 1.3340 0.3900 25 30
|
|
polarize 30 0.4960 0.3900 29
|
|
polarize 31 1.3340 0.3900 27 32
|
|
polarize 32 0.4960 0.3900 31
|
|
polarize 33 1.3340 0.3900 34 35
|
|
polarize 34 0.4960 0.3900 33
|
|
polarize 35 0.8370 0.3900 33 36
|
|
polarize 36 0.4960 0.3900 35
|
|
polarize 37 1.3340 0.3900 38 39
|
|
polarize 38 0.4960 0.3900 37
|
|
polarize 39 0.8370 0.3900 37 40
|
|
polarize 40 0.4960 0.3900 39
|
|
polarize 41 1.3340 0.3900 42
|
|
polarize 42 0.4960 0.3900 41
|
|
polarize 43 1.3340 0.3900 44 48 49
|
|
polarize 44 0.4960 0.3900 43
|
|
polarize 45 2.8000 0.3900 46
|
|
polarize 46 0.4960 0.3900 45
|
|
polarize 47 2.8000 0.3900 47
|
|
polarize 48 1.3340 0.3900 12 43
|
|
polarize 49 4.0000 0.3900 43
|
|
polarize 50 1.0730 0.3900 3 9 52 59 223 242
|
|
polarize 51 1.3340 0.3900 54
|
|
polarize 52 1.3340 0.3900 1 7 50 53 225 227
|
|
polarize 53 0.8370 0.3900 52
|
|
polarize 54 0.4960 0.3900 51
|
|
polarize 55 1.3340 0.3900 56
|
|
polarize 56 0.4960 0.3900 55
|
|
polarize 57 1.3340 0.3900 58
|
|
polarize 58 0.4960 0.3900 57
|
|
polarize 59 1.3340 0.3900 50 60
|
|
polarize 60 0.4960 0.3900 59
|
|
polarize 61 1.3340 0.3900 62 63
|
|
polarize 62 0.4960 0.3900 61
|
|
polarize 63 1.7500 0.3900 61 64
|
|
polarize 64 1.7500 0.3900 63 65 66
|
|
polarize 65 0.6960 0.3900 64
|
|
polarize 66 1.7500 0.3900 64 67 68
|
|
polarize 67 0.6960 0.3900 66
|
|
polarize 68 1.7500 0.3900 66 69
|
|
polarize 69 0.6960 0.3900 68
|
|
polarize 70 1.3340 0.3900 71 72
|
|
polarize 71 0.4960 0.3900 70
|
|
polarize 72 1.7500 0.3900 70 73
|
|
polarize 73 1.7500 0.3900 72 74 75
|
|
polarize 74 0.6960 0.3900 73
|
|
polarize 75 1.7500 0.3900 73 76 77
|
|
polarize 76 0.6960 0.3900 75
|
|
polarize 77 1.7500 0.3900 75 78
|
|
polarize 78 0.8370 0.3900 77 79
|
|
polarize 79 0.4960 0.3900 78
|
|
polarize 80 1.3340 0.3900 81
|
|
polarize 81 0.4960 0.3900 80
|
|
polarize 82 1.7500 0.3900 83
|
|
polarize 83 1.7500 0.3900 82 84 85
|
|
polarize 84 0.6960 0.3900 83
|
|
polarize 85 1.7500 0.3900 83 86 87
|
|
polarize 86 0.6960 0.3900 85
|
|
polarize 87 1.7500 0.3900 85 88
|
|
polarize 88 0.8370 0.3900 87
|
|
polarize 89 1.3340 0.3900 90
|
|
polarize 90 0.4960 0.3900 89
|
|
polarize 91 1.7500 0.3900 92 94
|
|
polarize 92 1.7500 0.3900 91 93 95
|
|
polarize 93 0.6960 0.3900 92
|
|
polarize 94 1.7500 0.3900 91 97 98
|
|
polarize 95 1.0730 0.3900 92 96 97
|
|
polarize 96 0.4960 0.3900 95
|
|
polarize 97 1.7500 0.3900 94 95 100
|
|
polarize 98 1.7500 0.3900 94 99 102
|
|
polarize 99 0.6960 0.3900 98
|
|
polarize 100 1.7500 0.3900 97 101 104
|
|
polarize 101 0.6960 0.3900 100
|
|
polarize 102 1.7500 0.3900 98 103 104
|
|
polarize 103 0.6960 0.3900 102
|
|
polarize 104 1.7500 0.3900 100 102 105
|
|
polarize 105 0.6960 0.3900 104
|
|
polarize 106 1.3340 0.3900 107 108
|
|
polarize 107 0.4960 0.3900 106
|
|
polarize 108 1.7500 0.3900 106 109 111
|
|
polarize 109 1.5000 0.3900 108 110 113
|
|
polarize 110 0.6960 0.3900 109
|
|
polarize 111 1.7500 0.3900 108 112 115
|
|
polarize 112 0.6960 0.3900 111
|
|
polarize 113 1.7500 0.3900 109 114 115
|
|
polarize 114 0.6960 0.3900 113
|
|
polarize 115 1.5000 0.3900 111 113 116
|
|
polarize 116 0.6960 0.3900 115
|
|
polarize 117 1.3340 0.3900 118 119
|
|
polarize 118 0.4960 0.3900 117
|
|
polarize 119 1.7500 0.3900 117 120 122
|
|
polarize 120 1.5000 0.3900 119 121 122 124
|
|
polarize 121 0.6960 0.3900 120
|
|
polarize 122 1.7500 0.3900 119 120 123 126
|
|
polarize 123 0.6960 0.3900 122
|
|
polarize 124 1.7500 0.3900 120 125 126
|
|
polarize 125 0.6960 0.3900 124
|
|
polarize 126 1.5000 0.3900 122 124
|
|
polarize 127 1.3340 0.3900 128 129
|
|
polarize 128 0.4960 0.3900 127
|
|
polarize 129 1.7500 0.3900 127 130 131
|
|
polarize 130 1.5000 0.3900 129 133
|
|
polarize 131 1.7500 0.3900 129 132 135
|
|
polarize 132 0.6960 0.3900 131
|
|
polarize 133 1.7500 0.3900 130 134 135
|
|
polarize 134 0.6960 0.3900 133
|
|
polarize 135 1.5000 0.3900 131 133 136
|
|
polarize 136 0.6960 0.3900 135
|
|
polarize 137 1.3340 0.3900 138 139
|
|
polarize 138 0.4960 0.3900 137
|
|
polarize 139 1.3340 0.3900 137 140
|
|
polarize 140 1.2000 0.3900 139
|
|
polarize 141 1.3340 0.3900 142 143
|
|
polarize 142 0.4960 0.3900 141
|
|
polarize 143 1.3340 0.3900 141 144 145
|
|
polarize 144 0.8370 0.3900 143
|
|
polarize 145 0.8370 0.3900 143 146
|
|
polarize 146 0.4960 0.3900 145
|
|
polarize 147 1.3340 0.3900 148 149
|
|
polarize 148 0.4960 0.3900 147
|
|
polarize 149 1.3340 0.3900 147 150 151
|
|
polarize 150 0.8340 0.3900 149
|
|
polarize 151 1.0730 0.3900 149 152
|
|
polarize 152 0.4960 0.3900 151
|
|
polarize 153 1.3340 0.3900 154
|
|
polarize 154 0.4960 0.3900 153
|
|
polarize 155 1.3340 0.3900 156 157
|
|
polarize 156 0.4960 0.3900 155
|
|
polarize 157 1.3340 0.3900 155 158
|
|
polarize 158 1.2000 0.3900 157
|
|
polarize 159 1.3340 0.3900 160
|
|
polarize 160 0.4960 0.3900 159
|
|
polarize 161 1.3340 0.3900 162 163
|
|
polarize 162 0.4960 0.3900 161
|
|
polarize 163 1.3340 0.3900 161 164 165
|
|
polarize 164 0.8370 0.3900 163
|
|
polarize 165 0.8370 0.3900 163 166
|
|
polarize 166 0.4960 0.3900 165
|
|
polarize 167 1.3340 0.3900 168
|
|
polarize 168 0.4960 0.3900 167
|
|
polarize 169 1.3340 0.3900 170 171
|
|
polarize 170 0.4960 0.3900 169
|
|
polarize 171 1.3340 0.3900 169 172 173
|
|
polarize 172 0.8340 0.3900 171
|
|
polarize 173 1.0730 0.3900 171 174
|
|
polarize 174 0.4960 0.3900 173
|
|
polarize 175 1.3340 0.3900 176
|
|
polarize 176 0.4960 0.3900 175
|
|
polarize 177 1.3340 0.3900 178 179
|
|
polarize 178 0.4960 0.3900 177
|
|
polarize 179 3.3000 0.3900 177 180
|
|
polarize 180 1.3340 0.3900 179 181
|
|
polarize 181 0.4960 0.3900 180
|
|
polarize 182 1.3340 0.3900 183 184
|
|
polarize 183 0.4960 0.3900 182
|
|
polarize 184 1.3340 0.3900 182 185 186
|
|
polarize 185 0.4960 0.3900 184
|
|
polarize 186 1.3340 0.3900 184 187
|
|
polarize 187 0.4960 0.3900 186
|
|
polarize 188 1.3340 0.3900 189 190
|
|
polarize 189 0.4960 0.3900 188
|
|
polarize 190 1.0730 0.3900 188 191
|
|
polarize 191 0.4960 0.3900 190
|
|
polarize 192 1.3340 0.3900 193 194
|
|
polarize 193 0.4960 0.3900 192
|
|
polarize 194 1.3340 0.3900 192 195 196
|
|
polarize 195 0.4960 0.3900 194
|
|
polarize 196 1.3340 0.3900 194 197
|
|
polarize 197 0.4960 0.3900 196
|
|
polarize 198 1.3340 0.3900 199 200
|
|
polarize 199 0.4960 0.3900 198
|
|
polarize 200 1.0730 0.3900 198 201
|
|
polarize 201 0.4960 0.3900 200
|
|
polarize 202 1.3340 0.3900 203 204
|
|
polarize 203 0.4960 0.3900 202
|
|
polarize 204 1.3340 0.3900 202 205 206
|
|
polarize 205 0.4960 0.3900 204
|
|
polarize 206 1.3340 0.3900 204 207
|
|
polarize 207 0.4960 0.3900 206
|
|
polarize 208 1.0730 0.3900 209 210
|
|
polarize 209 0.4960 0.3900 208
|
|
polarize 210 1.3340 0.3900 208 211
|
|
polarize 211 1.0730 0.3900 210 212
|
|
polarize 212 0.4960 0.3900 211
|
|
polarize 213 1.3340 0.3900 214 215
|
|
polarize 214 0.4960 0.3900 213
|
|
polarize 215 1.3340 0.3900 213 216
|
|
polarize 216 0.4960 0.3900 215
|
|
polarize 217 1.3340 0.3900 218 219
|
|
polarize 218 0.4960 0.3900 217
|
|
polarize 219 1.0730 0.3900 217 220
|
|
polarize 220 0.4960 0.3900 219
|
|
polarize 221 1.3340 0.3900 222
|
|
polarize 222 0.4960 0.3900 221
|
|
polarize 223 1.3340 0.3900 1 7 50 224
|
|
polarize 224 0.8370 0.3900 223
|
|
polarize 225 1.0730 0.3900 3 9 52 226 242
|
|
polarize 226 0.4960 0.3900 225
|
|
polarize 227 1.0730 0.3900 3 9 52 228 242
|
|
polarize 228 0.4960 0.3900 227
|
|
polarize 229 1.3340 0.3900 230
|
|
polarize 230 0.4960 0.3900 229
|
|
polarize 231 1.0730 0.3900 232
|
|
polarize 232 0.4960 0.3900 231
|
|
polarize 233 1.3340 0.3900 234
|
|
