# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/32209d46-fc6b-426b-bbb4-9a512d509cf1/download)

## Creator

[Atsushi Togo](https://orcid.org/0000-0001-8393-9766)

## Rights

Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/)

## Other metadata

[Ab-initio phonon calculation for K2Sr(NbCl3)6 / R-3 (148) / materials id 569413](https://mdr.nims.go.jp/datasets/7ba7f4d7-31b5-4d67-b0c2-8771420c4585)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "R-3"  number: 148  Hall_symbol: "-R 3"primitive_matrix:- [  0.666666666666667, -0.333333333333333, -0.333333333333333 ]- [  0.333333333333333,  0.333333333333333, -0.666666666666667 ]- [  0.333333333333333,  0.333333333333333,  0.333333333333333 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     4.664654663333337,     2.693139599999997,     8.631749283333324 ] # a  - [    -4.664654646666662,     2.693139639999997,     8.631749283333324 ] # b  - [    -0.000000016666662,    -5.386279240000003,     8.631749283333324 ] # c  points:  - symbol: K  # 1    coordinates: [  0.222073400000000,  0.222073410000003,  0.222073400000000 ]    mass: 39.098300  - symbol: K  # 2    coordinates: [  0.777926600000000,  0.777926600000002,  0.777926600000000 ]    mass: 39.098300  - symbol: Sr # 3    coordinates: [  0.500000000000000,  0.499999990000002,  0.500000000000000 ]    mass: 87.620000  - symbol: Nb # 4    coordinates: [  0.147480680000000,  0.790185440000003,  0.924975910000000 ]    mass: 92.906380  - symbol: Nb # 5    coordinates: [  0.852519330000000,  0.209814560000002,  0.075024090000000 ]    mass: 92.906380  - symbol: Nb # 6    coordinates: [  0.790185440000000,  0.924975910000003,  0.147480680000000 ]    mass: 92.906380  - symbol: Nb # 7    coordinates: [  0.209814570000000,  0.075024080000002,  0.852519330000000 ]    mass: 92.906380  - symbol: Nb # 8    coordinates: [  0.924975910000000,  0.147480680000003,  0.790185440000000 ]    mass: 92.906380  - symbol: Nb # 9    coordinates: [  0.075024090000000,  0.852519320000002,  0.209814570000000 ]    mass: 92.906380  - symbol: Cl # 10    coordinates: [  0.670473370000000,  0.479840410000002,  0.161369640000000 ]    mass: 35.453000  - symbol: Cl # 11    coordinates: [  0.665067500000000,  0.083341360000002,  0.925511030000000 ]    mass: 35.453000  - symbol: Cl # 12    coordinates: [  0.916658630000000,  0.074488970000002,  0.334932490000000 ]    mass: 35.453000  - symbol: Cl # 13    coordinates: [  0.083341360000000,  0.925511030000003,  0.665067500000000 ]    mass: 35.453000  - symbol: Cl # 14    coordinates: [  0.157592990000000,  0.262772320000002,  0.580455440000000 ]    mass: 35.453000  - symbol: Cl # 15    coordinates: [  0.925511030000000,  0.665067500000003,  0.083341360000000 ]    mass: 35.453000  - symbol: Cl # 16    coordinates: [  0.479840410000000,  0.161369640000002,  0.670473370000000 ]    mass: 35.453000  - symbol: Cl # 17    coordinates: [  0.419544550000000,  0.842407010000003,  0.737227670000000 ]    mass: 35.453000  - symbol: Cl # 18    coordinates: [  0.842407000000000,  0.737227680000003,  0.419544550000000 ]    mass: 35.453000  - symbol: Cl # 19    coordinates: [  0.520159590000000,  0.838630360000003,  0.329526640000000 ]    mass: 35.453000  - symbol: Cl # 20    coordinates: [  0.580455440000000,  0.157592980000002,  0.262772330000000 ]    mass: 35.453000  - symbol: Cl # 21    coordinates: [  0.737227670000000,  0.419544560000003,  0.842407000000000 ]    mass: 35.453000  - symbol: Cl # 22    coordinates: [  0.334932490000000,  0.916658640000002,  0.074488960000000 ]    mass: 35.453000  - symbol: Cl # 23    coordinates: [  0.838630360000000,  0.329526640000003,  0.520159590000000 ]    mass: 35.453000  - symbol: Cl # 24    coordinates: [  0.262772330000000,  0.580455430000002,  0.157592990000000 ]    mass: 35.453000  - symbol: Cl # 25    coordinates: [  0.074488960000000,  0.334932500000002,  0.916658630000000 ]    mass: 35.453000  - symbol: Cl # 26    coordinates: [  0.329526640000000,  0.520159590000003,  0.838630360000000 ]    mass: 35.453000  - symbol: Cl # 27    coordinates: [  0.161369640000000,  0.670473370000002,  0.479840410000000 ]    mass: 35.453000  reciprocal_lattice: # without 2pi  - [     0.107189071478586,     0.061885638804506,     0.038617124106808 ] # a*  - [    -0.107189070947909,     0.061885639467852,     0.038617124106808 ] # b*  - [    -0.000000000530677,    -0.123771278272358,     0.038617124106808 ] # c*unit_cell:  lattice:  - [     9.329309309999999,    -0.000000040000000,     0.000000000000000 ] # a  - [    -4.664654630000000,     8.079418880000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    25.895247850000001 ] # c  points:  - symbol: K  # 1    coordinates: [  0.333333330000000,  0.666666670000000,  0.888740070000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.777926600000000 ]    mass: 39.098300    reduced_to: 2  - symbol: K  # 3    coordinates: [  0.000000000000000,  0.000000000000000,  0.222073400000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 4    coordinates: [  0.666666670000000,  0.333333330000000,  0.111259930000000 ]    mass: 39.098300    reduced_to: 2  - symbol: K  # 5    coordinates: [  0.666666670000000,  0.333333330000000,  0.555406730000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 6    coordinates: [  0.333333330000000,  0.666666670000000,  0.444593270000000 ]    mass: 39.098300    reduced_to: 2  - symbol: Sr # 7    coordinates: [  0.666666670000000,  0.333333330000000,  0.833333330000000 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 8    coordinates: [  0.333333330000000,  0.666666670000000,  0.166666670000000 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 9    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 7  - symbol: Nb # 10    coordinates: [  0.193266670000000,  0.029238100000000,  0.954214010000000 ]    mass: 92.906380    reduced_to: 10  - symbol: Nb # 11    coordinates: [  0.140066670000000,  0.637428570000000,  0.712452660000000 ]    mass: 92.906380    reduced_to: 11  - symbol: Nb # 12    coordinates: [  0.835971430000000,  0.806733330000000,  0.954214010000000 ]    mass: 92.906380    reduced_to: 12  - symbol: Nb # 13    coordinates: [  0.497361910000000,  0.859933330000000,  0.712452660000000 ]    mass: 92.906380    reduced_to: 13  - symbol: Nb # 14    coordinates: [  0.970761900000000,  0.164028570000000,  0.954214010000000 ]    mass: 92.906380    reduced_to: 14  - symbol: Nb # 15    coordinates: [  0.362571430000000,  0.502638090000000,  0.712452660000000 ]    mass: 92.906380    reduced_to: 15  - symbol: Nb # 16    coordinates: [  0.859933330000000,  0.362571430000000,  0.287547340000000 ]    mass: 92.906380    reduced_to: 10  - symbol: Nb # 17    coordinates: [  0.806733330000000,  0.970761900000000,  0.045785990000000 ]    mass: 92.906380    reduced_to: 11  - symbol: Nb # 18    coordinates: [  0.502638090000000,  0.140066670000000,  0.287547340000000 ]    mass: 92.906380    reduced_to: 12  - symbol: Nb # 19    coordinates: [  0.164028570000000,  0.193266670000000,  0.045785990000000 ]    mass: 92.906380    reduced_to: 13  - symbol: Nb # 20    coordinates: [  0.637428570000000,  0.497361910000000,  0.287547340000000 ]    mass: 92.906380    reduced_to: 14  - symbol: Nb # 21    coordinates: [  0.029238100000000,  0.835971430000000,  0.045785990000000 ]    mass: 92.906380    reduced_to: 15  - symbol: Nb # 22    coordinates: [  0.526600000000000,  0.695904760000000,  0.620880680000000 ]    mass: 92.906380    reduced_to: 10  - symbol: Nb # 23    coordinates: [  0.473400000000000,  0.304095240000000,  0.379119320000000 ]    mass: 92.906380    reduced_to: 11  - symbol: Nb # 24    coordinates: [  0.169304760000000,  0.473400000000000,  0.620880680000000 ]    mass: 92.906380    reduced_to: 12  - symbol: Nb # 25    coordinates: [  0.830695240000000,  0.526600000000000,  0.379119320000000 ]    mass: 92.906380    reduced_to: 13  - symbol: Nb # 26    coordinates: [  0.304095240000000,  0.830695240000000,  0.620880680000000 ]    mass: 92.906380    reduced_to: 14  - symbol: Nb # 27    coordinates: [  0.695904760000000,  0.169304760000000,  0.379119320000000 ]    mass: 92.906380    reduced_to: 15  - symbol: Cl # 28    coordinates: [  0.899912230000000,  0.609191500000000,  0.770561140000000 ]    mass: 35.453000    reduced_to: 28  - symbol: Cl # 29    coordinates: [  0.773760870000000,  0.965795600000000,  0.891306630000000 ]    mass: 35.453000    reduced_to: 29  - symbol: Cl # 30    coordinates: [  0.141298600000000,  0.440427540000000,  0.775360030000000 ]    mass: 35.453000    reduced_to: 30  - symbol: Cl # 31    coordinates: [  0.192034730000000,  0.226239130000000,  0.891306630000000 ]    mass: 35.453000    reduced_to: 31  - symbol: Cl # 32    coordinates: [  0.490652740000000,  0.086484810000000,  0.666940250000000 ]    mass: 35.453000    reduced_to: 32  - symbol: Cl # 33    coordinates: [  0.034204400000000,  0.807965270000000,  0.891306630000000 ]    mass: 35.453000    reduced_to: 33  - symbol: Cl # 34    coordinates: [  0.709279270000000,  0.100087770000000,  0.770561140000000 ]    mass: 35.453000    reduced_to: 34  - symbol: Cl # 35    coordinates: [  0.419818140000000,  0.262498740000000,  0.999726410000000 ]    mass: 35.453000    reduced_to: 35  - symbol: Cl # 36    coordinates: [  0.842680590000000,  0.580181860000000,  0.999726410000000 ]    mass: 35.453000    reduced_to: 36  - symbol: Cl # 37    coordinates: [  0.624054060000000,  0.566578890000000,  0.896105530000000 ]    mass: 35.453000    reduced_to: 37  - symbol: Cl # 38    coordinates: [  0.913515190000000,  0.404167920000000,  0.666940250000000 ]    mass: 35.453000    reduced_to: 38  - symbol: Cl # 39    coordinates: [  0.737501260000000,  0.157319410000000,  0.999726410000000 ]    mass: 35.453000    reduced_to: 39  - symbol: Cl # 40    coordinates: [  0.559572460000000,  0.700871070000000,  0.775360030000000 ]    mass: 35.453000    reduced_to: 40  - symbol: Cl # 41    coordinates: [  0.942524830000000,  0.375945940000000,  0.896105530000000 ]    mass: 35.453000    reduced_to: 41  - symbol: Cl # 42    coordinates: [  0.595832080000000,  0.509347260000000,  0.666940250000000 ]    mass: 35.453000    reduced_to: 42  - symbol: Cl # 43    coordinates: [  0.299128930000000,  0.858701400000000,  0.775360030000000 ]    mass: 35.453000    reduced_to: 43  - symbol: Cl # 44    coordinates: [  0.433421110000000,  0.057475170000000,  0.896105530000000 ]    mass: 35.453000    reduced_to: 44  - symbol: Cl # 45    coordinates: [  0.390808500000000,  0.290720730000000,  0.770561140000000 ]    mass: 35.453000    reduced_to: 45  - symbol: Cl # 46    coordinates: [  0.566578890000000,  0.942524830000000,  0.103894470000000 ]    mass: 35.453000    reduced_to: 28  - symbol: Cl # 47    coordinates: [  0.440427540000000,  0.299128930000000,  0.224639970000000 ]    mass: 35.453000    reduced_to: 29  - symbol: Cl # 48    coordinates: [  0.807965270000000,  0.773760870000000,  0.108693370000000 ]    mass: 35.453000    reduced_to: 30  - symbol: Cl # 49    coordinates: [  0.858701400000000,  0.559572460000000,  0.224639970000000 ]    mass: 35.453000    reduced_to: 31  - symbol: Cl # 50    coordinates: [  0.157319410000000,  0.419818140000000,  0.000273590000000 ]    mass: 35.453000    reduced_to: 32  - symbol: Cl # 51    coordinates: [  0.700871070000000,  0.141298600000000,  0.224639970000000 ]    mass: 35.453000    reduced_to: 33  - symbol: Cl # 52    coordinates: [  0.375945940000000,  0.433421110000000,  0.103894470000000 ]    mass: 35.453000    reduced_to: 34  - symbol: Cl # 53    coordinates: [  0.086484810000000,  0.595832080000000,  0.333059750000000 ]    mass: 35.453000    reduced_to: 35  - symbol: Cl # 54    coordinates: [  0.509347260000000,  0.913515190000000,  0.333059750000000 ]    mass: 35.453000    reduced_to: 36  - symbol: Cl # 55    coordinates: [  0.290720730000000,  0.899912230000000,  0.229438860000000 ]    mass: 35.453000    reduced_to: 37  - symbol: Cl # 56    coordinates: [  0.580181860000000,  0.737501260000000,  0.000273590000000 ]    mass: 35.453000    reduced_to: 38  - symbol: Cl # 57    coordinates: [  0.404167920000000,  0.490652740000000,  0.333059750000000 ]    mass: 35.453000    reduced_to: 39  - symbol: Cl # 58    coordinates: [  0.226239130000000,  0.034204400000000,  0.108693370000000 ]    mass: 35.453000    reduced_to: 40  - symbol: Cl # 59    coordinates: [  0.609191500000000,  0.709279270000000,  0.229438860000000 ]    mass: 35.453000    reduced_to: 41  - symbol: Cl # 60    coordinates: [  0.262498740000000,  0.842680590000000,  0.000273590000000 ]    mass: 35.453000    reduced_to: 42  - symbol: Cl # 61    coordinates: [  0.965795600000000,  0.192034730000000,  0.108693370000000 ]    mass: 35.453000    reduced_to: 43  - symbol: Cl # 62    coordinates: [  0.100087770000000,  0.390808500000000,  0.229438860000000 ]    mass: 35.453000    reduced_to: 44  - symbol: Cl # 63    coordinates: [  0.057475170000000,  0.624054060000000,  0.103894470000000 ]    mass: 35.453000    reduced_to: 45  - symbol: Cl # 64    coordinates: [  0.233245560000000,  0.275858170000000,  0.437227800000000 ]    mass: 35.453000    reduced_to: 28  - symbol: Cl # 65    coordinates: [  0.107094200000000,  0.632462270000000,  0.557973300000000 ]    mass: 35.453000    reduced_to: 29  - symbol: Cl # 66    coordinates: [  0.474631930000000,  0.107094200000000,  0.442026700000000 ]    mass: 35.453000    reduced_to: 30  - symbol: Cl # 67    coordinates: [  0.525368070000000,  0.892905800000000,  0.557973300000000 ]    mass: 35.453000    reduced_to: 31  - symbol: Cl # 68    coordinates: [  0.823986070000000,  0.753151470000000,  0.333606920000000 ]    mass: 35.453000    reduced_to: 32  - symbol: Cl # 69    coordinates: [  0.367537730000000,  0.474631930000000,  0.557973300000000 ]    mass: 35.453000    reduced_to: 33  - symbol: Cl # 70    coordinates: [  0.042612610000000,  0.766754440000000,  0.437227800000000 ]    mass: 35.453000    reduced_to: 34  - symbol: Cl # 71    coordinates: [  0.753151470000000,  0.929165410000000,  0.666393080000000 ]    mass: 35.453000    reduced_to: 35  - symbol: Cl # 72    coordinates: [  0.176013930000000,  0.246848530000000,  0.666393080000000 ]    mass: 35.453000    reduced_to: 36  - symbol: Cl # 73    coordinates: [  0.957387390000000,  0.233245560000000,  0.562772200000000 ]    mass: 35.453000    reduced_to: 37  - symbol: Cl # 74    coordinates: [  0.246848530000000,  0.070834590000000,  0.333606920000000 ]    mass: 35.453000    reduced_to: 38  - symbol: Cl # 75    coordinates: [  0.070834590000000,  0.823986070000000,  0.666393080000000 ]    mass: 35.453000    reduced_to: 39  - symbol: Cl # 76    coordinates: [  0.892905800000000,  0.367537730000000,  0.442026700000000 ]    mass: 35.453000    reduced_to: 40  - symbol: Cl # 77    coordinates: [  0.275858170000000,  0.042612610000000,  0.562772200000000 ]    mass: 35.453000    reduced_to: 41  - symbol: Cl # 78    coordinates: [  0.929165410000000,  0.176013930000000,  0.333606920000000 ]    mass: 35.453000    reduced_to: 42  - symbol: Cl # 79    coordinates: [  0.632462270000000,  0.525368070000000,  0.442026700000000 ]    mass: 35.453000    reduced_to: 43  - symbol: Cl # 80    coordinates: [  0.766754440000000,  0.724141830000000,  0.562772200000000 ]    mass: 35.453000    reduced_to: 44  - symbol: Cl # 81    coordinates: [  0.724141830000000,  0.957387390000000,  0.437227800000000 ]    mass: 35.453000    reduced_to: 45supercell:  lattice:  - [     9.329309309999999,    -0.000000040000000,     0.000000000000000 ] # a  - [    -4.664654630000000,     8.079418880000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    25.895247850000001 ] # c  points:  - symbol: K  # 1    coordinates: [  0.333333330000000,  0.666666670000000,  0.888740070000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.777926600000000 ]    mass: 39.098300    reduced_to: 2  - symbol: K  # 3    coordinates: [  0.000000000000000,  0.000000000000000,  0.222073400000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 4    coordinates: [  0.666666670000000,  0.333333330000000,  0.111259930000000 ]    mass: 39.098300    reduced_to: 2  - symbol: K  # 5    coordinates: [  0.666666670000000,  0.333333330000000,  0.555406730000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 6    coordinates: [  0.333333330000000,  0.666666670000000,  0.444593270000000 ]    mass: 39.098300    reduced_to: 2  - symbol: Sr # 7    coordinates: [  0.666666670000000,  0.333333330000000,  0.833333330000000 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 8    coordinates: [  0.333333330000000,  0.666666670000000,  0.166666670000000 ]    mass: 87.620000    reduced_to: 7  - symbol: Sr # 9    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 7  - symbol: Nb # 10    coordinates: [  0.193266670000000,  0.029238100000000,  0.954214010000000 ]    mass: 92.906380    reduced_to: 10  - symbol: Nb # 11    coordinates: [  0.140066670000000,  0.637428570000000,  0.712452660000000 ]    mass: 92.906380    reduced_to: 11  - symbol: Nb # 12    coordinates: [  0.835971430000000,  0.806733330000000,  0.954214010000000 ]    mass: 92.906380    reduced_to: 12  - symbol: Nb # 13    coordinates: [  0.497361910000000,  0.859933330000000,  0.712452660000000 ]    mass: 92.906380    reduced_to: 13  - symbol: Nb # 14    coordinates: [  0.970761900000000,  0.164028570000000,  0.954214010000000 ]    mass: 92.906380    reduced_to: 14  - symbol: Nb # 15    coordinates: [  0.362571430000000,  0.502638090000000,  0.712452660000000 ]    mass: 92.906380    reduced_to: 15  - symbol: Nb # 16    coordinates: [  0.859933330000000,  0.362571430000000,  0.287547340000000 ]    mass: 92.906380    reduced_to: 10  - symbol: Nb # 17    coordinates: [  0.806733330000000,  0.970761900000000,  0.045785990000000 ]    mass: 92.906380    reduced_to: 11  - symbol: Nb # 18    coordinates: [  0.502638090000000,  0.140066670000000,  0.287547340000000 ]    mass: 92.906380    reduced_to: 12  - symbol: Nb # 19    coordinates: [  0.164028570000000,  0.193266670000000,  0.045785990000000 ]    mass: 92.906380    reduced_to: 13  - symbol: Nb # 20    coordinates: [  0.637428570000000,  0.497361910000000,  0.287547340000000 ]    mass: 92.906380    reduced_to: 14  - symbol: Nb # 21    coordinates: [  0.029238100000000,  0.835971430000000,  0.045785990000000 ]    mass: 92.906380    reduced_to: 15  - symbol: Nb # 22    coordinates: [  0.526600000000000,  0.695904760000000,  0.620880680000000 ]    mass: 92.906380    reduced_to: 10  - symbol: Nb # 23    coordinates: [  0.473400000000000,  0.304095240000000,  0.379119320000000 ]    mass: 92.906380    reduced_to: 11  - symbol: Nb # 24    coordinates: [  0.169304760000000,  0.473400000000000,  0.620880680000000 ]    mass: 92.906380    reduced_to: 12  - symbol: Nb # 25    coordinates: [  0.830695240000000,  0.526600000000000,  0.379119320000000 ]    mass: 92.906380    reduced_to: 13  - symbol: Nb # 26    coordinates: [  0.304095240000000,  0.830695240000000,  0.620880680000000 ]    mass: 92.906380    reduced_to: 14  - symbol: Nb # 27    coordinates: [  0.695904760000000,  0.169304760000000,  0.379119320000000 ]    mass: 92.906380    reduced_to: 15  - symbol: Cl # 28    coordinates: [  0.899912230000000,  0.609191500000000,  0.770561140000000 ]    mass: 35.453000    reduced_to: 28  - symbol: Cl # 29    coordinates: [  0.773760870000000,  0.965795600000000,  0.891306630000000 ]    mass: 35.453000    reduced_to: 29  - symbol: Cl # 30    coordinates: [  0.141298600000000,  0.440427540000000,  0.775360030000000 ]    mass: 35.453000    reduced_to: 30  - symbol: Cl # 31    coordinates: [  0.192034730000000,  0.226239130000000,  0.891306630000000 ]    mass: 35.453000    reduced_to: 31  - symbol: Cl # 32    coordinates: [  0.490652740000000,  0.086484810000000,  0.666940250000000 ]    mass: 35.453000    reduced_to: 32  - symbol: Cl # 33    coordinates: [  0.034204400000000,  0.807965270000000,  0.891306630000000 ]    mass: 35.453000    reduced_to: 33  - symbol: Cl # 34    coordinates: [  0.709279270000000,  0.100087770000000,  0.770561140000000 ]    mass: 35.453000    reduced_to: 34  - symbol: Cl # 35    coordinates: [  0.419818140000000,  0.262498740000000,  0.999726410000000 ]    mass: 35.453000    reduced_to: 35  - symbol: Cl # 36    coordinates: [  0.842680590000000,  0.580181860000000,  0.999726410000000 ]    mass: 35.453000    reduced_to: 36  - symbol: Cl # 37    coordinates: [  0.624054060000000,  0.566578890000000,  0.896105530000000 ]    mass: 35.453000    reduced_to: 37  - symbol: Cl # 38    coordinates: [  0.913515190000000,  0.404167920000000,  0.666940250000000 ]    mass: 35.453000    reduced_to: 38  - symbol: Cl # 39    coordinates: [  0.737501260000000,  0.157319410000000,  0.999726410000000 ]    mass: 35.453000    reduced_to: 39  - symbol: Cl # 40    coordinates: [  0.559572460000000,  0.700871070000000,  0.775360030000000 ]    mass: 35.453000    reduced_to: 40  - symbol: Cl # 41    coordinates: [  0.942524830000000,  0.375945940000000,  0.896105530000000 ]    mass: 35.453000    reduced_to: 41  - symbol: Cl # 42    coordinates: [  0.595832080000000,  0.509347260000000,  0.666940250000000 ]    mass: 35.453000    reduced_to: 42  - symbol: Cl # 43    coordinates: [  0.299128930000000,  0.858701400000000,  0.775360030000000 ]    mass: 35.453000    reduced_to: 43  - symbol: Cl # 44    coordinates: [  0.433421110000000,  0.057475170000000,  0.896105530000000 ]    mass: 35.453000    reduced_to: 44  - symbol: Cl # 45    coordinates: [  0.390808500000000,  0.290720730000000,  0.770561140000000 ]    mass: 35.453000    reduced_to: 45  - symbol: Cl # 46    coordinates: [  0.566578890000000,  0.942524830000000,  0.103894470000000 ]    mass: 35.453000    reduced_to: 28  - symbol: Cl # 47    coordinates: [  0.440427540000000,  0.299128930000000,  0.224639970000000 ]    mass: 35.453000    reduced_to: 29  - symbol: Cl # 48    coordinates: [  0.807965270000000,  0.773760870000000,  0.108693370000000 ]    mass: 35.453000    reduced_to: 30  - symbol: Cl # 49    coordinates: [  0.858701400000000,  0.559572460000000,  0.224639970000000 ]    mass: 35.453000    reduced_to: 31  - symbol: Cl # 50    coordinates: [  0.157319410000000,  0.419818140000000,  0.000273590000000 ]    mass: 35.453000    reduced_to: 32  - symbol: Cl # 51    coordinates: [  0.700871070000000,  0.141298600000000,  0.224639970000000 ]    mass: 35.453000    reduced_to: 33  - symbol: Cl # 52    coordinates: [  0.375945940000000,  0.433421110000000,  0.103894470000000 ]    mass: 35.453000    reduced_to: 34  - symbol: Cl # 53    coordinates: [  0.086484810000000,  0.595832080000000,  0.333059750000000 ]    mass: 35.453000    reduced_to: 35  - symbol: Cl # 54    coordinates: [  0.509347260000000,  0.913515190000000,  0.333059750000000 ]    mass: 35.453000    reduced_to: 36  - symbol: Cl # 55    coordinates: [  0.290720730000000,  0.899912230000000,  0.229438860000000 ]    mass: 35.453000    reduced_to: 37  - symbol: Cl # 56    coordinates: [  0.580181860000000,  0.737501260000000,  0.000273590000000 ]    mass: 35.453000    reduced_to: 38  - symbol: Cl # 57    coordinates: [  0.404167920000000,  0.490652740000000,  0.333059750000000 ]    mass: 35.453000    reduced_to: 39  - symbol: Cl # 58    coordinates: [  0.226239130000000,  0.034204400000000,  0.108693370000000 ]    mass: 35.453000    reduced_to: 40  - symbol: Cl # 59    coordinates: [  0.609191500000000,  0.709279270000000,  0.229438860000000 ]    mass: 35.453000    reduced_to: 41  - symbol: Cl # 60    coordinates: [  0.262498740000000,  0.842680590000000,  0.000273590000000 ]    mass: 35.453000    reduced_to: 42  - symbol: Cl # 61    coordinates: [  0.965795600000000,  0.192034730000000,  0.108693370000000 ]    mass: 35.453000    reduced_to: 43  - symbol: Cl # 62    coordinates: [  0.100087770000000,  0.390808500000000,  0.229438860000000 ]    mass: 35.453000    reduced_to: 44  - symbol: Cl # 63    coordinates: [  0.057475170000000,  0.624054060000000,  0.103894470000000 ]    mass: 35.453000    reduced_to: 45  - symbol: Cl # 64    coordinates: [  0.233245560000000,  0.275858170000000,  0.437227800000000 ]    mass: 35.453000    reduced_to: 28  - symbol: Cl # 65    coordinates: [  0.107094200000000,  0.632462270000000,  0.557973300000000 ]    mass: 35.453000    reduced_to: 29  - symbol: Cl # 66    coordinates: [  0.474631930000000,  0.107094200000000,  0.442026700000000 ]    mass: 35.453000    reduced_to: 30  - symbol: Cl # 67    coordinates: [  0.525368070000000,  0.892905800000000,  0.557973300000000 ]    mass: 35.453000    reduced_to: 31  - symbol: Cl # 68    coordinates: [  0.823986070000000,  0.753151470000000,  0.333606920000000 ]    mass: 35.453000    reduced_to: 32  - symbol: Cl # 69    coordinates: [  0.367537730000000,  0.474631930000000,  0.557973300000000 ]    mass: 35.453000    reduced_to: 33  - symbol: Cl # 70    coordinates: [  0.042612610000000,  0.766754440000000,  0.437227800000000 ]    mass: 35.453000    reduced_to: 34  - symbol: Cl # 71    coordinates: [  0.753151470000000,  0.929165410000000,  0.666393080000000 ]    mass: 35.453000    reduced_to: 35  - symbol: Cl # 72    coordinates: [  0.176013930000000,  0.246848530000000,  0.666393080000000 ]    mass: 35.453000    reduced_to: 36  - symbol: Cl # 73    coordinates: [  0.957387390000000,  0.233245560000000,  0.562772200000000 ]    mass: 35.453000    reduced_to: 37  - symbol: Cl # 74    coordinates: [  0.246848530000000,  0.070834590000000,  0.333606920000000 ]    mass: 35.453000    reduced_to: 38  - symbol: Cl # 75    coordinates: [  0.070834590000000,  0.823986070000000,  0.666393080000000 ]    mass: 35.453000    reduced_to: 39  - symbol: Cl # 76    coordinates: [  0.892905800000000,  0.367537730000000,  0.442026700000000 ]    mass: 35.453000    reduced_to: 40  - symbol: Cl # 77    coordinates: [  0.275858170000000,  0.042612610000000,  0.562772200000000 ]    mass: 35.453000    reduced_to: 41  - symbol: Cl # 78    coordinates: [  0.929165410000000,  0.176013930000000,  0.333606920000000 ]    mass: 35.453000    reduced_to: 42  - symbol: Cl # 79    coordinates: [  0.632462270000000,  0.525368070000000,  0.442026700000000 ]    mass: 35.453000    reduced_to: 43  - symbol: Cl # 80    coordinates: [  0.766754440000000,  0.724141830000000,  0.562772200000000 ]    mass: 35.453000    reduced_to: 44  - symbol: Cl # 81    coordinates: [  0.724141830000000,  0.957387390000000,  0.437227800000000 ]    mass: 35.453000    reduced_to: 45displacements:- atom:    1  displacement:    [   0.0100000000000000, -0.0000000000428756,  0.0000000000000000 ]  forces:  - [  -0.0071520400000000,  0.0000340600000000,  0.0002496100000000 ]  - [   0.0002440700000000,  0.0000022500000000, -0.0002608800000000 ]  - [   0.0000023700000000,  0.0000025700000000,  0.0002590300000000 ]  - [   0.0000251800000000,  0.0000044000000000, -0.0002612400000000 ]  - [   0.0000033100000000, -0.0000018600000000,  0.0002606900000000 ]  - [  -0.0000016900000000,  0.0000000500000000, -0.0002613800000000 ]  - [   0.0015641300000000, -0.0007981200000000,  0.0000001800000000 ]  - [  -0.0000495500000000, -0.0000064000000000, -0.0000024500000000 ]  - [   0.0000046900000000,  0.0000029500000000,  0.0000001800000000 ]  - [   0.0007430900000000, -0.0020495500000000, -0.0002566500000000 ]  - [   0.0003546200000000,  0.0000520400000000,  0.0003548000000000 ]  - [   0.0038376900000000,  0.0016435900000000,  0.0011797200000000 ]  - [  -0.0016352800000000,  0.0004198300000000, -0.0009623800000000 ]  - [  -0.0009510500000000,  0.0014566900000000,  0.0008732800000000 ]  - [  -0.0009427500000000, -0.0004510900000000, -0.0012390800000000 ]  - [  -0.0003015800000000,  0.0001869000000000,  0.0006146100000000 ]  - [   0.0006988500000000,  0.0007492400000000, -0.0002241600000000 ]  - [   0.0002965000000000,  0.0001697100000000,  0.0006134200000000 ]  - [  -0.0006019200000000, -0.0000195500000000, -0.0005419000000000 ]  - [  -0.0000027400000000, -0.0003412800000000,  0.0006152000000000 ]  - [   0.0007655200000000,  0.0002571800000000, -0.0010254500000000 ]  - [  -0.0002835900000000,  0.0001495200000000,  0.0006032300000000 ]  - [   0.0002953200000000, -0.0001597700000000, -0.0006127400000000 ]  - [   0.0003159200000000,  0.0001638800000000,  0.0006066000000000 ]  - [  -0.0002928400000000, -0.0001637900000000, -0.0006102600000000 ]  - [   0.0000084700000000, -0.0003340500000000,  0.0006059600000000 ]  - [  -0.0000050800000000,  0.0003452900000000, -0.0006099100000000 ]  - [  -0.0004324600000000, -0.0000982700000000, -0.0000176700000000 ]  - [  -0.0006306200000000,  0.0001509400000000, -0.0015569900000000 ]  - [   0.0000501800000000,  0.0002777500000000,  0.0004654900000000 ]  - [   0.0001309400000000,  0.0001260100000000, -0.0009047200000000 ]  - [  -0.0001064300000000,  0.0002353500000000,  0.0002307600000000 ]  - [  -0.0004769300000000,  0.0001962700000000,  0.0007789300000000 ]  - [   0.0000517800000000,  0.0000633400000000,  0.0002913100000000 ]  - [   0.0002912900000000,  0.0004297300000000, -0.0002709500000000 ]  - [  -0.0000139200000000, -0.0002295500000000, -0.0003844400000000 ]  - [   0.0017600400000000, -0.0014447300000000, -0.0003384700000000 ]  - [  -0.0001575600000000, -0.0003085400000000,  0.0002274900000000 ]  - [  -0.0003645700000000, -0.0000431000000000, -0.0002394700000000 ]  - [   0.0013271900000000,  0.0000198400000000,  0.0010244800000000 ]  - [   0.0015953400000000,  0.0005940300000000,  0.0000971800000000 ]  - [   0.0004838400000000, -0.0000508400000000,  0.0002688400000000 ]  - [   0.0006126000000000, -0.0002700800000000,  0.0002998300000000 ]  - [   0.0004639400000000, -0.0002673000000000, -0.0002351400000000 ]  - [   0.0001393900000000,  0.0000687300000000,  0.0004114000000000 ]  - [  -0.0001469500000000, -0.0000826200000000,  0.0001200300000000 ]  - [  -0.0001612400000000,  0.0001685900000000, -0.0005845700000000 ]  - [  -0.0003265900000000, -0.0000837200000000,  0.0006118900000000 ]  - [   0.0002072600000000,  0.0000571900000000, -0.0005764000000000 ]  - [  -0.0001066100000000,  0.0001035400000000,  0.0000965700000000 ]  - [  -0.0000525300000000, -0.0002255500000000, -0.0006031100000000 ]  - [   0.0000900800000000,  0.0002445900000000,  0.0001572100000000 ]  - [   0.0001862200000000,  0.0003008700000000, -0.0002423700000000 ]  - [   0.0001620000000000, -0.0003447200000000, -0.0002503100000000 ]  - [  -0.0000097500000000, -0.0001834300000000, -0.0002195100000000 ]  - [  -0.0011273100000000, -0.0011167000000000,  0.0005995700000000 ]  - [  -0.0003431900000000,  0.0000188200000000, -0.0002529100000000 ]  - [   0.0000820800000000, -0.0001598000000000,  0.0005888400000000 ]  - [  -0.0001451400000000,  0.0001011700000000, -0.0002152400000000 ]  - [  -0.0006081600000000,  0.0002631100000000,  0.0001931800000000 ]  - [   0.0000322900000000,  0.0001396700000000,  0.0004739000000000 ]  - [   0.0001733000000000,  0.0000783100000000, -0.0002270200000000 ]  - [   0.0001152800000000, -0.0001517800000000,  0.0001980500000000 ]  - [  -0.0001989200000000, -0.0000575200000000,  0.0001902200000000 ]  - [  -0.0001576200000000,  0.0001572000000000, -0.0005369400000000 ]  - [  -0.0002362000000000, -0.0000724900000000,  0.0005186900000000 ]  - [   0.0002621200000000,  0.0000563200000000, -0.0004914800000000 ]  - [  -0.0001833000000000,  0.0002797900000000,  0.0003138000000000 ]  - [  -0.0000358100000000, -0.0002123600000000, -0.0004715300000000 ]  - [   0.0000417900000000,  0.0001905200000000,  0.0001794700000000 ]  - [   0.0003097800000000,  0.0003833300000000, -0.0002705900000000 ]  - [   0.0002227400000000, -0.0002227700000000, -0.0003275600000000 ]  - [  -0.0000470300000000, -0.0001984100000000, -0.0001868500000000 ]  - [  -0.0001786700000000, -0.0003174200000000,  0.0003132800000000 ]  - [  -0.0002858400000000, -0.0000134200000000, -0.0003537100000000 ]  - [   0.0001725800000000, -0.0001510200000000,  0.0005096000000000 ]  - [  -0.0001491400000000,  0.0001445000000000, -0.0001934000000000 ]  - [   0.0003738800000000,  0.0000069100000000,  0.0003093200000000 ]  - [   0.0000638500000000,  0.0002322800000000,  0.0004961100000000 ]  - [   0.0001864400000000,  0.0000557000000000, -0.0001802000000000 ]  - [   0.0001546400000000, -0.0001529300000000,  0.0001981000000000 ]- atom:    1  displacement:    [  -0.0100000000000000,  0.0000000000428756,  0.0000000000000000 ]  forces:  - [   0.0070222000000000,  0.0000343600000000,  0.0002502000000000 ]  - [  -0.0002407000000000,  0.0000026800000000, -0.0002616800000000 ]  - [  -0.0000057900000000, -0.0000026000000000,  0.0002584100000000 ]  - [  -0.0000217200000000,  0.0000049800000000, -0.0002617100000000 ]  - [  -0.0000049000000000,  0.0000040000000000,  0.0002612400000000 ]  - [   0.0000035100000000,  0.0000003400000000, -0.0002618100000000 ]  - [  -0.0015651300000000,  0.0007875600000000,  0.0000000500000000 ]  - [   0.0000468200000000,  0.0000076500000000, -0.0000026600000000 ]  - [  -0.0000051900000000, -0.0000025400000000, -0.0000000300000000 ]  - [  -0.0013099100000000,  0.0024418400000000,  0.0014494100000000 ]  - [   0.0002432700000000, -0.0004047700000000, -0.0015845000000000 ]  - [  -0.0032311500000000, -0.0013127800000000,  0.0000248400000000 ]  - [   0.0010283300000000, -0.0007555600000000, -0.0002703200000000 ]  - [   0.0009335600000000, -0.0021152800000000,  0.0003215100000000 ]  - [   0.0009551400000000,  0.0011387800000000,  0.0000084400000000 ]  - [  -0.0002953300000000,  0.0001797900000000,  0.0006135000000000 ]  - [  -0.0001213000000000, -0.0010980600000000, -0.0009726100000000 ]  - [   0.0003024900000000,  0.0001753900000000,  0.0006134000000000 ]  - [  -0.0000040700000000, -0.0002755200000000, -0.0006573300000000 ]  - [  -0.0000128600000000, -0.0003383400000000,  0.0006141600000000 ]  - [  -0.0007237100000000,  0.0004365700000000, -0.0001640100000000 ]  - [  -0.0003010300000000,  0.0001836800000000,  0.0006111300000000 ]  - [   0.0002893300000000, -0.0001593000000000, -0.0006093500000000 ]  - [   0.0002724200000000,  0.0001772700000000,  0.0006072200000000 ]  - [  -0.0002966100000000, -0.0001649200000000, -0.0006102900000000 ]  - [  -0.0000012400000000, -0.0003407000000000,  0.0006087000000000 ]  - [  -0.0000016100000000,  0.0003404000000000, -0.0006067400000000 ]  - [   0.0000840700000000, -0.0000729400000000,  0.0004745900000000 ]  - [   0.0003645200000000,  0.0002137200000000,  0.0004389000000000 ]  - [  -0.0004846500000000, -0.0004170100000000,  0.0007264500000000 ]  - [   0.0002809000000000, -0.0000654400000000, -0.0001863900000000 ]  - [  -0.0002221900000000,  0.0004233200000000,  0.0002606300000000 ]  - [   0.0003095500000000, -0.0005976000000000, -0.0019191200000000 ]  - [  -0.0000293300000000,  0.0003197800000000,  0.0001587400000000 ]  - [   0.0001146600000000,  0.0001445300000000, -0.0003221400000000 ]  - [   0.0003107700000000, -0.0004577200000000, -0.0002131200000000 ]  - [  -0.0016775100000000,  0.0009901100000000,  0.0000190100000000 ]  - [  -0.0002442500000000, -0.0003076500000000,  0.0002580600000000 ]  - [  -0.0003389500000000,  0.0001325600000000, -0.0003736100000000 ]  - [  -0.0009733300000000, -0.0003395100000000,  0.0001488200000000 ]  - [  -0.0019421700000000, -0.0003983600000000, -0.0004021000000000 ]  - [   0.0002285700000000,  0.0000177300000000,  0.0002229800000000 ]  - [  -0.0005098100000000,  0.0007341200000000,  0.0008953300000000 ]  - [  -0.0000806900000000,  0.0003956600000000, -0.0000785400000000 ]  - [   0.0001708800000000, -0.0002698500000000,  0.0000302300000000 ]  - [  -0.0002572100000000, -0.0000319400000000,  0.0002018800000000 ]  - [  -0.0001649500000000,  0.0001692500000000, -0.0005848200000000 ]  - [  -0.0001027100000000, -0.0000044200000000,  0.0005249100000000 ]  - [   0.0002151400000000,  0.0000619100000000, -0.0005799800000000 ]  - [  -0.0001764200000000,  0.0005116900000000,  0.0004910700000000 ]  - [  -0.0000524300000000, -0.0002212300000000, -0.0005936000000000 ]  - [   0.0000031200000000,  0.0001372500000000,  0.0001454200000000 ]  - [   0.0001928500000000,  0.0003043100000000, -0.0002493700000000 ]  - [   0.0001651800000000, -0.0003456500000000, -0.0002519000000000 ]  - [  -0.0000081700000000, -0.0001932200000000, -0.0002279100000000 ]  - [   0.0006811400000000,  0.0005203000000000, -0.0000021900000000 ]  - [  -0.0003447100000000,  0.0000161700000000, -0.0002528800000000 ]  - [   0.0001961700000000, -0.0001621300000000,  0.0005169300000000 ]  - [  -0.0001519200000000,  0.0000873100000000, -0.0002102000000000 ]  - [   0.0013251600000000, -0.0003341700000000,  0.0003995900000000 ]  - [   0.0001267000000000,  0.0002821100000000,  0.0006359100000000 ]  - [   0.0001593100000000,  0.0000958700000000, -0.0002142300000000 ]  - [   0.0001803400000000, -0.0001377500000000,  0.0001211000000000 ]  - [  -0.0001883700000000, -0.0000711300000000,  0.0001826600000000 ]  - [  -0.0001849800000000,  0.0001692000000000, -0.0004735700000000 ]  - [  -0.0002393500000000, -0.0000734600000000,  0.0005176800000000 ]  - [   0.0001982900000000,  0.0000768700000000, -0.0005134100000000 ]  - [  -0.0001869100000000,  0.0002878100000000,  0.0003157300000000 ]  - [  -0.0000820900000000, -0.0002423100000000, -0.0005221200000000 ]  - [   0.0000346600000000,  0.0002000400000000,  0.0001858600000000 ]  - [   0.0000371200000000,  0.0002437100000000, -0.0003683400000000 ]  - [   0.0001517000000000, -0.0003832500000000, -0.0003072200000000 ]  - [  -0.0000353600000000, -0.0001988800000000, -0.0001865400000000 ]  - [  -0.0001803600000000, -0.0003156800000000,  0.0003196100000000 ]  - [  -0.0004489400000000,  0.0000072100000000, -0.0002831400000000 ]  - [   0.0001792400000000, -0.0001555700000000,  0.0005141500000000 ]  - [  -0.0001512900000000,  0.0001317100000000, -0.0001814800000000 ]  - [   0.0003754600000000,  0.0000096100000000,  0.0003118200000000 ]  - [   0.0000592700000000,  0.0002328100000000,  0.0004960100000000 ]  - [   0.0001969000000000,  0.0000741000000000, -0.0001902600000000 ]  - [   0.0001625800000000, -0.0001388300000000,  0.0001949200000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0054654800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012379900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0007589100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0002040500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0007593300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0002576800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0026723100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0012203100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011077600000000 ]  - [  -0.0009284200000000,  0.0012155400000000, -0.0012578100000000 ]  - [   0.0012192900000000, -0.0000669300000000,  0.0008169300000000 ]  - [   0.0015169000000000,  0.0001962700000000, -0.0012578100000000 ]  - [  -0.0006676100000000, -0.0010224700000000,  0.0008169300000000 ]  - [  -0.0005884700000000, -0.0014118100000000, -0.0012578100000000 ]  - [  -0.0005516800000000,  0.0010894000000000,  0.0008169300000000 ]  - [  -0.0005097300000000,  0.0001582000000000,  0.0011689700000000 ]  - [   0.0007042500000000,  0.0010281300000000,  0.0004716000000000 ]  - [   0.0003918800000000,  0.0003623400000000,  0.0011689700000000 ]  - [   0.0005382600000000, -0.0011239700000000,  0.0004716000000000 ]  - [   0.0001178600000000, -0.0005205400000000,  0.0011689700000000 ]  - [  -0.0012425100000000,  0.0000958400000000,  0.0004716000000000 ]  - [  -0.0006343400000000,  0.0001225300000000,  0.0011174500000000 ]  - [   0.0000790100000000, -0.0001910600000000, -0.0000577800000000 ]  - [   0.0004232900000000,  0.0004880900000000,  0.0011174500000000 ]  - [  -0.0002049700000000,  0.0000271100000000, -0.0000577800000000 ]  - [   0.0002110500000000, -0.0006106200000000,  0.0011174500000000 ]  - [   0.0001259600000000,  0.0001639500000000, -0.0000577800000000 ]  - [  -0.0007103700000000, -0.0003520300000000,  0.0008328200000000 ]  - [   0.0000964700000000,  0.0002287100000000,  0.0002524900000000 ]  - [   0.0002486300000000,  0.0009521400000000,  0.0001471200000000 ]  - [   0.0001498400000000, -0.0001979000000000,  0.0002524900000000 ]  - [  -0.0001741800000000,  0.0004753600000000,  0.0000984200000000 ]  - [  -0.0002463100000000, -0.0000308100000000,  0.0002524900000000 ]  - [   0.0000503200000000,  0.0007912100000000,  0.0008328200000000 ]  - [   0.0002574700000000,  0.0003990100000000, -0.0002498600000000 ]  - [   0.0002168200000000, -0.0004224800000000, -0.0002498600000000 ]  - [   0.0001145700000000,  0.0005080500000000,  0.0011004500000000 ]  - [  -0.0003245800000000, -0.0003885300000000,  0.0000984200000000 ]  - [  -0.0004742900000000,  0.0000234600000000, -0.0002498600000000 ]  - [  -0.0009489000000000, -0.0002607500000000,  0.0001471200000000 ]  - [   0.0003827000000000, -0.0003532500000000,  0.0011004500000000 ]  - [   0.0004987700000000, -0.0000868300000000,  0.0000984200000000 ]  - [   0.0007002600000000, -0.0006913900000000,  0.0001471200000000 ]  - [  -0.0004972700000000, -0.0001548000000000,  0.0011004500000000 ]  - [   0.0006600500000000, -0.0004391800000000,  0.0008328200000000 ]  - [  -0.0000198900000000, -0.0000401500000000, -0.0002734900000000 ]  - [  -0.0003463200000000,  0.0001143300000000, -0.0009630000000000 ]  - [  -0.0001823700000000,  0.0001158300000000,  0.0003025700000000 ]  - [   0.0002721700000000,  0.0002427600000000, -0.0009630000000000 ]  - [  -0.0005959800000000,  0.0014371400000000,  0.0010720600000000 ]  - [   0.0000741500000000, -0.0003570900000000, -0.0009630000000000 ]  - [  -0.0000248200000000,  0.0000373000000000, -0.0002734900000000 ]  - [   0.0002235200000000,  0.0002745100000000, -0.0003712800000000 ]  - [   0.0001259700000000, -0.0003308300000000, -0.0003712800000000 ]  - [  -0.0000255900000000, -0.0004800800000000, -0.0006640600000000 ]  - [  -0.0009466100000000, -0.0012347100000000,  0.0010720600000000 ]  - [  -0.0003494900000000,  0.0000563200000000, -0.0003712800000000 ]  - [  -0.0000091200000000, -0.0002158500000000,  0.0003025700000000 ]  - [  -0.0004029700000000,  0.0002622000000000, -0.0006640600000000 ]  - [   0.0015425900000000, -0.0002024400000000,  0.0010720600000000 ]  - [   0.0001915000000000,  0.0001000200000000,  0.0003025700000000 ]  - [   0.0004285600000000,  0.0002178800000000, -0.0006640600000000 ]  - [   0.0000447200000000,  0.0000028400000000, -0.0002734900000000 ]  - [   0.0000770300000000,  0.0000297600000000, -0.0002420500000000 ]  - [  -0.0003567200000000,  0.0001160200000000, -0.0009364400000000 ]  - [  -0.0002054200000000,  0.0000793600000000,  0.0001761300000000 ]  - [   0.0002788400000000,  0.0002509200000000, -0.0009364400000000 ]  - [  -0.0002325700000000,  0.0003445300000000,  0.0002069700000000 ]  - [   0.0000778800000000, -0.0003669400000000, -0.0009364400000000 ]  - [  -0.0000127400000000, -0.0000815900000000, -0.0002420500000000 ]  - [   0.0002875100000000,  0.0004192900000000, -0.0004440400000000 ]  - [   0.0002193600000000, -0.0004586400000000, -0.0004440400000000 ]  - [  -0.0000616400000000, -0.0004785800000000, -0.0006149100000000 ]  - [  -0.0001820900000000, -0.0003736800000000,  0.0002069700000000 ]  - [  -0.0005068700000000,  0.0000393500000000, -0.0004440400000000 ]  - [   0.0000339800000000, -0.0002175800000000,  0.0001761300000000 ]  - [  -0.0003836400000000,  0.0002926700000000, -0.0006149100000000 ]  - [   0.0004146600000000,  0.0000291500000000,  0.0002069700000000 ]  - [   0.0001714400000000,  0.0001382200000000,  0.0001761300000000 ]  - [   0.0004452800000000,  0.0001859100000000, -0.0006149100000000 ]  - [  -0.0000642900000000,  0.0000518300000000, -0.0002420500000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0060137500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0007247100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002421900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0007279300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002409200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0007798300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026929500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012255700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011100800000000 ]  - [   0.0003380800000000, -0.0008448600000000,  0.0024372700000000 ]  - [  -0.0006541500000000, -0.0002947800000000, -0.0020402500000000 ]  - [  -0.0009007100000000,  0.0001296400000000,  0.0024372700000000 ]  - [   0.0000717800000000,  0.0007139000000000, -0.0020402500000000 ]  - [   0.0005626300000000,  0.0007152100000000,  0.0024372700000000 ]  - [   0.0005823600000000, -0.0004191200000000, -0.0020402500000000 ]  - [  -0.0000639200000000,  0.0002033600000000,  0.0000505600000000 ]  - [  -0.0001131100000000, -0.0013896200000000, -0.0016769300000000 ]  - [   0.0002080700000000, -0.0000463300000000,  0.0000505600000000 ]  - [  -0.0011468900000000,  0.0007927700000000, -0.0016769300000000 ]  - [  -0.0001441600000000, -0.0001570400000000,  0.0000505600000000 ]  - [   0.0012600000000000,  0.0005968500000000, -0.0016769300000000 ]  - [   0.0000659200000000,  0.0002172700000000,  0.0000947500000000 ]  - [   0.0004948300000000, -0.0001482300000000, -0.0011559600000000 ]  - [   0.0001552000000000, -0.0001657200000000,  0.0000947500000000 ]  - [  -0.0003757800000000, -0.0003544300000000, -0.0011559600000000 ]  - [  -0.0002211200000000, -0.0000515500000000,  0.0000947500000000 ]  - [  -0.0001190500000000,  0.0005026500000000, -0.0011559600000000 ]  - [   0.0004008700000000,  0.0001689600000000, -0.0004085300000000 ]  - [  -0.0003778200000000,  0.0001146700000000, -0.0013589700000000 ]  - [  -0.0007204400000000, -0.0011201700000000,  0.0010066700000000 ]  - [   0.0002882200000000,  0.0002698600000000, -0.0013589700000000 ]  - [  -0.0001523100000000,  0.0002073600000000,  0.0004191800000000 ]  - [   0.0000896000000000, -0.0003845400000000, -0.0013589700000000 ]  - [  -0.0000541100000000, -0.0004316400000000, -0.0004085300000000 ]  - [   0.0001791600000000,  0.0001880700000000, -0.0003606600000000 ]  - [   0.0000733000000000, -0.0002491900000000, -0.0003606600000000 ]  - [  -0.0001992200000000, -0.0008954100000000, -0.0014204700000000 ]  - [  -0.0001034200000000, -0.0002355900000000,  0.0004191800000000 ]  - [  -0.0002524500000000,  0.0000611200000000, -0.0003606600000000 ]  - [   0.0013303100000000, -0.0000638400000000,  0.0010066700000000 ]  - [  -0.0006758400000000,  0.0006202400000000, -0.0014204700000000 ]  - [   0.0002557400000000,  0.0000282300000000,  0.0004191800000000 ]  - [  -0.0006098700000000,  0.0011840000000000,  0.0010066700000000 ]  - [   0.0008750600000000,  0.0002751700000000, -0.0014204700000000 ]  - [  -0.0003467600000000,  0.0002626800000000, -0.0004085300000000 ]  - [  -0.0003693200000000, -0.0000914000000000,  0.0006036100000000 ]  - [  -0.0000142500000000,  0.0002132700000000, -0.0002388100000000 ]  - [  -0.0002659200000000, -0.0002123300000000,  0.0008463300000000 ]  - [   0.0001918200000000, -0.0000942900000000, -0.0002388100000000 ]  - [   0.0002918200000000, -0.0007855300000000, -0.0004412200000000 ]  - [  -0.0001775700000000, -0.0001189700000000, -0.0002388100000000 ]  - [   0.0001055000000000,  0.0003655400000000,  0.0006036100000000 ]  - [   0.0002132500000000,  0.0003598800000000, -0.0001426600000000 ]  - [   0.0002050400000000, -0.0003646200000000, -0.0001426600000000 ]  - [   0.0000303200000000,  0.0001035700000000,  0.0002228500000000 ]  - [   0.0005343800000000,  0.0006454900000000, -0.0004412200000000 ]  - [  -0.0004182900000000,  0.0000047400000000, -0.0001426600000000 ]  - [   0.0003168400000000, -0.0001241300000000,  0.0008463300000000 ]  - [   0.0000745300000000, -0.0000780400000000,  0.0002228500000000 ]  - [  -0.0008262000000000,  0.0001400400000000, -0.0004412200000000 ]  - [  -0.0000509200000000,  0.0003364600000000,  0.0008463300000000 ]  - [  -0.0001048500000000, -0.0000255300000000,  0.0002228500000000 ]  - [   0.0002638100000000, -0.0002741400000000,  0.0006036100000000 ]  - [  -0.0004688400000000, -0.0001856300000000,  0.0006386700000000 ]  - [  -0.0000430100000000,  0.0002174900000000, -0.0001437800000000 ]  - [  -0.0002849500000000, -0.0002613900000000,  0.0009032000000000 ]  - [   0.0002098500000000, -0.0000715000000000, -0.0001437800000000 ]  - [  -0.0001536100000000,  0.0003182900000000,  0.0004320200000000 ]  - [  -0.0001668500000000, -0.0001459900000000, -0.0001437800000000 ]  - [   0.0000736600000000,  0.0004988400000000,  0.0006386700000000 ]  - [   0.0000785100000000,  0.0002381300000000, -0.0001878500000000 ]  - [   0.0001669700000000, -0.0001870600000000, -0.0001878500000000 ]  - [  -0.0000013700000000,  0.0000638100000000,  0.0002193600000000 ]  - [  -0.0001988400000000, -0.0002921700000000,  0.0004320200000000 ]  - [  -0.0002454800000000, -0.0000510700000000, -0.0001878500000000 ]  - [   0.0003688500000000, -0.0001160800000000,  0.0009032000000000 ]  - [   0.0000559400000000, -0.0000307200000000,  0.0002193600000000 ]  - [   0.0003524500000000, -0.0000261100000000,  0.0004320200000000 ]  - [  -0.0000839000000000,  0.0003774700000000,  0.0009032000000000 ]  - [  -0.0000545700000000, -0.0000330900000000,  0.0002193600000000 ]  - [   0.0003951800000000, -0.0003132100000000,  0.0006386700000000 ]- atom:    7  displacement:    [   0.0100000000000000, -0.0000000000428756,  0.0000000000000000 ]  forces:  - [   0.0015644700000000,  0.0007936400000000,  0.0002643300000000 ]  - [   0.0015653100000000,  0.0007878100000000, -0.0002614300000000 ]  - [   0.0000038200000000, -0.0000042400000000,  0.0002594300000000 ]  - [  -0.0000474600000000,  0.0000110500000000, -0.0002619100000000 ]  - [  -0.0000485100000000,  0.0000063000000000,  0.0002607000000000 ]  - [   