polarize 234 0.8370 0.3900 233
|
|
polarize 235 1.3340 0.3900 236 237
|
|
polarize 236 0.8370 0.3900 235
|
|
polarize 237 0.8370 0.3900 235 238
|
|
polarize 238 0.4960 0.3900 237
|
|
polarize 239 1.0730 0.3900 240
|
|
polarize 240 0.4960 0.3900 239
|
|
polarize 241 1.3340 0.3900 244
|
|
polarize 242 1.3340 0.3900 1 7 50 225 227 243
|
|
polarize 243 0.8370 0.3900 242
|
|
polarize 244 0.4960 0.3900 241
|
|
polarize 245 1.3340 0.3900 246
|
|
polarize 246 0.4960 0.3900 245
|
|
polarize 247 1.7500 0.3900 250 251 252 256
|
|
polarize 248 1.7500 0.3900 251 252 255 258
|
|
polarize 249 2.2500 0.3900 250 253 257
|
|
polarize 250 2.2500 0.3900 247 249 255
|
|
polarize 251 1.0730 0.3900 247 248
|
|
polarize 252 1.0730 0.3900 247 248
|
|
polarize 253 1.4500 0.3900 249 260
|
|
polarize 254 1.7500 0.3900 256 257 259
|
|
polarize 255 1.4500 0.3900 248 250
|
|
polarize 256 1.4500 0.3900 247 254
|
|
polarize 257 1.4500 0.3900 249 254
|
|
polarize 258 0.6960 0.3900 248
|
|
polarize 259 0.6960 0.3900 254
|
|
polarize 260 0.6960 0.3900 253
|
|
polarize 261 1.0730 0.3900 265 266
|
|
polarize 262 1.0730 0.3900 265 266
|
|
polarize 263 1.7500 0.3900 265 267 269
|
|
polarize 264 1.4500 0.3900 267 272
|
|
polarize 265 1.7500 0.3900 261 262 263 271
|
|
polarize 266 1.7500 0.3900 261 262 268 270
|
|
polarize 267 1.7500 0.3900 263 264 268
|
|
polarize 268 1.4500 0.3900 266 267
|
|
polarize 269 0.6960 0.3900 263
|
|
polarize 270 1.3000 0.3900 266
|
|
polarize 271 0.6960 0.3900 265
|
|
polarize 272 0.6960 0.3900 264
|
|
polarize 273 1.7500 0.3900 277 278 283
|
|
polarize 274 1.7500 0.3900 277 279 285
|
|
polarize 275 2.2500 0.3900 279 280 281 283
|
|
polarize 276 1.7500 0.3900 280 281 282 286
|
|
polarize 277 1.0730 0.3900 273 274 284
|
|
polarize 278 1.4500 0.3900 273 287
|
|
polarize 279 2.2500 0.3900 274 275 282
|
|
polarize 280 1.0730 0.3900 275 276
|
|
polarize 281 1.0730 0.3900 275 276
|
|
polarize 282 1.4500 0.3900 276 279
|
|
polarize 283 1.4500 0.3900 273 275
|
|
polarize 284 0.4960 0.3900 277
|
|
polarize 285 1.3000 0.3900 274
|
|
polarize 286 0.6960 0.3900 276
|
|
polarize 287 0.6960 0.3900 278
|
|
polarize 288 1.3340 0.3900 289 295
|
|
polarize 289 1.7500 0.3900 288 290 291
|
|
polarize 290 1.7500 0.3900 289 293 298
|
|
polarize 291 1.7500 0.3900 289 292 297
|
|
polarize 292 1.0730 0.3900 291 294
|
|
polarize 293 1.0730 0.3900 290 294 299
|
|
polarize 294 1.7500 0.3900 292 293 296
|
|
polarize 295 0.4960 0.3900 288
|
|
polarize 296 1.3000 0.3900 294
|
|
polarize 297 0.6960 0.3900 291
|
|
polarize 298 1.3000 0.3900 290
|
|
polarize 299 0.4960 0.3900 293
|
|
polarize 300 1.7500 0.3900 303 304 308
|
|
polarize 301 1.7500 0.3900 304 305 310
|
|
polarize 302 1.7500 0.3900 303 305 309
|
|
polarize 303 1.0730 0.3900 300 302 306
|
|
polarize 304 1.0730 0.3900 300 301
|
|
polarize 305 1.7500 0.3900 301 302 307
|
|
polarize 306 0.4960 0.3900 303
|
|
polarize 307 0.6960 0.3900 305
|
|
polarize 308 1.3000 0.3900 300
|
|
polarize 309 1.3000 0.3900 302
|
|
polarize 310 0.6960 0.3900 301
|
|
polarize 311 0.8370 0.3900 312 314
|
|
polarize 312 1.3340 0.3900 311 313
|
|
polarize 313 0.4960 0.3900 312
|
|
polarize 314 1.3340 0.3900 311 315
|
|
polarize 315 0.4960 0.3900 314
|
|
polarize 316 1.3340 0.3900 317 320
|
|
polarize 317 0.4960 0.3900 316
|
|
polarize 318 1.3340 0.3900 319 322 346
|
|
polarize 319 0.4960 0.3900 318
|
|
polarize 320 0.8370 0.3900 316 321
|
|
polarize 321 0.4960 0.3900 320
|
|
polarize 322 0.8370 0.3900 318 343
|
|
polarize 323 0.4960 0.3900 346
|
|
polarize 324 1.3340 0.3900 325 326 345
|
|
polarize 325 0.4960 0.3900 324
|
|
polarize 326 0.8370 0.3900 324 343
|
|
polarize 327 0.4960 0.3900 345
|
|
polarize 328 1.3340 0.3900 332 336
|
|
polarize 329 1.3340 0.3900 335 338 347
|
|
polarize 330 1.3340 0.3900 333
|
|
polarize 331 1.3340 0.3900 332 334
|
|
polarize 332 0.8370 0.3900 328 331
|
|
polarize 333 0.4960 0.3900 330
|
|
polarize 334 0.4960 0.3900 331
|
|
polarize 335 0.4960 0.3900 329
|
|
polarize 336 0.4960 0.3900 328
|
|
polarize 337 1.3340 0.3900 340 341 348
|
|
polarize 338 0.8370 0.3900 329 343
|
|
polarize 339 0.4960 0.3900 347
|
|
polarize 340 0.4960 0.3900 337
|
|
polarize 341 0.8370 0.3900 337 343
|
|
polarize 342 0.4960 0.3900 348
|
|
polarize 343 1.7880 0.3900 322 326 338 341 344
|
|
polarize 344 1.7240 0.3900 343
|
|
polarize 345 0.8370 0.3900 324 327
|
|
polarize 346 0.8370 0.3900 318 323
|
|
polarize 347 0.8370 0.3900 329 339
|
|
polarize 348 0.8370 0.3900 337 342
|
|
polarize 349 0.8370 0.3900 350
|
|
polarize 350 0.4960 0.3900 349
|
|
polarize 351 0.0280 0.3900
|
|
polarize 352 0.1200 0.3900
|
|
polarize 353 0.7800 0.3900
|
|
polarize 354 1.3500 0.3900
|
|
polarize 355 2.2600 0.3900
|
|
polarize 356 0.0100 0.0650
|
|
polarize 357 0.0800 0.1150
|
|
polarize 358 0.5500 0.1800
|
|
polarize 359 0.8200 0.1650
|
|
polarize 360 1.5100 0.3000
|
|
polarize 361 0.2600 0.2096
|
|
polarize 362 1.3500 0.3900
|
|
polarize 363 4.0000 0.3900
|
|
polarize 364 5.6500 0.3900
|
|
polarize 365 7.2500 0.3900
|
|
|
|
|
|
######################################
|
|
## ##
|
|
## Polarizability Pair Parameters ##
|
|
## ##
|
|
######################################
|
|
|
|
|
|
polpair 49 361 0.2840
|
|
polpair 88 361 0.2080
|
|
polpair 140 361 0.2470
|
|
polpair 158 361 0.2470
|
|
polpair 190 361 0.2010
|
|
polpair 219 361 0.2010
|
|
|
|
|
|
#####################################
|
|
## ##
|
|
## Implicit Solvation Parameters ##
|
|
## ##
|
|
#####################################
|
|
|
|
|
|
solute 1 2.8836 2.9900 3.2180 0.1350
|
|
solute 2 3.3025 2.8540 4.9016 0.1350
|
|
solute 3 4.2668 3.7760 3.8331 0.1350
|
|
solute 4 3.6491 3.4040 2.9894 0.1350
|
|
solute 5 2.9835 3.3560 3.3000 0.1350
|
|
solute 6 3.0352 2.6860 3.3152 0.1350
|
|
solute 7 2.8836 2.9900 3.2180 0.1350
|
|
solute 8 3.3025 2.8540 4.9016 0.1350
|
|
solute 9 4.2668 3.7760 3.8331 0.1350
|
|
solute 10 3.6491 3.4040 2.9894 0.1350
|
|
solute 11 2.9835 3.3560 3.3000 0.1350
|
|
solute 12 3.0556 2.9960 4.0320 0.1350
|
|
solute 13 3.5062 3.3090 4.5360 0.1350
|
|
solute 14 3.1430 3.3740 4.1440 0.1350
|
|
solute 15 3.3967 3.2550 4.7385 0.1350
|
|
solute 16 2.9089 2.8360 3.5214 0.1350
|
|
solute 17 3.5062 3.3090 4.5360 0.1350
|
|
solute 18 3.1430 3.3740 4.1440 0.1350
|
|
solute 19 3.3025 2.8540 4.9016 0.1350
|
|
solute 20 3.0205 3.8850 4.0505 0.1350
|
|
solute 21 3.3967 3.2550 4.7385 0.1350
|
|
solute 22 2.9089 2.8360 3.5214 0.1350
|
|
solute 23 3.5062 3.3090 4.5360 0.1350
|
|
solute 24 3.1430 3.3740 4.1440 0.1350
|
|
solute 25 3.3967 3.2550 4.7385 0.1350
|
|
solute 26 2.9089 2.8360 3.5214 0.1350
|
|
solute 27 3.3025 2.8540 4.9016 0.1350
|
|
solute 28 3.0205 3.8850 4.0505 0.1350
|
|
solute 29 3.5062 3.3090 4.5360 0.1350
|
|
solute 30 3.1430 3.3740 4.1440 0.1350
|
|
solute 31 3.5062 3.3090 4.5360 0.1350
|
|
solute 32 3.1430 3.3740 4.1440 0.1350
|
|
solute 33 3.3025 2.8540 4.9016 0.1350
|
|
solute 34 3.6491 3.4040 2.9894 0.1350
|
|
solute 35 3.1684 3.1340 3.0999 0.1350
|
|
solute 36 2.6533 3.3920 2.9044 0.1350
|
|
solute 37 3.3967 3.2550 4.7385 0.1350
|
|
solute 38 3.6491 3.4040 2.9894 0.1350
|
|
solute 39 3.1684 3.1340 3.0999 0.1350
|
|
solute 40 2.6533 3.3920 2.9044 0.1350
|
|
solute 41 3.5062 3.3090 4.5360 0.1350
|
|
solute 42 3.1430 3.3740 4.1440 0.1350
|
|
solute 43 3.3967 3.2550 4.7385 0.1350
|
|
solute 44 2.6533 3.3920 2.9044 0.1350
|
|
solute 45 4.4346 4.1940 4.5431 0.1350
|
|
solute 46 2.9958 2.9280 3.3559 0.1350
|
|
solute 47 4.4346 4.1940 4.5431 0.1350
|
|
solute 48 3.3025 2.8540 4.9016 0.1350
|
|
solute 49 3.6946 3.6500 3.6351 0.1350
|
|
solute 50 2.8836 2.9900 3.2180 0.1350
|
|
solute 51 3.3967 3.2550 4.7385 0.1350
|
|
solute 52 4.2668 3.7760 3.8331 0.1350
|
|
solute 53 2.9835 3.3560 3.3000 0.1350
|
|
solute 54 3.0556 2.9960 4.0320 0.1350
|
|
solute 55 3.3025 2.8540 4.9016 0.1350
|
|
solute 56 3.9912 4.1440 3.8925 0.1350
|
|
solute 57 3.3025 2.8540 4.9016 0.1350
|
|
solute 58 3.9912 4.1440 3.8925 0.1350
|
|
solute 59 3.3025 2.8540 4.9016 0.1350
|
|
solute 60 3.0352 2.6860 3.3152 0.1350
|
|
solute 61 3.3025 2.8540 4.9016 0.1350
|
|
solute 62 3.0556 2.9960 4.0320 0.1350
|
|
solute 63 3.6909 3.7660 4.4258 0.1350
|
|
solute 64 3.8585 3.7660 3.8448 0.1350
|
|
solute 65 3.0020 2.6350 3.3763 0.1350
|
|
solute 66 3.8286 3.8930 4.5084 0.1350
|
|
solute 67 3.0020 2.6350 3.3763 0.1350
|
|
solute 68 3.8286 3.8930 4.5084 0.1350
|
|
solute 69 3.0020 2.6350 3.3763 0.1350
|
|
solute 70 3.3025 2.8540 4.9016 0.1350
|
|
solute 71 3.0556 2.9960 4.0320 0.1350
|
|
solute 72 3.6909 3.7660 4.4258 0.1350
|
|
solute 73 3.8585 3.7660 3.8448 0.1350
|
|
solute 74 3.0020 2.6350 3.3763 0.1350
|
|
solute 75 3.8585 3.7660 3.8448 0.1350
|
|
solute 76 3.0020 2.6350 3.3763 0.1350
|
|
solute 77 3.6909 3.7660 4.4258 0.1350
|
|
solute 78 3.1684 3.1340 3.0999 0.1350
|
|
solute 79 2.6533 3.3920 2.9044 0.1350
|
|
solute 80 3.3025 2.8540 4.9016 0.1350
|
|
solute 81 3.0556 2.9960 4.0320 0.1350
|
|
solute 82 3.6909 3.7660 4.4258 0.1350
|
|
solute 83 3.8585 3.7660 3.8448 0.1350
|
|
solute 84 3.0020 2.6350 3.3763 0.1350
|
|
solute 85 3.8585 3.7660 3.8448 0.1350
|
|
solute 86 3.0020 2.6350 3.3763 0.1350
|
|
solute 87 3.6909 3.7660 4.4258 0.1350
|
|
solute 88 2.6550 2.3880 2.6074 0.1350
|
|
solute 89 3.3025 2.8540 4.9016 0.1350
|
|
solute 90 3.0556 2.9960 4.0320 0.1350
|
|
solute 91 3.8286 3.8930 4.5084 0.1350
|
|
solute 92 3.8286 3.8930 4.5084 0.1350
|
|
solute 93 2.9059 2.6020 2.5726 0.1350
|
|
solute 94 3.8286 3.8930 4.5084 0.1350
|
|
solute 95 3.6017 4.0340 3.4613 0.1350
|
|
solute 96 2.9089 2.8360 3.5214 0.1350
|
|
solute 97 3.8286 3.8930 4.5084 0.1350
|
|
solute 98 3.8286 3.8930 4.5084 0.1350
|
|
solute 99 3.0020 2.6350 3.3763 0.1350
|
|
solute 100 3.8286 3.8930 4.5084 0.1350
|
|
solute 101 3.0020 2.6350 3.3763 0.1350
|
|
solute 102 3.8286 3.8930 4.5084 0.1350
|
|
solute 103 3.0020 2.6350 3.3763 0.1350
|
|
solute 104 3.8286 3.8930 4.5084 0.1350
|
|
solute 105 3.0020 2.6350 3.3763 0.1350
|
|
solute 106 3.3025 2.8540 4.9016 0.1350
|
|
solute 107 3.0556 2.9960 4.0320 0.1350
|
|
solute 108 3.8585 3.7660 3.8448 0.1350
|
|
solute 109 2.2260 4.7000 3.2588 0.1350
|
|
solute 110 3.6491 3.4040 2.9894 0.1350
|
|
solute 111 3.8585 3.7660 3.8448 0.1350
|
|
solute 112 2.9059 2.6020 2.5726 0.1350
|
|
solute 113 3.8585 3.7660 3.8448 0.1350
|
|
solute 114 2.9059 2.6020 2.5726 0.1350
|
|
solute 115 2.2260 4.7000 3.2588 0.1350
|
|
solute 116 3.6491 3.4040 2.9894 0.1350
|
|
solute 117 3.3025 2.8540 4.9016 0.1350
|
|
solute 118 3.0556 2.9960 4.0320 0.1350
|
|
solute 119 3.8585 3.7660 3.8448 0.1350
|
|
solute 120 3.6017 4.0340 3.4613 0.1350
|
|
solute 121 2.9089 2.8360 3.5214 0.1350
|
|
solute 122 3.8585 3.7660 3.8448 0.1350
|
|
solute 123 2.9059 2.6020 2.5726 0.1350
|
|
solute 124 3.8585 3.7660 3.8448 0.1350
|
|
solute 125 2.9059 2.6020 2.5726 0.1350
|
|
solute 126 3.6017 4.0340 3.4613 0.1350
|
|
solute 127 3.3025 2.8540 4.9016 0.1350
|
|
solute 128 3.0556 2.9960 4.0320 0.1350
|
|
solute 129 3.8585 3.7660 3.8448 0.1350
|
|
solute 130 3.6017 4.0340 3.4613 0.1350
|
|
solute 131 3.8585 3.7660 3.8448 0.1350
|
|
solute 132 2.9059 2.6020 2.5726 0.1350
|
|
solute 133 3.8585 3.7660 3.8448 0.1350
|
|
solute 134 2.9059 2.6020 2.5726 0.1350
|
|
solute 135 3.6017 4.0340 3.4613 0.1350
|
|
solute 136 2.9089 2.8360 3.5214 0.1350
|
|
solute 137 3.3025 2.8540 4.9016 0.1350
|
|
solute 138 3.0205 3.8850 4.0505 0.1350
|
|
solute 139 3.3967 3.2550 3.8200 0.1350
|
|
solute 140 3.0389 3.1560 3.5500 0.1350
|
|
solute 141 3.3025 2.8540 4.9016 0.1350
|
|
solute 142 3.0205 3.8850 4.0505 0.1350
|
|
solute 143 4.2668 3.7760 3.8331 0.1350
|
|
solute 144 2.9835 3.3560 3.3000 0.1350
|
|
solute 145 3.3991 2.8190 3.4050 0.1350
|
|
solute 146 2.5740 2.7580 2.9054 0.1350
|
|
solute 147 3.3025 2.8540 4.9016 0.1350
|
|
solute 148 3.0205 3.8850 4.0505 0.1350
|
|
solute 149 3.3967 3.2550 3.8200 0.1350
|
|
solute 150 2.9835 3.3560 3.3000 0.1350
|
|
solute 151 3.4243 3.4910 3.9000 0.1350
|
|
solute 152 2.9089 2.8360 3.5214 0.1350
|
|
solute 153 3.3025 2.8540 4.9016 0.1350
|
|
solute 154 3.0205 3.8850 4.0505 0.1350
|
|
solute 155 3.3025 2.8540 4.9016 0.1350
|
|
solute 156 3.0205 3.8850 4.0505 0.1350
|
|
solute 157 3.3967 3.2550 3.8200 0.1350
|
|
solute 158 3.0389 3.1560 3.5500 0.1350
|
|
solute 159 3.3025 2.8540 4.9016 0.1350
|
|
solute 160 3.0205 3.8850 4.0505 0.1350
|
|
solute 161 3.3025 2.8540 4.9016 0.1350
|
|
solute 162 3.0205 3.8850 4.0505 0.1350
|
|
solute 163 4.2668 3.7760 3.8331 0.1350
|
|
solute 164 2.9835 3.3560 3.3000 0.1350
|
|
solute 165 3.3991 2.8190 3.4050 0.1350
|
|
solute 166 2.5740 2.7580 2.9054 0.1350
|
|
solute 167 3.3025 2.8540 4.9016 0.1350
|
|
solute 168 3.0205 3.8850 4.0505 0.1350
|
|
solute 169 3.3025 2.8540 4.9016 0.1350
|
|
solute 170 3.0205 3.8850 4.0505 0.1350
|
|
solute 171 3.3967 3.2550 3.8200 0.1350
|
|
solute 172 2.9835 3.3560 3.3000 0.1350
|
|
solute 173 3.4243 3.4910 3.9000 0.1350
|
|
solute 174 2.9089 2.8360 3.5214 0.1350
|
|
solute 175 3.3025 2.8540 4.9016 0.1350
|
|
solute 176 3.0205 3.8850 4.0505 0.1350
|
|
solute 177 3.3967 3.2550 4.7385 0.1350
|
|
solute 178 2.6533 3.3920 2.9044 0.1350
|
|
solute 179 4.4346 4.1940 4.5431 0.1350
|
|
solute 180 3.3967 3.2550 4.7385 0.1350
|
|
solute 181 2.6533 3.3920 2.9044 0.1350
|
|
solute 182 3.3025 2.8540 4.9016 0.1350
|
|
solute 183 3.0205 3.8850 4.0505 0.1350
|
|
solute 184 3.3025 2.8540 4.9016 0.1350
|
|
solute 185 3.0205 3.8850 4.0505 0.1350
|
|
solute 186 3.3025 2.8540 4.9016 0.1350
|
|
solute 187 3.9912 4.1440 3.8925 0.1350
|
|
solute 188 3.3025 2.8540 4.9016 0.1350
|
|
solute 189 3.0352 2.6860 3.3152 0.1350
|
|
solute 190 2.2260 4.7000 3.2588 0.1350
|
|
solute 191 3.0352 2.6860 3.1370 0.1350
|
|
solute 192 3.3025 2.8540 4.9016 0.1350
|
|
solute 193 3.0205 3.8850 4.0505 0.1350
|
|
solute 194 3.3025 2.8540 4.9016 0.1350
|
|
solute 195 3.0205 3.8850 4.0505 0.1350
|
|
solute 196 3.3025 2.8540 4.9016 0.1350
|
|
solute 197 3.9912 4.1440 3.8925 0.1350
|
|
solute 198 3.3025 2.8540 4.9016 0.1350
|
|
solute 199 3.0352 2.6860 3.3152 0.1350
|
|
solute 200 2.8836 2.9900 3.2180 0.1350
|
|
solute 201 3.6491 3.4040 2.9894 0.1350
|
|
solute 202 3.3025 2.8540 4.9016 0.1350
|
|
solute 203 3.0205 3.8850 4.0505 0.1350
|
|
solute 204 3.3025 2.8540 4.9016 0.1350
|
|
solute 205 3.9912 4.1440 3.8925 0.1350
|
|
solute 206 3.3025 2.8540 4.9016 0.1350
|
|
solute 207 3.0352 2.6860 3.3152 0.1350
|
|
solute 208 2.2260 4.7000 3.2588 0.1350
|
|
solute 209 3.6491 3.4040 2.9894 0.1350
|
|
solute 210 2.9301 4.5060 4.2118 0.1350
|
|
solute 211 2.2260 4.7000 3.2588 0.1350
|
|
solute 212 2.9089 2.8360 3.4000 0.1350
|
|
solute 213 3.3025 2.8540 4.9016 0.1350
|
|
solute 214 3.0205 3.8850 4.0505 0.1350
|
|
solute 215 3.3025 2.8540 4.9016 0.1350
|
|
solute 216 3.9912 4.1440 3.8925 0.1350
|
|
solute 217 3.3025 2.8540 4.9016 0.1350
|
|
solute 218 3.0352 2.6860 3.3152 0.1350
|
|
solute 219 2.8836 2.9900 3.2180 0.1350
|
|
solute 220 3.6491 3.4040 2.9894 0.1350
|
|
solute 221 3.5062 3.3090 4.5360 0.1350
|
|
solute 222 2.9089 2.8360 3.5214 0.1350
|
|
solute 223 3.3967 3.2550 4.7385 0.1350
|
|
solute 224 2.9835 3.3560 2.9616 0.1350
|
|
solute 225 3.4243 3.4910 4.2676 0.1350
|
|
solute 226 2.9089 2.8360 3.5214 0.1350
|
|