0.0000050300000000, -0.0000030700000000, -0.0002623600000000 ]  - [  -0.0428057600000000,  0.0000021700000000, -0.0000028000000000 ]  - [  -0.0000061600000000,  0.0000016700000000, -0.0000020200000000 ]  - [  -0.0000043900000000,  0.0000014200000000, -0.0000046800000000 ]  - [   0.0016053100000000,  0.0019371600000000, -0.0008438900000000 ]  - [   0.0021653500000000,  0.0015802000000000, -0.0020544900000000 ]  - [  -0.0014130600000000, -0.0027227300000000, -0.0009259400000000 ]  - [  -0.0020106500000000, -0.0030490800000000, -0.0021315800000000 ]  - [   0.0040877700000000, -0.0040047900000000,  0.0035607600000000 ]  - [   0.0040946100000000, -0.0033270900000000,  0.0023230900000000 ]  - [  -0.0002977300000000,  0.0001861600000000,  0.0006090800000000 ]  - [   0.0002749400000000, -0.0003161200000000, -0.0006607300000000 ]  - [   0.0002978300000000,  0.0001725700000000,  0.0006070400000000 ]  - [   0.0000007900000000, -0.0004160600000000, -0.0008585400000000 ]  - [  -0.0000026800000000, -0.0003454800000000,  0.0006134000000000 ]  - [   0.0002749700000000,  0.0004138500000000, -0.0002559100000000 ]  - [  -0.0003024500000000,  0.0000258700000000,  0.0005350700000000 ]  - [   0.0002895900000000, -0.0001585700000000, -0.0006093900000000 ]  - [   0.0005984400000000, -0.0000883600000000,  0.0003437300000000 ]  - [  -0.0002989900000000, -0.0001687500000000, -0.0006127700000000 ]  - [   0.0002593100000000, -0.0002761100000000,  0.0009400800000000 ]  - [  -0.0000000200000000,  0.0003400600000000, -0.0006051300000000 ]  - [   0.0011213800000000,  0.0032994500000000, -0.0022445300000000 ]  - [  -0.0004607600000000,  0.0004418000000000, -0.0010488800000000 ]  - [  -0.0006069700000000, -0.0002745800000000,  0.0013139300000000 ]  - [  -0.0001666500000000, -0.0001646200000000,  0.0001596500000000 ]  - [  -0.0001805300000000,  0.0002842000000000,  0.0003818500000000 ]  - [  -0.0000082300000000, -0.0002354100000000, -0.0007931600000000 ]  - [   0.0060859000000000, -0.0035489400000000, -0.0033824200000000 ]  - [  -0.0002936800000000,  0.0000333400000000, -0.0002880300000000 ]  - [   0.0001322700000000, -0.0003962500000000, -0.0001559300000000 ]  - [   0.0059784000000000, -0.0037916400000000, -0.0036392500000000 ]  - [  -0.0006872500000000, -0.0005550500000000,  0.0002495000000000 ]  - [  -0.0007776700000000,  0.0002965900000000, -0.0004336700000000 ]  - [  -0.0001388100000000,  0.0001011900000000,  0.0001084700000000 ]  - [   0.0098673800000000,  0.0041505900000000,  0.0060415300000000 ]  - [  -0.0000855200000000,  0.0002542700000000,  0.0000997100000000 ]  - [   0.0001108500000000,  0.0001936800000000,  0.0003665200000000 ]  - [   0.0014840300000000,  0.0034099300000000, -0.0025851500000000 ]  - [   0.0096725400000000,  0.0038429000000000,  0.0060084700000000 ]  - [  -0.0001655200000000, -0.0000429400000000,  0.0001467700000000 ]  - [  -0.0001586100000000,  0.0001665500000000, -0.0005794600000000 ]  - [  -0.0002636300000000, -0.0000155200000000,  0.0005408400000000 ]  - [   0.0002160700000000,  0.0000515500000000, -0.0005706500000000 ]  - [  -0.0004521500000000,  0.0007581200000000, -0.0000443900000000 ]  - [  -0.0000548900000000, -0.0002145900000000, -0.0005828600000000 ]  - [   0.0000038800000000,  0.0001762300000000,  0.0001491400000000 ]  - [   0.0001914600000000,  0.0002955600000000, -0.0002570600000000 ]  - [   0.0001623900000000, -0.0003358800000000, -0.0002566500000000 ]  - [  -0.0000041000000000, -0.0001869500000000, -0.0002211400000000 ]  - [  -0.0000218400000000,  0.0000065100000000,  0.0004969000000000 ]  - [  -0.0003485700000000,  0.0000148500000000, -0.0002554700000000 ]  - [   0.0000773600000000, -0.0001472000000000,  0.0005327600000000 ]  - [  -0.0001514000000000,  0.0000954100000000, -0.0002167300000000 ]  - [   0.0001765000000000, -0.0001072300000000,  0.0004692200000000 ]  - [   0.0000302300000000,  0.0002225600000000,  0.0005739600000000 ]  - [   0.0001559300000000,  0.0000846300000000, -0.0002146600000000 ]  - [   0.0001659700000000, -0.0001938800000000,  0.0001777400000000 ]  - [  -0.0001909000000000, -0.0000686700000000,  0.0001826700000000 ]  - [  -0.0002248700000000,  0.0001729300000000, -0.0005250400000000 ]  - [  -0.0002382000000000, -0.0000729300000000,  0.0005122800000000 ]  - [   0.0001942700000000,  0.0000707600000000, -0.0005101700000000 ]  - [  -0.0001878800000000,  0.0002935900000000,  0.0003108700000000 ]  - [  -0.0001103400000000, -0.0001923500000000, -0.0004521100000000 ]  - [   0.0000414700000000,  0.0002039500000000,  0.0001873100000000 ]  - [   0.0003684200000000,  0.0005946500000000, -0.0001448400000000 ]  - [  -0.0001247700000000,  0.0001452500000000, -0.0006776300000000 ]  - [  -0.0000755600000000, -0.0002161500000000, -0.0001946400000000 ]  - [  -0.0001722800000000, -0.0003127500000000,  0.0003144000000000 ]  - [  -0.0005513800000000, -0.0000838900000000, -0.0001509400000000 ]  - [   0.0001804200000000, -0.0001575000000000,  0.0005113700000000 ]  - [  -0.0001398900000000,  0.0000897900000000, -0.0001840500000000 ]  - [   0.0003648300000000,  0.0000158300000000,  0.0003042700000000 ]  - [   0.0000559400000000,  0.0002312800000000,  0.0004978500000000 ]  - [   0.0001965300000000,  0.0000804700000000, -0.0001869100000000 ]  - [   0.0001587200000000, -0.0001429700000000,  0.0001953500000000 ]- atom:    7  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0024122900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029343000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0013646000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0009684800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014823300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0008431000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0446610000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0024956400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0024924400000000 ]  - [  -0.0032434600000000, -0.0005124700000000,  0.0017330400000000 ]  - [  -0.0025886000000000, -0.0008495000000000,  0.0004974500000000 ]  - [   0.0011779200000000,  0.0030651500000000,  0.0017330400000000 ]  - [   0.0005586100000000,  0.0026665500000000,  0.0004974500000000 ]  - [   0.0020655400000000, -0.0025526800000000,  0.0017330400000000 ]  - [   0.0020299900000000, -0.0018170400000000,  0.0004974500000000 ]  - [  -0.0008183100000000,  0.0001215800000000,  0.0018328100000000 ]  - [   0.0003506700000000, -0.0004842600000000,  0.0006498200000000 ]  - [   0.0005144500000000,  0.0006478900000000,  0.0018328100000000 ]  - [  -0.0005947100000000, -0.0000615600000000,  0.0006498200000000 ]  - [   0.0003038600000000, -0.0007694700000000,  0.0018328100000000 ]  - [   0.0002440400000000,  0.0005458200000000,  0.0006498200000000 ]  - [  -0.0002694600000000, -0.0001326600000000,  0.0018706500000000 ]  - [  -0.0001505700000000, -0.0002117600000000,  0.0005680700000000 ]  - [   0.0000198500000000,  0.0002996900000000,  0.0018706500000000 ]  - [  -0.0001081100000000,  0.0002362700000000,  0.0005680700000000 ]  - [   0.0002496200000000, -0.0001670300000000,  0.0018706500000000 ]  - [   0.0002586700000000, -0.0000245100000000,  0.0005680700000000 ]  - [  -0.0024572500000000, -0.0073389000000000,  0.0066869600000000 ]  - [   0.0000159800000000, -0.0000509100000000, -0.0001335700000000 ]  - [  -0.0004856300000000, -0.0000970500000000,  0.0010412600000000 ]  - [  -0.0000520700000000,  0.0000116200000000, -0.0001335700000000 ]  - [  -0.0001469800000000, -0.0001872000000000,  0.0002431000000000 ]  - [   0.0000361000000000,  0.0000392900000000, -0.0001335700000000 ]  - [  -0.0051270500000000,  0.0057974900000000,  0.0066869600000000 ]  - [   0.0006359100000000,  0.0005561700000000, -0.0002781300000000 ]  - [   0.0001637000000000, -0.0008288000000000, -0.0002781300000000 ]  - [  -0.0053377500000000,  0.0056369600000000,  0.0064130200000000 ]  - [   0.0002356100000000, -0.0000336900000000,  0.0002431000000000 ]  - [  -0.0007996100000000,  0.0002726300000000, -0.0002781300000000 ]  - [   0.0003268700000000, -0.0003720400000000,  0.0010412600000000 ]  - [   0.0075506200000000,  0.0018041400000000,  0.0064130200000000 ]  - [  -0.0000886300000000,  0.0002208900000000,  0.0002431000000000 ]  - [   0.0001587600000000,  0.0004690900000000,  0.0010412600000000 ]  - [  -0.0022128800000000, -0.0074411000000000,  0.0064130200000000 ]  - [   0.0075843000000000,  0.0015414100000000,  0.0066869600000000 ]  - [   0.0004283200000000,  0.0002196200000000, -0.0008372400000000 ]  - [  -0.0004993700000000,  0.0000506500000000, -0.0013593300000000 ]  - [  -0.0001227900000000,  0.0003369100000000, -0.0001106900000000 ]  - [   0.0002935500000000,  0.0004071400000000, -0.0013593300000000 ]  - [  -0.0002197200000000,  0.0005353600000000,  0.0001451900000000 ]  - [   0.0002058200000000, -0.0004577900000000, -0.0013593300000000 ]  - [  -0.0000239600000000, -0.0004807400000000, -0.0008372400000000 ]  - [   0.0002101800000000,  0.0001954300000000, -0.0005179400000000 ]  - [   0.0000641600000000, -0.0002797400000000, -0.0005179400000000 ]  - [  -0.0000743800000000, -0.0008014000000000, -0.0011785700000000 ]  - [  -0.0003537700000000, -0.0004579600000000,  0.0001451900000000 ]  - [  -0.0002743400000000,  0.0000843000000000, -0.0005179400000000 ]  - [  -0.0002303800000000, -0.0002748000000000, -0.0001106900000000 ]  - [  -0.0006568400000000,  0.0004651100000000, -0.0011785700000000 ]  - [   0.0005734900000000, -0.0000774000000000,  0.0001451900000000 ]  - [   0.0003531700000000, -0.0000621200000000, -0.0001106900000000 ]  - [   0.0007312200000000,  0.0003362900000000, -0.0011785700000000 ]  - [  -0.0004043500000000,  0.0002611200000000, -0.0008372400000000 ]  - [   0.0003943400000000,  0.0001935500000000, -0.0007767800000000 ]  - [  -0.0005098700000000,  0.0000571600000000, -0.0011423000000000 ]  - [  -0.0001440800000000,  0.0002912200000000, -0.0002780300000000 ]  - [   0.0003044400000000,  0.0004129800000000, -0.0011423000000000 ]  - [  -0.0002793800000000,  0.0003229300000000,  0.0000367100000000 ]  - [   0.0002054300000000, -0.0004701400000000, -0.0011423000000000 ]  - [  -0.0000295500000000, -0.0004382800000000, -0.0007767800000000 ]  - [   0.0000238200000000,  0.0001279900000000, -0.0004759500000000 ]  - [   0.0000989300000000, -0.0000846200000000, -0.0004759500000000 ]  - [  -0.0001072000000000, -0.0008461500000000, -0.0011759000000000 ]  - [  -0.0001399800000000, -0.0004034100000000,  0.0000367100000000 ]  - [  -0.0001227500000000, -0.0000433700000000, -0.0004759500000000 ]  - [  -0.0001801600000000, -0.0002703900000000, -0.0002780300000000 ]  - [  -0.0006791900000000,  0.0005159100000000, -0.0011759000000000 ]  - [   0.0004193500000000,  0.0000804800000000,  0.0000367100000000 ]  - [   0.0003242500000000, -0.0000208300000000, -0.0002780300000000 ]  - [   0.0007863900000000,  0.0003302400000000, -0.0011759000000000 ]  - [  -0.0003647900000000,  0.0002447300000000, -0.0007767800000000 ]- atom:   10  displacement:    [   0.0100000000000000, -0.0000000000428756,  0.0000000000000000 ]  forces:  - [   0.0010375200000000, -0.0029412200000000, -0.0003817300000000 ]  - [   0.0000566300000000,  0.0002151900000000,  0.0006780700000000 ]  - [   0.0000059200000000, -0.0000041700000000, -0.0000813000000000 ]  - [   0.0004141000000000,  0.0002878700000000,  0.0001496900000000 ]  - [  -0.0000018800000000,  0.0000043200000000,  0.0000484000000000 ]  - [   0.0000016700000000, -0.0000006400000000, -0.0004750700000000 ]  - [   0.0018888000000000,  0.0049688800000000, -0.0029176000000000 ]  - [  -0.0000078000000000,  0.0000801000000000,  0.0000431900000000 ]  - [  -0.0000010200000000,  0.0000019400000000, -0.0004671600000000 ]  - [  -0.1777570800000000,  0.0041251600000000, -0.0147398700000000 ]  - [   0.0002016800000000, -0.0009215800000000, -0.0007974900000000 ]  - [   0.0287123300000000,  0.0211411700000000,  0.0021675500000000 ]  - [   0.0000465700000000, -0.0005156300000000, -0.0012955900000000 ]  - [   0.0394467200000000, -0.0149009700000000, -0.0000930100000000 ]  - [  -0.0001609500000000,  0.0004009500000000, -0.0005287500000000 ]  - [  -0.0002146200000000,  0.0001774600000000,  0.0004211600000000 ]  - [   0.0051265000000000, -0.0004189500000000, -0.0001837000000000 ]  - [   0.0002561800000000,  0.0000667100000000,  0.0003904000000000 ]  - [   0.0014487300000000, -0.0105845100000000, -0.0100181400000000 ]  - [  -0.0000599900000000, -0.0002963900000000,  0.0004141200000000 ]  - [  -0.0045657800000000,  0.0070887400000000, -0.0050015800000000 ]  - [  -0.0002137200000000,  0.0001748300000000,  0.0004107000000000 ]  - [   0.0003906900000000, -0.0001632700000000, -0.0008465100000000 ]  - [   0.0002902900000000,  0.0000935200000000,  0.0003936300000000 ]  - [  -0.0003316400000000, -0.0002568900000000, -0.0008460800000000 ]  - [  -0.0000750100000000, -0.0002527300000000,  0.0003783600000000 ]  - [  -0.0000581700000000,  0.0004219600000000, -0.0008516300000000 ]  - [  -0.0004452300000000, -0.0007706500000000,  0.0001834500000000 ]  - [   0.0011511800000000,  0.0000118800000000, -0.0008814900000000 ]  - [  -0.0002182300000000,  0.0001472100000000,  0.0004081200000000 ]  - [   0.0111263800000000, -0.0108790900000000,  0.0108115900000000 ]  - [  -0.0001542100000000,  0.0003611500000000,  0.0002896700000000 ]  - [   0.0080887700000000,  0.0048719100000000,  0.0028811800000000 ]  - [  -0.0006093800000000,  0.0005250000000000,  0.0008527800000000 ]  - [   0.0214977500000000,  0.0231847100000000,  0.0093742300000000 ]  - [   0.0017731400000000, -0.0012511200000000, -0.0004767600000000 ]  - [   0.0000375400000000, -0.0006020200000000, -0.0000826000000000 ]  - [  -0.0001091600000000, -0.0001833900000000,  0.0002892500000000 ]  - [  -0.0020925600000000,  0.0019260800000000, -0.0013104900000000 ]  - [   0.0001253200000000, -0.0001142100000000,  0.0006592500000000 ]  - [  -0.0008622300000000, -0.0007411400000000,  0.0001675300000000 ]  - [   0.0003207000000000,  0.0000036200000000,  0.0002626900000000 ]  - [  -0.0001288300000000,  0.0006212900000000,  0.0012849600000000 ]  - [   0.0250364400000000, -0.0000700300000000, -0.0091516700000000 ]  - [   0.0010669500000000, -0.0003499300000000,  0.0003077300000000 ]  - [  -0.0018334800000000, -0.0001942700000000,  0.0004656600000000 ]  - [  -0.0000782000000000,  0.0001895200000000, -0.0004370600000000 ]  - [   0.0001633100000000, -0.0001835400000000,  0.0010919400000000 ]  - [   0.0002055600000000, -0.0000093200000000, -0.0004699200000000 ]  - [   0.0012983200000000,  0.0012134900000000, -0.0003268800000000 ]  - [  -0.0001110600000000, -0.0001618300000000, -0.0004582000000000 ]  - [   0.0003924700000000, -0.0000756400000000, -0.0005662700000000 ]  - [   0.0001768300000000,  0.0003075900000000, -0.0001804200000000 ]  - [   0.0001762400000000, -0.0003161600000000, -0.0001807400000000 ]  - [   0.0000815800000000, -0.0001219100000000,  0.0000042700000000 ]  - [  -0.0011605900000000, -0.0021054300000000, -0.0009343000000000 ]  - [  -0.0003484600000000,  0.0000022600000000, -0.0001826500000000 ]  - [   0.0020670500000000,  0.0001992000000000,  0.0016914400000000 ]  - [  -0.0001203100000000,  0.0000102000000000, -0.0000770500000000 ]  - [   0.0365716400000000, -0.0244261400000000,  0.0156702600000000 ]  - [   0.0004328500000000,  0.0005785500000000,  0.0012136100000000 ]  - [   0.0000722500000000,  0.0001075500000000, -0.0000668400000000 ]  - [   0.0006278500000000,  0.0001752300000000, -0.0004267000000000 ]  - [  -0.0003033300000000, -0.0000873500000000,  0.0003724300000000 ]  - [  -0.0001028300000000,  0.0001935400000000, -0.0003520200000000 ]  - [  -0.0002387700000000, -0.0001253300000000,  0.0006541500000000 ]  - [   0.0001955700000000,  0.0000068100000000, -0.0003474800000000 ]  - [  -0.0001625400000000,  0.0002784100000000,  0.0003637600000000 ]  - [  -0.0001064500000000, -0.0001666600000000, -0.0003679400000000 ]  - [   0.0000757900000000,  0.0003062500000000,  0.0003722800000000 ]  - [   0.0001126000000000,  0.0003380700000000, -0.0002223700000000 ]  - [   0.0001874600000000, -0.0002551500000000, -0.0002720200000000 ]  - [  -0.0000496200000000, -0.0000744200000000, -0.0000052100000000 ]  - [  -0.0001595100000000, -0.0002767900000000,  0.0003654500000000 ]  - [  -0.0003925400000000, -0.0000010900000000, -0.0002559400000000 ]  - [   0.0002253500000000, -0.0001305800000000,  0.0006510600000000 ]  - [  -0.0000361400000000,  0.0000834700000000, -0.0000053900000000 ]  - [   0.0003324700000000,  0.0000047100000000,  0.0003582100000000 ]  - [   0.0000121700000000,  0.0002648400000000,  0.0006418000000000 ]  - [   0.0000836500000000, -0.0000024900000000, -0.0000011200000000 ]  - [   0.0002318000000000, -0.0002287100000000,  0.0003807300000000 ]- atom:   10  displacement:    [  -0.0100000000000000,  0.0000000000428756,  0.0000000000000000 ]  forces:  - [  -0.0010231700000000,  0.0029096500000000,  0.0008916100000000 ]  - [  -0.0000569300000000, -0.0002132900000000, -0.0011874600000000 ]  - [  -0.0000094800000000,  0.0000034500000000,  0.0006028300000000 ]  - [  -0.0004048400000000, -0.0002726900000000, -0.0006711200000000 ]  - [   0.0000005200000000, -0.0000033300000000,  0.0004777900000000 ]  - [   0.0000000900000000,  0.0000011300000000, -0.0000458500000000 ]  - [  -0.0018596200000000, -0.0049349700000000,  0.0029069100000000 ]  - [   0.0000086700000000, -0.0000861900000000, -0.0000426400000000 ]  - [   0.0000012700000000, -0.0000006700000000,  0.0004746300000000 ]  - [   0.1777562400000000, -0.0037415200000000,  0.0160223400000000 ]  - [   0.0004047600000000,  0.0005642400000000, -0.0004447000000000 ]  - [  -0.0288616900000000, -0.0211782500000000, -0.0009745300000000 ]  - [  -0.0006521800000000,  0.0001609900000000,  0.0000500600000000 ]  - [  -0.0405422600000000,  0.0144806100000000,  0.0012816200000000 ]  - [   0.0001543800000000,  0.0003084800000000, -0.0007125900000000 ]  - [  -0.0004045900000000,  0.0001701600000000,  0.0008283800000000 ]  - [  -0.0044815000000000,  0.0000886800000000, -0.0012023100000000 ]  - [   0.0003625800000000,  0.0002984300000000,  0.0008619200000000 ]  - [  -0.0022532000000000,  0.0103490200000000,  0.0090950200000000 ]  - [   0.0000653000000000, -0.0004136700000000,  0.0008325300000000 ]  - [   0.0044501200000000, -0.0064854300000000,  0.0040293000000000 ]  - [  -0.0003995900000000,  0.0001544500000000,  0.0008234900000000 ]  - [   0.0002183100000000, -0.0001665100000000, -0.0003804700000000 ]  - [   0.0003031300000000,  0.0002740100000000,  0.0008404100000000 ]  - [  -0.0002577200000000, -0.0001046300000000, -0.0003801300000000 ]  - [   0.0000971500000000, -0.0004426800000000,  0.0008550900000000 ]  - [   0.0000379000000000,  0.0002753200000000, -0.0003816200000000 ]  - [   0.0001225700000000,  0.0006181400000000,  0.0002420600000000 ]  - [  -0.0015563200000000,  0.0002982600000000, -0.0002334700000000 ]  - [  -0.0002077800000000, -0.0002538000000000,  0.0007530000000000 ]  - [  -0.0108064200000000,  0.0112066600000000, -0.0122092900000000 ]  - [  -0.0001663700000000,  0.0002675600000000,  0.0001893700000000 ]  - [  -0.0082235700000000, -0.0052072500000000, -0.0039955000000000 ]  - [   0.0006407400000000, -0.0001660300000000, -0.0004214400000000 ]  - [  -0.0211011200000000, -0.0222798100000000, -0.0098688400000000 ]  - [  -0.0014180100000000,  0.0006091100000000, -0.0000854000000000 ]  - [  -0.0001539400000000,  0.0001649600000000, -0.0002680000000000 ]  - [  -0.0002710400000000, -0.0004039100000000,  0.0001904800000000 ]  - [   0.0013539100000000, -0.0018484800000000,  0.0007639800000000 ]  - [   0.0001868600000000, -0.0002013400000000,  0.0005083600000000 ]  - [   0.0005707300000000,  0.0010652600000000, -0.0005050000000000 ]  - [   0.0003802700000000, -0.0000390600000000,  0.0002189000000000 ]  - [   0.0002427100000000, -0.0001894300000000, -0.0001073300000000 ]  - [  -0.0236038800000000,  0.0002766000000000,  0.0081151400000000 ]  - [  -0.0007706900000000,  0.0001295200000000,  0.0001376800000000 ]  - [   0.0014254300000000,  0.0000999000000000, -0.0001477600000000 ]  - [  -0.0002402500000000,  0.0001273100000000, -0.0007413100000000 ]  - [  -0.0005265000000000,  0.0001134600000000,  0.0000162100000000 ]  - [   0.0002211100000000,  0.0001271200000000, -0.0007074700000000 ]  - [  -0.0015619500000000, -0.0005316300000000,  0.0009339400000000 ]  - [  -0.0000004600000000, -0.0002706000000000, -0.0007243100000000 ]  - [  -0.0002450600000000,  0.0004819700000000,  0.0008958100000000 ]  - [   0.0002091300000000,  0.0002877200000000, -0.0002991800000000 ]  - [   0.0001439400000000, -0.0003236600000000, -0.0003015800000000 ]  - [  -0.0001211600000000, -0.0002486800000000, -0.0004544100000000 ]  - [   0.0007139600000000,  0.0015242700000000,  0.0015413600000000 ]  - [  -0.0003520900000000,  0.0000345500000000, -0.0002994300000000 ]  - [  -0.0017685300000000, -0.0005453000000000, -0.0005734900000000 ]  - [  -0.0001780900000000,  0.0002127500000000, -0.0003709900000000 ]  - [  -0.0353768900000000,  0.0235873400000000, -0.0145552500000000 ]  - [  -0.0002496800000000, -0.0001694400000000, -0.0000920800000000 ]  - [   0.0002693400000000,  0.0000462800000000, -0.0003808300000000 ]  - [  -0.0003325300000000, -0.0004705700000000,  0.0007463700000000 ]  - [  -0.0000881500000000, -0.0000205900000000,  0.0000031800000000 ]  - [  -0.0002267900000000,  0.0001300000000000, -0.0006544800000000 ]  - [  -0.0002085200000000,  0.0000015800000000,  0.0003502000000000 ]  - [   0.0002478700000000,  0.0001202300000000, -0.0006578900000000 ]  - [  -0.0002030600000000,  0.0003160100000000,  0.0002590200000000 ]  - [  -0.0000118100000000, -0.0002815500000000, -0.0006364900000000 ]  - [   0.0000254000000000,  0.0000870800000000,  0.0000025400000000 ]  - [   0.0002192000000000,  0.0002765900000000, -0.0004012700000000 ]  - [   0.0001775300000000, -0.0003358200000000, -0.0003506300000000 ]  - [  -0.0000519500000000, -0.0003198900000000, -0.0003742300000000 ]  - [  -0.0001800600000000, -0.0003420600000000,  0.0002560100000000 ]  - [  -0.0003031200000000, -0.0000199300000000, -0.0003661700000000 ]  - [   0.0001017800000000, -0.0001901700000000,  0.0003509000000000 ]  - [  -0.0002527500000000,  0.0002096900000000, -0.0003774700000000 ]  - [   0.0003757100000000,  0.0000140700000000,  0.0002617400000000 ]  - [   0.0001101200000000,  0.0001809400000000,  0.0003517500000000 ]  - [   0.0003084700000000,  0.0001121700000000, -0.0003773000000000 ]  - [   0.0000581300000000, -0.0000629200000000, -0.0000002300000000 ]- atom:   10  displacement:    [  -0.0049999999716508,  0.0086602540542118,  0.0000000000000000 ]  forces:  - [  -0.0024494100000000,  0.0026549700000000,  0.0014618600000000 ]  - [   0.0001670100000000, -0.0014408100000000, -0.0006335900000000 ]  - [  -0.0000199000000000,  0.0000148500000000,  0.0003898400000000 ]  - [   0.0005976500000000,  0.0000056700000000,  0.0005785000000000 ]  - [   0.0000031400000000,  0.0000000600000000,  0.0003499200000000 ]  - [  -0.0000004700000000,  0.0000011200000000, -0.0001735600000000 ]  - [   0.0005846500000000, -0.0016502500000000,  0.0008714300000000 ]  - [  -0.0001181700000000,  0.0002793600000000, -0.0002871100000000 ]  - [   0.0000015700000000, -0.0000008000000000,  0.0001936800000000 ]  - [   0.0921702200000000, -0.1760204500000000,  0.0061453800000000 ]  - [  -0.0002836000000000,  0.0003209700000000, -0.0002520200000000 ]  - [   0.0066616200000000,  0.0048225400000000, -0.0034788400000000 ]  - [  -0.0005975200000000, -0.0000539300000000, -0.0002535000000000 ]  - [  -0.0354972700000000,  0.0128190700000000,  0.0050276400000000 ]  - [  -0.0000542400000000,  0.0007239700000000, -0.0010854700000000 ]  - [  -0.0003418600000000,  0.0001629100000000,  0.0006996000000000 ]  - [  -0.0023418300000000,  0.0023384800000000, -0.0005136900000000 ]  - [   0.0003466000000000,  0.0001959900000000,  0.0007176500000000 ]  - [  -0.0141427400000000,  0.0121199500000000,  0.0199126900000000 ]  - [   0.0000250300000000, -0.0003407200000000,  0.0007265300000000 ]  - [   0.0118384400000000,  0.0091868600000000, -0.0158334600000000 ]  - [  -0.0003443000000000,  0.0001450400000000,  0.0007295900000000 ]  - [   0.0002607600000000, -0.0001615500000000, -0.0005232000000000 ]  - [   0.0002772700000000,  0.0002138900000000,  0.0006833200000000 ]  - [  -0.0002807700000000, -0.0001378500000000, -0.0005240700000000 ]  - [   0.0000145800000000, -0.0003965400000000,  0.0007029900000000 ]  - [   0.0000124900000000,  0.0003165900000000, -0.0005220000000000 ]  - [   0.0002752300000000, -0.0000837300000000, -0.0006198000000000 ]  - [  -0.0008332400000000,  0.0011916000000000, -0.0005469500000000 ]  - [  -0.0001658300000000, -0.0003693900000000,  0.0008725000000000 ]  - [  -0.0142970500000000,  0.0319073400000000, -0.0299876200000000 ]  - [  -0.0001615100000000,  0.0003145500000000,  0.0002233300000000 ]  - [  -0.0008105800000000,  0.0270311400000000,  0.0222692000000000 ]  - [   0.0003031100000000,  0.0000307500000000, -0.0000013200000000 ]  - [   0.0106724100000000,  0.0250959200000000,  0.0102586100000000 ]  - [  -0.0005625300000000,  0.0026458200000000, -0.0006382100000000 ]  - [  -0.0011737100000000, -0.0007811400000000,  0.0007251600000000 ]  - [  -0.0001859600000000, -0.0003538700000000,  0.0001832900000000 ]  - [   0.0002509300000000, -0.0008769900000000,  0.0009299600000000 ]  - [   0.0002158100000000, -0.0002230000000000,  0.0005859900000000 ]  - [   0.0007536200000000,  0.0002226100000000, -0.0009057100000000 ]  - [   0.0003680300000000, -0.0000572400000000,  0.0002848800000000 ]  - [   0.0003107600000000,  0.0000287700000000,  0.0001455900000000 ]  - [  -0.0105769300000000,  0.0108005000000000,  0.0026668400000000 ]  - [  -0.0004767300000000, -0.0003242600000000,  0.0008551200000000 ]  - [   0.0008837600000000, -0.0001959700000000,  0.0003277200000000 ]  - [  -0.0002058500000000,  0.0001506600000000, -0.0006910400000000 ]  - [   0.0003137400000000, -0.0001041200000000,  0.0006603100000000 ]  - [   0.0002116200000000,  0.0000878200000000, -0.0006633700000000 ]  - [  -0.0012730900000000,  0.0028050100000000,  0.0006977500000000 ]  - [  -0.0000402100000000, -0.0002328700000000, -0.0006639200000000 ]  - [   0.0011344100000000,  0.0004833100000000,  0.0003310700000000 ]  - [   0.0002062500000000,  0.0003037000000000, -0.0002658000000000 ]  - [   0.0001510700000000, -0.0003345300000000, -0.0002754500000000 ]  - [  -0.0000714600000000, -0.0002075600000000, -0.0003119900000000 ]  - [   0.0003550200000000,  0.0003817600000000, -0.0000729400000000 ]  - [  -0.0003581800000000,  0.0000287100000000, -0.0002699500000000 ]  - [  -0.0004262100000000,  0.0005719500000000,  0.0000736800000000 ]  - [  -0.0001643200000000,  0.0001253000000000, -0.0002518200000000 ]  - [  -0.0396998500000000,  0.0344336200000000, -0.0201578200000000 ]  - [  -0.0006429400000000, -0.0002489700000000,  0.0000061600000000 ]  - [   0.0002141400000000,  0.0000472000000000, -0.0002827300000000 ]  - [  -0.0011821100000000, -0.0002625700000000,  0.0003134400000000 ]  - [  -0.0001628000000000, -0.0000455400000000,  0.0001226600000000 ]  - [  -0.0001943400000000,  0.0001478000000000, -0.0005691500000000 ]  - [  -0.0002310700000000, -0.0000484000000000,  0.0004595600000000 ]  - [   0.0002453000000000,  0.0000930500000000, -0.0005785600000000 ]  - [  -0.0001949700000000,  0.0003027700000000,  0.0002915100000000 ]  - [  -0.0000311600000000, -0.0002580200000000, -0.0005579500000000 ]  - [   0.0000392500000000,  0.0001609700000000,  0.0001193700000000 ]  - [   0.0002192700000000,  0.0003043700000000, -0.0003538000000000 ]  - [   0.0002116700000000, -0.0003780400000000, -0.0002926700000000 ]  - [  -0.0000488500000000, -0.0002606300000000, -0.0002707500000000 ]  - [  -0.0001841100000000, -0.0003313400000000,  0.0002920400000000 ]  - [  -0.0002494300000000, -0.0000397300000000, -0.0003622900000000 ]  - [   0.0001519100000000, -0.0001659500000000,  0.0004562500000000 ]  - [  -0.0001955200000000,  0.0001783500000000, -0.0002686000000000 ]  - [   0.0003794700000000,  0.0000105100000000,  0.0002917800000000 ]  - [   0.0000767300000000,  0.0002189400000000,  0.0004480600000000 ]  - [   0.0002463000000000,  0.0000817900000000, -0.0002670800000000 ]  - [   0.0001217900000000, -0.0001221000000000,  0.0001253300000000 ]- atom:   10  displacement:    [   0.0049999999716508, -0.0086602540542118,  0.0000000000000000 ]  forces:  - [   0.0024690900000000, -0.0026726000000000, -0.0009569800000000 ]  - [  -0.0001731100000000,  0.0014418300000000,  0.0001011700000000 ]  - [   0.0000150800000000, -0.0000146900000000,  0.0001266300000000 ]  - [  -0.0005921700000000,  0.0000074100000000, -0.0011061600000000 ]  - [  -0.0000052400000000,  0.0000011700000000,  0.0001709700000000 ]  - [   0.0000017700000000, -0.0000015200000000, -0.0003515500000000 ]  - [  -0.0005711400000000,  0.0016332100000000, -0.0008586100000000 ]  - [   0.0001193200000000, -0.0002862400000000,  0.0002785300000000 ]  - [  -0.0000025900000000,  0.0000005100000000, -0.0001991800000000 ]  - [  -0.0924153100000000,  0.1762225100000000, -0.0052289400000000 ]  - [   0.0008915700000000, -0.0006747000000000, -0.0010013200000000 ]  - [  -0.0060948200000000, -0.0046524900000000,  0.0047745300000000 ]  - [  -0.0000084800000000, -0.0002897100000000, -0.0009947200000000 ]  - [   0.0348208700000000, -0.0130679600000000, -0.0037325500000000 ]  - [   0.0000626800000000, -0.0000267800000000, -0.0001602400000000 ]  - [  -0.0002694700000000,  0.0001962300000000,  0.0005327300000000 ]  - [   0.0029121400000000, -0.0026367900000000, -0.0006868900000000 ]  - [   0.0002620400000000,  0.0001624300000000,  0.0005144200000000 ]  - [   0.0132818200000000, -0.0121080700000000, -0.0208586200000000 ]  - [  -0.0000336300000000, -0.0003529800000000,  0.0005044900000000 ]  - [  -0.0118914700000000, -0.0087931100000000,  0.0148118900000000 ]  - [  -0.0002562300000000,  0.0001864800000000,  0.0004935300000000 ]  - [   0.0003283100000000, -0.0001625000000000, -0.0007149200000000 ]  - [   0.0003160700000000,  0.0001444000000000,  0.0005422800000000 ]  - [  -0.0003100700000000, -0.0001985700000000, -0.0007117100000000 ]  - [  -0.0000032000000000, -0.0002879300000000,  0.0005165100000000 ]  - [  -0.0000252600000000,  0.0003741000000000, -0.0007185900000000 ]  - [  -0.0006369000000000, -0.0000877100000000,  0.0010830100000000 ]  - [   0.0005768600000000, -0.0008747300000000, -0.0006306900000000 ]  - [  -0.0002623700000000,  0.0002255500000000,  0.0003288900000000 ]  - [   0.0140398600000000, -0.0307607600000000,  0.0275841300000000 ]  - [  -0.0001694200000000,  0.0003466100000000,  0.0002684000000000 ]  - [   0.0003841300000000, -0.0277989400000000, -0.0239409200000000 ]  - [  -0.0002789500000000,  0.0003584800000000,  0.0004516700000000 ]  - [  -0.0099516400000000, -0.0242258600000000, -0.0105661900000000 ]  - [   0.0008071400000000, -0.0034006800000000,  0.0001035400000000 ]  - [   0.0010710900000000,  0.0003634500000000, -0.0010513300000000 ]  - [  -0.0002294600000000, -0.0002702400000000,  0.0003103200000000 ]  - [  -0.0010213100000000,  0.0009466800000000, -0.0014808400000000 ]  - [   0.0001276600000000, -0.0001092400000000,  0.0006075100000000 ]  - [  -0.0010736900000000,  0.0001038400000000,  0.0005706500000000 ]  - [   0.0003489200000000,  0.0000129600000000,  0.0002210200000000 ]  - [  -0.0002062100000000,  0.0004379700000000,  0.0010674400000000 ]  - [   0.0112071800000000, -0.0106639300000000, -0.0031618000000000 ]  - [   0.0007861200000000,  0.0001142100000000, -0.0003997300000000 ]  - [  -0.0012966000000000,  0.0000785800000000, -0.0000180700000000 ]  - [  -0.0001233400000000,  0.0001900800000000, -0.0004752800000000 ]  - [  -0.0007347300000000,  0.0000256600000000,  0.0004457100000000 ]  - [   0.0002119000000000,  0.0000385200000000, -0.0005012400000000 ]  - [   0.0008288100000000, -0.0019974200000000, -0.0000090200000000 ]  - [  -0.0000702800000000, -0.0002183200000000, -0.0005285900000000 ]  - [  -0.0010313700000000, -0.0000819900000000, -0.0000148300000000 ]  - [   0.0001824100000000,  0.0003081700000000, -0.0002237800000000 ]  - [   0.0001752800000000, -0.0003459300000000, -0.0002232100000000 ]  - [   0.0000461200000000, -0.0001760700000000, -0.0001374000000000 ]  - [  -0.0007873500000000, -0.0009845000000000,  0.0006552400000000 ]  - [  -0.0003354300000000,  0.0000103300000000, -0.0002356100000000 ]  - [   0.0007659500000000, -0.0009284800000000,  0.0009988500000000 ]  - [  -0.0001373200000000,  0.0000705100000000, -0.0001762300000000 ]  - [   0.0417874000000000, -0.0357489300000000,  0.0220755100000000 ]  - [   0.0007790000000000,  0.0006560800000000,  0.0011209400000000 ]  - [   0.0001298800000000,  0.0001276800000000, -0.0001610200000000 ]  - [   0.0014451800000000, -0.0000128400000000, -0.0000127500000000 ]  - [  -0.0002392000000000, -0.0000883000000000,  0.0002631500000000 ]  - [  -0.0001616300000000,  0.0001904200000000, -0.0004545600000000 ]  - [  -0.0002455900000000, -0.0001025900000000,  0.0005830500000000 ]  - [   0.0002137700000000,  0.0000504000000000, -0.0004372000000000 ]  - [  -0.0001810800000000,  0.0002773600000000,  0.0003383200000000 ]  - [  -0.0000765200000000, -0.0002113000000000, -0.0004575400000000 ]  - [   0.0000411700000000,  0.0002507900000000,  0.0002636700000000 ]  - [   0.0001346700000000,  0.0003296400000000, -0.0002788500000000 ]  - [   0.0001717700000000, -0.0002398100000000, -0.0003277200000000 ]  - [  -0.0000374600000000, -0.0001587100000000, -0.0001149100000000 ]  - [  -0.0001723600000000, -0.0003004600000000,  0.0003440000000000 ]  - [  -0.0004861300000000,  0.0000384700000000, -0.0002773600000000 ]  - [   0.0002069900000000, -0.0001468300000000,  0.0005788000000000 ]  - [  -0.0001143200000000,  0.0001013500000000, -0.0001109900000000 ]  - [   0.0003676700000000,  0.0000023500000000,  0.0003375700000000 ]  - [   0.0000383100000000,  0.0002557700000000,  0.0005605500000000 ]  - [   0.0001550000000000,  0.0000533700000000, -0.0001151000000000 ]  - [   0.0002018200000000, -0.0001743900000000,  0.0002741200000000 ]- atom:   10  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0008510100000000,  0.0001721900000000, -0.0015760800000000 ]  - [   0.0009628300000000,  0.0001605500000000,  0.0011575800000000 ]  - [  -0.0000019400000000,  0.0000003300000000,  0.0007624700000000 ]  - [   0.0003752100000000,  0.0002890700000000,  0.0008126500000000 ]  - [  -0.0000011000000000,  0.0000005800000000,  0.0008102600000000 ]  - [   0.0000004900000000, -0.0000002500000000,  0.0002842300000000 ]  - [  -0.0014285800000000, -0.0025801200000000,  0.0011209600000000 ]  - [  -0.0000717200000000, -0.0003467500000000,  0.0012509200000000 ]  - [   0.0000010900000000,  0.0000010900000000,  0.0012028100000000 ]  - [  -0.0156178400000000, -0.0021120500000000, -0.1919938500000000 ]  - [   0.0001335800000000,  0.0001554100000000,  0.0001546300000000 ]  - [   0.0046077500000000, -0.0015860600000000, -0.0059836400000000 ]  - [  -0.0007631300000000, -0.0000197300000000, -0.0001070800000000 ]  - [   0.0024521800000000,  0.0029353800000000, -0.0059857300000000 ]  - [   0.0002970300000000, -0.0002451700000000, -0.0001088000000000 ]  - [  -0.0005076900000000,  0.0001955400000000,  0.0012049000000000 ]  - [   0.0008401000000000,  0.0002223200000000,  0.0028196300000000 ]  - [   0.0003941000000000,  0.0003981400000000,  0.0012481200000000 ]  - [  -0.0157241000000000,  0.0140583400000000,  0.0316421300000000 ]  - [   0.0001529400000000, -0.0005164000000000,  0.0012084500000000 ]  - [  -0.0108790200000000, -0.0171185000000000,  0.0316422700000000 ]  - [  -0.0005043800000000,  0.0001418700000000,  0.0012024400000000 ]  - [   0.0000698800000000, -0.0001815100000000, -0.0000290100000000 ]  - [   0.0004037100000000,  0.0003572900000000,  0.0012020400000000 ]  - [  -0.0002034700000000,  0.0000344300000000, -0.0000277700000000 ]  - [   0.0001421200000000, -0.0005376000000000,  0.0012434300000000 ]  - [   0.0001328100000000,  0.0001578200000000, -0.0000211500000000 ]  - [   0.0001088400000000, -0.0000177900000000, -0.0001173600000000 ]  - [   0.0015849400000000,  0.0005805800000000,  0.0041419700000000 ]  - [  -0.0001738200000000,  0.0001018500000000,  0.0003008100000000 ]  - [   0.0097345000000000, -0.0263599900000000,  0.0349008300000000 ]  - [  -0.0001733000000000,  0.0003001800000000,  0.0001533600000000 ]  - [   0.0018177200000000,  0.0279069100000000,  0.0347246000000000 ]  - [   0.0002318800000000,  0.0000194200000000,  0.0001219800000000 ]  - [   0.0126919700000000,  0.0211167900000000,  0.0158133200000000 ]  - [   0.0001240300000000, -0.0007451200000000,  0.0008909000000000 ]  - [  -0.0006028400000000,  0.0015004800000000,  0.0020198800000000 ]  - [  -0.0002216400000000, -0.0003801500000000,  0.0001195600000000 ]  - [   0.0001113300000000,  0.0000357000000000,  0.0000555900000000 ]  - [   0.0001623100000000, -0.0001572300000000,  0.0004819000000000 ]  - [   0.0003643400000000, -0.0012309300000000,  0.0018714100000000 ]  - [   0.0003696500000000,  0.0000253300000000,  0.0001137800000000 ]  - [   0.0004319700000000, -0.0000593800000000, -0.0000852500000000 ]  - [  -0.0094687200000000, -0.0006465600000000,  0.0167355600000000 ]  - [  -0.0001384800000000,  0.0006061100000000, -0.0005480500000000 ]  - [  -0.0000081400000000,  0.0001341100000000, -0.0010047500000000 ]  - [  -0.0003535100000000,  0.0001116800000000, -0.0009976500000000 ]  - [  -0.0012136100000000,  0.0008945800000000,  0.0003392600000000 ]  - [   0.0002516300000000,  0.0002233700000000, -0.0009585600000000 ]  - [  -0.0002862900000000,  0.0001425700000000,  0.0019196500000000 ]  - [   0.0000877500000000, -0.0003625400000000, -0.0010133100000000 ]  - [   0.0009777400000000,  0.0011798900000000,  0.0001437600000000 ]  - [   0.0001940500000000,  0.0002539400000000, -0.0003556700000000 ]  - [   0.0001195800000000, -0.0003199900000000, -0.0003630800000000 ]  - [  -0.0000299800000000, -0.0005045800000000, -0.0007242500000000 ]  - [  -0.0002069300000000, -0.0004456500000000,  0.0007884000000000 ]  - [  -0.0003124200000000,  0.0000463400000000, -0.0003622300000000 ]  - [   0.0005325100000000, -0.0000837700000000,  0.0035796100000000 ]  - [  -0.0003995000000000,  0.0003006100000000, -0.0006813800000000 ]  - [   0.0181235400000000, -0.0164986800000000,  0.0187367400000000 ]  - [  -0.0005986300000000, -0.0009659100000000,  0.0003193700000000 ]  - [   0.0004356700000000,  0.0002141900000000, -0.0006428200000000 ]  - [   0.0012082100000000, -0.0009817800000000,  0.0002833500000000 ]  - [   0.0000918200000000,  0.0000606100000000, -0.0002803500000000 ]  - [  -0.0003485400000000,  0.0001018800000000, -0.0009002500000000 ]  - [  -0.0001905100000000,  0.0001133600000000,  0.0001262100000000 ]  - [   0.0002846700000000,  0.0002466800000000, -0.0008915400000000 ]  - [  -0.0002280500000000,  0.0002993100000000,  0.0001987900000000 ]  - [   0.0000841100000000, -0.0003531100000000, -0.0008716200000000 ]  - [   0.0000045700000000, -0.0001107000000000, -0.0002825900000000 ]  - [   0.0002238000000000,  0.0002942200000000, -0.0004298400000000 ]  - [   0.0001469400000000, -0.0002272500000000, -0.0004392400000000 ]  - [  -0.0000900400000000, -0.0005151800000000, -0.0006604100000000 ]  - [  -0.0001688300000000, -0.0003595300000000,  0.0001993400000000 ]  - [  -0.0002787300000000, -0.0000038300000000, -0.0004491000000000 ]  - [  -0.0000077400000000, -0.0002122500000000,  0.0001236200000000 ]  - [  -0.0003984900000000,  0.0003413900000000, -0.0006658900000000 ]  - [   0.0004005600000000,  0.0000345800000000,  0.0002005200000000 ]  - [   0.0001959800000000,  0.0001018200000000,  0.0001133800000000 ]  - [   0.0004836200000000,  0.0001786000000000, -0.0006572000000000 ]  - [  -0.0000933700000000,  0.0000386400000000, -0.0002718700000000 ]- atom:   10  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0008581800000000, -0.0001759700000000,  0.0021045400000000 ]  - [  -0.0009722000000000, -0.0001604000000000, -0.0017078000000000 ]  - [   0.0000053100000000, -0.0000026800000000, -0.0002544800000000 ]  - [  -0.0003741500000000, -0.0002774800000000, -0.0013384900000000 ]  - [   0.0000002000000000, -0.0000002700000000, -0.0002948700000000 ]  - [   0.0000029700000000, -0.0000012100000000, -0.0008156700000000 ]  - [   0.0014425800000000,  0.0025739200000000, -0.0011260400000000 ]  - [   0.0000664900000000,  0.0003378200000000, -0.0012630900000000 ]  - [  -0.0000009200000000, -0.0000004900000000, -0.0012201600000000 ]  - [   0.0151175000000000,  0.0025001900000000,  0.1927099600000000 ]  - [   0.0004953900000000, -0.0005059400000000, -0.0014122300000000 ]  - [  -0.0041514800000000,  0.0019093700000000,  0.0071658100000000 ]  - [   0.0001549000000000, -0.0003473000000000, -0.0011475700000000 ]  - [  -0.0026438400000000, -0.0036606100000000,  0.0071547600000000 ]  - [  -0.0003100000000000,  0.0009707800000000, -0.0011482300000000 ]  - [  -0.0001060700000000,  0.0001756000000000,  0.0000334700000000 ]  - [  -0.0001222800000000, -0.0005714900000000, -0.0039560500000000 ]  - [   0.0002012000000000, -0.0000309100000000, -0.0000100300000000 ]  - [   0.0148970300000000, -0.0141326700000000, -0.0320040100000000 ]  - [  -0.0001498800000000, -0.0001859100000000,  0.0000519600000000 ]  - [   0.0107546900000000,  0.0175116500000000, -0.0320110700000000 ]  - [  -0.0001046400000000,  0.0001866000000000,  0.0000276100000000 ]  - [   0.0005510600000000, -0.0001230300000000, -0.0012133900000000 ]  - [   0.0001911100000000,  0.0000039100000000,  0.0000251700000000 ]  - [  -0.0004117600000000, -0.0004063700000000, -0.0012203300000000 ]  - [  -0.0001187100000000, -0.0001536600000000, -0.0000186700000000 ]  - [  -0.0001508700000000,  0.0005398700000000, -0.0011903600000000 ]  - [  -0.0004518100000000, -0.0001275100000000,  0.0005662100000000 ]  - [  -0.0018977800000000, -0.0002527500000000, -0.0052850800000000 ]  - [  -0.0002613000000000, -0.0002221100000000,  0.0008785900000000 ]  - [  -0.0097925500000000,  0.0273452800000000, -0.0365824000000000 ]  - [  -0.0001310900000000,  0.0003267500000000,  0.0003559900000000 ]  - [  -0.0021740400000000, -0.0293274000000000, -0.0364117800000000 ]  - [  -0.0001976600000000,  0.0003355200000000,  0.0003035100000000 ]  - [  -0.0119888400000000, -0.0200091900000000, -0.0161882300000000 ]  - [   0.0001814000000000,  0.0001055700000000, -0.0015717400000000 ]  - [   0.0004821900000000, -0.0018914300000000, -0.0023565200000000 ]  - [  -0.0001421800000000, -0.0002073500000000,  0.0003615500000000 ]  - [  -0.0008113100000000,  0.0000494100000000, -0.0007039100000000 ]  - [   0.0001518600000000, -0.0001414800000000,  0.0006830500000000 ]  - [  -0.0006324100000000,  0.0015198300000000, -0.0022041200000000 ]  - [   0.0003382900000000, -0.0000554300000000,  0.0003686900000000 ]  - [  -0.0003047500000000,  0.0004958900000000,  0.0012521700000000 ]  - [   0.0103953000000000,  0.0008130200000000, -0.0174699800000000 ]  - [   0.0004459000000000, -0.0008490600000000,  0.0010120100000000 ]  - [  -0.0003923900000000, -0.0002279200000000,  0.0013002400000000 ]  - [   0.0000280600000000,  0.0002422900000000, -0.0001625300000000 ]  - [   0.0007544400000000, -0.0009679100000000,  0.0007840300000000 ]  - [   0.0001518000000000, -0.0000957300000000, -0.0001973000000000 ]  - [   0.0000160400000000,  0.0005068600000000, -0.0014416000000000 ]  - [  -0.0001881300000000, -0.0000792400000000, -0.0001799400000000 ]  - [  -0.0008501100000000, -0.0007576900000000,  0.0001848600000000 ]  - [   0.0001705600000000,  0.0003450000000000, -0.0000982700000000 ]  - [   0.0002124400000000, -0.0003212500000000, -0.0000930200000000 ]  - [  -0.0000061800000000,  0.0001172500000000,  0.0002775900000000 ]  - [  -0.0002140000000000, -0.0001338000000000, -0.0002616300000000 ]  - [  -0.0003417600000000, -0.0000231800000000, -0.0001103800000000 ]  - [  -0.0003296500000000, -0.0002633300000000, -0.0022920300000000 ]  - [   0.0001159000000000, -0.0001030600000000,  0.0002640100000000 ]  - [  -0.0170016700000000,  0.0159657700000000, -0.0179143600000000 ]  - [   0.0006960400000000,  0.0013559600000000,  0.0008090600000000 ]  - [  -0.0000833700000000, -0.0000540600000000,  0.0002006200000000 ]  - [  -0.0009176100000000,  0.0006653000000000,  0.0000354500000000 ]  - [  -0.0004679800000000, -0.0001743300000000,  0.0006610100000000 ]  - [   0.0000237500000000,  0.0002030200000000, -0.0000921100000000 ]  - [  -0.0002635800000000, -0.0002131300000000,  0.0008639900000000 ]  - [   0.0001823500000000, -0.0001217000000000, -0.0001102200000000 ]  - [  -0.0001426300000000,  0.0002482900000000,  0.0004390900000000 ]  - [  -0.0002136400000000, -0.0000942800000000, -0.0001031800000000 ]  - [   0.0000844500000000,  0.0004967900000000,  0.0006635000000000 ]  - [   0.0000882300000000,  0.0003135600000000, -0.0001834000000000 ]  - [   0.0002134300000000, -0.0003605700000000, -0.0001946300000000 ]  - [  -0.0000018600000000,  0.0001311400000000,  0.0003016700000000 ]  - [  -0.0001723400000000, -0.0002389900000000,  0.0004652200000000 ]  - [  -0.0004355000000000, -0.0000216500000000, -0.0001604500000000 ]  - [   0.0003176700000000, -0.0001021500000000,  0.0008672900000000 ]  - [   0.0000964300000000, -0.0000344500000000,  0.0002800800000000 ]  - [   0.0003050100000000, -0.0000145300000000,  0.0004518900000000 ]  - [  -0.0000638800000000,  0.0003293400000000,  0.0008557500000000 ]  - [  -0.0000939100000000, -0.0000670800000000,  0.0002904200000000 ]  - [   0.0003926000000000, -0.0003314600000000,  0.0006705300000000 ]- atom:   28  displacement:    [   0.0100000000000000, -0.0000000000428756,  0.0000000000000000 ]  forces:  - [  -0.0002544700000000, -0.0000407900000000, -0.0002980400000000 ]  - [   0.0002632600000000,  0.0003851300000000, -0.0009403800000000 ]  - [  -0.0000023900000000,  0.0000011400000000,  0.0005287000000000 ]  - [   0.0000038600000000,  0.0000015300000000,  0.0000081800000000 ]  - [   0.0000571300000000, -0.0000411500000000,  0.0004339800000000 ]  - [  -0.0000042300000000,  0.0000011900000000, -0.0000030100000000 ]  - [   0.0012901000000000,  0.0008900400000000, -0.0023372700000000 ]  - [  -0.0000000200000000, -0.0000002300000000,  0.0005897600000000 ]  - [   0.0000198500000000,  0.0000532400000000,  0.0006182300000000 ]  - [  -0.0005761000000000,  0.0005575500000000,  0.0008852400000000 ]  - [   0.0251074000000000,  0.0013518300000000, -0.0108962500000000 ]  - [   0.0004268500000000,  0.0008603000000000,  0.0013695000000000 ]  - [  -0.0006911200000000,  0.0005616500000000, -0.0020590600000000 ]  - [  -0.0000201600000000, -0.0003314100000000,  0.0006417300000000 ]  - [  -0.0013064600000000, -0.0001089600000000, -0.0018216000000000 ]  - [  -0.0004103900000000,  0.0001745000000000,  0.0009025100000000 ]  - [   0.0001933700000000, -0.0001855400000000, -0.0003385100000000 ]  - [   0.0003434000000000,  0.0002783800000000,  0.0009029900000000 ]  - [  -0.0002869100000000, -0.0000490900000000, -0.0003085700000000 ]  - [   0.0000580200000000, -0.0004308200000000,  0.0009072800000000 ]  - [   0.0000797400000000,  0.0002700800000000, -0.0003211800000000 ]  - [  -0.0019142800000000,  0.0004962900000000,  0.0007870500000000 ]  - [   0.0001727500000000, -0.0001729000000000, -0.0003253100000000 ]  - [   0.0008616100000000, -0.0001961700000000, -0.0006517000000000 ]  - [  -0.0002453900000000, -0.0000600300000000, -0.0003265400000000 ]  - [   0.0006982800000000,  0.0001607900000000, -0.0007065700000000 ]  - [   0.0000638000000000,  0.0002499500000000, -0.0003144200000000 ]  - [  -0.0434824800000000, -0.0070481800000000,  0.0202433800000000 ]  - [  -0.0001606200000000,  0.0001238600000000, -0.0006603700000000 ]  - [   0.0062501600000000, -0.0022942200000000, -0.0003171800000000 ]  - [   0.0002189600000000, -0.0000189200000000, -0.0005473100000000 ]  - [  -0.0001079500000000,  0.0004750000000000,  0.0002956100000000 ]  - [  -0.0000862700000000, -0.0003794300000000, -0.0008146600000000 ]  - [   0.0000142500000000,  0.0014112900000000,  0.0013220400000000 ]  - [   0.0001972700000000,  0.0002436400000000, -0.0003367200000000 ]  - [   0.0001346100000000, -0.0003854700000000, -0.0003562500000000 ]  - [   0.0006788200000000, -0.0006788700000000, -0.0013645300000000 ]  - [  -0.0000961800000000, -0.0016166900000000, -0.0015157400000000 ]  - [  -0.0003198500000000,  0.0000245100000000, -0.0003246300000000 ]  - [   0.0029274000000000, -0.0001665400000000,  0.0022018300000000 ]  - [  -0.0005627600000000, -0.0000445200000000, -0.0000434300000000 ]  - [   0.0022237100000000, -0.0002758600000000,  0.0009807600000000 ]  - [   0.0058890300000000,  0.0044678800000000,  0.0000078500000000 ]  - [   0.0007561200000000,  0.0009532600000000, -0.0006460400000000 ]  - [   0.0019783800000000, -0.0002747000000000,  0.0014236400000000 ]  - [  -0.0000559300000000,  0.0000019200000000, -0.0000698000000000 ]  - [  -0.0002525700000000,  0.0001497500000000, -0.0007714000000000 ]  - [  -0.0001895500000000,  0.0000387900000000,  0.0003802100000000 ]  - [   0.0002259600000000,  0.0001543500000000, -0.0007692200000000 ]  - [  -0.0001465800000000,  0.0002802600000000,  0.0002657600000000 ]  - [   0.0000171200000000, -0.0002897700000000, -0.0007948700000000 ]  - [   0.0000300800000000,  0.0000389300000000, -0.0000754700000000 ]  - [   0.0001985700000000,  0.0002873900000000, -0.0002979700000000 ]  - [   0.0001418900000000, -0.0003503000000000, -0.0003064400000000 ]  - [  -0.0000361200000000, -0.0003461500000000, -0.0004570300000000 ]  - [  -0.0002448200000000, -0.0003859900000000,  0.0001943700000000 ]  - [  -0.0003236100000000,  0.0000349500000000, -0.0003107300000000 ]  - [   0.0000530200000000, -0.0001961300000000,  0.0003643700000000 ]  - [  -0.0002655100000000,  