solute 227 3.4243 3.4910 4.2676 0.1350
|
|
solute 228 2.9089 2.8360 3.5214 0.1350
|
|
solute 229 3.5062 3.3090 4.5360 0.1350
|
|
solute 230 2.2886 2.0030 2.6260 0.1350
|
|
solute 231 2.2260 4.7000 3.2588 0.1350
|
|
solute 232 3.0352 2.6860 3.3152 0.1350
|
|
solute 233 3.3967 3.2550 3.8200 0.1350
|
|
solute 234 3.0389 3.1560 3.5500 0.1350
|
|
solute 235 4.2668 3.7760 3.8331 0.1350
|
|
solute 236 2.9835 3.3560 3.3000 0.1350
|
|
solute 237 3.3991 2.8190 2.9337 0.1350
|
|
solute 238 2.5740 2.7580 2.9054 0.1350
|
|
solute 239 2.2260 4.7000 3.2588 0.1350
|
|
solute 240 3.0352 2.6860 3.3152 0.1350
|
|
solute 241 3.3967 3.2550 4.7385 0.1350
|
|
solute 242 4.2668 3.7760 3.8331 0.1350
|
|
solute 243 2.9835 3.3560 3.3000 0.1350
|
|
solute 244 3.0556 2.9960 4.0320 0.1350
|
|
solute 245 3.3025 2.8540 4.9016 0.1350
|
|
solute 246 3.0352 2.6860 3.3152 0.1350
|
|
solute 247 3.8585 3.7660 3.8448 0.0000
|
|
solute 248 3.8585 3.7660 3.8448 0.0000
|
|
solute 249 3.8585 3.7660 3.8448 0.0000
|
|
solute 250 3.8585 3.7660 3.8448 0.0000
|
|
solute 251 3.6017 4.0340 3.4613 0.0000
|
|
solute 252 3.6017 4.0340 3.4613 0.0000
|
|
solute 253 3.4243 3.4910 4.2676 0.0000
|
|
solute 254 3.8585 3.7660 3.8448 0.0000
|
|
solute 255 3.6017 4.0340 3.4613 0.0000
|
|
solute 256 3.6017 4.0340 3.4613 0.0000
|
|
solute 257 3.6017 4.0340 3.4613 0.0000
|
|
solute 258 2.9059 2.6020 2.5726 0.0000
|
|
solute 259 2.9059 2.6020 2.5726 0.0000
|
|
solute 260 2.9089 2.8360 3.5214 0.0000
|
|
solute 261 3.6017 4.0340 3.4613 0.0000
|
|
solute 262 3.6017 4.0340 3.4613 0.0000
|
|
solute 263 3.8585 3.7660 3.8448 0.0000
|
|
solute 264 3.4243 3.4910 4.2676 0.0000
|
|
solute 265 3.8585 3.7660 3.8448 0.0000
|
|
solute 266 3.8585 3.7660 3.8448 0.0000
|
|
solute 267 3.8585 3.7660 3.8448 0.0000
|
|
solute 268 3.6017 4.0340 3.4613 0.0000
|
|
solute 269 3.0020 2.6350 3.3763 0.0000
|
|
solute 270 2.9835 3.3560 2.9616 0.0000
|
|
solute 271 2.9059 2.6020 2.5726 0.0000
|
|
solute 272 2.9089 2.8360 3.5214 0.0000
|
|
solute 273 3.8585 3.7660 3.8448 0.0000
|
|
solute 274 3.8585 3.7660 3.8448 0.0000
|
|
solute 275 3.8585 3.7660 3.8448 0.0000
|
|
solute 276 3.8585 3.7660 3.8448 0.0000
|
|
solute 277 3.6017 4.0340 3.4613 0.0000
|
|
solute 278 3.4243 3.4910 4.2676 0.0000
|
|
solute 279 3.8585 3.7660 3.8448 0.0000
|
|
solute 280 3.6017 4.0340 3.4613 0.0000
|
|
solute 281 3.6017 4.0340 3.4613 0.0000
|
|
solute 282 3.6017 4.0340 3.4613 0.0000
|
|
solute 283 3.6017 4.0340 3.4613 0.0000
|
|
solute 284 2.9089 2.8360 3.5214 0.0000
|
|
solute 285 2.9835 3.3560 2.9616 0.0000
|
|
solute 286 2.9059 2.6020 2.5726 0.0000
|
|
solute 287 2.9089 2.8360 3.5214 0.0000
|
|
solute 288 3.5062 3.3090 4.5360 0.0000
|
|
solute 289 3.8585 3.7660 3.8448 0.0000
|
|
solute 290 3.8585 3.7660 3.8448 0.0000
|
|
solute 291 3.8585 3.7660 3.8448 0.0000
|
|
solute 292 3.6017 4.0340 3.4613 0.0000
|
|
solute 293 3.6017 4.0340 3.4613 0.0000
|
|
solute 294 3.8585 3.7660 3.8448 0.0000
|
|
solute 295 3.0556 2.9960 4.0320 0.0000
|
|
solute 296 2.9835 3.3560 2.9616 0.0000
|
|
solute 297 2.9059 2.6020 2.5726 0.0000
|
|
solute 298 2.9835 3.3560 2.9616 0.0000
|
|
solute 299 2.9089 2.8360 3.5214 0.0000
|
|
solute 300 3.8585 3.7660 3.8448 0.0000
|
|
solute 301 3.8585 3.7660 3.8448 0.0000
|
|
solute 302 3.8585 3.7660 3.8448 0.0000
|
|
solute 303 3.6017 4.0340 3.4613 0.0000
|
|
solute 304 3.6017 4.0340 3.4613 0.0000
|
|
solute 305 3.8585 3.7660 3.8448 0.0000
|
|
solute 306 2.9089 2.8360 3.5214 0.0000
|
|
solute 307 3.0020 2.6350 3.3763 0.0000
|
|
solute 308 2.9835 3.3560 2.9616 0.0000
|
|
solute 309 2.9835 3.3560 2.9616 0.0000
|
|
solute 310 2.9059 2.6020 2.5726 0.0000
|
|
solute 311 3.1684 3.1340 3.0999 0.0000
|
|
solute 312 3.3967 3.2550 4.7385 0.0000
|
|
solute 313 2.9089 2.8360 3.5214 0.0000
|
|
solute 314 3.3025 2.8540 4.9016 0.0000
|
|
solute 315 2.9089 2.8360 3.5214 0.0000
|
|
solute 316 3.3967 3.2550 4.7385 0.0000
|
|
solute 317 3.6491 3.4040 2.9894 0.0000
|
|
solute 318 3.3967 3.2550 4.7385 0.0000
|
|
solute 319 3.6491 3.4040 2.9894 0.0000
|
|
solute 320 3.1684 3.1340 3.0999 0.0000
|
|
solute 321 2.6533 3.3920 2.9044 0.0000
|
|
solute 322 3.1684 3.1340 3.0999 0.0000
|
|
solute 323 2.6533 3.3920 2.9044 0.0000
|
|
solute 324 3.3025 2.8540 4.9016 0.0000
|
|
solute 325 3.0205 3.8850 4.0505 0.0000
|
|
solute 326 3.1684 3.1340 3.0999 0.0000
|
|
solute 327 2.6533 3.3920 2.9044 0.0000
|
|
solute 328 3.3967 3.2550 4.7385 0.0000
|
|
solute 329 3.3967 3.2550 4.7385 0.0000
|
|
solute 330 3.3967 3.2550 4.7385 0.0000
|
|
solute 331 3.3025 2.8540 4.9016 0.0000
|
|
solute 332 3.1684 3.1340 3.0999 0.0000
|
|
solute 333 3.0205 3.8850 4.0505 0.0000
|
|
solute 334 2.9089 2.8360 3.5214 0.0000
|
|
solute 335 3.6491 3.4040 2.9894 0.0000
|
|
solute 336 2.9089 2.8360 3.5214 0.0000
|
|
solute 337 3.3025 2.8540 4.9016 0.0000
|
|
solute 338 3.1684 3.1340 3.0999 0.0000
|
|
solute 339 2.6533 3.3920 2.9044 0.0000
|
|
solute 340 3.0205 3.8850 4.0505 0.0000
|
|
solute 341 3.1684 3.1340 3.0999 0.0000
|
|
solute 342 2.6533 3.3920 2.9044 0.0000
|
|
solute 343 4.8697 4.3530 3.5816 0.0000
|
|
solute 344 2.8010 3.1280 2.7814 0.0000
|
|
solute 345 2.8010 3.1280 2.9814 0.0000
|
|
solute 346 2.8010 3.1280 2.9814 0.0000
|
|
solute 347 2.8010 3.1280 2.9814 0.0000
|
|
solute 348 2.8010 3.1280 2.9814 0.0000
|
|
solute 349 3.1243 2.9060 2.7947 0.0000
|
|
solute 350 2.5740 2.7580 2.9054 0.0000
|
|
solute 351 2.7880 2.7880 2.7687 0.1350
|
|
solute 352 3.5320 3.5320 3.5126 0.1350
|
|
solute 353 4.3060 4.3060 4.2867 0.1350
|
|
solute 354 4.6200 4.6200 4.6004 0.1350
|
|
solute 355 4.9980 4.9980 4.9784 0.1350
|
|
solute 356 1.8800 1.8800 1.8800 0.1350
|
|
solute 357 3.0150 3.0150 3.0003 0.1350
|
|
solute 358 3.6670 3.6670 3.6497 0.1350
|
|
solute 359 3.8700 3.8700 3.8700 0.1350
|
|
solute 360 4.2000 4.2000 4.2000 0.1350
|
|
solute 361 2.8100 2.8100 2.7946 0.1350
|
|
solute 362 2.7710 2.7710 2.7566 0.1350
|
|
solute 363 3.7200 3.7200 3.7033 0.1350
|
|
solute 364 4.0210 4.0210 4.0053 0.1350
|
|
solute 365 4.4960 4.4960 4.4822 0.1350
|
|
|
|
|
|
########################################
|
|
## ##
|
|
## 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" 27
|
|
biotype 50 HG1 "Isoleucine" 28
|
|
biotype 51 CG2 "Isoleucine" 29
|
|
biotype 52 HG2 "Isoleucine" 30
|
|
biotype 53 CD "Isoleucine" 31
|
|
biotype 54 HD "Isoleucine" 32
|
|
biotype 55 N "Serine" 7
|
|
biotype 56 CA "Serine" 8
|
|
biotype 57 C "Serine" 9
|
|
biotype 58 HN "Serine" 10
|
|
biotype 59 O "Serine" 11
|
|
biotype 60 HA "Serine" 12
|
|
biotype 61 CB "Serine" 33
|
|
biotype 62 HB "Serine" 34
|
|
biotype 63 OG "Serine" 35
|
|
biotype 64 HG "Serine" 36
|
|
biotype 65 N "Threonine" 7
|
|
biotype 66 CA "Threonine" 8
|
|
biotype 67 C "Threonine" 9
|
|
biotype 68 HN "Threonine" 10
|
|
biotype 69 O "Threonine" 11
|
|
biotype 70 HA "Threonine" 12
|
|
biotype 71 CB "Threonine" 37
|
|
biotype 72 HB "Threonine" 38
|
|
biotype 73 OG1 "Threonine" 39
|
|
biotype 74 HG1 "Threonine" 40
|
|
biotype 75 CG2 "Threonine" 41
|
|
biotype 76 HG2 "Threonine" 42
|
|
biotype 77 N "Cysteine (SH)" 7
|
|
biotype 78 CA "Cysteine (SH)" 8
|
|
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)" 43
|
|
biotype 84 HB "Cysteine (SH)" 44
|
|
biotype 85 SG "Cysteine (SH)" 45
|
|
biotype 86 HG "Cysteine (SH)" 46
|
|
biotype 87 N "Cystine (SS)" 7
|
|
biotype 88 CA "Cystine (SS)" 8
|
|
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)" 43
|
|
biotype 94 HB "Cystine (SS)" 44
|
|
biotype 95 SG "Cystine (SS)" 47
|
|
biotype 96 N "Cysteine (S-)" 7
|
|
biotype 97 CA "Cysteine (S-)" 48
|
|
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-)" 43
|
|
biotype 103 HB "Cysteine (S-)" 44
|
|
biotype 104 SG "Cysteine (S-)" 49
|
|
biotype 105 N "Proline" 50
|
|
biotype 106 CA "Proline" 51
|
|
biotype 107 C "Proline" 52
|
|
biotype 108 O "Proline" 53
|
|
biotype 109 HA "Proline" 54
|
|
biotype 110 CB "Proline" 55
|
|
biotype 111 HB "Proline" 56
|
|
biotype 112 CG "Proline" 57
|
|
biotype 113 HG "Proline" 58
|
|
biotype 114 CD "Proline" 59
|
|
biotype 115 HD "Proline" 60
|
|
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" 61
|
|
biotype 123 HB "Phenylalanine" 62
|
|
biotype 124 CG "Phenylalanine" 63
|
|
biotype 125 CD "Phenylalanine" 64
|
|
biotype 126 HD "Phenylalanine" 65
|
|
biotype 127 CE "Phenylalanine" 66
|
|
biotype 128 HE "Phenylalanine" 67
|
|
biotype 129 CZ "Phenylalanine" 68
|
|
biotype 130 HZ "Phenylalanine" 69
|
|
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" 70
|
|
biotype 138 HB "Tyrosine" 71
|
|
biotype 139 CG "Tyrosine" 72
|
|
biotype 140 CD "Tyrosine" 73
|
|
biotype 141 HD "Tyrosine" 74
|
|
biotype 142 CE "Tyrosine" 75
|
|
biotype 143 HE "Tyrosine" 76
|
|
biotype 144 CZ "Tyrosine" 77
|
|
biotype 145 OH "Tyrosine" 78
|
|
biotype 146 HH "Tyrosine" 79
|
|
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-)" 80
|
|
biotype 154 HB "Tyrosine (O-)" 81
|
|
biotype 155 CG "Tyrosine (O-)" 82
|
|
biotype 156 CD "Tyrosine (O-)" 83
|
|
biotype 157 HD "Tyrosine (O-)" 84
|
|
biotype 158 CE "Tyrosine (O-)" 85
|
|
biotype 159 HE "Tyrosine (O-)" 86
|
|
biotype 160 CZ "Tyrosine (O-)" 87
|
|
biotype 161 OH "Tyrosine (O-)" 88
|
|
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" 89
|
|
biotype 169 HB "Tryptophan" 90
|
|
biotype 170 CG "Tryptophan" 91
|
|
biotype 171 CD1 "Tryptophan" 92
|
|
biotype 172 HD1 "Tryptophan" 93
|
|
biotype 173 CD2 "Tryptophan" 94
|
|
biotype 174 NE1 "Tryptophan" 95
|
|
biotype 175 HE1 "Tryptophan" 96
|
|
biotype 176 CE2 "Tryptophan" 97
|
|
biotype 177 CE3 "Tryptophan" 98
|
|
biotype 178 HE3 "Tryptophan" 99
|
|
biotype 179 CZ2 "Tryptophan" 100
|
|
biotype 180 HZ2 "Tryptophan" 101
|
|
biotype 181 CZ3 "Tryptophan" 102
|
|
biotype 182 HZ3 "Tryptophan" 103
|
|
biotype 183 CH2 "Tryptophan" 104
|
|
biotype 184 HH2 "Tryptophan" 105
|
|
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 (+)" 106
|
|
biotype 192 HB "Histidine (+)" 107
|
|
biotype 193 CG "Histidine (+)" 108
|
|
biotype 194 ND1 "Histidine (+)" 109
|
|
biotype 195 HD1 "Histidine (+)" 110
|
|
biotype 196 CD2 "Histidine (+)" 111
|
|
biotype 197 HD2 "Histidine (+)" 112
|
|
biotype 198 CE1 "Histidine (+)" 113
|
|
biotype 199 HE1 "Histidine (+)" 114
|
|
biotype 200 NE2 "Histidine (+)" 115
|
|
biotype 201 HE2 "Histidine (+)" 116
|
|
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)" 117
|
|
biotype 209 HB "Histidine (HD)" 118
|
|
biotype 210 CG "Histidine (HD)" 119
|
|
biotype 211 ND1 "Histidine (HD)" 120
|
|
biotype 212 HD1 "Histidine (HD)" 121
|
|
biotype 213 CD2 "Histidine (HD)" 122
|
|
biotype 214 HD2 "Histidine (HD)" 123
|
|
biotype 215 CE1 "Histidine (HD)" 124
|
|
biotype 216 HE1 "Histidine (HD)" 125
|
|
biotype 217 NE2 "Histidine (HD)" 126
|
|
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)" 127
|
|
biotype 225 HB "Histidine (HE)" 128
|
|
biotype 226 CG "Histidine (HE)" 129
|
|
biotype 227 ND1 "Histidine (HE)" 130
|
|
biotype 228 CD2 "Histidine (HE)" 131
|
|
biotype 229 HD2 "Histidine (HE)" 132
|
|
biotype 230 CE1 "Histidine (HE)" 133
|
|
biotype 231 HE1 "Histidine (HE)" 134
|
|
biotype 232 NE2 "Histidine (HE)" 135
|
|
biotype 233 HE2 "Histidine (HE)" 136
|
|
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" 137
|
|
biotype 241 HB "Aspartic Acid" 138
|
|
biotype 242 CG "Aspartic Acid" 139
|
|
biotype 243 OD "Aspartic Acid" 140
|
|
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)" 141
|
|
biotype 251 HB "Aspartic Acid (COOH)" 142
|
|
biotype 252 CG "Aspartic Acid (COOH)" 143
|
|
biotype 253 OD1 "Aspartic Acid (COOH)" 144
|
|
biotype 254 OD2 "Aspartic Acid (COOH)" 145
|
|
biotype 255 HD2 "Aspartic Acid (COOH)" 146
|
|
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" 147
|
|
biotype 263 HB "Asparagine" 148
|
|
biotype 264 CG "Asparagine" 149
|
|
biotype 265 OD1 "Asparagine" 150
|
|
biotype 266 ND2 "Asparagine" 151
|
|
biotype 267 HD2 "Asparagine" 152
|
|
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" 153
|
|
biotype 275 HB "Glutamic Acid" 154
|
|
biotype 276 CG "Glutamic Acid" 155
|
|
biotype 277 HG "Glutamic Acid" 156
|
|
biotype 278 CD "Glutamic Acid" 157
|
|
biotype 279 OE "Glutamic Acid" 158
|
|
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)" 159
|
|
biotype 287 HB "Glutamic Acid (COOH)" 160
|
|
biotype 288 CG "Glutamic Acid (COOH)" 161
|
|
biotype 289 HG "Glutamic Acid (COOH)" 162
|
|
biotype 290 CD "Glutamic Acid (COOH)" 163
|
|
biotype 291 OE1 "Glutamic Acid (COOH)" 164
|
|
biotype 292 OE2 "Glutamic Acid (COOH)" 165
|
|
biotype 293 HE2 "Glutamic Acid (COOH)" 166
|
|
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" 167
|
|
biotype 301 HB "Glutamine" 168
|
|
biotype 302 CG "Glutamine" 169
|
|
biotype 303 HG "Glutamine" 170
|
|
biotype 304 CD "Glutamine" 171
|
|
biotype 305 OE1 "Glutamine" 172
|
|
biotype 306 NE2 "Glutamine" 173
|
|
biotype 307 HE2 "Glutamine" 174
|
|
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" 175
|
|
biotype 315 HB "Methionine" 176
|
|
biotype 316 CG "Methionine" 177
|
|
biotype 317 HG "Methionine" 178
|
|
biotype 318 SD "Methionine" 179
|
|
biotype 319 CE "Methionine" 180
|
|
biotype 320 HE "Methionine" 181
|
|
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" 182
|
|
biotype 328 HB "Lysine" 183
|
|
biotype 329 CG "Lysine" 184
|
|
biotype 330 HG "Lysine" 185
|
|
biotype 331 CD "Lysine" 186
|
|
biotype 332 HD "Lysine" 187
|
|
biotype 333 CE "Lysine" 188
|
|
biotype 334 HE "Lysine" 189
|
|
biotype 335 NZ "Lysine" 190
|
|
biotype 336 HZ "Lysine" 191
|
|
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)" 192
|
|
biotype 344 HB "Lysine (NH2)" 193
|
|
biotype 345 CG "Lysine (NH2)" 194
|
|
biotype 346 HG "Lysine (NH2)" 195
|
|
biotype 347 CD "Lysine (NH2)" 196
|
|
biotype 348 HD "Lysine (NH2)" 197
|
|
biotype 349 CE "Lysine (NH2)" 198
|
|
biotype 350 HE "Lysine (NH2)" 199
|
|
biotype 351 NZ "Lysine (NH2)" 200
|
|
biotype 352 HZ "Lysine (NH2)" 201
|
|
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" 202
|
|
biotype 360 HB "Arginine" 203
|
|
biotype 361 CG "Arginine" 204
|
|
biotype 362 HG "Arginine" 205
|
|
biotype 363 CD "Arginine" 206
|
|
biotype 364 HD "Arginine" 207
|
|
biotype 365 NE "Arginine" 208
|
|
biotype 366 HE "Arginine" 209
|
|
biotype 367 CZ "Arginine" 210
|
|
biotype 368 NH "Arginine" 211
|
|
biotype 369 HH "Arginine" 212
|
|
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" 213
|
|
biotype 377 HB "Ornithine" 214
|
|
biotype 378 CG "Ornithine" 215
|
|
biotype 379 HG "Ornithine" 216
|
|
biotype 380 CD "Ornithine" 217
|
|
biotype 381 HD "Ornithine" 218
|
|
biotype 382 NE "Ornithine" 219
|
|
biotype 383 HE "Ornithine" 220
|
|
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" 231
|
|
biotype 404 CA "N-Terminal GLY" 2
|
|
biotype 405 C "N-Terminal GLY" 3
|
|
biotype 406 HN "N-Terminal GLY" 232
|
|
biotype 407 O "N-Terminal GLY" 5
|
|
biotype 408 HA "N-Terminal GLY" 6
|
|
biotype 409 N "N-Terminal ALA" 231
|
|
biotype 410 CA "N-Terminal ALA" 8
|
|
biotype 411 C "N-Terminal ALA" 9
|
|
biotype 412 HN "N-Terminal ALA" 232
|
|
biotype 413 O "N-Terminal ALA" 11
|
|
biotype 414 HA "N-Terminal ALA" 12
|
|
biotype 415 N "N-Terminal VAL" 231
|
|
biotype 416 CA "N-Terminal VAL" 8
|
|
biotype 417 C "N-Terminal VAL" 9
|
|
biotype 418 HN "N-Terminal VAL" 232
|
|