0.0001869700000000, -0.0004384900000000 ]  - [   0.0004119600000000, -0.0000255000000000,  0.0002217300000000 ]  - [   0.0001472800000000,  0.0001360400000000,  0.0003722400000000 ]  - [   0.0003167100000000,  0.0001437500000000, -0.0004537600000000 ]  - [   0.0000214100000000, -0.0000490700000000, -0.0000700200000000 ]  - [  -0.0000545800000000,  0.0000074200000000, -0.0000464700000000 ]  - [  -0.0001523300000000,  0.0001462600000000, -0.0006394700000000 ]  - [  -0.0002233500000000,  0.0000136900000000,  0.0003438200000000 ]  - [   0.0002828800000000,  0.0000946900000000, -0.0005549500000000 ]  - [  -0.0002088800000000,  0.0002910500000000,  0.0002532100000000 ]  - [   0.0001062200000000, -0.0002907000000000, -0.0006313700000000 ]  - [   0.0000247100000000,  0.0000404400000000, -0.0000469200000000 ]  - [   0.0007043900000000,  0.0005798400000000, -0.0001703100000000 ]  - [   0.0003412500000000, -0.0005901500000000, -0.0001487800000000 ]  - [  -0.0002585700000000, -0.0005711000000000, -0.0005278900000000 ]  - [  -0.0001809500000000, -0.0003382500000000,  0.0002608400000000 ]  - [  -0.0014246200000000,  0.0011581900000000, -0.0014319500000000 ]  - [   0.0000915100000000, -0.0001738800000000,  0.0003368300000000 ]  - [  -0.0005494700000000,  0.0004107300000000, -0.0005344300000000 ]  - [   0.0004055800000000,  0.0000170300000000,  0.0002515100000000 ]  - [   0.0001235700000000,  0.0001757700000000,  0.0003207900000000 ]  - [   0.0005110000000000,  0.0000972300000000, -0.0004653200000000 ]  - [   0.0000322900000000, -0.0000710300000000, -0.0000276300000000 ]- atom:   28  displacement:    [  -0.0100000000000000,  0.0000000000428756,  0.0000000000000000 ]  forces:  - [   0.0002551000000000,  0.0000352700000000,  0.0008185400000000 ]  - [  -0.0002627100000000, -0.0003695400000000,  0.0004171900000000 ]  - [  -0.0000009200000000, -0.0000019200000000, -0.0000094800000000 ]  - [  -0.0000004300000000,  0.0000072700000000, -0.0005340000000000 ]  - [  -0.0000583900000000,  0.0000426800000000,  0.0000926100000000 ]  - [   0.0000046200000000, -0.0000003800000000, -0.0005171100000000 ]  - [  -0.0012942300000000, -0.0009265100000000,  0.0023582000000000 ]  - [  -0.0000048100000000,  0.0000018000000000, -0.0005931300000000 ]  - [  -0.0000206600000000, -0.0000520800000000, -0.0006139000000000 ]  - [  -0.0000142900000000, -0.0001732400000000,  0.0003193600000000 ]  - [  -0.0235227400000000, -0.0015973500000000,  0.0089521400000000 ]  - [   0.0001729500000000, -0.0005237700000000, -0.0001693500000000 ]  - [   0.0001072800000000, -0.0008881400000000,  0.0008229700000000 ]  - [   0.0000099600000000, -0.0003586600000000,  0.0005657500000000 ]  - [   0.0013461500000000,  0.0007912500000000,  0.0005870400000000 ]  - [  -0.0001984100000000,  0.0001942000000000,  0.0003284600000000 ]  - [   0.0004181100000000, -0.0001581300000000, -0.0008700300000000 ]  - [   0.0002579000000000,  0.0000824700000000,  0.0003259400000000 ]  - [  -0.0003319300000000, -0.0002905900000000, -0.0009055400000000 ]  - [  -0.0000613200000000, -0.0002619300000000,  0.0003325300000000 ]  - [  -0.0000694300000000,  0.0004526700000000, -0.0008857500000000 ]  - [   0.0013099900000000, -0.0001693500000000,  0.0004158200000000 ]  - [   0.0004255900000000, -0.0001392900000000, -0.0009045700000000 ]  - [  -0.0002595800000000,  0.0005500600000000,  0.0018392500000000 ]  - [  -0.0003551300000000, -0.0002860900000000, -0.0009053100000000 ]  - [  -0.0006701400000000, -0.0008425100000000,  0.0018913000000000 ]  - [  -0.0000794800000000,  0.0004475300000000, -0.0009042600000000 ]  - [   0.0419545200000000,  0.0067707500000000, -0.0190304100000000 ]  - [  -0.0000968000000000,  0.0002271700000000, -0.0004343400000000 ]  - [  -0.0065511500000000,  0.0020965800000000,  0.0014841800000000 ]  - [   0.0001895900000000,  0.0000653900000000, -0.0005307400000000 ]  - [  -0.0002285300000000,  0.0001991800000000,  0.0001893100000000 ]  - [  -0.0000639500000000, -0.0000190100000000, -0.0003122500000000 ]  - [   0.0000203000000000, -0.0010148400000000, -0.0008655800000000 ]  - [   0.0001973100000000,  0.0003177800000000, -0.0002609900000000 ]  - [   0.0001551500000000, -0.0002865700000000, -0.0002450200000000 ]  - [  -0.0007906500000000,  0.0002861900000000,  0.0010490600000000 ]  - [  -0.0003199900000000,  0.0010146400000000,  0.0020085200000000 ]  - [  -0.0003745000000000,  0.0000598300000000, -0.0002868800000000 ]  - [  -0.0026314300000000, -0.0001375800000000, -0.0009981500000000 ]  - [   0.0002902900000000,  0.0003292300000000, -0.0002716700000000 ]  - [  -0.0015034400000000,  0.0002381300000000, -0.0005200600000000 ]  - [  -0.0056903400000000, -0.0039174300000000,  0.0011706200000000 ]  - [  -0.0003691900000000, -0.0008472000000000,  0.0003270200000000 ]  - [  -0.0016702700000000,  0.0000473900000000, -0.0009724000000000 ]  - [  -0.0003600800000000, -0.0001032100000000,  0.0003956200000000 ]  - [  -0.0000657500000000,  0.0002004200000000, -0.0003894900000000 ]  - [  -0.0002415300000000, -0.0001247300000000,  0.0007576600000000 ]  - [   0.0001822800000000, -0.0000418100000000, -0.0003749600000000 ]  - [  -0.0001357900000000,  0.0003272100000000,  0.0003140200000000 ]  - [  -0.0001228600000000, -0.0001437700000000, -0.0003993900000000 ]  - [   0.0000769800000000,  0.0003441300000000,  0.0003796200000000 ]  - [   0.0001770600000000,  0.0003139500000000, -0.0001907800000000 ]  - [   0.0001815000000000, -0.0003515700000000, -0.0001940200000000 ]  - [  -0.0000011300000000, -0.0000364000000000,  0.0000017400000000 ]  - [  -0.0001932600000000, -0.0002003300000000,  0.0003796300000000 ]  - [  -0.0003481100000000,  0.0000020100000000, -0.0001958200000000 ]  - [   0.0002210700000000, -0.0001202500000000,  0.0007399500000000 ]  - [  -0.0000160600000000,  0.0000016900000000,  0.0000191000000000 ]  - [   0.0002996400000000, -0.0000439800000000,  0.0003487000000000 ]  - [   0.0000119100000000,  0.0002807800000000,  0.0007345300000000 ]  - [   0.0000179400000000,  0.0000181700000000,  0.0000119000000000 ]  - [   0.0002716900000000, -0.0002562100000000,  0.0003947800000000 ]  - [  -0.0003374600000000, -0.0001206100000000,  0.0004258100000000 ]  - [  -0.0001959300000000,  0.0001751500000000, -0.0003766500000000 ]  - [  -0.0002598600000000, -0.0001576100000000,  0.0007047200000000 ]  - [   0.0001797200000000,  0.0000397000000000, -0.0004594200000000 ]  - [  -0.0001639700000000,  0.0002668500000000,  0.0003614300000000 ]  - [  -0.0002225200000000, -0.0001653600000000, -0.0003716000000000 ]  - [   0.0000668800000000,  0.0003545400000000,  0.0004218800000000 ]  - [  -0.0003409400000000,  0.0000519000000000, -0.0004732200000000 ]  - [   0.0000213700000000, -0.0000365500000000, -0.0004916600000000 ]  - [   0.0001659300000000,  0.0001794200000000,  0.0001578500000000 ]  - [  -0.0001780000000000, -0.0002855800000000,  0.0003671000000000 ]  - [   0.0006723500000000, -0.0011872000000000,  0.0008286100000000 ]  - [   0.0002638000000000, -0.0001192100000000,  0.0007037200000000 ]  - [   0.0002477400000000, -0.0001232200000000,  0.0001531900000000 ]  - [   0.0003483600000000,  0.0000028300000000,  0.0003553800000000 ]  - [  -0.0000045700000000,  0.0002878600000000,  0.0006728200000000 ]  - [  -0.0001246100000000,  0.0000219500000000,  0.0000931400000000 ]  - [   0.0002862100000000, -0.0002463400000000,  0.0004391400000000 ]- atom:   28  displacement:    [  -0.0049999999716508,  0.0086602540542118,  0.0000000000000000 ]  forces:  - [   0.0001114800000000,  0.0001015000000000,  0.0003161700000000 ]  - [  -0.0004350500000000,  0.0018405400000000, -0.0001005700000000 ]  - [  -0.0000002300000000, -0.0000010700000000,  0.0002169900000000 ]  - [  -0.0000010600000000,  0.0000088500000000, -0.0002936600000000 ]  - [  -0.0000554800000000,  0.0000128300000000,  0.0001966800000000 ]  - [   0.0000014700000000,  0.0000003300000000, -0.0002957300000000 ]  - [   0.0022123700000000,  0.0082578100000000, -0.0051470600000000 ]  - [  -0.0000025600000000,  0.0000020500000000, -0.0000779700000000 ]  - [   0.0000035100000000, -0.0000439700000000, -0.0000734900000000 ]  - [  -0.0007514900000000, -0.0003476400000000,  0.0004978400000000 ]  - [  -0.0119496900000000,  0.0097601400000000,  0.0036721000000000 ]  - [   0.0008038200000000,  0.0001732100000000,  0.0001066400000000 ]  - [  -0.0007992000000000, -0.0011994500000000,  0.0003336900000000 ]  - [   0.0003365800000000, -0.0008637500000000,  0.0008034800000000 ]  - [   0.0010200000000000,  0.0010463800000000, -0.0011458800000000 ]  - [  -0.0002823700000000,  0.0001860400000000,  0.0005722600000000 ]  - [   0.0003752100000000, -0.0001853900000000, -0.0006114700000000 ]  - [   0.0002935500000000,  0.0001583300000000,  0.0005724300000000 ]  - [  -0.0003088000000000, -0.0002364100000000, -0.0006376400000000 ]  - [  -0.0000177600000000, -0.0003260100000000,  0.0005726000000000 ]  - [  -0.0000354700000000,  0.0004431700000000, -0.0006080300000000 ]  - [   0.0003942200000000, -0.0002118900000000,  0.0006619000000000 ]  - [   0.0003142600000000, -0.0001575900000000, -0.0006537800000000 ]  - [   0.0010518200000000,  0.0003371400000000,  0.0007884100000000 ]  - [  -0.0003058300000000, -0.0001778900000000, -0.0006531300000000 ]  - [  -0.0013853000000000, -0.0007712100000000,  0.0015170900000000 ]  - [  -0.0000144200000000,  0.0003525400000000, -0.0006515200000000 ]  - [   0.0151496500000000, -0.0229625300000000, -0.0011525100000000 ]  - [  -0.0001634500000000,  0.0002005700000000, -0.0004124900000000 ]  - [  -0.0064410500000000,  0.0007640000000000,  0.0025411100000000 ]  - [   0.0001922200000000,  0.0001059100000000, -0.0004624600000000 ]  - [  -0.0001526400000000,  0.0003224600000000,  0.0002215800000000 ]  - [  -0.0000773800000000,  0.0005798600000000,  0.0010038000000000 ]  - [  -0.0003045100000000,  0.0012493900000000,  0.0004925000000000 ]  - [   0.0002770900000000,  0.0003948200000000, -0.0002670300000000 ]  - [   0.0001464900000000, -0.0003534000000000, -0.0002798300000000 ]  - [  -0.0000934600000000, -0.0006096400000000, -0.0000325400000000 ]  - [  -0.0028268400000000,  0.0004135800000000,  0.0037723200000000 ]  - [  -0.0004357300000000,  0.0001025700000000, -0.0003227500000000 ]  - [  -0.0014844600000000, -0.0001657600000000, -0.0000734100000000 ]  - [  -0.0008264500000000,  0.0005820700000000, -0.0009997100000000 ]  - [  -0.0003023100000000, -0.0000255300000000,  0.0000929400000000 ]  - [   0.0024526000000000, -0.0000797700000000, -0.0006973000000000 ]  - [   0.0006836500000000,  0.0009346900000000, -0.0008223000000000 ]  - [   0.0004651400000000,  0.0000858600000000,  0.0003871500000000 ]  - [  -0.0002171800000000, -0.0000665000000000,  0.0001851300000000 ]  - [  -0.0001526900000000,  0.0001743600000000, -0.0005606100000000 ]  - [  -0.0002329400000000, -0.0000549400000000,  0.0006427300000000 ]  - [   0.0002100600000000,  0.0000503300000000, -0.0005554900000000 ]  - [  -0.0001805600000000,  0.0004094500000000,  0.0002580500000000 ]  - [  -0.0000601000000000, -0.0002183100000000, -0.0005767100000000 ]  - [   0.0000386200000000,  0.0002038100000000,  0.0001707700000000 ]  - [   0.0001980100000000,  0.0003125700000000, -0.0002405900000000 ]  - [   0.0001687800000000, -0.0003541600000000, -0.0002445200000000 ]  - [   0.0000015900000000, -0.0001691600000000, -0.0001912200000000 ]  - [  -0.0003084600000000, -0.0003232600000000,  0.0003202200000000 ]  - [  -0.0003513400000000,  0.0000180100000000, -0.0002471700000000 ]  - [   0.0001512600000000, -0.0001357500000000,  0.0006214100000000 ]  - [  -0.0001351000000000,  0.0000743900000000, -0.0001793000000000 ]  - [   0.0003935900000000, -0.0000273000000000,  0.0002772600000000 ]  - [   0.0000654400000000,  0.0002344300000000,  0.0005991200000000 ]  - [   0.0001450900000000,  0.0000855500000000, -0.0001885800000000 ]  - [   0.0001732100000000, -0.0001563600000000,  0.0001871900000000 ]  - [  -0.0002143600000000, -0.0000804300000000,  0.0002223800000000 ]  - [  -0.0001982300000000,  0.0001193300000000, -0.0005192300000000 ]  - [  -0.0002412100000000, -0.0000897000000000,  0.0005490100000000 ]  - [   0.0003456400000000,  0.0000814000000000, -0.0005897100000000 ]  - [  -0.0001844000000000,  0.0002895000000000,  0.0003228900000000 ]  - [  -0.0001721100000000, -0.0002279600000000, -0.0004339600000000 ]  - [   0.0000346100000000,  0.0002232200000000,  0.0002162400000000 ]  - [  -0.0000795700000000,  0.0001594300000000, -0.0004805200000000 ]  - [   0.0001309400000000, -0.0002539200000000, -0.0003547400000000 ]  - [  -0.0000873900000000, -0.0001335600000000, -0.0000289200000000 ]  - [  -0.0001850500000000, -0.0003175500000000,  0.0003254600000000 ]  - [   0.0031340800000000,  0.0004088900000000, -0.0036925500000000 ]  - [   0.0001984700000000, -0.0001505600000000,  0.0005505100000000 ]  - [   0.0001107400000000,  0.0000452800000000, -0.0001802300000000 ]  - [   0.0003833100000000,  0.0000024100000000,  0.0003200900000000 ]  - [   0.0000484000000000,  0.0002456200000000,  0.0005279000000000 ]  - [   0.0000530300000000,  0.0000749700000000, -0.0001292700000000 ]  - [   0.0001837000000000, -0.0001512700000000,  0.0002295400000000 ]- atom:   28  displacement:    [   0.0049999999716508, -0.0086602540542118,  0.0000000000000000 ]  forces:  - [  -0.0001124100000000, -0.0001076400000000,  0.0002084800000000 ]  - [   0.0003934000000000, -0.0016615400000000, -0.0004063900000000 ]  - [  -0.0000027000000000,  0.0000012700000000,  0.0002986600000000 ]  - [   0.0000046200000000,  0.0000012300000000, -0.0002319500000000 ]  - [   0.0000541000000000, -0.0000105000000000,  0.0003234000000000 ]  - [   0.0000005100000000,  0.0000003300000000, -0.0002294400000000 ]  - [  -0.0023328300000000, -0.0083471900000000,  0.0052798000000000 ]  - [   0.0000011700000000, -0.0000002500000000,  0.0000698700000000 ]  - [  -0.0000039600000000,  0.0000451400000000,  0.0000702000000000 ]  - [   0.0001810700000000,  0.0007257300000000,  0.0006885000000000 ]  - [   0.0126482100000000, -0.0100761400000000, -0.0049892300000000 ]  - [  -0.0001988300000000,  0.0001475800000000,  0.0010730000000000 ]  - [   0.0002097700000000,  0.0008782300000000, -0.0015519400000000 ]  - [  -0.0003614900000000,  0.0001954800000000,  0.0003846600000000 ]  - [  -0.0009976900000000, -0.0003686300000000, -0.0000675300000000 ]  - [  -0.0003082100000000,  0.0001796300000000,  0.0006485400000000 ]  - [   0.0002024600000000, -0.0001632100000000, -0.0005827100000000 ]  - [   0.0003055700000000,  0.0001815400000000,  0.0006488900000000 ]  - [  -0.0002903700000000, -0.0000590100000000, -0.0005537000000000 ]  - [  -0.0000025700000000, -0.0003493200000000,  0.0006494500000000 ]  - [   0.0000715500000000,  0.0002516100000000, -0.0005829100000000 ]  - [  -0.0009576600000000,  0.0005570500000000,  0.0005372800000000 ]  - [   0.0002678000000000, -0.0001640500000000, -0.0005696200000000 ]  - [  -0.0004663000000000, -0.0000065900000000,  0.0004207700000000 ]  - [  -0.0002819500000000, -0.0001486000000000, -0.0005682900000000 ]  - [   0.0013803900000000,  0.0001131000000000, -0.0003126000000000 ]  - [   0.0000123300000000,  0.0003260400000000, -0.0005646300000000 ]  - [  -0.0155993700000000,  0.0227260300000000,  0.0016278700000000 ]  - [  -0.0001175700000000,  0.0001504900000000, -0.0007082300000000 ]  - [   0.0061358700000000, -0.0009286100000000, -0.0013533000000000 ]  - [   0.0002266800000000, -0.0000425700000000, -0.0006313400000000 ]  - [  -0.0001736900000000,  0.0003496600000000,  0.0002731100000000 ]  - [  -0.0000562900000000, -0.0009828400000000, -0.0021267200000000 ]  - [   0.0003144200000000, -0.0008836800000000, -0.0000542400000000 ]  - [   0.0001281200000000,  0.0001774600000000, -0.0003265200000000 ]  - [   0.0001501500000000, -0.0003508900000000, -0.0003176900000000 ]  - [  -0.0000068400000000,  0.0002055100000000, -0.0002936900000000 ]  - [   0.0024273900000000, -0.0010486600000000, -0.0033437900000000 ]  - [  -0.0002790600000000, -0.0000080300000000, -0.0002876100000000 ]  - [   0.0018048100000000, -0.0001518700000000,  0.0012634400000000 ]  - [   0.0005455600000000, -0.0003087500000000,  0.0006905100000000 ]  - [   0.0010283200000000, -0.0000091400000000,  0.0003964600000000 ]  - [  -0.0023695800000000,  0.0005298700000000,  0.0019131400000000 ]  - [  -0.0002988700000000, -0.0008205400000000,  0.0005060600000000 ]  - [  -0.0001469400000000, -0.0002800100000000,  0.0000478400000000 ]  - [  -0.0001875100000000, -0.0000481600000000,  0.0001384800000000 ]  - [  -0.0001759600000000,  0.0001642500000000, -0.0006114700000000 ]  - [  -0.0002022900000000, -0.0000397900000000,  0.0005112700000000 ]  - [   0.0002136800000000,  0.0000730000000000, -0.0006068100000000 ]  - [  -0.0001027100000000,  0.0002177800000000,  0.0003333700000000 ]  - [  -0.0000426400000000, -0.0002313600000000, -0.0006230100000000 ]  - [   0.0000524400000000,  0.0001771900000000,  0.0001308800000000 ]  - [   0.0001935500000000,  0.0003000700000000, -0.0002522800000000 ]  - [   0.0001603100000000, -0.0003446200000000, -0.0002564100000000 ]  - [  -0.0000181100000000, -0.0002077600000000, -0.0002552300000000 ]  - [  -0.0001548400000000, -0.0002836200000000,  0.0002654200000000 ]  - [  -0.0003445700000000,  0.0000223100000000, -0.0002593700000000 ]  - [   0.0001310900000000, -0.0001786900000000,  0.0004955700000000 ]  - [  -0.0001603000000000,  0.0001102300000000, -0.0002439300000000 ]  - [   0.0003408300000000, -0.0000468900000000,  0.0003031100000000 ]  - [   0.0000950800000000,  0.0001903500000000,  0.0005153200000000 ]  - [   0.0001861200000000,  0.0000893300000000, -0.0002506900000000 ]  - [   0.0001288700000000, -0.0001376500000000,  0.0001387800000000 ]  - [  -0.0001757500000000, -0.0000499300000000,  0.0001548600000000 ]  - [  -0.0001543700000000,  0.0002030900000000, -0.0005085900000000 ]  - [  -0.0002345800000000, -0.0000635700000000,  0.0004982500000000 ]  - [   0.0001239400000000,  0.0000552800000000, -0.0004254700000000 ]  - [  -0.0001887600000000,  0.0002898100000000,  0.0003045500000000 ]  - [   0.0000606500000000, -0.0002303100000000, -0.0005698100000000 ]  - [   0.0000420300000000,  0.0001738000000000,  0.0001548600000000 ]  - [   0.0004275100000000,  0.0004685500000000, -0.0001611900000000 ]  - [   0.0002428700000000, -0.0003653000000000, -0.0002841200000000 ]  - [   0.0000111100000000, -0.0002621500000000, -0.0003440100000000 ]  - [  -0.0001798500000000, -0.0003205100000000,  0.0003069800000000 ]  - [  -0.0038694700000000, -0.0004163600000000,  0.0030384800000000 ]  - [   0.0001632000000000, -0.0001580000000000,  0.0004870400000000 ]  - [  -0.0004154400000000,  0.0002337000000000, -0.0001987200000000 ]  - [   0.0003760300000000,  0.0000079400000000,  0.0003024900000000 ]  - [   0.0000682300000000,  0.0002259700000000,  0.0004772600000000 ]  - [   0.0003243900000000,  0.0000562900000000, -0.0002385100000000 ]  - [   0.0001361300000000, -0.0001390000000000,  0.0001668400000000 ]- atom:   28  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0002515600000000, -0.0000744900000000,  0.0008873100000000 ]  - [  -0.0000712100000000, -0.0002489800000000,  0.0009989000000000 ]  - [  -0.0000002300000000, -0.0000024500000000, -0.0001803200000000 ]  - [  -0.0000014600000000,  0.0000075600000000, -0.0007078200000000 ]  - [  -0.0000436100000000, -0.0000212800000000, -0.0001786200000000 ]  - [   0.0000042500000000,  0.0000019900000000, -0.0006847300000000 ]  - [  -0.0024970700000000, -0.0056069400000000,  0.0065715400000000 ]  - [  -0.0000051700000000,  0.0000016800000000, -0.0009729200000000 ]  - [  -0.0000080400000000, -0.0000114800000000, -0.0010054600000000 ]  - [  -0.0003304600000000, -0.0008147200000000,  0.0002573700000000 ]  - [  -0.0081054100000000, -0.0017743100000000,  0.0162942000000000 ]  - [   0.0009349100000000, -0.0002866600000000, -0.0001810200000000 ]  - [  -0.0010384900000000, -0.0001311200000000,  0.0014105700000000 ]  - [  -0.0004137900000000,  0.0001532800000000,  0.0005062400000000 ]  - [  -0.0009786000000000, -0.0001105900000000,  0.0015673900000000 ]  - [  -0.0001214700000000,  0.0002017000000000,  0.0001399900000000 ]  - [   0.0004546200000000, -0.0001476600000000, -0.0010236800000000 ]  - [   0.0002278100000000,  0.0000131600000000,  0.0001414700000000 ]  - [  -0.0003354800000000, -0.0003190200000000, -0.0010740500000000 ]  - [  -0.0001077700000000, -0.0002008800000000,  0.0001440900000000 ]  - [  -0.0001346500000000,  0.0005355800000000, -0.0011028600000000 ]  - [   0.0000130600000000,  0.0005334000000000, -0.0005457200000000 ]  - [   0.0004886400000000, -0.0001373100000000, -0.0010911700000000 ]  - [   0.0004496100000000,  0.0007549600000000,  0.0007219600000000 ]  - [  -0.0003793000000000, -0.0003496000000000, -0.0010926000000000 ]  - [   0.0005697800000000, -0.0008532400000000,  0.0005787000000000 ]  - [  -0.0001170200000000,  0.0005009300000000, -0.0010893000000000 ]  - [   0.0192382400000000,  0.0097084600000000, -0.0342213700000000 ]  - [  -0.0001989800000000,  0.0001956300000000, -0.0006242500000000 ]  - [   0.0004864000000000,  0.0008164800000000, -0.0016388300000000 ]  - [   0.0002127700000000,  0.0001298300000000, -0.0006981900000000 ]  - [  -0.0002510600000000,  0.0002246600000000,  0.0001360700000000 ]  - [  -0.0001118200000000,  0.0015812200000000,  0.0023036700000000 ]  - [   0.0001886500000000, -0.0012939800000000, -0.0014871300000000 ]  - [   0.0003293900000000,  0.0004911100000000, -0.0001611600000000 ]  - [   0.0001490000000000, -0.0002656900000000, -0.0002279100000000 ]  - [  -0.0009062300000000,  0.0001642400000000,  0.0006382400000000 ]  - [  -0.0034456700000000,  0.0015257800000000,  0.0046125400000000 ]  - [  -0.0003643800000000,  0.0000294500000000, -0.0002252800000000 ]  - [  -0.0007319900000000, -0.0002600400000000, -0.0007463200000000 ]  - [   0.0009470300000000, -0.0006383300000000,  0.0006445900000000 ]  - [   0.0012575900000000,  0.0000902000000000,  0.0009451800000000 ]  - [   0.0008190800000000, -0.0002702700000000, -0.0016727400000000 ]  - [  -0.0002956200000000, -0.0010075700000000,  0.0003562900000000 ]  - [  -0.0012226700000000,  0.0003701400000000, -0.0014911800000000 ]  - [  -0.0004430000000000, -0.0001420100000000,  0.0005421100000000 ]  - [  -0.0000122200000000,  0.0002148000000000, -0.0002687500000000 ]  - [  -0.0002608900000000, -0.0001692300000000,  0.0008654300000000 ]  - [   0.0001731500000000, -0.0000970200000000, -0.0002547100000000 ]  - [  -0.0001214300000000,  0.0003066800000000,  0.0003602000000000 ]  - [  -0.0001640100000000, -0.0001064500000000, -0.0002766000000000 ]  - [   0.0000853000000000,  0.0004411700000000,  0.0005305500000000 ]  - [   0.0001757700000000,  0.0003271000000000, -0.0001532300000000 ]  - [   0.0001956100000000, -0.0003515700000000, -0.0001543600000000 ]  - [   0.0000151900000000,  0.0000638700000000,  0.0001539000000000 ]  - [  -0.0003241600000000, -0.0002702900000000,  0.0004198100000000 ]  - [  -0.0003618000000000, -0.0000087000000000, -0.0001563200000000 ]  - [   0.0002672100000000, -0.0001022700000000,  0.0008579800000000 ]  - [   0.0000603400000000, -0.0000572900000000,  0.0001671400000000 ]  - [   0.0002645800000000, -0.0000447400000000,  0.0003851500000000 ]  - [  -0.0000292300000000,  0.0003102300000000,  0.0008286100000000 ]  - [  -0.0000753500000000, -0.0000202400000000,  0.0001623500000000 ]  - [   0.0003442300000000, -0.0003052900000000,  0.0005414500000000 ]  - [  -0.0004233400000000, -0.0001607000000000,  0.0005660400000000 ]  - [  -0.0001128200000000,  0.0001848800000000, -0.0003230700000000 ]  - [  -0.0002709500000000, -0.0002123800000000,  0.0008236100000000 ]  - [   0.0000665600000000, -0.0000835100000000, -0.0002289500000000 ]  - [  -0.0001509900000000,  0.0002658900000000,  0.0004023400000000 ]  - [  -0.0002268800000000, -0.0001808900000000, -0.0002736400000000 ]  - [   0.0000706100000000,  0.0004507100000000,  0.0005661300000000 ]  - [   0.0001098300000000,  0.0001792700000000, -0.0005142100000000 ]  - [   0.0000711900000000, -0.0001052000000000, -0.0005131000000000 ]  - [  -0.0000338600000000,  0.0001962300000000,  0.0002980200000000 ]  - [  -0.0001797400000000, -0.0002713300000000,  0.0004081500000000 ]  - [  -0.0039153000000000, -0.0031787800000000,  0.0053656100000000 ]  - [   0.0003153700000000, -0.0001073100000000,  0.0008201300000000 ]  - [   0.0000353000000000, -0.0001465900000000,  0.0002929100000000 ]  - [   0.0003325100000000, -0.0000055200000000,  0.0003979800000000 ]  - [  -0.0000476100000000,  0.0003268300000000,  0.0007969700000000 ]  - [  -0.0000891400000000, -0.0000472700000000,  0.0002551600000000 ]  - [   0.0003583600000000, -0.0002978600000000,  0.0005775200000000 ]- atom:   28  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0002465700000000,  0.0000679500000000, -0.0003593900000000 ]  - [   0.0000730600000000,  0.0002493000000000, -0.0015127300000000 ]  - [  -0.0000029500000000,  0.0000014000000000,  0.0006968800000000 ]  - [   0.0000042600000000,  0.0000012200000000,  0.0001806200000000 ]  - [   0.0000423400000000,  0.0000228400000000,  0.0006995200000000 ]  - [  -0.0000042800000000, -0.0000012000000000,  0.0001604700000000 ]  - [   0.0024023500000000,  0.0053930800000000, -0.0064639900000000 ]  - [   0.0000002800000000,  0.0000004300000000,  0.0009641300000000 ]  - [   0.0000075200000000,  0.0000125200000000,  0.0010002300000000 ]  - [  -0.0002628400000000,  0.0011840600000000,  0.0009456300000000 ]  - [   0.0091306300000000,  0.0014782800000000, -0.0178905100000000 ]  - [  -0.0003205800000000,  0.0006213200000000,  0.0013736700000000 ]  - [   0.0004549500000000, -0.0001889400000000, -0.0026519800000000 ]  - [   0.0003978300000000, -0.0008347600000000,  0.0006991600000000 ]  - [   0.0010111300000000,  0.0007905600000000, -0.0028073900000000 ]  - [  -0.0004788400000000,  0.0001641600000000,  0.0010844300000000 ]  - [   0.0001424400000000, -0.0001988800000000, -0.0001776800000000 ]  - [   0.0003734100000000,  0.0003402000000000,  0.0010847700000000 ]  - [  -0.0002765200000000, -0.0000067200000000, -0.0001344300000000 ]  - [   0.0000980800000000, -0.0004866000000000,  0.0010875200000000 ]  - [   0.0001548600000000,  0.0001767900000000, -0.0000983400000000 ]  - [  -0.0005954100000000, -0.0002015900000000,  0.0017529400000000 ]  - [   0.0001034900000000, -0.0001797200000000, -0.0001366900000000 ]  - [   0.0001424100000000, -0.0004131200000000,  0.0004757000000000 ]  - [  -0.0002178500000000,  0.0000059700000000, -0.0001372800000000 ]  - [  -0.0005620100000000,  0.0001796900000000,  0.0006188500000000 ]  - [   0.0001054100000000,  0.0001900500000000, -0.0001316000000000 ]  - [  -0.0200379400000000, -0.0097626500000000,  0.0350035800000000 ]  - [  -0.0000679300000000,  0.0001529700000000, -0.0004813200000000 ]  - [  -0.0009752800000000, -0.0009452900000000,  0.0028433900000000 ]  - [   0.0001965700000000, -0.0000749500000000, -0.0003889400000000 ]  - [  -0.0000870200000000,  0.0004453500000000,  0.0003394900000000 ]  - [  -0.0000287100000000, -0.0019340200000000, -0.0033566100000000 ]  - [  -0.0001612100000000,  0.0016776000000000,  0.0019306200000000 ]  - [   0.0000666600000000,  0.0000763100000000, -0.0004224100000000 ]  - [   0.0001426900000000, -0.0004052800000000, -0.0003614500000000 ]  - [   0.0007913000000000, -0.0005571300000000, -0.0009547400000000 ]  - [   0.0031336200000000, -0.0021837300000000, -0.0042235100000000 ]  - [  -0.0003286900000000,  0.0000518600000000, -0.0003750300000000 ]  - [   0.0011001600000000, -0.0000561700000000,  0.0019645400000000 ]  - [  -0.0012097300000000,  0.0009055700000000, -0.0009464200000000 ]  - [  -0.0005466300000000, -0.0001290400000000, -0.0004929800000000 ]  - [  -0.0007692700000000,  0.0007028800000000,  0.0028869200000000 ]  - [   0.0006779400000000,  0.0011052100000000, -0.0006677500000000 ]  - [   0.0015295300000000, -0.0005800900000000,  0.0019306600000000 ]  - [   0.0000411200000000,  0.0000397200000000, -0.0002171300000000 ]  - [  -0.0003058800000000,  0.0001279700000000, -0.0008876200000000 ]  - [  -0.0001647000000000,  0.0000939200000000,  0.0002628900000000 ]  - [   0.0002422600000000,  0.0002076100000000, -0.0008859200000000 ]  - [  -0.0001594300000000,  0.0003051300000000,  0.0002314100000000 ]  - [   0.0000571100000000, -0.0003265100000000, -0.0009049200000000 ]  - [   0.0000134500000000, -0.0000667300000000, -0.0002247200000000 ]  - [   0.0001985300000000,  0.0002693200000000, -0.0003338300000000 ]  - [   0.0001290400000000, -0.0003329500000000, -0.0003400800000000 ]  - [  -0.0000434200000000, -0.0004370200000000, -0.0005966100000000 ]  - [  -0.0001160700000000, -0.0003143200000000,  0.0001682200000000 ]  - [  -0.0003138300000000,  0.0000409200000000, -0.0003426100000000 ]  - [  -0.0000026400000000, -0.0002162800000000,  0.0002436600000000 ]  - [  -0.0003442900000000,  0.0002425600000000, -0.0005826600000000 ]  - [   0.0004430500000000, -0.0000273600000000,  0.0002004300000000 ]  - [   0.0001925100000000,  0.0000971700000000,  0.0002724700000000 ]  - [   0.0003983200000000,  0.0001830000000000, -0.0005928200000000 ]  - [  -0.0000571300000000,  0.0000126700000000, -0.0002161300000000 ]  - [   0.0000397800000000,  0.0000443900000000, -0.0001895900000000 ]  - [  -0.0002234200000000,  0.0001384800000000, -0.0006786500000000 ]  - [  -0.0002035000000000,  0.0000745800000000,  0.0002102900000000 ]  - [   0.0003917100000000,  0.0002059700000000, -0.0007734500000000 ]  - [  -0.0002204200000000,  0.0002957400000000,  0.0002224700000000 ]  - [   0.0001042000000000, -0.0002653800000000, -0.0007185000000000 ]  - [   0.0000137500000000, -0.0000602100000000, -0.0001923600000000 ]  - [   0.0002531600000000,  0.0004500200000000, -0.0001397200000000 ]  - [   0.0002915000000000, -0.0005171400000000, -0.0001361200000000 ]  - [  -0.0000468700000000, -0.0005769500000000, -0.0006647100000000 ]  - [  -0.0001738700000000, -0.0003499100000000,  0.0002274000000000 ]  - [   0.0032748500000000,  0.0032545600000000, -0.0061289400000000 ]  - [   0.0000319400000000, -0.0001949900000000,  0.0002081900000000 ]  - [  -0.0003244200000000,  0.0004196300000000, -0.0006677800000000 ]  - [   0.0004055500000000,  0.0000287700000000,  0.0002201600000000 ]  - [   0.0001682800000000,  0.0001305000000000,  0.0001934300000000 ]  - [   0.0004616200000000,  0.0001657600000000, -0.0006208700000000 ]  - [  -0.0000476500000000, -0.0000003100000000, -0.0001758100000000 ]- atom:   29  displacement:    [   0.0100000000000000, -0.0000000000428756,  0.0000000000000000 ]  forces:  - [  -0.0005003000000000, -0.0003409600000000,  0.0004975700000000 ]  - [   0.0011547800000000,  0.0001628800000000, -0.0014133800000000 ]  - [   0.0000106500000000, -0.0000044000000000,  0.0000984700000000 ]  - [  -0.0000537800000000,  0.0000818500000000, -0.0004283000000000 ]  - [  -0.0000004300000000,  0.0000032000000000,  0.0000926200000000 ]  - [   0.0000002100000000, -0.0000004700000000, -0.0004281600000000 ]  - [  -0.0003061600000000,  0.0002381400000000,  0.0001460100000000 ]  - [  -0.0000587200000000, -0.0000189900000000, -0.0003579300000000 ]  - [   0.0000001100000000,  0.0000024600000000, -0.0003652600000000 ]  - [   0.0010816200000000,  0.0001301800000000,  0.0023745300000000 ]  - [   0.0002837100000000, -0.0001415100000000, -0.0006290300000000 ]  - [   0.0244550900000000, -0.0142333100000000,  0.0247211200000000 ]  - [  -0.0006080000000000, -0.0005208200000000, -0.0010553500000000 ]  - [   0.0159607400000000,  0.0136452900000000,  0.0190992000000000 ]  - [  -0.0000752800000000,  0.0001274000000000, -0.0007943400000000 ]  - [  -0.0002547900000000,  0.0001919000000000,  0.0004455700000000 ]  - [   0.0022121600000000,  0.0002147300000000, -0.0001815000000000 ]  - [   0.0002719900000000,  0.0001215400000000,  0.0004384000000000 ]  - [  -0.0003430600000000, -0.0003282300000000, -0.0012957800000000 ]  - [  -0.0000245700000000, -0.0003012600000000,  0.0004421100000000 ]  - [   0.0002661700000000,  0.0004499400000000, -0.0009404100000000 ]  - [  -0.0002303000000000,  0.0001603800000000,  0.0004186300000000 ]  - [   0.0003832600000000, -0.0001486600000000, -0.0008048900000000 ]  - [   0.0002857300000000,  0.0001101100000000,  0.0004212500000000 ]  - [  -0.0003300800000000, -0.0002509200000000, -0.0008064200000000 ]  - [  -0.0000317000000000, -0.0003059500000000,  0.0004473800000000 ]  - [  -0.0000519400000000,  0.0004104400000000, -0.0007974400000000 ]  - [  -0.0002031400000000, -0.0001032700000000,  0.0001570800000000 ]  - [  -0.0512317600000000,  0.0032550900000000, -0.0433250200000000 ]  - [  -0.0002103400000000, -0.0000719700000000,  0.0006426100000000 ]  - [   0.0030421900000000,  0.0001259200000000,  0.0001958200000000 ]  - [  -0.0001169200000000,  0.0003462800000000,  0.0003077400000000 ]  - [   0.0037383000000000,  0.0002650000000000,  0.0003898600000000 ]  - [   0.0007160100000000, -0.0000338800000000,  0.0017563200000000 ]  - [   0.0011349500000000,  0.0006101900000000,  0.0004003500000000 ]  - [   0.0007835100000000, -0.0032682300000000,  0.0015463200000000 ]  - [  -0.0015302700000000, -0.0001528600000000, -0.0009618500000000 ]  - [  -0.0001751600000000, -0.0002838700000000,  0.0002385200000000 ]  - [  -0.0010738800000000, -0.0005160600000000, -0.0029896900000000 ]  - [   0.0003590400000000,  0.0000606600000000,  0.0009563900000000 ]  - [  -0.0012364200000000, -0.0019871000000000, -0.0012872300000000 ]  - [   0.0003332300000000, -0.0000052900000000,  0.0002392800000000 ]  - [   0.0000732300000000,  0.0002334000000000,  0.0006288500000000 ]  - [   0.0029326900000000, -0.0002523300000000, -0.0010573700000000 ]  - [   0.0001694400000000, -0.0000784900000000,  0.0001368200000000 ]  - [  -0.0001684900000000, -0.0000464000000000,  0.0002168900000000 ]  - [  -0.0000857300000000,  0.0001913300000000, -0.0004460800000000 ]  - [  -0.0004369200000000, -0.0002112400000000,  0.0005340400000000 ]  - [   0.0001762000000000, -0.0000110200000000, -0.0004411900000000 ]  - [  -0.0005643600000000,  0.0027524300000000,  0.0013855600000000 ]  - [  -0.0001004100000000, -0.0001684200000000, -0.0004705200000000 ]  - [   0.0001300300000000,  0.0003184300000000,  0.0002888900000000 ]  - [   0.0001814200000000,  0.0003050600000000, -0.0002141200000000 ]  - [   0.0001697200000000, -0.0003295500000000, -0.0002194200000000 ]  - [  -0.0000046300000000, -0.0000863400000000, -0.0000793400000000 ]  - [  -0.0015585800000000, -0.0004756100000000, -0.0018010600000000 ]  - [  -0.0003405400000000,  0.0000181900000000, -0.0002312500000000 ]  - [   0.0001821000000000, -0.0001372700000000,  0.0008220300000000 ]  - [  -0.0000544000000000,  0.0000434400000000, -0.0000699900000000 ]  - [   0.0013823100000000, -0.0000337500000000,  0.0009285900000000 ]  - [  -0.0002775100000000,  0.0003157300000000,  0.0004843200000000 ]  - [   0.0000877600000000,  0.0000277200000000, -0.0000892700000000 ]  - [   0.0002321100000000, -0.0001264500000000,  0.0003586700000000 ]  - [  -0.0003041200000000, -0.0000828100000000,  0.0003390900000000 ]  - [  -0.0000904100000000,  0.0001665500000000, -0.0003792600000000 ]  - [  -0.0002398100000000, -0.0001326300000000,  0.0006363400000000 ]  - [   0.0002209700000000, -0.0000120300000000, -0.0003745800000000 ]  - [  -0.0001745000000000,  0.0002608500000000,  0.0003222900000000 ]  - [  -0.0001124900000000, -0.0001593500000000, -0.0003505300000000 ]  - [   0.0000729200000000,  0.0002929400000000,  0.0003282600000000 ]  - [   0.0001928700000000,  0.0003330100000000, -0.0002851000000000 ]  - [   0.0001816700000000, -0.0002320900000000, -0.0003038000000000 ]  - [  -0.0000391900000000, -0.0000869800000000, -0.0000443900000000 ]  - [  -0.0001706800000000, -0.0002994400000000,  0.0003256000000000 ]  - [  -0.0003338800000000, -0.0000236900000000, -0.0002993000000000 ]  - [   0.0002276800000000, -0.0001330000000000,  0.0006258200000000 ]  - [  -0.0000652400000000,  0.0000983700000000, -0.0000598800000000 ]  - [   0.0003475900000000,  0.0000050000000000,  0.0003271900000000 ]  - [   0.0000171200000000,  0.0002753600000000,  0.0006203600000000 ]  - [   0.0000921400000000,  0.0000093400000000, -0.0000449800000000 ]  - [   0.0002254700000000, -0.0002238600000000,  0.0003406400000000 ]- atom:   29  displacement:    [  -0.0100000000000000,  0.0000000000428756,  0.0000000000000000 ]  forces:  - [   0.0004971100000000,  0.0003358400000000,  0.0000258900000000 ]  - [  -0.0011444800000000, -0.0001585800000000,  0.0008628200000000 ]  - [  -0.0000128000000000,  0.0000035600000000,  0.0004240100000000 ]  - [   0.0000578200000000, -0.0000719100000000, -0.0000938300000000 ]  - [  -0.0000004600000000, -0.0000009700000000,  0.0004291200000000 ]  - [   0.0000016800000000,  0.0000007900000000, -0.0000957100000000 ]  - [   0.0003150700000000, -0.0002504300000000, -0.0001513600000000 ]  - [   0.0000567200000000,  0.0000217900000000,  0.0003578100000000 ]  - [  -0.0000010500000000,  0.0000001600000000,  0.0003632200000000 ]  - [  -0.0015950300000000,  0.0002389700000000, -0.0011526000000000 ]  - [   0.0003297400000000, -0.0002116100000000, -0.0006188400000000 ]  - [  -0.0236204500000000,  0.0141461800000000, -0.0229033200000000 ]  - [   0.0000045900000000,  0.0001776100000000, -0.0001766100000000 ]  - [  -0.0160237000000000, -0.0141926200000000, -0.0176752600000000 ]  - [   0.0000775700000000,  0.0005792800000000, -0.0004478100000000 ]  - [  -0.0003664900000000,  0.0001660300000000,  0.0007910400000000 ]  - [  -0.0016534900000000, -0.0005804500000000, -0.0010115300000000 ]  - [   0.0003410100000000,  0.0002465300000000,  0.0007958400000000 ]  - [  -0.0002534300000000,  0.0000058000000000,  0.0000794900000000 ]  - [   0.0000271300000000, -0.0003984900000000,  0.0007925700000000 ]  - [  -0.0002269300000000,  0.0002361900000000, -0.0002723400000000 ]  - [  -0.0003679200000000,  0.0001678900000000,  0.0007960200000000 ]  - [   0.0002184700000000, -0.0001709900000000, -0.0004315600000000 ]  - [   0.0003063300000000,  0.0002468800000000,  0.0008009900000000 ]  - [  -0.0002619900000000, -0.0000962400000000, -0.0004301200000000 ]  - [   0.0000458300000000, -0.0003818100000000,  0.0007684300000000 ]  - [   0.0000388900000000,  0.0002828600000000, -0.0004355500000000 ]  - [  -0.0001556500000000, -0.0000546700000000,  0.0003019500000000 ]  - [   0.0505244600000000, -0.0027105600000000,  0.0413069500000000 ]  - [  -0.0002258100000000, -0.0000724200000000,  0.0005598900000000 ]  - [  -0.0025477100000000, -0.0000315300000000, -0.0012834200000000 ]  - [  -0.0002055700000000,  0.0003105000000000,  0.0001661100000000 ]  - [  -0.0037596500000000, -0.0006960500000000, -0.0014715200000000 ]  - [  -0.0006803000000000,  0.0004200100000000, -0.0013278300000000 ]  - [  -0.0007133500000000, -0.0000517900000000, -0.0009804300000000 ]  - [  -0.0004843700000000,  0.0026066100000000, -0.0021115400000000 ]  - [   0.0014266700000000, -0.0001924300000000,  0.0006457900000000 ]  - [  -0.0002079200000000, -0.0003231300000000,  0.0002218100000000 ]  - [   0.0003650600000000,  0.0006214900000000,  0.0024457600000000 ]  - [  -0.0000151900000000, -0.0003779300000000,  0.0002374000000000 ]  - [   0.0009728600000000,  0.0022707600000000,  0.0009691000000000 ]  - [   0.0003716400000000, -0.0000217200000000,  0.0002233200000000 ]  - [   0.0000291700000000,  0.0002261100000000,  0.0005782400000000 ]  - [  -0.0026209700000000,  0.0003687400000000,  0.0007643300000000 ]  - [   0.0001394100000000, -0.0001480800000000,  0.0003175200000000 ]  - [  -0.0002264500000000, -0.0000567100000000,  0.0001117300000000 ]  - [  -0.0002199300000000,  0.0001590500000000, -0.0007028400000000 ]  - [   0.0000265400000000,  0.0001510400000000,  0.0005585800000000 ]  - [   0.0002222300000000,  0.0001239200000000, -0.0007036200000000 ]  - [   0.0002682800000000, -0.0020983400000000, -0.0007907700000000 ]  - [  -0.0000147300000000, -0.0002652600000000, -0.0007162800000000 ]  - [  -0.0000169400000000,  0.0000740400000000,  0.0000381900000000 ]  - [   0.0001964600000000,  0.0002992800000000, -0.0002772600000000 ]  - [   0.0001529200000000, -0.0003428100000000, -0.0002861300000000 ]  - [  -0.0000278900000000, -0.0002868600000000, -0.0003739300000000 ]  - [   0.0011447700000000, -0.0001248800000000,  0.0024186400000000 ]  - [  -0.0003363500000000,  0.0000323400000000, -0.0002943600000000 ]  - [   0.0000763500000000, -0.0002132700000000,  0.0002734400000000 ]  - [  -0.0002238100000000,  0.0001411100000000, -0.0003505300000000 ]  - [  -0.0006929700000000, -0.0000316600000000, -0.0003150800000000 ]  - [   0.0004287500000000,  0.0000769200000000,  0.0006151900000000 ]  - [   0.0002534500000000,  0.0001344500000000, -0.0003593200000000 ]  - [   0.0000426500000000, -0.0001514700000000, -0.0000410100000000 ]  - [  -0.0001080000000000, -0.0000331100000000,  0.0000470800000000 ]  - [  -0.0002319600000000,  0.0001469300000000, -0.0006267300000000 ]  - [  -0.0002255100000000, -0.0000221100000000,  0.0004070200000000 ]  - [   0.0002420100000000,  0.0001245100000000, -0.0006263300000000 ]  - [  -0.0001983900000000,  0.0002916600000000,  0.0002800200000000 ]  - [  -0.0000159700000000, -0.0002765900000000, -0.0006304500000000 ]  - [   0.0000220400000000,  0.0001038800000000,  0.0000423800000000 ]  - [   0.0001476300000000,  0.0002789300000000, -0.0003665800000000 ]  - [   0.0001826200000000, -0.0003663800000000, -0.0003461900000000 ]  - [  -0.0000493400000000, -0.0002961400000000, -0.0003328800000000 ]  - [  -0.0001836600000000, -0.0003344400000000,  0.0002817900000000 ]  - [  -0.0003965600000000,  0.0000141200000000, -0.0003416300000000 ]  - [   0.0001253900000000, -0.0001685400000000,  0.0003984700000000 ]  - [  -0.0002322100000000,  0.0001941300000000, -0.0003342700000000 ]  - [   0.0003908700000000,  0.0000118100000000,  0.0002811100000000 ]  - [   0.0001041500000000,  0.0002035500000000,  0.0003846400000000 ]  - [   0.0002833200000000,  0.0001056300000000, -0.0003315500000000 ]  - [   0.0000877200000000, -0.0000849200000000,  0.0000552100000000 ]- atom:   29  displacement:    [  -0.0049999999716508,  0.0086602540542118,  0.0000000000000000 ]  forces:  - [   0.0002158900000000,  0.0000416700000000,  0.0001929200000000 ]  - [  -0.0004161300000000,  0.0000702000000000,  0.0002201700000000 ]  - [  -0.0000098600000000,  0.0000308300000000,  0.0002949600000000 ]  - [   0.0000339800000000, -0.0001123700000000, -0.0002192100000000 ]  - [  -0.0000004000000000, -0.0000000800000000,  0.0003007200000000 ]  - [   0.0000009100000000,  0.0000002200000000, -0.0002230500000000 ]  - [   0.0003838400000000, -0.0002223000000000, -0.0002603800000000 ]  - [   0.0000432500000000, -0.0000272000000000,  0.0000806500000000 ]  - [  -0.0000000900000000,  0.0000002800000000,  0.0000839100000000 ]  - [  -0.0011004000000000,  0.0011607300000000,  0.0000787500000000 ]  - [   0.0003546100000000, -0.0002291000000000, -0.0006214700000000 ]  - [  -0.0227278600000000,  0.0230533300000000, -0.0245815300000000 ]  - [  -0.0002607900000000,  0.0001015700000000, -0.0005690100000000 ]  - [   0.0032703900000000,  0.0142464500000000,  0.0104331300000000 ]  - [  -0.0000400400000000,  0.0003231600000000, -0.0005860300000000 ]  - [  -0.0003167700000000,  0.0001669300000000,  0.0006629500000000 ]  - [  -0.0003414300000000,  0.0005670700000000, -0.0007496400000000 ]  - [   0.0003177600000000,  0.0002089200000000,  0.0006618100000000 ]  - [   0.0004464800000000, -0.0000364300000000,  0.0007322700000000 ]  - [   0.0000078400000000, -0.0003786400000000,  0.0006740000000000 ]  - [  -0.0008426300000000,  0.0002431200000000, -0.0015655800000000 ]  - [  -0.0003169600000000,  0.0001675600000000,  0.0006623700000000 ]  - [   0.0002912700000000, -0.0001605200000000, -0.0005809900000000 ]  - [   0.0002966400000000,  0.0002019700000000,  0.0006668600000000 ]  - [  -0.0002919400000000, -0.0001626400000000, -0.0005780400000000 ]  - [   0.0000235600000000, -0.0003493800000000,  0.0006586200000000 ]  - [   0.0000001700000000,  0.0003373600000000, -0.0005766000000000 ]  - [  -0.0002074600000000, -0.0000671200000000,  0.0002796300000000 ]  - [   0.0273746000000000, -0.0620206300000000,  0.0153755100000000 ]  - [  -0.0002095300000000, -0.0000386700000000,  0.0005571100000000 ]  - [   0.0023237700000000,  0.0014450200000000, -0.0002386400000000 ]  - [  -0.0001776600000000,  0.0002862200000000,  0.0002148400000000 ]  - [  -0.0049243700000000,  0.0001659900000000, -0.0014712500000000 ]  - [  -0.0006568100000000,  0.0003918700000000, -0.0012817100000000 ]  - [   0.0002339700000000,  0.0001502300000000, -0.0003415000000000 ]  - [  -0.0015556800000000,  0.0025448200000000, -0.0027416400000000 ]  - [  -0.0009846700000000,  0.0077751000000000, -0.0001422900000000 ]  - [  -0.0001909600000000, -0.0002985700000000,  0.0002453500000000 ]  - [  -0.0008739600000000,  0.0010009600000000,  0.0036614000000000 ]  - [   0.0002578200000000, -0.0000397400000000,  0.0008690500000000 ]  - [  -0.0002463900000000,  0.0075658500000000,  0.0005833900000000 ]  - [   0.0003669400000000, -0.0000188000000000,  0.0002393900000000 ]  - [   0.0000369200000000,  0.0002239200000000,  0.0006053800000000 ]  - [  -0.0012089000000000,  0.0001925500000000,  0.0002076500000000 ]  - [   0.0001672800000000, -0.0000930500000000,  0.0002375200000000 ]  - [  -0.0002335200000000, -0.0001020200000000,  0.0001564500000000 ]  - [  -0.0001678800000000,  0.0001649900000000, -0.0006027300000000 ]  - [  -0.0001895600000000, -0.0001246800000000,  0.0003191100000000 ]  - [   0.0002116000000000,  0.0000781800000000, -0.0006129900000000 ]  - [   0.0009532000000000,  0.0016332100000000,  0.0015687800000000 ]  - [  -0.0000538100000000, -0.0002229700000000, -0.0006077900000000 ]  - [   0.0001145900000000,  0.0001933800000000,  0.0002004000000000 ]  - [   0.0001855500000000,  0.0002956800000000, -0.0002462000000000 ]  - [   0.0001594500000000, -0.0003267900000000, -0.0002504200000000 ]  - [  -0.0000229500000000, -0.0002170700000000, -0.0002625200000000 ]  - [   0.0005944200000000,  0.0005809200000000, -0.0018957000000000 ]  - [  -0.0003348700000000,  0.0000192100000000, -0.0002564900000000 ]  - [   0.0001449600000000, -0.0002941300000000,  0.0004636900000000 ]  - [  -0.0001635400000000,  0.0001255100000000, -0.0002655700000000 ]  - [  -0.0002062300000000, -0.0001880900000000, -0.0000999600000000 ]  - [   0.0003047200000000,  0.0000570900000000,  0.0008564100000000 ]  - [   0.0001824000000000,  0.0001054800000000, -0.0002412400000000 ]  - [  -0.0000086600000000, -0.0001822900000000, -0.0000043500000000 ]  - [  -0.0001784000000000, -0.0000518500000000,  0.0001598900000000 ]  - [  -0.0001847800000000,  0.0001580600000000, -0.0005338200000000 ]  - [  -0.0002266000000000, -0.0000531100000000,  0.0004844600000000 ]  - [   0.0002332200000000,  0.0000795400000000, -0.0005287500000000 ]  - [  -0.0001882000000000,  0.0002845700000000,  0.0003056700000000 ]  - [  -0.0000463700000000, -0.0002370600000000, -0.0005274800000000 ]  - [   0.0000417600000000,  0.0001789800000000,  0.0001579100000000 ]  - [   0.0001599800000000,  0.0002997100000000, -0.0003231000000000 ]  - [   0.0001896500000000, -0.0002912900000000, -0.0003088200000000 ]  - [  -0.0000497600000000, -0.0002265300000000, -0.0002233800000000 ]  - [  -0.0001692700000000, -0.0003119500000000,  0.0003086700000000 ]  - [  -0.0003707300000000, -0.0000010700000000, -0.0003126200000000 ]  - [   0.0001550600000000, -0.0001610400000000,  0.0004799100000000 ]  - [  -0.0001730900000000,  0.0001607900000000, -0.0002266800000000 ]  - [   0.0003596600000000,  0.0000130100000000,  0.0003070500000000 ]  - [   0.0000731300000000,  0.0002184800000000,  0.0004683100000000 ]  - [   0.0002216400000000,  0.0000701100000000, -0.0002225100000000 ]  - [   0.0001370300000000, -0.0001336400000000,  0.0001646300000000 ]- atom:   29  displacement:    [   0.0049999999716508, -0.0086602540542118,  0.0000000000000000 ]  forces:  - [  -0.0002309700000000, -0.0000525400000000,  0.0003311000000000 ]  - [   0.0004257300000000, -0.0000631100000000, -0.0007494300000000 ]  - [   0.0000063300000000, -0.0000312800000000,  0.0002217500000000 ]  - [  -0.0000289600000000,  0.0001199800000000, -0.0003084200000000 ]  - [  -0.0000011900000000,  0.0000021600000000,  0.0002199700000000 ]  - [   0.0000008300000000, -0.0000001200000000, -0.0003023100000000 ]  - [  -0.0003807000000000,  0.0002226000000000,  0.0002647200000000 ]  - [  -0.0000435200000000,  0.0000302600000000, -0.0000900900000000 ]  - [  -0.0000003100000000,  0.0000011000000000, -0.0000881700000000 ]  - [   0.0005114600000000, -0.0007993400000000,  0.0011144000000000 ]  - [   0.0002501300000000, -0.0001252500000000, -0.0006241700000000 ]  - [   0.0241268900000000, -0.0235067000000000,  0.0269717300000000 ]  - [  -0.0003457100000000, -0.0004502100000000, -0.0006842700000000 ]  - [  -0.0031280600000000, -0.0147732300000000, -0.0090731700000000 ]  - [   0.0000422300000000,  0.0003809200000000, -0.0006729500000000 ]  - [  -0.0003062700000000,  0.0001920400000000,  0.0005821500000000 ]  - [   0.0009244200000000, -0.0009057400000000, -0.0004717800000000 ]  - [   0.0002940900000000,  0.0001616200000000,  0.0005827300000000 ]  - [  -0.0010349900000000, -0.0002935400000000, -0.0019151500000000 ]  - [  -0.0000064700000000, -0.0003225300000000,  0.0005703000000000 ]  - [   0.0008881000000000,  0.0004655200000000,  0.0003919700000000 ]  - [  -0.0002854900000000,  0.0001591000000000,  0.0005642800000000 ]  - [   0.0003198500000000, -0.0001577800000000, -0.0006640500000000 ]  - [   0.0003011400000000,  0.0001589700000000,  0.0005620700000000 ]  - [  -0.0003053500000000, -0.0001930900000000, -0.0006652800000000 ]  - [   0.0000009300000000, -0.0003479000000000,  0.0005703900000000 ]  - [  -0.0000207500000000,  0.0003644200000000, -0.0006634800000000 ]  - [  -0.0001490800000000, -0.0000958400000000,  