biotype 419 O "N-Terminal VAL" 11
|
|
biotype 420 HA "N-Terminal VAL" 12
|
|
biotype 421 N "N-Terminal LEU" 231
|
|
biotype 422 CA "N-Terminal LEU" 8
|
|
biotype 423 C "N-Terminal LEU" 9
|
|
biotype 424 HN "N-Terminal LEU" 232
|
|
biotype 425 O "N-Terminal LEU" 11
|
|
biotype 426 HA "N-Terminal LEU" 12
|
|
biotype 427 N "N-Terminal ILE" 231
|
|
biotype 428 CA "N-Terminal ILE" 8
|
|
biotype 429 C "N-Terminal ILE" 9
|
|
biotype 430 HN "N-Terminal ILE" 232
|
|
biotype 431 O "N-Terminal ILE" 11
|
|
biotype 432 HA "N-Terminal ILE" 12
|
|
biotype 433 N "N-Terminal SER" 231
|
|
biotype 434 CA "N-Terminal SER" 8
|
|
biotype 435 C "N-Terminal SER" 9
|
|
biotype 436 HN "N-Terminal SER" 232
|
|
biotype 437 O "N-Terminal SER" 11
|
|
biotype 438 HA "N-Terminal SER" 12
|
|
biotype 439 N "N-Terminal THR" 231
|
|
biotype 440 CA "N-Terminal THR" 8
|
|
biotype 441 C "N-Terminal THR" 9
|
|
biotype 442 HN "N-Terminal THR" 232
|
|
biotype 443 O "N-Terminal THR" 11
|
|
biotype 444 HA "N-Terminal THR" 12
|
|
biotype 445 N "N-Terminal CYS (SH)" 231
|
|
biotype 446 CA "N-Terminal CYS (SH)" 8
|
|
biotype 447 C "N-Terminal CYS (SH)" 9
|
|
biotype 448 HN "N-Terminal CYS (SH)" 232
|
|
biotype 449 O "N-Terminal CYS (SH)" 11
|
|
biotype 450 HA "N-Terminal CYS (SH)" 12
|
|
biotype 451 N "N-Terminal CYX (SS)" 231
|
|
biotype 452 CA "N-Terminal CYX (SS)" 8
|
|
biotype 453 C "N-Terminal CYX (SS)" 9
|
|
biotype 454 HN "N-Terminal CYX (SS)" 232
|
|
biotype 455 O "N-Terminal CYX (SS)" 11
|
|
biotype 456 HA "N-Terminal CYX (SS)" 12
|
|
biotype 457 N "N-Terminal CYD (S-)" 231
|
|
biotype 458 CA "N-Terminal CYD (S-)" 48
|
|
biotype 459 C "N-Terminal CYD (S-)" 9
|
|
biotype 460 HN "N-Terminal CYD (S-)" 232
|
|
biotype 461 O "N-Terminal CYD (S-)" 11
|
|
biotype 462 HA "N-Terminal CYD (S-)" 12
|
|
biotype 463 N "N-Terminal PRO" 239
|
|
biotype 464 CA "N-Terminal PRO" 241
|
|
biotype 465 C "N-Terminal PRO" 242
|
|
biotype 466 HN "N-Terminal PRO" 240
|
|
biotype 467 O "N-Terminal PRO" 243
|
|
biotype 468 HA "N-Terminal PRO" 244
|
|
biotype 469 CD "N-Terminal PRO" 245
|
|
biotype 470 HD "N-Terminal PRO" 246
|
|
biotype 471 N "N-Terminal PHE" 231
|
|
biotype 472 CA "N-Terminal PHE" 8
|
|
biotype 473 C "N-Terminal PHE" 9
|
|
biotype 474 HN "N-Terminal PHE" 232
|
|
biotype 475 O "N-Terminal PHE" 11
|
|
biotype 476 HA "N-Terminal PHE" 12
|
|
biotype 477 N "N-Terminal TYR" 231
|
|
biotype 478 CA "N-Terminal TYR" 8
|
|
biotype 479 C "N-Terminal TYR" 9
|
|
biotype 480 HN "N-Terminal TYR" 232
|
|
biotype 481 O "N-Terminal TYR" 11
|
|
biotype 482 HA "N-Terminal TYR" 12
|
|
biotype 483 N "N-Terminal TYD (O-)" 231
|
|
biotype 484 CA "N-Terminal TYD (O-)" 8
|
|
biotype 485 C "N-Terminal TYD (O-)" 9
|
|
biotype 486 HN "N-Terminal TYD (O-)" 232
|
|
biotype 487 O "N-Terminal TYD (O-)" 11
|
|
biotype 488 HA "N-Terminal TYD (O-)" 12
|
|
biotype 489 N "N-Terminal TRP" 231
|
|
biotype 490 CA "N-Terminal TRP" 8
|
|
biotype 491 C "N-Terminal TRP" 9
|
|
biotype 492 HN "N-Terminal TRP" 232
|
|
biotype 493 O "N-Terminal TRP" 11
|
|
biotype 494 HA "N-Terminal TRP" 12
|
|
biotype 495 N "N-Terminal HIS (+)" 231
|
|
biotype 496 CA "N-Terminal HIS (+)" 8
|
|
biotype 497 C "N-Terminal HIS (+)" 9
|
|
biotype 498 HN "N-Terminal HIS (+)" 232
|
|
biotype 499 O "N-Terminal HIS (+)" 11
|
|
biotype 500 HA "N-Terminal HIS (+)" 12
|
|
biotype 501 N "N-Terminal HIS (HD)" 231
|
|
biotype 502 CA "N-Terminal HIS (HD)" 8
|
|
biotype 503 C "N-Terminal HIS (HD)" 9
|
|
biotype 504 HN "N-Terminal HIS (HD)" 232
|
|
biotype 505 O "N-Terminal HIS (HD)" 11
|
|
biotype 506 HA "N-Terminal HIS (HD)" 12
|
|
biotype 507 N "N-Terminal HIS (HE)" 231
|
|
biotype 508 CA "N-Terminal HIS (HE)" 8
|
|
biotype 509 C "N-Terminal HIS (HE)" 9
|
|
biotype 510 HN "N-Terminal HIS (HE)" 232
|
|
biotype 511 O "N-Terminal HIS (HE)" 11
|
|
biotype 512 HA "N-Terminal HIS (HE)" 12
|
|
biotype 513 N "N-Terminal ASP" 231
|
|
biotype 514 CA "N-Terminal ASP" 8
|
|
biotype 515 C "N-Terminal ASP" 9
|
|
biotype 516 HN "N-Terminal ASP" 232
|
|
biotype 517 O "N-Terminal ASP" 11
|
|
biotype 518 HA "N-Terminal ASP" 12
|
|
biotype 519 N "N-Terminal ASH (COOH)" 231
|
|
biotype 520 CA "N-Terminal ASH (COOH)" 8
|
|
biotype 521 C "N-Terminal ASH (COOH)" 9
|
|
biotype 522 HN "N-Terminal ASH (COOH)" 232
|
|
biotype 523 O "N-Terminal ASH (COOH)" 11
|
|
biotype 524 HA "N-Terminal ASH (COOH)" 12
|
|
biotype 525 N "N-Terminal ASN" 231
|
|
biotype 526 CA "N-Terminal ASN" 8
|
|
biotype 527 C "N-Terminal ASN" 9
|
|
biotype 528 HN "N-Terminal ASN" 232
|
|
biotype 529 O "N-Terminal ASN" 11
|
|
biotype 530 HA "N-Terminal ASN" 12
|
|
biotype 531 N "N-Terminal GLU" 231
|
|
biotype 532 CA "N-Terminal GLU" 8
|
|
biotype 533 C "N-Terminal GLU" 9
|
|
biotype 534 HN "N-Terminal GLU" 232
|
|
biotype 535 O "N-Terminal GLU" 11
|
|
biotype 536 HA "N-Terminal GLU" 12
|
|
biotype 537 N "N-Terminal GLH (COOH)" 231
|
|
biotype 538 CA "N-Terminal GLH (COOH)" 8
|
|
biotype 539 C "N-Terminal GLH (COOH)" 9
|
|
biotype 540 HN "N-Terminal GLH (COOH)" 232
|
|
biotype 541 O "N-Terminal GLH (COOH)" 11
|
|
biotype 542 HA "N-Terminal GLH (COOH)" 12
|
|
biotype 543 N "N-Terminal GLN" 231
|
|
biotype 544 CA "N-Terminal GLN" 8
|
|
biotype 545 C "N-Terminal GLN" 9
|
|
biotype 546 HN "N-Terminal GLN" 232
|
|
biotype 547 O "N-Terminal GLN" 11
|
|
biotype 548 HA "N-Terminal GLN" 12
|
|
biotype 549 N "N-Terminal MET" 231
|
|
biotype 550 CA "N-Terminal MET" 8
|
|
biotype 551 C "N-Terminal MET" 9
|
|
biotype 552 HN "N-Terminal MET" 232
|
|
biotype 553 O "N-Terminal MET" 11
|
|
biotype 554 HA "N-Terminal MET" 12
|
|
biotype 555 N "N-Terminal LYS" 231
|
|
biotype 556 CA "N-Terminal LYS" 8
|
|
biotype 557 C "N-Terminal LYS" 9
|
|
biotype 558 HN "N-Terminal LYS" 232
|
|
biotype 559 O "N-Terminal LYS" 11
|
|
biotype 560 HA "N-Terminal LYS" 12
|
|
biotype 561 N "N-Terminal LYD (NH2)" 231
|
|
biotype 562 CA "N-Terminal LYD (NH2)" 8
|
|
biotype 563 C "N-Terminal LYD (NH2)" 9
|
|
biotype 564 HN "N-Terminal LYD (NH2)" 232
|
|
biotype 565 O "N-Terminal LYD (NH2)" 11
|
|
biotype 566 HA "N-Terminal LYD (NH2)" 12
|
|
biotype 567 N "N-Terminal ARG" 231
|
|
biotype 568 CA "N-Terminal ARG" 8
|
|
biotype 569 C "N-Terminal ARG" 9
|
|
biotype 570 HN "N-Terminal ARG" 232
|
|
biotype 571 O "N-Terminal ARG" 11
|
|
biotype 572 HA "N-Terminal ARG" 12
|
|
biotype 573 N "N-Terminal ORN" 231
|
|
biotype 574 CA "N-Terminal ORN" 8
|
|
biotype 575 C "N-Terminal ORN" 9
|
|
biotype 576 HN "N-Terminal ORN" 232
|
|
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" 233
|
|
biotype 587 HN "C-Terminal GLY" 4
|
|
biotype 588 OXT "C-Terminal GLY" 234
|
|
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" 233
|
|
biotype 593 HN "C-Terminal ALA" 10
|
|
biotype 594 OXT "C-Terminal ALA" 234
|
|
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" 233
|
|
biotype 599 HN "C-Terminal VAL" 10
|
|
biotype 600 OXT "C-Terminal VAL" 234
|
|
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" 233
|
|
biotype 605 HN "C-Terminal LEU" 10
|
|
biotype 606 OXT "C-Terminal LEU" 234
|
|
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" 233
|
|
biotype 611 HN "C-Terminal ILE" 10
|
|
biotype 612 OXT "C-Terminal ILE" 234
|
|
biotype 613 HA "C-Terminal ILE" 12
|
|
biotype 614 N "C-Terminal SER" 7
|
|
biotype 615 CA "C-Terminal SER" 8
|
|
biotype 616 C "C-Terminal SER" 233
|
|
biotype 617 HN "C-Terminal SER" 10
|
|
biotype 618 OXT "C-Terminal SER" 234
|
|
biotype 619 HA "C-Terminal SER" 12
|
|
biotype 620 N "C-Terminal THR" 7
|
|
biotype 621 CA "C-Terminal THR" 8
|
|
biotype 622 C "C-Terminal THR" 233
|
|
biotype 623 HN "C-Terminal THR" 10