0.0001740800000000 ]  - [  -0.0287115300000000,  0.0630186500000000, -0.0179183800000000 ]  - [  -0.0002329100000000, -0.0000965900000000,  0.0006420600000000 ]  - [  -0.0019081900000000, -0.0013730100000000, -0.0008983600000000 ]  - [  -0.0001430000000000,  0.0003754500000000,  0.0002787300000000 ]  - [   0.0048998900000000, -0.0006144200000000,  0.0003526100000000 ]  - [   0.0006902000000000, -0.0000121200000000,  0.0017175300000000 ]  - [   0.0001820100000000,  0.0004310500000000, -0.0002461000000000 ]  - [   0.0018559200000000, -0.0032153800000000,  0.0021522100000000 ]  - [   0.0008984200000000, -0.0083504700000000, -0.0001618000000000 ]  - [  -0.0002054800000000, -0.0003095000000000,  0.0002391400000000 ]  - [   0.0001225400000000, -0.0008749400000000, -0.0042051400000000 ]  - [   0.0000815200000000, -0.0002740000000000,  0.0003237300000000 ]  - [  -0.0000346100000000, -0.0070748500000000, -0.0008854600000000 ]  - [   0.0003454000000000, -0.0000113000000000,  0.0002399900000000 ]  - [   0.0000706100000000,  0.0002285000000000,  0.0005903400000000 ]  - [   0.0015929100000000, -0.0000836700000000, -0.0005292000000000 ]  - [   0.0001472800000000, -0.0001324100000000,  0.0002146700000000 ]  - [  -0.0001890800000000, -0.0000070300000000,  0.0001793300000000 ]  - [  -0.0001524100000000,  0.0001705900000000, -0.0005627200000000 ]  - [  -0.0002276900000000,  0.0000294700000000,  0.0008247900000000 ]  - [   0.0002060600000000,  0.0000406200000000, -0.0005470700000000 ]  - [  -0.0012511800000000, -0.0010095700000000, -0.0009947200000000 ]  - [  -0.0000569300000000, -0.0002211700000000, -0.0005823400000000 ]  - [  -0.0000094900000000,  0.0001934900000000,  0.0001080000000000 ]  - [   0.0001963500000000,  0.0003077400000000, -0.0002370100000000 ]  - [   0.0001666700000000, -0.0003483800000000, -0.0002409700000000 ]  - [  -0.0000109600000000, -0.0001684300000000, -0.0001923500000000 ]  - [  -0.0010516700000000, -0.0012013700000000,  0.0024790600000000 ]  - [  -0.0003509000000000,  0.0000187700000000, -0.0002451400000000 ]  - [   0.0001297000000000, -0.0000345400000000,  0.0006409500000000 ]  - [  -0.0001344600000000,  0.0000811000000000, -0.0001686900000000 ]  - [   0.0009294300000000,  0.0001058300000000,  0.0006986500000000 ]  - [  -0.0001432100000000,  0.0003723200000000,  0.0002693100000000 ]  - [   0.0001676100000000,  0.0000592100000000, -0.0002098000000000 ]  - [   0.0002976000000000, -0.0001118100000000,  0.0003220700000000 ]  - [  -0.0002310200000000, -0.0000686800000000,  0.0002302100000000 ]  - [  -0.0001611300000000,  0.0001589400000000, -0.0004914000000000 ]  - [  -0.0002375600000000, -0.0000937400000000,  0.0005534400000000 ]  - [   0.0002377000000000,  0.0000512200000000, -0.0004870400000000 ]  - [  -0.0001827600000000,  0.0002857300000000,  0.0003182300000000 ]  - [  -0.0000677700000000, -0.0002134900000000, -0.0004701800000000 ]  - [   0.0000516100000000,  0.0002268300000000,  0.0002234200000000 ]  - [   0.0001791100000000,  0.0003184500000000, -0.0003113700000000 ]  - [   0.0001808100000000, -0.0003211900000000, -0.0003239100000000 ]  - [  -0.0000452400000000, -0.0001802600000000, -0.0001591300000000 ]  - [  -0.0001812400000000, -0.0003183600000000,  0.0003178100000000 ]  - [  -0.0003649300000000, -0.0000115300000000, -0.0003097200000000 ]  - [   0.0001946200000000, -0.0001511200000000,  0.0005477200000000 ]  - [  -0.0001376300000000,  0.0001436600000000, -0.0001681700000000 ]  - [   0.0003779100000000,  0.0000001000000000,  0.0003169600000000 ]  - [   0.0000485100000000,  0.0002466600000000,  0.0005348300000000 ]  - [   0.0001698100000000,  0.0000492000000000, -0.0001540200000000 ]  - [   0.0001784500000000, -0.0001708000000000,  0.0002354900000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0009992300000000, -0.0009847000000000,  0.0010558300000000 ]  - [   0.0004406300000000,  0.0000977300000000, -0.0007000900000000 ]  - [  -0.0000345100000000, -0.0000060600000000, -0.0001451500000000 ]  - [   0.0000380400000000,  0.0000816800000000, -0.0005411300000000 ]  - [  -0.0000009300000000,  0.0000043400000000, -0.0000975400000000 ]  - [  -0.0000003600000000, -0.0000000700000000, -0.0006201600000000 ]  - [  -0.0004790500000000,  0.0005403700000000,  0.0004157500000000 ]  - [  -0.0000194100000000, -0.0000245100000000, -0.0006581300000000 ]  - [  -0.0000008300000000,  0.0000019900000000, -0.0007889100000000 ]  - [  -0.0005747100000000,  0.0000517100000000,  0.0053301500000000 ]  - [   0.0003681000000000, -0.0001476600000000, -0.0007369500000000 ]  - [   0.0238295700000000, -0.0175154400000000,  0.0365473500000000 ]  - [  -0.0007560500000000, -0.0006991500000000, -0.0013068700000000 ]  - [   0.0175816100000000,  0.0234113600000000,  0.0367132200000000 ]  - [  -0.0000912900000000,  0.0000881200000000, -0.0009217300000000 ]  - [  -0.0001500700000000,  0.0002030100000000,  0.0002261800000000 ]  - [   0.0014541000000000, -0.0000688400000000,  0.0023878500000000 ]  - [   0.0002518900000000,  0.0000507600000000,  0.0002460900000000 ]  - [  -0.0008849200000000, -0.0005841400000000, -0.0008526200000000 ]  - [  -0.0000886000000000, -0.0002105300000000,  0.0002367700000000 ]  - [  -0.0006293000000000,  0.0006132300000000, -0.0008371000000000 ]  - [  -0.0001575400000000,  0.0001371300000000,  0.0002003100000000 ]  - [   0.0004465700000000, -0.0001429200000000, -0.0010074200000000 ]  - [   0.0002356400000000,  0.0000678400000000,  0.0001980500000000 ]  - [  -0.0003620000000000, -0.0003068200000000, -0.0010083700000000 ]  - [  -0.0000332700000000, -0.0002421600000000,  0.0002382900000000 ]  - [  -0.0000912200000000,  0.0004698800000000, -0.0010036500000000 ]  - [  -0.0002866500000000,  0.0000306100000000,  0.0001519600000000 ]  - [  -0.0432054100000000, -0.0051694900000000, -0.0807513600000000 ]  - [  -0.0002062000000000, -0.0001111000000000,  0.0006948500000000 ]  - [  -0.0007040300000000, -0.0004945800000000, -0.0030687600000000 ]  - [  -0.0000944100000000,  0.0003571500000000,  0.0003835600000000 ]  - [  -0.0011388400000000,  0.0000304800000000, -0.0030827600000000 ]  - [   0.0015651300000000, -0.0004151200000000,  0.0030157100000000 ]  - [   0.0008942700000000,  0.0006861000000000, -0.0003911500000000 ]  - [   0.0020853800000000, -0.0040598300000000,  0.0008617500000000 ]  - [  -0.0013700000000000,  0.0012630500000000, -0.0024238900000000 ]  - [  -0.0002098900000000, -0.0002924400000000,  0.0002937600000000 ]  - [  -0.0004961400000000, -0.0006268500000000,  0.0017819000000000 ]  - [   0.0005223200000000,  0.0003539700000000,  0.0013444400000000 ]  - [  -0.0011796900000000, -0.0015256600000000, -0.0023767600000000 ]  - [   0.0003350300000000, -0.0000199300000000,  0.0002988800000000 ]  - [   0.0000442000000000,  0.0002793200000000,  0.0006972400000000 ]  - [   0.0018012700000000,  0.0002069500000000, -0.0015056500000000 ]  - [   0.0000778200000000, -0.0001604300000000,  0.0000663500000000 ]  - [  -0.0003221600000000, -0.0001239400000000,  0.0003359800000000 ]  - [  -0.0000510400000000,  0.0002043200000000, -0.0003458900000000 ]  - [   0.0000923100000000, -0.0001468900000000,  0.0017354600000000 ]  - [   0.0001772500000000, -0.0000618100000000, -0.0003283400000000 ]  - [   0.0008034500000000,  0.0045221400000000,  0.0011793100000000 ]  - [  -0.0001477700000000, -0.0001424900000000, -0.0003546200000000 ]  - [   0.0001132100000000,  0.0002930000000000,  0.0003711200000000 ]  - [   0.0001875000000000,  0.0003360300000000, -0.0001672600000000 ]  - [   0.0001901500000000, -0.0003562800000000, -0.0001741900000000 ]  - [   0.0000271200000000, -0.0000065300000000,  0.0000508400000000 ]  - [  -0.0006106900000000,  0.0002834400000000,  0.0023253200000000 ]  - [  -0.0003690600000000,  0.0000040900000000, -0.0001802100000000 ]  - [   0.0004222000000000, -0.0000987600000000,  0.0008512600000000 ]  - [  -0.0000187700000000, -0.0000486500000000,  0.0000899700000000 ]  - [   0.0011309500000000, -0.0002632600000000, -0.0000027700000000 ]  - [   0.0003207500000000,  0.0003581300000000,  0.0017197900000000 ]  - [  -0.0000129200000000,  0.0000461400000000,  0.0000803200000000 ]  - [   0.0002690800000000, -0.0001132400000000,  0.0004279900000000 ]  - [  -0.0003959500000000, -0.0001407500000000,  0.0005005800000000 ]  - [  -0.0000498200000000,  0.0002052500000000, -0.0002679800000000 ]  - [  -0.0002636700000000, -0.0002001200000000,  0.0007768300000000 ]  - [   0.0002066000000000, -0.0000542300000000, -0.0002573200000000 ]  - [  -0.0001606100000000,  0.0002722100000000,  0.0003856400000000 ]  - [  -0.0001456200000000, -0.0001349500000000, -0.0002464500000000 ]  - [   0.0000696200000000,  0.0004063000000000,  0.0004934900000000 ]  - [   0.0002504500000000,  0.0003986500000000, -0.0002210000000000 ]  - [   0.0002096600000000, -0.0002888900000000, -0.0002380600000000 ]  - [  -0.0000173300000000, -0.0000037100000000,  0.0001124000000000 ]  - [  -0.0001859500000000, -0.0002921300000000,  0.0003859300000000 ]  - [  -0.0004028700000000,  0.0000052500000000, -0.0002486300000000 ]  - [   0.0002982100000000, -0.0001190200000000,  0.0007694400000000 ]  - [   0.0000109100000000,  0.0000197600000000,  0.0001151100000000 ]  - [   0.0003518500000000, -0.0000136600000000,  0.0003881100000000 ]  - [  -0.0000312900000000,  0.0003241500000000,  0.0007555400000000 ]  - [   0.0000037100000000, -0.0000111900000000,  0.0001162700000000 ]  - [   0.0003235200000000, -0.0002766800000000,  0.0005059300000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0010008600000000,  0.0009829100000000, -0.0005484800000000 ]  - [  -0.0004259000000000, -0.0000934200000000,  0.0001536100000000 ]  - [   0.0000310200000000,  0.0000061500000000,  0.0006649000000000 ]  - [  -0.0000346600000000, -0.0000701000000000,  0.0000200400000000 ]  - [  -0.0000005700000000, -0.0000019200000000,  0.0006225400000000 ]  - [   0.0000019600000000,  0.0000009500000000,  0.0000988800000000 ]  - [   0.0004871700000000, -0.0005478900000000, -0.0004350500000000 ]  - [   0.0000169100000000,  0.0000253900000000,  0.0006619400000000 ]  - [  -0.0000003700000000, -0.0000002100000000,  0.0007939800000000 ]  - [   0.0000299800000000,  0.0003271200000000, -0.0041351100000000 ]  - [   0.0002333500000000, -0.0002057800000000, -0.0005112000000000 ]  - [  -0.0223568300000000,  0.0171372100000000, -0.0346232100000000 ]  - [   0.0001613700000000,  0.0003689300000000,  0.0000729300000000 ]  - [  -0.0169681500000000, -0.0231703100000000, -0.0347870300000000 ]  - [   0.0001064900000000,  0.0006107200000000, -0.0003200600000000 ]  - [  -0.0004580600000000,  0.0001616800000000,  0.0010114800000000 ]  - [  -0.0008537500000000, -0.0002806400000000, -0.0034608900000000 ]  - [   0.0003539900000000,  0.0003096700000000,  0.0009923800000000 ]  - [   0.0002575600000000,  0.0002717500000000, -0.0003540600000000 ]  - [   0.0000795800000000, -0.0004758900000000,  0.0010014600000000 ]  - [   0.0006392200000000,  0.0000802700000000, -0.0003656200000000 ]  - [  -0.0004372400000000,  0.0001950900000000,  0.0010244000000000 ]  - [   0.0001392600000000, -0.0001756500000000, -0.0002208900000000 ]  - [   0.0003578500000000,  0.0002879100000000,  0.0010317700000000 ]  - [  -0.0002292900000000, -0.0000239400000000, -0.0002199500000000 ]  - [   0.0000474200000000, -0.0004439000000000,  0.0009874700000000 ]  - [   0.0000837000000000,  0.0002177400000000, -0.0002205400000000 ]  - [  -0.0000730900000000, -0.0002032200000000,  0.0003083300000000 ]  - [   0.0414432300000000,  0.0052770500000000,  0.0779738900000000 ]  - [  -0.0002275900000000, -0.0000341000000000,  0.0005073600000000 ]  - [   0.0011127700000000,  0.0005667700000000,  0.0019660500000000 ]  - [  -0.0002333300000000,  0.0003017800000000,  0.0000993000000000 ]  - [   0.0009853400000000, -0.0004515900000000,  0.0019492200000000 ]  - [  -0.0015781600000000,  0.0008213900000000, -0.0026394900000000 ]  - [  -0.0004774500000000, -0.0001052900000000, -0.0001990600000000 ]  - [  -0.0017678600000000,  0.0033158000000000, -0.0014306500000000 ]  - [   0.0012474700000000, -0.0016121500000000,  0.0021175500000000 ]  - [  -0.0001968600000000, -0.0003256300000000,  0.0001866400000000 ]  - [  -0.0002361900000000,  0.0007233100000000, -0.0023345400000000 ]  - [  -0.0001855900000000, -0.0006914100000000, -0.0001727700000000 ]  - [   0.0008972300000000,  0.0017687100000000,  0.0020855000000000 ]  - [   0.0003747200000000, -0.0000146300000000,  0.0001890200000000 ]  - [   0.0000616300000000,  0.0001880600000000,  0.0005089200000000 ]  - [  -0.0014045400000000, -0.0000985400000000,  0.0012052700000000 ]  - [   0.0002379700000000, -0.0000496200000000,  0.0003814400000000 ]  - [  -0.0000834800000000,  0.0000131700000000, -0.0000086300000000 ]  - [  -0.0002826200000000,  0.0001400300000000, -0.0008338300000000 ]  - [  -0.0005178200000000,  0.0000559000000000, -0.0005686700000000 ]  - [   0.0002406700000000,  0.0001935900000000, -0.0008425600000000 ]  - [  -0.0010829700000000, -0.0038402000000000, -0.0005630800000000 ]  - [   0.0000444900000000, -0.0003128900000000, -0.0008572400000000 ]  - [  -0.0000181900000000,  0.0000901200000000, -0.0000646000000000 ]  - [   0.0002030800000000,  0.0002814800000000, -0.0003217900000000 ]  - [   0.0001390300000000, -0.0003419700000000, -0.0003254100000000 ]  - [  -0.0000519900000000, -0.0003825700000000, -0.0005094400000000 ]  - [   0.0001378800000000, -0.0008966600000000, -0.0016844300000000 ]  - [  -0.0003271200000000,  0.0000420000000000, -0.0003321800000000 ]  - [  -0.0001363500000000, -0.0002270800000000,  0.0002706500000000 ]  - [  -0.0002809500000000,  0.0002401800000000, -0.0005199200000000 ]  - [  -0.0003970200000000,  0.0001806300000000,  0.0005938500000000 ]  - [  -0.0001559200000000,  0.0000671700000000, -0.0005827200000000 ]  - [   0.0003643000000000,  0.0001295200000000, -0.0005347400000000 ]  - [   0.0000239200000000, -0.0001705000000000, -0.0001068500000000 ]  - [  -0.0000072700000000,  0.0000136500000000, -0.0001199800000000 ]  - [  -0.0002994300000000,  0.0001253100000000, -0.0007601700000000 ]  - [  -0.0002128000000000,  0.0000430400000000,  0.0002728500000000 ]  - [   0.0002554300000000,  0.0001911200000000, -0.0007605300000000 ]  - [  -0.0002131500000000,  0.0003076800000000,  0.0002365000000000 ]  - [   0.0000345900000000, -0.0003233400000000, -0.0007650800000000 ]  - [   0.0000128200000000, -0.0000034200000000, -0.0001226700000000 ]  - [   0.0000916800000000,  0.0002258400000000, -0.0004211000000000 ]  - [   0.0001681400000000, -0.0003235200000000, -0.0003959600000000 ]  - [  -0.0000683100000000, -0.0004044700000000, -0.0005003200000000 ]  - [  -0.0001817100000000, -0.0003472900000000,  0.0002410700000000 ]  - [  -0.0003319900000000, -0.0000088100000000, -0.0003945500000000 ]  - [   0.0000655500000000, -0.0001873700000000,  0.0002687000000000 ]  - [  -0.0003180300000000,  0.0002647400000000, -0.0005040900000000 ]  - [   0.0004081300000000,  0.0000209900000000,  0.0002346100000000 ]  - [   0.0001490300000000,  0.0001557600000000,  0.0002515600000000 ]  - [   0.0003857400000000,  0.0001416000000000, -0.0004979400000000 ]  - [   0.0000000600000000, -0.0000239300000000, -0.0001089400000000 ]- atom:   32  displacement:    [   0.0100000000000000, -0.0000000000428756,  0.0000000000000000 ]  forces:  - [   0.0000547600000000, -0.0000094800000000,  0.0002502400000000 ]  - [  -0.0001582600000000,  0.0000042200000000, -0.0001880800000000 ]  - [  -0.0000013700000000, -0.0000000200000000,  0.0002189000000000 ]  - [   0.0000020500000000,  0.0000051600000000, -0.0003016400000000 ]  - [   0.0000317100000000,  0.0002745900000000, -0.0001796500000000 ]  - [   0.0000393000000000, -0.0000148100000000, -0.0002341100000000 ]  - [  -0.0000235900000000, -0.0000227700000000,  0.0000210200000000 ]  - [   0.0000001600000000, -0.0000001600000000, -0.0000899100000000 ]  - [  -0.0003076300000000,  0.0000009700000000, -0.0000774300000000 ]  - [  -0.0002926000000000,  0.0001949100000000,  0.0005896000000000 ]  - [   0.0018713800000000, -0.0000438700000000, -0.0006568900000000 ]  - [   0.0002588400000000,  0.0001401400000000,  0.0005486500000000 ]  - [   0.0159150700000000, -0.0201513900000000,  0.0111814700000000 ]  - [  -0.0000263800000000, -0.0003605300000000,  0.0005592500000000 ]  - [   0.0003097000000000, -0.0003811200000000, -0.0008468700000000 ]  - [  -0.0002874100000000,  0.0001841600000000,  0.0005767300000000 ]  - [   0.0003184000000000, -0.0001737500000000, -0.0006502400000000 ]  - [   0.0002964000000000,  0.0001643100000000,  0.0005764400000000 ]  - [  -0.0003096900000000, -0.0001776800000000, -0.0006483700000000 ]  - [  -0.0000141100000000, -0.0003313300000000,  0.0005800000000000 ]  - [  -0.0000015200000000,  0.0003669200000000, -0.0006467500000000 ]  - [   0.0011531700000000, -0.0002234400000000,  0.0004591000000000 ]  - [   0.0003027600000000, -0.0001306400000000, -0.0006570000000000 ]  - [   0.0005984900000000,  0.0012572800000000,  0.0004660700000000 ]  - [  -0.0003279800000000, -0.0002140200000000, -0.0006573200000000 ]  - [   0.0072744600000000,  0.0070970500000000,  0.0058901100000000 ]  - [   0.0000012000000000,  0.0003694300000000, -0.0006612500000000 ]  - [  -0.0001097400000000, -0.0000369100000000,  0.0001362900000000 ]  - [  -0.0000899900000000,  0.0001789700000000, -0.0004801100000000 ]  - [  -0.0003577000000000,  0.0002065900000000,  0.0005915300000000 ]  - [   0.0002089800000000,  0.0000194100000000, -0.0005245200000000 ]  - [  -0.0384166300000000,  0.0123234900000000, -0.0246409900000000 ]  - [  -0.0000701800000000, -0.0001929700000000, -0.0005456900000000 ]  - [   0.0019707500000000,  0.0004301200000000,  0.0034786700000000 ]  - [   0.0001943100000000,  0.0002789700000000, -0.0002872300000000 ]  - [   0.0001539300000000, -0.0003327600000000, -0.0002802500000000 ]  - [  -0.0000003900000000, -0.0001983200000000, -0.0000503200000000 ]  - [   0.0003569000000000,  0.0012265300000000,  0.0001829400000000 ]  - [  -0.0003474300000000,  0.0000375200000000, -0.0002894600000000 ]  - [   0.0008086300000000, -0.0017496000000000,  0.0025102300000000 ]  - [  -0.0001273900000000,  0.0001478200000000, -0.0001340800000000 ]  - [   0.0008517000000000, -0.0015079500000000, -0.0000102800000000 ]  - [  -0.0002265200000000,  0.0010402700000000,  0.0012442200000000 ]  - [   0.0001814900000000,  0.0000412300000000, -0.0001503000000000 ]  - [   0.0005221000000000, -0.0007120300000000, -0.0003223000000000 ]  - [  -0.0002225300000000, -0.0000615900000000,  0.0001974000000000 ]  - [  -0.0001523200000000,  0.0001746300000000, -0.0005574000000000 ]  - [  -0.0002161100000000, -0.0000508800000000,  0.0005960300000000 ]  - [   0.0002074600000000,  0.0000487600000000, -0.0005515700000000 ]  - [  -0.0001363400000000,  0.0003048100000000,  0.0003054100000000 ]  - [  -0.0000608600000000, -0.0002141500000000, -0.0005701100000000 ]  - [   0.0000541500000000,  0.0002131600000000,  0.0001886800000000 ]  - [   0.0001923300000000,  0.0003080600000000, -0.0002322400000000 ]  - [   0.0001681100000000, -0.0003481300000000, -0.0002360300000000 ]  - [  -0.0000132400000000, -0.0001705700000000, -0.0001895700000000 ]  - [  -0.0002151400000000, -0.0002854800000000,  0.0003049700000000 ]  - [  -0.0003423400000000,  0.0000148900000000, -0.0002404800000000 ]  - [   0.0001447600000000, -0.0001567600000000,  0.0005758400000000 ]  - [  -0.0001289000000000,  0.0000855600000000, -0.0001762900000000 ]  - [   0.0003531400000000, -0.0000344600000000,  0.0002980400000000 ]  - [   0.0000730400000000,  0.0002130400000000,  0.0005809400000000 ]  - [   0.0001524100000000,  0.0000756700000000, -0.0001863200000000 ]  - [   0.0001647700000000, -0.0001614900000000,  0.0001979600000000 ]  - [  -0.0002064900000000, -0.0001084700000000,  0.0002144000000000 ]  - [  -0.0005920700000000,  0.0011942800000000,  0.0004320900000000 ]  - [  -0.0002431000000000, -0.0000931300000000,  0.0005620100000000 ]  - [   0.0005944000000000, -0.0007403200000000,  0.0001773100000000 ]  - [  -0.0001826300000000,  0.0002875500000000,  0.0003231100000000 ]  - [   0.0000513100000000, -0.0007722200000000, -0.0006965900000000 ]  - [   0.0000677100000000,  0.0002664100000000,  0.0002616000000000 ]  - [   0.0032681900000000, -0.0033156800000000, -0.0015467500000000 ]  - [   0.0002642600000000, -0.0005424600000000, -0.0003265800000000 ]  - [  -0.0000479500000000, -0.0001510600000000, -0.0002671900000000 ]  - [  -0.0001809700000000, -0.0003144200000000,  0.0003236600000000 ]  - [   0.0013938700000000,  0.0042146700000000, -0.0012999000000000 ]  - [   0.0001887000000000, -0.0001419000000000,  0.0005456500000000 ]  - [   0.0024317300000000,  0.0010778300000000,  0.0043463800000000 ]  - [   0.0003679900000000,  0.0000068200000000,  0.0003201200000000 ]  - [   0.0000605900000000,  0.0002350900000000,  0.0005174500000000 ]  - [   0.0003477300000000,  0.0000811500000000, -0.0002985300000000 ]  - [   0.0002142400000000, -0.0001637200000000,  0.0002560700000000 ]- atom:   32  displacement:    [  -0.0100000000000000,  0.0000000000428756,  0.0000000000000000 ]  forces:  - [  -0.0000591000000000,  0.0000033300000000,  0.0002719800000000 ]  - [   0.0001627200000000, -0.0000035900000000, -0.0003334600000000 ]  - [  -0.0000017900000000, -0.0000004000000000,  0.0002981800000000 ]  - [   0.0000012700000000,  0.0000043900000000, -0.0002227700000000 ]  - [  -0.0000406800000000, -0.0002748200000000,  0.0007059000000000 ]  - [  -0.0000372900000000,  0.0000153800000000, -0.0002890700000000 ]  - [   0.0000169200000000,  0.0000262200000000, -0.0000196400000000 ]  - [  -0.0000010600000000, -0.0000014900000000,  0.0000845400000000 ]  - [   0.0003088000000000, -0.0000009900000000,  0.0000777000000000 ]  - [  -0.0003010800000000,  0.0001763100000000,  0.0006149000000000 ]  - [  -0.0013128500000000, -0.0002938900000000, -0.0005883000000000 ]  - [   0.0003533500000000,  0.0002044100000000,  0.0006560000000000 ]  - [  -0.0165114200000000,  0.0194355800000000, -0.0120996900000000 ]  - [   0.0000128700000000, -0.0003275600000000,  0.0006468500000000 ]  - [  -0.0002831800000000,  0.0010529900000000, -0.0003938300000000 ]  - [  -0.0003194600000000,  0.0001824400000000,  0.0006603300000000 ]  - [   0.0002772300000000, -0.0001751900000000, -0.0005626500000000 ]  - [   0.0003070300000000,  0.0001938100000000,  0.0006595800000000 ]  - [  -0.0002998700000000, -0.0001429700000000, -0.0005631800000000 ]  - [   0.0000055000000000, -0.0003547900000000,  0.0006591800000000 ]  - [   0.0000205600000000,  0.0003407100000000, -0.0005653800000000 ]  - [  -0.0016936400000000,  0.0005519400000000,  0.0007539600000000 ]  - [   0.0002895000000000, -0.0001854300000000, -0.0005773600000000 ]  - [  -0.0000115500000000, -0.0009334700000000,  0.0007396700000000 ]  - [  -0.0002657100000000, -0.0001233900000000, -0.0005779400000000 ]  - [  -0.0071615800000000, -0.0076806000000000, -0.0046810200000000 ]  - [  -0.0000131300000000,  0.0003234400000000, -0.0005690300000000 ]  - [  -0.0002326500000000, -0.0001265300000000,  0.0003066600000000 ]  - [  -0.0001858000000000,  0.0001654500000000, -0.0006350500000000 ]  - [  -0.0000939200000000, -0.0003466500000000,  0.0006138000000000 ]  - [   0.0002108200000000,  0.0000409100000000, -0.0005732400000000 ]  - [   0.0379099100000000, -0.0111704000000000,  0.0248268000000000 ]  - [  -0.0000697000000000, -0.0002092400000000, -0.0005820900000000 ]  - [  -0.0019145200000000, -0.0000540000000000, -0.0029960200000000 ]  - [   0.0002058500000000,  0.0002842400000000, -0.0002998600000000 ]  - [   0.0001369800000000, -0.0003456700000000, -0.0003085800000000 ]  - [  -0.0001143900000000, -0.0002072600000000, -0.0002821600000000 ]  - [  -0.0007391600000000, -0.0018148400000000,  0.0002936900000000 ]  - [  -0.0003564800000000,  0.0000459700000000, -0.0003068300000000 ]  - [  -0.0004511200000000,  0.0014429700000000, -0.0013108300000000 ]  - [  -0.0001496100000000,  0.0001429900000000, -0.0001800300000000 ]  - [  -0.0001326800000000,  0.0014717800000000,  0.0004875400000000 ]  - [   0.0003287400000000, -0.0005780600000000, -0.0000252800000000 ]  - [   0.0002126900000000,  0.0000644600000000, -0.0001668400000000 ]  - [  -0.0002141900000000,  0.0004973600000000,  0.0007768800000000 ]  - [  -0.0001847200000000, -0.0000431300000000,  0.0001279300000000 ]  - [  -0.0001748700000000,  0.0001640700000000, -0.0006137900000000 ]  - [  -0.0002157800000000, -0.0000330200000000,  0.0005474900000000 ]  - [   0.0002122600000000,  0.0000727600000000, -0.0006082900000000 ]  - [  -0.0001460000000000,  0.0003095200000000,  0.0002865400000000 ]  - [  -0.0000446800000000, -0.0002326700000000, -0.0006273500000000 ]  - [   0.0000525800000000,  0.0001731000000000,  0.0001207900000000 ]  - [   0.0001899000000000,  0.0002970900000000, -0.0002542800000000 ]  - [   0.0001573200000000, -0.0003408200000000, -0.0002603500000000 ]  - [  -0.0000187900000000, -0.0002097400000000, -0.0002573900000000 ]  - [  -0.0002328300000000, -0.0003078700000000,  0.0002807000000000 ]  - [  -0.0003440700000000,  0.0000237700000000, -0.0002632100000000 ]  - [   0.0001268300000000, -0.0001641700000000,  0.0005321500000000 ]  - [  -0.0001626200000000,  0.0001147700000000, -0.0002473300000000 ]  - [   0.0003645800000000, -0.0000380500000000,  0.0002841200000000 ]  - [   0.0000857600000000,  0.0001988500000000,  0.0005306400000000 ]  - [   0.0001921400000000,  0.0000890000000000, -0.0002560300000000 ]  - [   0.0001292100000000, -0.0001410600000000,  0.0001295800000000 ]  - [  -0.0001978400000000, -0.0000087600000000,  0.0001690600000000 ]  - [   0.0002478200000000, -0.0008570400000000, -0.0014343400000000 ]  - [  -0.0002303600000000, -0.0000575200000000,  0.0004844500000000 ]  - [  -0.0001301500000000,  0.0008774100000000, -0.0012059000000000 ]  - [  -0.0001894300000000,  0.0002849500000000,  0.0002999400000000 ]  - [  -0.0001738700000000,  0.0003167900000000, -0.0003066100000000 ]  - [   0.0000260900000000,  0.0001343200000000,  0.0001139400000000 ]  - [  -0.0027634600000000,  0.0038462200000000,  0.0009003400000000 ]  - [   0.0000862300000000, -0.0000626600000000, -0.0003195100000000 ]  - [  -0.0000437500000000, -0.0002343200000000, -0.0001013100000000 ]  - [  -0.0001749500000000, -0.0003171300000000,  0.0003031700000000 ]  - [  -0.0022210200000000, -0.0043393300000000,  0.0006655900000000 ]  - [   0.0001694600000000, -0.0001630400000000,  0.0004923600000000 ]  - [  -0.0027564300000000, -0.0008038800000000, -0.0047959700000000 ]  - [   0.0003786000000000,  0.0000079900000000,  0.0002982900000000 ]  - [   0.0000580000000000,  0.0002355200000000,  0.0004889700000000 ]  - [   0.0000334200000000,  0.0000374000000000, -0.0000739100000000 ]  - [   0.0001022700000000, -0.0001451600000000,  0.0001455300000000 ]- atom:   32  displacement:    [  -0.0049999999716508,  0.0086602540542118,  0.0000000000000000 ]  forces:  - [  -0.0001114000000000,  0.0000794300000000,  0.0003887900000000 ]  - [   0.0001746900000000,  0.0000864400000000, -0.0003679500000000 ]  - [  -0.0000014200000000, -0.0000001300000000,  0.0002908100000000 ]  - [   0.0000017800000000,  0.0000029400000000, -0.0002286500000000 ]  - [  -0.0002028000000000, -0.0012276500000000,  0.0014484800000000 ]  - [   0.0000497200000000,  0.0001219100000000, -0.0003986100000000 ]  - [  -0.0000386100000000, -0.0005135800000000, -0.0004501700000000 ]  - [  -0.0000000800000000, -0.0000003400000000,  0.0000687400000000 ]  - [   0.0005409900000000,  0.0001032400000000,  0.0002275000000000 ]  - [  -0.0002723700000000,  0.0001909100000000,  0.0005860600000000 ]  - [  -0.0013207200000000,  0.0023007200000000, -0.0009383700000000 ]  - [   0.0003402200000000,  0.0003199200000000,  0.0006790300000000 ]  - [  -0.0263032100000000,  0.0492144900000000, -0.0239228000000000 ]  - [   0.0000221100000000, -0.0003808000000000,  0.0006201900000000 ]  - [   0.0010980900000000, -0.0010048400000000, -0.0001492500000000 ]  - [  -0.0003228300000000,  0.0001767000000000,  0.0006506800000000 ]  - [   0.0002920300000000, -0.0001682900000000, -0.0005775500000000 ]  - [   0.0003131200000000,  0.0002011900000000,  0.0006568000000000 ]  - [  -0.0003057000000000, -0.0001572200000000, -0.0005746500000000 ]  - [   0.0000119600000000, -0.0003605100000000,  0.0006572300000000 ]  - [   0.0000148800000000,  0.0003511900000000, -0.0005792100000000 ]  - [  -0.0002187800000000,  0.0031466800000000,  0.0005095700000000 ]  - [   0.0003405400000000, -0.0002229600000000, -0.0005322500000000 ]  - [  -0.0005901300000000, -0.0016501800000000,  0.0007348400000000 ]  - [  -0.0003124500000000, -0.0001748400000000, -0.0006306400000000 ]  - [   0.0045545700000000,  0.0434470200000000,  0.0178598100000000 ]  - [  -0.0000789500000000,  0.0002619400000000, -0.0005283400000000 ]  - [  -0.0000768800000000, -0.0000544700000000,  0.0001637000000000 ]  - [  -0.0001367500000000,  0.0001432900000000, -0.0005648500000000 ]  - [  -0.0001245700000000,  0.0007440000000000, -0.0000846000000000 ]  - [   0.0002029600000000,  0.0000327100000000, -0.0005501100000000 ]  - [   0.0287273700000000, -0.1026936900000000,  0.0080061100000000 ]  - [  -0.0000734900000000, -0.0002083700000000, -0.0005746700000000 ]  - [   0.0006767500000000, -0.0014340900000000,  0.0002490300000000 ]  - [   0.0002003500000000,  0.0002799400000000, -0.0003033800000000 ]  - [   0.0001408100000000, -0.0003582800000000, -0.0003158500000000 ]  - [  -0.0001848000000000, -0.0001624000000000, -0.0004101600000000 ]  - [   0.0016192300000000,  0.0013237700000000,  0.0005008700000000 ]  - [  -0.0003513800000000,  0.0000433500000000, -0.0003107400000000 ]  - [  -0.0026881400000000,  0.0020231700000000, -0.0035219400000000 ]  - [  -0.0000970700000000,  0.0002036700000000, -0.0001819500000000 ]  - [  -0.0019696500000000,  0.0031839300000000,  0.0004913400000000 ]  - [   0.0012829800000000,  0.0001104500000000,  0.0004657100000000 ]  - [   0.0001640900000000,  0.0000443000000000, -0.0001056900000000 ]  - [  -0.0010554400000000,  0.0013558000000000,  0.0011389800000000 ]  - [  -0.0001895000000000, -0.0000459800000000,  0.0001310000000000 ]  - [  -0.0001705600000000,  0.0001668700000000, -0.0006090400000000 ]  - [  -0.0002132800000000, -0.0000318600000000,  0.0005445600000000 ]  - [   0.0002119600000000,  0.0000694400000000, -0.0006017900000000 ]  - [  -0.0001422800000000,  0.0003104900000000,  0.0002837300000000 ]  - [  -0.0000468500000000, -0.0002260500000000, -0.0006185100000000 ]  - [   0.0000520100000000,  0.0001781100000000,  0.0001238200000000 ]  - [   0.0001931500000000,  0.0003037300000000, -0.0002456400000000 ]  - [   0.0001591600000000, -0.0003233500000000, -0.0002569500000000 ]  - [  -0.0000173000000000, -0.0002086900000000, -0.0002516500000000 ]  - [  -0.0002287700000000, -0.0003069500000000,  0.0002742500000000 ]  - [  -0.0003472900000000,  0.0000261300000000, -0.0002586400000000 ]  - [   0.0001269700000000, -0.0001639500000000,  0.0005272700000000 ]  - [  -0.0001627000000000,  0.0001115400000000, -0.0002426600000000 ]  - [   0.0003548300000000, -0.0000334300000000,  0.0002812500000000 ]  - [   0.0000874900000000,  0.0001977600000000,  0.0005280500000000 ]  - [   0.0001891900000000,  0.0000906200000000, -0.0002503400000000 ]  - [   0.0001339900000000, -0.0001432800000000,  0.0001318700000000 ]  - [  -0.0002193600000000,  0.0000447500000000,  0.0001820900000000 ]  - [   0.0021116400000000,  0.0021817000000000,  0.0026282800000000 ]  - [  -0.0002202000000000, -0.0000241000000000,  0.0003973300000000 ]  - [  -0.0009442300000000, -0.0002235900000000, -0.0008137600000000 ]  - [  -0.0001844300000000,  0.0002876000000000,  0.0003095900000000 ]  - [  -0.0005479000000000,  0.0007091300000000,  0.0002622200000000 ]  - [   0.0000917200000000,  0.0000690700000000,  0.0002235800000000 ]  - [  -0.0014182500000000,  0.0014621200000000,  0.0011723600000000 ]  - [  -0.0000728000000000,  0.0011191800000000, -0.0004291400000000 ]  - [   0.0002100800000000,  0.0002104300000000, -0.0000319800000000 ]  - [  -0.0001725600000000, -0.0003103300000000,  0.0003094400000000 ]  - [  -0.0005464500000000, -0.0017080900000000, -0.0009314800000000 ]  - [   0.0002149400000000, -0.0001204200000000,  0.0005085700000000 ]  - [  -0.0026145700000000, -0.0024868400000000, -0.0037835600000000 ]  - [   0.0003820100000000,  0.0000094500000000,  0.0002982700000000 ]  - [   0.0000503400000000,  0.0002483300000000,  0.0004551200000000 ]  - [  -0.0001239700000000, -0.0000278800000000,  0.0000503700000000 ]  - [   0.0000821700000000, -0.0001321000000000,  0.0001102900000000 ]- atom:   32  displacement:    [   0.0049999999716508, -0.0086602540542118,  0.0000000000000000 ]  forces:  - [   0.0001093000000000, -0.0000882200000000,  0.0001332800000000 ]  - [  -0.0001701600000000, -0.0000825200000000, -0.0001519900000000 ]  - [  -0.0000013800000000, -0.0000020100000000,  0.0002295600000000 ]  - [   0.0000021200000000,  0.0000045800000000, -0.0002941400000000 ]  - [   0.0001935000000000,  0.0012301900000000, -0.0009162800000000 ]  - [  -0.0000493100000000, -0.0001245400000000, -0.0001247100000000 ]  - [   0.0000269900000000,  0.0005206300000000,  0.0004472000000000 ]  - [  -0.0000020400000000,  0.0000005400000000, -0.0000716100000000 ]  - [  -0.0005360900000000, -0.0001013900000000, -0.0002286300000000 ]  - [  -0.0003437600000000,  0.0001801300000000,  0.0006229900000000 ]  - [   0.0019115200000000, -0.0027227800000000, -0.0002937500000000 ]  - [   0.0002780800000000,  0.0000329800000000,  0.0005220100000000 ]  - [   0.0267528700000000, -0.0515230300000000,  0.0240223700000000 ]  - [  -0.0000183000000000, -0.0003232900000000,  0.0005921300000000 ]  - [  -0.0010793100000000,  0.0017168300000000, -0.0011081800000000 ]  - [  -0.0003071100000000,  0.0001868700000000,  0.0005998800000000 ]  - [   0.0003180100000000, -0.0001778000000000, -0.0006392700000000 ]  - [   0.0002975100000000,  0.0001747000000000,  0.0005905800000000 ]  - [  -0.0003113700000000, -0.0001854500000000, -0.0006527600000000 ]  - [  -0.0000016200000000, -0.0003512100000000,  0.0006015400000000 ]  - [  -0.0000001400000000,  0.0003680200000000, -0.0006380300000000 ]  - [  -0.0003062100000000, -0.0029311300000000,  0.0006914900000000 ]  - [   0.0002642000000000, -0.0000919700000000, -0.0007008100000000 ]  - [   0.0011847000000000,  0.0020247300000000,  0.0005010200000000 ]  - [  -0.0002884700000000, -0.0001789800000000, -0.0006035300000000 ]  - [  -0.0049558800000000, -0.0451525100000000, -0.0172392500000000 ]  - [   0.0000596700000000,  0.0004390900000000, -0.0006941300000000 ]  - [  -0.0002495500000000, -0.0001059800000000,  0.0002640900000000 ]  - [  -0.0001174400000000,  0.0002048100000000, -0.0005301500000000 ]  - [  -0.0003258800000000, -0.0008704800000000,  0.0012627300000000 ]  - [   0.0002044200000000,  0.0000145500000000, -0.0005340100000000 ]  - [  -0.0298037400000000,  0.1064126400000000, -0.0082822900000000 ]  - [  -0.0000816700000000, -0.0001786800000000, -0.0005320200000000 ]  - [  -0.0006724900000000,  0.0018189900000000,  0.0001474900000000 ]  - [   0.0001873300000000,  0.0002770600000000, -0.0002879600000000 ]  - [   0.0001476300000000, -0.0002871200000000, -0.0002812700000000 ]  - [   0.0000828900000000, -0.0002294300000000,  0.0000847300000000 ]  - [  -0.0020031400000000, -0.0019108100000000, -0.0000143900000000 ]  - [  -0.0003326000000000,  0.0000348100000000, -0.0002968200000000 ]  - [   0.0030919800000000, -0.0023871400000000,  0.0047836100000000 ]  - [  -0.0001760700000000,  0.0000699200000000, -0.0001329500000000 ]  - [   0.0026439300000000, -0.0031557500000000, -0.0000209000000000 ]  - [  -0.0011964100000000,  0.0003481000000000,  0.0007191300000000 ]  - [   0.0002257200000000,  0.0000620200000000, -0.0002171100000000 ]  - [   0.0013432200000000, -0.0015521500000000, -0.0006810300000000 ]  - [  -0.0002159200000000, -0.0000609700000000,  0.0001912400000000 ]  - [  -0.0001524200000000,  0.0001673300000000, -0.0005485300000000 ]  - [  -0.0002059000000000, -0.0000377500000000,  0.0005707900000000 ]  - [   0.0002096100000000,  0.0000475500000000, -0.0005474200000000 ]  - [  -0.0001377000000000,  0.0002889100000000,  0.0002990100000000 ]  - [  -0.0000629200000000, -0.0002121500000000, -0.0005562300000000 ]  - [   0.0000470100000000,  0.0001995900000000,  0.0001787000000000 ]  - [   0.0001708300000000,  0.0002856200000000, -0.0002285100000000 ]  - [   0.0001628700000000, -0.0003352200000000, -0.0002270500000000 ]  - [  -0.0000100200000000, -0.0001723100000000, -0.0001889000000000 ]  - [  -0.0001944500000000, -0.0002710100000000,  0.0003019800000000 ]  - [  -0.0003246100000000, -0.0000003900000000, -0.0002236600000000 ]  - [   0.0001305700000000, -0.0001586300000000,  0.0005569300000000 ]  - [  -0.0001373400000000,  0.0000882500000000, -0.0001815500000000 ]  - [   0.0003395000000000, -0.0000326700000000,  0.0002966000000000 ]  - [   0.0000815100000000,  0.0002065700000000,  0.0005630000000000 ]  - [   0.0001481900000000,  0.0000775300000000, -0.0001841800000000 ]  - [   0.0001547500000000, -0.0001475500000000,  0.0001855300000000 ]  - [  -0.0001565400000000, -0.0001649200000000,  0.0001914400000000 ]  - [  -0.0024685600000000, -0.0018694400000000, -0.0036636300000000 ]  - [  -0.0002457700000000, -0.0000952700000000,  0.0006124600000000 ]  - [   0.0014135800000000,  0.0003610300000000, -0.0001593500000000 ]  - [  -0.0001845300000000,  0.0002703500000000,  0.0003304900000000 ]  - [   0.0004330800000000, -0.0011531600000000, -0.0012491800000000 ]  - [  -0.0000119700000000,  0.0003175400000000,  0.0001490800000000 ]  - [   0.0018100100000000, -0.0008650000000000, -0.0018443500000000 ]  - [   0.0004339400000000, -0.0017086700000000, -0.0002088400000000 ]  - [  -0.0002959400000000, -0.0006027600000000, -0.0003363700000000 ]  - [  -0.0001619400000000, -0.0003018600000000,  0.0003355100000000 ]  - [  -0.0001442900000000,  0.0017141700000000,  0.0002994100000000 ]  - [   0.0001112900000000, -0.0001890800000000,  0.0004941900000000 ]  - [   0.0023340900000000,  0.0027482300000000,  0.0034134300000000 ]  - [   0.0003395500000000,  0.0000165300000000,  0.0003325200000000 ]  - [   0.0000809200000000,  0.0001944400000000,  0.0005170700000000 ]  - [   0.0004883900000000,  0.0001488500000000, -0.0004095100000000 ]  - [   0.0002256800000000, -0.0001614600000000,  0.0002900300000000 ]- atom:   32  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0000167600000000,  0.0000197200000000,  0.0000990000000000 ]  - [  -0.0000857500000000,  0.0000273200000000, -0.0002024600000000 ]  - [  -0.0000018700000000,  0.0000000300000000,  0.0001481100000000 ]  - [   0.0000018900000000,  0.0000054700000000, -0.0003716400000000 ]  - [  -0.0001935500000000, -0.0002207500000000,  0.0009946300000000 ]  - [  -0.0000082100000000, -0.0000485500000000, -0.0003866500000000 ]  - [   0.0001331600000000, -0.0000806700000000,  0.0000165700000000 ]  - [  -0.0000025500000000,  0.0000020200000000, -0.0002455400000000 ]  - [  -0.0003513900000000, -0.0000104200000000, -0.0001575500000000 ]  - [  -0.0002657800000000,  0.0001822300000000,  0.0005095600000000 ]  - [   0.0001285500000000, -0.0007113000000000,  0.0005924600000000 ]  - [   0.0002512900000000,  0.0001598100000000,  0.0004782400000000 ]  - [   0.0102712700000000, -0.0175467700000000,  0.0154503000000000 ]  - [  -0.0000543000000000, -0.0003702700000000,  0.0004701700000000 ]  - [  -0.0002145000000000, -0.0009388100000000, -0.0002643000000000 ]  - [  -0.0002717000000000,  0.0001827900000000,  0.0005090800000000 ]  - [   0.0003585600000000, -0.0001780100000000, -0.0007265000000000 ]  - [   0.0002859200000000,  0.0001408000000000,  0.0005006600000000 ]  - [  -0.0003256900000000, -0.0002216600000000, -0.0007208700000000 ]  - [  -0.0000192000000000, -0.0003198600000000,  0.0005148300000000 ]  - [  -0.0000274600000000,  0.0003925500000000, -0.0007237700000000 ]  - [  -0.0009478300000000,  0.0002250300000000,  0.0022749000000000 ]  - [   0.0003383300000000, -0.0001178300000000, -0.0007454000000000 ]  - [  -0.0000731200000000,  0.0018125700000000,  0.0011459400000000 ]  - [  -0.0003369000000000, -0.0002530800000000, -0.0007378700000000 ]  - [   0.0058602400000000,  0.0202401300000000,  0.0188505500000000 ]  - [  -0.0000101700000000,  0.0003967100000000, -0.0007490900000000 ]  - [  -0.0001016500000000, -0.0000703400000000,  0.0001040500000000 ]  - [  -0.0000512900000000,  0.0001761800000000, -0.0004152000000000 ]  - [  -0.0002668300000000, -0.0008154600000000,  0.0004605700000000 ]  - [   0.0002008700000000,  0.0000106400000000, -0.0004988100000000 ]  - [  -0.0249763000000000, -0.0039911900000000, -0.0538322000000000 ]  - [  -0.0000895100000000, -0.0001749800000000, -0.0005032700000000 ]  - [   0.0036350000000000,  0.0001898800000000,  0.0047023900000000 ]  - [   0.0001924400000000,  0.0002870700000000, -0.0002514200000000 ]  - [   0.0001577500000000, -0.0003300600000000, -0.0002524800000000 ]  - [  -0.0000409300000000, -0.0001720700000000, -0.0000404600000000 ]  - [  -0.0001600000000000, -0.0005499000000000, -0.0000729800000000 ]  - [  -0.0003516300000000,  0.0000424200000000, -0.0002677000000000 ]  - [   0.0019910000000000, -0.0019418400000000,  0.0017532900000000 ]  - [  -0.0000932500000000,  0.0001540000000000, -0.0000889600000000 ]  - [   0.0006055000000000, -0.0001123800000000, -0.0000715100000000 ]  - [  -0.0011988000000000, -0.0037036200000000,  0.0027043300000000 ]  - [   0.0001464700000000,  0.0000304900000000, -0.0000981800000000 ]  - [  -0.0004628400000000,  0.0004135000000000,  0.0009467400000000 ]  - [  -0.0002695400000000, -0.0000611800000000,  0.0002668900000000 ]  - [  -0.0001320700000000,  0.0001935500000000, -0.0005124400000000 ]  - [  -0.0002005900000000, -0.0000631600000000,  0.0006347300000000 ]  - [   0.0001822600000000,  0.0000378400000000, -0.0005082200000000 ]  - [  -0.0001230400000000,  0.0003139800000000,  0.0003197100000000 ]  - [  -0.0000683400000000, -0.0002000000000000, -0.0005423400000000 ]  - [   0.0000727400000000,  0.0002446200000000,  0.0002522800000000 ]  - [   0.0001767200000000,  0.0003144000000000, -0.0001876900000000 ]  - [   0.0001730800000000, -0.0003501200000000, -0.0002005300000000 ]  - [  -0.0000305400000000, -0.0001379800000000, -0.0001407000000000 ]  - [  -0.0002128700000000, -0.0002762700000000,  0.0003135200000000 ]  - [  -0.0003269700000000,  0.0000141000000000, -0.0002133800000000 ]  - [   0.0001516900000000, -0.0001450000000000,  0.0006170600000000 ]  - [  -0.0000833300000000,  0.0000698800000000, -0.0001153500000000 ]  - [   0.0003372600000000, -0.0000415500000000,  0.0003164300000000 ]  - [   0.0000685600000000,  0.0002239400000000,  0.0006262400000000 ]  - [   0.0001331100000000,  0.0000464600000000, -0.0001376500000000 ]  - [   0.0001814800000000, -0.0001932300000000,  0.0002590300000000 ]  - [  -0.0002326500000000, -0.0001056200000000,  0.0002619400000000 ]  - [   0.0009554200000000,  0.0022834500000000,  0.0004027900000000 ]  - [  -0.0002412500000000, -0.0001007300000000,  0.0006138000000000 ]  - [  -0.0019567400000000,  0.0037049900000000,  0.0014578900000000 ]  - [  -0.0001703100000000,  0.0002569900000000,  0.0003370200000000 ]  - [  -0.0003071600000000,  0.0003604400000000, -0.0007937300000000 ]  - [   0.0000805600000000,  0.0002851000000000,  0.0003127300000000 ]  - [   0.0018109400000000,  0.0001231300000000, -0.0003993100000000 ]  - [   0.0001691900000000, -0.0004109700000000, -0.0005120000000000 ]  - [  -0.0002097300000000, -0.0002657000000000, -0.0003702100000000 ]  - [  -0.0001903500000000, -0.0003006000000000,  0.0003457500000000 ]  - [   0.0011871200000000,  0.0005238000000000, -0.0003829900000000 ]  - [   0.0001789700000000, -0.0001178200000000,  0.0005790300000000 ]  - [   0.0043065600000000,  0.0014231800000000,  0.0054920700000000 ]  - [   0.0003613100000000, -0.0000010500000000,  0.0003420400000000 ]  - [   0.0000612300000000,  0.0002310500000000,  0.0005553500000000 ]  - [   0.0003800300000000,  0.0001043700000000, -0.0003886800000000 ]  - [   0.0002287600000000, -0.0001958200000000,  0.0002973100000000 ]- atom:   32  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000111700000000, -0.0000250200000000,  0.0004206300000000 ]  - [   0.0000897800000000, -0.0000262800000000, -0.0003182100000000 ]  - [  -0.0000017800000000, -0.0000004300000000,  0.0003706700000000 ]  - [   0.0000016200000000,  0.0000042100000000, -0.0001523800000000 ]  - [   0.0001976000000000,  0.0002524000000000, -0.0005147500000000 ]  - [   0.0000112600000000,  0.0000507500000000, -0.0001372300000000 ]  - [  -0.0001304300000000,  0.0000874100000000, -0.0000052900000000 ]  - [   0.0000000300000000,  0.0000016400000000,  0.0002425600000000 ]  - [   0.0003499400000000,  0.0000100700000000,  0.0001493300000000 ]  - [  -0.0003400200000000,  0.0001744400000000,  0.0007034800000000 ]  - [   0.0004948200000000,  0.0003713900000000, -0.0018376300000000 ]  - [   0.0003676300000000,  0.0001874200000000,  0.0007345100000000 ]  - [  -0.0105484700000000,  0.0167441600000000, -0.0165436800000000 ]  - [   0.0000445200000000, -0.0003345900000000,  0.0007375000000000 ]  - [   0.0001820100000000,  0.0016229400000000, -0.0010016600000000 ]  - [  -0.0003512100000000,  0.0001734700000000,  0.0007444000000000 ]  - [   0.0002494700000000, -0.0001812700000000, -0.0004777800000000 ]  - [   0.0003258500000000,  0.0002228100000000,  0.0007440800000000 ]  - [  -0.0002859100000000, -0.0001196300000000, -0.0004792700000000 ]  - [   0.0000268600000000, -0.0003824000000000,  0.0007365600000000 ]  - [   0.0000361400000000,  0.0003175000000000, -0.0004832800000000 ]  - [   0.0003223500000000,  0.0001094000000000, -0.0010848700000000 ]  - [   0.0002740100000000, -0.0002005700000000, -0.0004839800000000 ]  - [   0.0006575100000000, -0.0014638300000000,  0.0000920000000000 ]  - [  -0.0002581200000000, -0.0001069900000000, -0.0004958800000000 ]  - [  -0.0061003100000000, -0.0215419500000000, -0.0178191300000000 ]  - [  -0.0000069600000000,  0.0003036100000000, -0.0004771900000000 ]  - [  -0.0002335200000000, -0.0000810500000000,  0.0003277400000000 ]  - [  -0.0002333300000000,  0.0001563700000000, -0.0007244400000000 ]  - [  -0.0001810400000000,  0.0006867900000000,  0.0007119500000000 ]  - [   0.0002189200000000,  0.0000672200000000, -0.0006321700000000 ]  - [   0.0245153600000000,  0.0058242900000000,  0.0543985700000000 ]  - [  -0.0000487300000000, -0.0002341900000000, -0.0006381700000000 ]  - [  -0.0034888600000000,  0.0002203000000000, -0.0041360000000000 ]  - [   0.0002168800000000,  0.0002840400000000, -0.0003128800000000 ]  - [   0.0001330200000000, -0.0003334900000000, -0.0003170300000000 ]  - [  -0.0000906900000000, -0.0002358300000000, -0.0003036200000000 ]  - [  -0.0001966900000000, -0.0000187100000000,  0.0005417300000000 ]  - [  -0.0003659500000000,  0.0000521900000000, -0.0003176600000000 ]  - [  -0.0016433000000000,  0.0016119500000000, -0.0005262800000000 ]  - [  -0.0001888500000000,  0.0001624700000000, -0.0002466700000000 ]  - [   0.0001127700000000,  0.0000575800000000,  0.0005492800000000 ]  - [   0.0012322100000000,  0.0040371300000000, -0.0013797100000000 ]  - [   0.0002722200000000,  0.0000654800000000, -0.0002396300000000 ]  - [   0.0007477500000000, -0.0006278400000000, -0.0004862700000000 ]  - [  -0.0001504700000000, -0.0000299900000000,  0.0000709200000000 ]  - [  -0.0001981400000000,  0.0001458500000000, -0.0006710000000000 ]  - [  -0.0002042400000000, -0.0000070800000000,  0.0004896200000000 ]  - [   0.0002305000000000,  0.0000930800000000, -0.0006654100000000 ]  - [  -0.0001532500000000,  0.0003266600000000,  0.0002764300000000 ]  - [  -0.0000263000000000, -0.0002457600000000, -0.0006694700000000 ]  - [   0.0000483900000000,  0.0001351400000000,  0.0000633200000000 ]  - [   0.0001900600000000,  0.0002818900000000, -0.0002740300000000 ]  - [   0.0001527600000000, -0.0003185800000000, -0.0002734200000000 ]  - [  -0.0000235100000000, -0.0002505800000000, -0.0003206400000000 ]  - [  -0.0002323400000000, -0.0003178300000000,  0.0002667400000000 ]  - [  -0.0003523000000000,  0.0000274800000000, -0.0002744600000000 ]  - [   0.0001004400000000, -0.0001798400000000,  0.0004774000000000 ]  - [  -0.0002031000000000,  0.0001514500000000, -0.0003203400000000 ]  - [   0.0003684600000000, -0.0000404800000000,  0.0002766700000000 ]  - [   0.0001042800000000,  0.0001801700000000,  0.0004824800000000 ]  - [   0.0002225600000000,  0.0001031900000000, -0.0003147900000000 ]  - [   0.0000935000000000, -0.0001102100000000,  0.0000660800000000 ]  - [  -0.0001716400000000,  0.0000060700000000,  0.0001220300000000 ]  - [  -0.0012418000000000, -0.0019457000000000, -0.0013530700000000 ]  - [  -0.0002137500000000, -0.0000254400000000,  0.0004046600000000 ]  - [   0.0024327800000000, -0.0036732100000000, -0.0025544500000000 ]  - [  -0.0001908900000000,  0.0002953700000000,  0.0002897600000000 ]  - [   0.0001621600000000, -0.0008144800000000, -0.0001877600000000 ]  - [   0.0000252300000000,  0.0000999800000000,  0.0000583900000000 ]  - [  -0.0014193200000000,  0.0005394100000000, -0.0002498300000000 ]  - [   0.0001844500000000, -0.0001634300000000, -0.0001316500000000 ]  - [   0.0001111600000000, -0.0000998100000000,  0.0000087200000000 ]  - [  -0.0001685600000000, -0.0003239100000000,  0.0002862300000000 ]  - [  -0.0018599800000000, -0.0005496900000000, -0.0002520400000000 ]  - [   0.0001415200000000, -0.0001831500000000,  0.0004180600000000 ]  - [  -0.0046834900000000, -0.0011717400000000, -0.0059854800000000 ]  - [   0.0003657300000000,  0.0000163800000000,  0.0002820600000000 ]  - [   0.0000762000000000,  0.0002179500000000,  0.0004240100000000 ]  - [   0.0000182800000000, -0.0000016500000000,  0.0000079000000000 ]  - [   0.0000671100000000, -0.0001128500000000,  0.0000941100000000 ]