|
|
biotype 624 OXT "C-Terminal THR" 234
|
|
biotype 625 HA "C-Terminal THR" 12
|
|
biotype 626 N "C-Terminal CYS (SH)" 7
|
|
biotype 627 CA "C-Terminal CYS (SH)" 8
|
|
biotype 628 C "C-Terminal CYS (SH)" 233
|
|
biotype 629 HN "C-Terminal CYS (SH)" 10
|
|
biotype 630 OXT "C-Terminal CYS (SH)" 234
|
|
biotype 631 HA "C-Terminal CYS (SH)" 12
|
|
biotype 632 N "C-Terminal CYX (SS)" 7
|
|
biotype 633 CA "C-Terminal CYX (SS)" 8
|
|
biotype 634 C "C-Terminal CYX (SS)" 233
|
|
biotype 635 HN "C-Terminal CYX (SS)" 10
|
|
biotype 636 OXT "C-Terminal CYX (SS)" 234
|
|
biotype 637 HA "C-Terminal CYX (SS)" 12
|
|
biotype 638 N "C-Terminal CYD (S-)" 7
|
|
biotype 639 CA "C-Terminal CYD (S-)" 48
|
|
biotype 640 C "C-Terminal CYD (S-)" 233
|
|
biotype 641 HN "C-Terminal CYD (S-)" 10
|
|
biotype 642 OXT "C-Terminal CYD (S-)" 234
|
|
biotype 643 HA "C-Terminal CYD (S-)" 12
|
|
biotype 644 N "C-Terminal PRO" 50
|
|
biotype 645 CA "C-Terminal PRO" 51
|
|
biotype 646 C "C-Terminal PRO" 233
|
|
biotype 647 OXT "C-Terminal PRO" 234
|
|
biotype 648 HA "C-Terminal PRO" 54
|
|
biotype 649 N "C-Terminal PHE" 7
|
|
biotype 650 CA "C-Terminal PHE" 8
|
|
biotype 651 C "C-Terminal PHE" 233
|
|
biotype 652 HN "C-Terminal PHE" 10
|
|
biotype 653 OXT "C-Terminal PHE" 234
|
|
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" 233
|
|
biotype 658 HN "C-Terminal TYR" 10
|
|
biotype 659 OXT "C-Terminal TYR" 234
|
|
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-)" 233
|
|
biotype 664 HN "C-Terminal TYD (O-)" 10
|
|
biotype 665 OXT "C-Terminal TYD (O-)" 234
|
|
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" 233
|
|
biotype 670 HN "C-Terminal TRP" 10
|
|
biotype 671 OXT "C-Terminal TRP" 234
|
|
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 (+)" 233
|
|
biotype 676 HN "C-Terminal HIS (+)" 10
|
|
biotype 677 OXT "C-Terminal HIS (+)" 234
|
|
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)" 233
|
|
biotype 682 HN "C-Terminal HIS (HD)" 10
|
|
biotype 683 OXT "C-Terminal HIS (HD)" 234
|
|
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)" 233
|
|
biotype 688 HN "C-Terminal HIS (HE)" 10
|
|
biotype 689 OXT "C-Terminal HIS (HE)" 234
|
|
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" 233
|
|
biotype 694 HN "C-Terminal ASP" 10
|
|
biotype 695 OXT "C-Terminal ASP" 234
|
|
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)" 233
|
|
biotype 700 HN "C-Terminal ASH (COOH)" 10
|
|
biotype 701 OXT "C-Terminal ASH (COOH)" 234
|
|
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" 233
|
|
biotype 706 HN "C-Terminal ASN" 10
|
|
biotype 707 OXT "C-Terminal ASN" 234
|
|
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" 233
|
|
biotype 712 HN "C-Terminal GLU" 10
|
|
biotype 713 OXT "C-Terminal GLU" 234
|
|
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)" 233
|
|
biotype 718 HN "C-Terminal GLH (COOH)" 10
|
|
biotype 719 OXT "C-Terminal GLH (COOH)" 234
|
|
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" 233
|
|
biotype 724 HN "C-Terminal GLN" 10
|
|
biotype 725 OXT "C-Terminal GLN" 234
|
|
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" 233
|
|
biotype 730 HN "C-Terminal MET" 10
|
|
biotype 731 OXT "C-Terminal MET" 234
|
|
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" 233
|
|
biotype 736 HN "C-Terminal LYS" 10
|
|
biotype 737 OXT "C-Terminal LYS" 234
|
|
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)" 233
|
|
biotype 742 HN "C-Terminal LYD (NH2)" 10
|
|
biotype 743 OXT "C-Terminal LYD (NH2)" 234
|
|
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" 233
|
|
biotype 748 HN "C-Terminal ARG" 10
|
|
biotype 749 OXT "C-Terminal ARG" 234
|
|
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" 233
|
|
biotype 754 HN "C-Terminal ORN" 10
|
|
biotype 755 OXT "C-Terminal ORN" 234
|
|
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" -1
|
|
biotype 763 H "Deprotonated N-Terminus" -1
|
|
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" 221
|
|
biotype 768 H "Acetyl N-Terminus" 222
|
|
biotype 769 C "Acetyl N-Terminus" 223
|
|
biotype 770 O "Acetyl N-Terminus" 224
|
|
biotype 771 C "Protonated C-Terminus" 235
|
|
biotype 772 O "Protonated C-Terminus" 236
|
|
biotype 773 OH "Protonated C-Terminus" 237
|
|
biotype 774 HO "Protonated C-Terminus" 238
|
|
biotype 775 N "Amide C-Terminus" 225
|
|
biotype 776 HN "Amide C-Terminus" 226
|
|
biotype 777 N "N-MeAmide C-Terminus" 227
|
|
biotype 778 HN "N-MeAmide C-Terminus" 228
|
|
biotype 779 C "N-MeAmide C-Terminus" 229
|
|
biotype 780 H "N-MeAmide C-Terminus" 230
|
|
biotype 1001 O5* "Adenosine" 326
|
|
biotype 1002 C5* "Adenosine" 324
|
|
biotype 1003 H5* "Adenosine" 325
|
|
biotype 1004 H5* "Adenosine" 325
|
|
biotype 1005 C4* "Adenosine" 312
|
|
biotype 1006 H4* "Adenosine" 313
|
|
biotype 1007 O4* "Adenosine" 311
|
|
biotype 1008 C1* "Adenosine" 314
|
|
biotype 1009 H1* "Adenosine" 315
|
|
biotype 1010 C3* "Adenosine" 318
|
|
biotype 1011 H3* "Adenosine" 319
|
|
biotype 1012 C2* "Adenosine" 316
|
|
biotype 1013 H2* "Adenosine" 317
|
|
biotype 1014 O2* "Adenosine" 320
|
|
biotype 1015 HO* "Adenosine" 321
|
|
biotype 1016 O3* "Adenosine" 322
|
|
biotype 1017 N9 "Adenosine" 251
|
|
biotype 1018 C4 "Adenosine" 247
|
|
biotype 1019 C5 "Adenosine" 250
|
|
biotype 1020 N7 "Adenosine" 255
|
|
biotype 1021 C8 "Adenosine" 248
|
|
biotype 1022 N3 "Adenosine" 256
|
|
biotype 1023 C2 "Adenosine" 254
|
|
biotype 1024 N1 "Adenosine" 257
|
|
biotype 1025 C6 "Adenosine" 249
|
|
biotype 1026 H2 "Adenosine" 259
|
|
biotype 1027 N6 "Adenosine" 253
|
|
biotype 1028 H61 "Adenosine" 260
|
|
biotype 1029 H62 "Adenosine" 260
|
|
biotype 1030 H8 "Adenosine" 258
|
|
biotype 1031 O5* "Guanosine" 326
|
|
biotype 1032 C5* "Guanosine" 324
|
|
biotype 1033 H5* "Guanosine" 325
|
|
biotype 1034 H5* "Guanosine" 325
|
|
biotype 1035 C4* "Guanosine" 312
|
|
biotype 1036 H4* "Guanosine" 313
|
|
biotype 1037 O4* "Guanosine" 311
|
|
biotype 1038 C1* "Guanosine" 314
|
|
biotype 1039 H1* "Guanosine" 315
|
|
biotype 1040 C3* "Guanosine" 318
|
|
biotype 1041 H3* "Guanosine" 319
|
|
biotype 1042 C2* "Guanosine" 316
|
|
biotype 1043 H2* "Guanosine" 317
|
|
biotype 1044 O2* "Guanosine" 320
|
|
biotype 1045 HO* "Guanosine" 321
|
|
biotype 1046 O3* "Guanosine" 322
|
|
biotype 1047 N9 "Guanosine" 280
|
|
biotype 1048 C4 "Guanosine" 275
|
|
biotype 1049 C5 "Guanosine" 279
|
|
biotype 1050 N7 "Guanosine" 282
|
|
biotype 1051 C8 "Guanosine" 276
|
|
biotype 1052 N3 "Guanosine" 283
|
|
biotype 1053 C2 "Guanosine" 273
|
|
biotype 1054 N1 "Guanosine" 277
|
|
biotype 1055 C6 "Guanosine" 274
|
|
biotype 1056 H1 "Guanosine" 284
|
|
biotype 1057 N2 "Guanosine" 278
|
|
biotype 1058 H21 "Guanosine" 287
|
|
biotype 1059 H22 "Guanosine" 287
|
|
biotype 1060 O6 "Guanosine" 285
|
|
biotype 1061 H8 "Guanosine" 286
|
|
biotype 1062 O5* "Cytidine" 326
|
|
biotype 1063 C5* "Cytidine" 324
|
|
biotype 1064 H5* "Cytidine" 325
|
|
biotype 1065 H5* "Cytidine" 325
|
|
biotype 1066 C4* "Cytidine" 312
|
|
biotype 1067 H4* "Cytidine" 313
|
|
biotype 1068 O4* "Cytidine" 311
|
|
biotype 1069 C1* "Cytidine" 314
|
|
biotype 1070 H1* "Cytidine" 315
|
|
biotype 1071 C3* "Cytidine" 318
|
|
biotype 1072 H3* "Cytidine" 319
|
|
biotype 1073 C2* "Cytidine" 316
|
|
biotype 1074 H2* "Cytidine" 317
|
|
biotype 1075 O2* "Cytidine" 320
|
|
biotype 1076 HO* "Cytidine" 321
|
|
biotype 1077 O3* "Cytidine" 322
|
|
biotype 1078 N1 "Cytidine" 261
|
|
biotype 1079 C2 "Cytidine" 266
|
|
biotype 1080 N3 "Cytidine" 268
|
|
biotype 1081 C4 "Cytidine" 267
|
|
biotype 1082 C5 "Cytidine" 263
|
|
biotype 1083 C6 "Cytidine" 265
|
|
biotype 1084 O2 "Cytidine" 270
|
|
biotype 1085 N4 "Cytidine" 264
|
|
biotype 1086 H41 "Cytidine" 272
|
|
biotype 1087 H42 "Cytidine" 272
|
|
biotype 1088 H5 "Cytidine" 269
|
|
biotype 1089 H6 "Cytidine" 271
|
|
biotype 1090 O5* "Uridine" 326
|
|
biotype 1091 C5* "Uridine" 324
|
|
biotype 1092 H5* "Uridine" 325
|
|
biotype 1093 H5* "Uridine" 325
|
|
biotype 1094 C4* "Uridine" 312
|
|
biotype 1095 H4* "Uridine" 313
|
|
biotype 1096 O4* "Uridine" 311
|
|
biotype 1097 C1* "Uridine" 314
|
|
biotype 1098 H1* "Uridine" 315
|
|
biotype 1099 C3* "Uridine" 318
|
|
biotype 1100 H3* "Uridine" 319
|
|
biotype 1101 C2* "Uridine" 316
|
|
biotype 1102 H2* "Uridine" 317
|
|
biotype 1103 O2* "Uridine" 320
|
|
biotype 1104 HO* "Uridine" 321
|
|
biotype 1105 O3* "Uridine" 322
|
|
biotype 1106 N1 "Uridine" 304
|
|
biotype 1107 C2 "Uridine" 300
|
|
biotype 1108 N3 "Uridine" 303
|
|
biotype 1109 C4 "Uridine" 302
|
|
biotype 1110 C5 "Uridine" 305
|
|
biotype 1111 C6 "Uridine" 301
|
|
biotype 1112 O2 "Uridine" 308
|
|
biotype 1113 H3 "Uridine" 306
|
|
biotype 1114 O4 "Uridine" 309
|
|
biotype 1115 H5 "Uridine" 307
|
|
biotype 1116 H6 "Uridine" 310
|
|
biotype 1117 O5* "Deoxyadenosine" 341
|
|
biotype 1118 C5* "Deoxyadenosine" 337
|
|
biotype 1119 H5* "Deoxyadenosine" 340
|
|
biotype 1120 H5* "Deoxyadenosine" 340
|
|
biotype 1121 C4* "Deoxyadenosine" 328
|
|
biotype 1122 H4* "Deoxyadenosine" 336
|
|
biotype 1123 O4* "Deoxyadenosine" 332
|
|
biotype 1124 C1* "Deoxyadenosine" 331
|
|
biotype 1125 H1* "Deoxyadenosine" 334
|
|
biotype 1126 C3* "Deoxyadenosine" 329
|
|
biotype 1127 H3* "Deoxyadenosine" 335
|
|
biotype 1128 C2* "Deoxyadenosine" 330
|
|
biotype 1129 H2* "Deoxyadenosine" 333
|
|
biotype 1130 H2* "Deoxyadenosine" 333
|
|
biotype 1131 O3* "Deoxyadenosine" 338
|
|
biotype 1132 N9 "Deoxyadenosine" 252
|
|
biotype 1133 C4 "Deoxyadenosine" 247
|
|
biotype 1134 C5 "Deoxyadenosine" 250
|
|
biotype 1135 N7 "Deoxyadenosine" 255
|
|
biotype 1136 C8 "Deoxyadenosine" 248
|
|
biotype 1137 N3 "Deoxyadenosine" 256
|
|
biotype 1138 C2 "Deoxyadenosine" 254
|
|
biotype 1139 N1 "Deoxyadenosine" 257
|
|
biotype 1140 C6 "Deoxyadenosine" 249
|
|
biotype 1141 H2 "Deoxyadenosine" 259
|
|
biotype 1142 N6 "Deoxyadenosine" 253
|
|
biotype 1143 H61 "Deoxyadenosine" 260
|
|
biotype 1144 H62 "Deoxyadenosine" 260
|
|
biotype 1145 H8 "Deoxyadenosine" 258
|
|
biotype 1146 O5* "Deoxyguanosine" 341
|
|
biotype 1147 C5* "Deoxyguanosine" 337
|
|
biotype 1148 H5* "Deoxyguanosine" 340
|
|
biotype 1149 H5* "Deoxyguanosine" 340
|
|
biotype 1150 C4* "Deoxyguanosine" 328
|
|
biotype 1151 H4* "Deoxyguanosine" 336
|
|
biotype 1152 O4* "Deoxyguanosine" 332
|
|
biotype 1153 C1* "Deoxyguanosine" 331
|
|
biotype 1154 H1* "Deoxyguanosine" 334
|
|
biotype 1155 C3* "Deoxyguanosine" 329
|
|
biotype 1156 H3* "Deoxyguanosine" 335
|
|
biotype 1157 C2* "Deoxyguanosine" 330
|
|
biotype 1158 H2* "Deoxyguanosine" 333
|
|
biotype 1159 H2* "Deoxyguanosine" 333
|
|
biotype 1160 O3* "Deoxyguanosine" 338
|
|
biotype 1161 N9 "Deoxyguanosine" 281
|
|
biotype 1162 C4 "Deoxyguanosine" 275
|
|
biotype 1163 C5 "Deoxyguanosine" 279
|
|
biotype 1164 N7 "Deoxyguanosine" 282
|
|
biotype 1165 C8 "Deoxyguanosine" 276
|
|
biotype 1166 N3 "Deoxyguanosine" 283
|
|
biotype 1167 C2 "Deoxyguanosine" 273
|
|
biotype 1168 N1 "Deoxyguanosine" 277
|
|
biotype 1169 C6 "Deoxyguanosine" 274
|
|
biotype 1170 H1 "Deoxyguanosine" 284
|
|
biotype 1171 N2 "Deoxyguanosine" 278
|
|
biotype 1172 H21 "Deoxyguanosine" 287
|
|
biotype 1173 H22 "Deoxyguanosine" 287
|
|
biotype 1174 O6 "Deoxyguanosine" 285
|
|
biotype 1175 H8 "Deoxyguanosine" 286
|
|
biotype 1176 O5* "Deoxycytidine" 341
|
|
biotype 1177 C5* "Deoxycytidine" 337
|
|
biotype 1178 H5* "Deoxycytidine" 340
|
|
biotype 1179 H5* "Deoxycytidine" 340
|
|
biotype 1180 C4* "Deoxycytidine" 328
|
|
biotype 1181 H4* "Deoxycytidine" 336
|
|
biotype 1182 O4* "Deoxycytidine" 332
|
|
biotype 1183 C1* "Deoxycytidine" 331
|
|
biotype 1184 H1* "Deoxycytidine" 334
|
|
biotype 1185 C3* "Deoxycytidine" 329
|
|
biotype 1186 H3* "Deoxycytidine" 335
|
|
biotype 1187 C2* "Deoxycytidine" 330
|
|
biotype 1188 H2* "Deoxycytidine" 333
|
|
biotype 1189 H2* "Deoxycytidine" 333
|
|
biotype 1190 O3* "Deoxycytidine" 338
|
|
biotype 1191 N1 "Deoxycytidine" 262
|
|
biotype 1192 C2 "Deoxycytidine" 266
|
|
biotype 1193 N3 "Deoxycytidine" 268
|
|
biotype 1194 C4 "Deoxycytidine" 267
|
|
biotype 1195 C5 "Deoxycytidine" 263
|
|
biotype 1196 C6 "Deoxycytidine" 265
|
|
biotype 1197 O2 "Deoxycytidine" 270
|
|
biotype 1198 N4 "Deoxycytidine" 264
|
|
biotype 1199 H41 "Deoxycytidine" 272
|
|
biotype 1200 H42 "Deoxycytidine" 272
|
|
biotype 1201 H5 "Deoxycytidine" 269
|
|
biotype 1202 H6 "Deoxycytidine" 271
|
|
biotype 1203 O5* "Deoxythymidine" 341
|
|
biotype 1204 C5* "Deoxythymidine" 337
|
|
biotype 1205 H5* "Deoxythymidine" 340
|
|
biotype 1206 H5* "Deoxythymidine" 340
|
|
biotype 1207 C4* "Deoxythymidine" 328
|
|
biotype 1208 H4* "Deoxythymidine" 336
|
|
biotype 1209 O4* "Deoxythymidine" 332
|
|
biotype 1210 C1* "Deoxythymidine" 331
|
|
biotype 1211 H1* "Deoxythymidine" 334
|
|
biotype 1212 C3* "Deoxythymidine" 329
|
|
biotype 1213 H3* "Deoxythymidine" 335
|
|
biotype 1214 C2* "Deoxythymidine" 330
|
|
biotype 1215 H2* "Deoxythymidine" 333
|
|
biotype 1216 H2* "Deoxythymidine" 333
|
|
biotype 1217 O3* "Deoxythymidine" 338
|
|
biotype 1218 N1 "Deoxythymidine" 292
|
|
biotype 1219 C2 "Deoxythymidine" 294
|
|
biotype 1220 N3 "Deoxythymidine" 293
|
|
biotype 1221 C4 "Deoxythymidine" 290
|
|
biotype 1222 C5 "Deoxythymidine" 289
|
|
biotype 1223 C6 "Deoxythymidine" 291
|
|
biotype 1224 O2 "Deoxythymidine" 296
|
|
biotype 1225 H3 "Deoxythymidine" 299
|
|
biotype 1226 O4 "Deoxythymidine" 298
|
|
biotype 1227 C7 "Deoxythymidine" 288
|
|
biotype 1228 H7 "Deoxythymidine" 295
|
|
biotype 1229 H6 "Deoxythymidine" 297
|
|
biotype 1230 P "Phosphodiester RNA" 343
|
|
biotype 1231 OP "Phosphodiester RNA" 344
|
|
biotype 1232 O5* "5'-Hydroxyl RNA" 345
|
|
biotype 1233 H5T "5'-Hydroxyl RNA" 327
|
|
biotype 1234 O5* "5'-Monophosphate OS RNA" -1
|
|
biotype 1235 P "5'-Monophosphate P RNA" -1
|
|
biotype 1236 OP "5'-Monophosphate OP RNA" -1
|
|
biotype 1237 O3* "3'-Hydroxyl RNA" 346
|
|
biotype 1238 H3T "3'-Hydroxyl RNA" 323
|
|
biotype 1239 O3* "3'-Monophosphate OS RNA" -1
|
|
biotype 1240 P "3'-Monophosphate P RNA" -1
|
|
biotype 1241 OP "3'-Monophosphate OP RNA" -1
|
|
biotype 1242 P "Phosphodiester DNA" 343
|
|
biotype 1243 OP "Phosphodiester DNA" 344
|
|
biotype 1244 O5* "5'-Hydroxyl DNA" 348
|
|
biotype 1245 H5T "5'-Hydroxyl DNA" 342
|
|
biotype 1246 O5* "5'-Monophosphate OS DNA" -1
|
|
biotype 1247 P "5'-Monophosphate P DNA" -1
|
|
biotype 1248 OP "5'-Monophosphate OP DNA" -1
|
|
biotype 1249 O3* "3'-Hydroxyl DNA" 347
|
|
biotype 1250 H3T "3'-Hydroxyl DNA" 339
|
|
biotype 1251 O3* "3'-Monophosphate OS DNA" -1
|
|
biotype 1252 P "3'-Monophosphate P DNA" -1
|
|
biotype 1253 OP "3'-Monophosphate OP DNA" -1
|
|
biotype 2001 O "Water" 349
|
|
biotype 2002 H "Water" 350
|
|
biotype 2003 EP "Water" 0
|
|
biotype 2004 LI "Lithium Ion" 351
|
|
biotype 2005 NA "Sodium Ion" 352
|
|
biotype 2006 K "Potassium Ion" 353
|
|
biotype 2007 RB "Rubidium Ion" 354
|
|
biotype 2008 CS "Cesium Ion" 355
|
|
biotype 2009 MG "Magnesium Ion" 357
|
|
biotype 2010 CA "Calcium Ion" 358
|
|
biotype 2011 SR "Strontium Ion" 359
|
|
biotype 2012 BA "Barium Ion" 360
|
|
biotype 2013 F "Fluoride Ion" 362
|
|
biotype 2014 CL "Chloride Ion" 363
|
|
biotype 2015 BR "Bromide Ion" 364
|
|
biotype 2016 I "Iodide Ion" 365
|
|
biotype 2017 ZN "Zinc Ion" 361
|