# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/390d54b9-da1d-4187-bb61-3bed18b2cdf8/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 Er(BiO2)3 / R-3 (148) / materials id 754989](https://mdr.nims.go.jp/datasets/d9888272-fea7-49bb-9c56-1af147133c13)

## 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:  - [     5.022618383333339,     2.899810076666664,     3.744758426666663 ] # a  - [    -5.022618386666662,     2.899810076666664,     3.744758426666663 ] # b  - [     0.000000003333338,    -5.799620153333336,     3.744758426666663 ] # c  points:  - symbol: Er # 1    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 167.259000  - symbol: Er # 2    coordinates: [  0.500000000000000,  0.500000000000002,  0.500000000000000 ]    mass: 167.259000  - symbol: Bi # 3    coordinates: [  0.928188490000000,  0.748574160000002,  0.442876640000000 ]    mass: 208.980400  - symbol: Bi # 4    coordinates: [  0.748574170000000,  0.442876630000002,  0.928188490000000 ]    mass: 208.980400  - symbol: Bi # 5    coordinates: [  0.557123360000000,  0.071811520000001,  0.251425830000000 ]    mass: 208.980400  - symbol: Bi # 6    coordinates: [  0.442876640000000,  0.928188480000002,  0.748574170000000 ]    mass: 208.980400  - symbol: Bi # 7    coordinates: [  0.251425830000000,  0.557123370000001,  0.071811510000000 ]    mass: 208.980400  - symbol: Bi # 8    coordinates: [  0.071811510000000,  0.251425840000001,  0.557123360000000 ]    mass: 208.980400  - symbol: O  # 9    coordinates: [  0.931952880000000,  0.069696100000001,  0.307712210000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.930303910000000,  0.692287780000002,  0.068047120000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.809111870000000,  0.471723820000002,  0.599568300000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.692287790000000,  0.068047110000002,  0.930303910000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.599568300000000,  0.809111860000002,  0.471723830000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.528276170000000,  0.400431710000001,  0.190888130000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.471723830000000,  0.599568290000002,  0.809111870000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.400431700000000,  0.190888140000001,  0.528276170000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.307712210000000,  0.931952890000001,  0.069696090000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.190888130000000,  0.528276180000001,  0.400431700000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.069696090000000,  0.307712220000001,  0.931952880000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.068047120000000,  0.930303900000002,  0.692287790000000 ]    mass: 15.999400  reciprocal_lattice: # without 2pi  - [     0.099549669449952,     0.057475028510890,     0.089013307496592 ] # a*  - [    -0.099549669449952,     0.057475028396458,     0.089013307496592 ] # b*  - [    -0.000000000000000,    -0.114950056907348,     0.089013307496592 ] # c*unit_cell:  lattice:  - [    10.045236770000001,     0.000000000000000,     0.000000000000000 ] # a  - [    -5.022618390000000,     8.699430230000001,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.234275280000000 ] # c  points:  - symbol: Er # 1    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 167.259000    reduced_to: 1  - symbol: Er # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 167.259000    reduced_to: 2  - symbol: Er # 3    coordinates: [  0.666666670000000,  0.333333330000000,  0.333333330000000 ]    mass: 167.259000    reduced_to: 1  - symbol: Er # 4    coordinates: [  0.666666670000000,  0.333333330000000,  0.833333330000000 ]    mass: 167.259000    reduced_to: 2  - symbol: Er # 5    coordinates: [  0.333333330000000,  0.666666670000000,  0.666666670000000 ]    mass: 167.259000    reduced_to: 1  - symbol: Er # 6    coordinates: [  0.333333330000000,  0.666666670000000,  0.166666670000000 ]    mass: 167.259000    reduced_to: 2  - symbol: Bi # 7    coordinates: [  0.221642060000000,  0.263669790000000,  0.706546430000000 ]    mass: 208.980400    reduced_to: 7  - symbol: Bi # 8    coordinates: [  0.042027740000000,  0.778357940000000,  0.706546430000000 ]    mass: 208.980400    reduced_to: 8  - symbol: Bi # 9    coordinates: [  0.263669790000000,  0.042027740000000,  0.293453570000000 ]    mass: 208.980400    reduced_to: 9  - symbol: Bi # 10    coordinates: [  0.736330210000000,  0.957972260000000,  0.706546430000000 ]    mass: 208.980400    reduced_to: 10  - symbol: Bi # 11    coordinates: [  0.957972260000000,  0.221642060000000,  0.293453570000000 ]    mass: 208.980400    reduced_to: 11  - symbol: Bi # 12    coordinates: [  0.778357940000000,  0.736330210000000,  0.293453570000000 ]    mass: 208.980400    reduced_to: 12  - symbol: Bi # 13    coordinates: [  0.888308720000000,  0.597003120000000,  0.039879760000000 ]    mass: 208.980400    reduced_to: 7  - symbol: Bi # 14    coordinates: [  0.708694410000000,  0.111691280000000,  0.039879760000000 ]    mass: 208.980400    reduced_to: 8  - symbol: Bi # 15    coordinates: [  0.930336460000000,  0.375361080000000,  0.626786900000000 ]    mass: 208.980400    reduced_to: 9  - symbol: Bi # 16    coordinates: [  0.402996880000000,  0.291305590000000,  0.039879760000000 ]    mass: 208.980400    reduced_to: 10  - symbol: Bi # 17    coordinates: [  0.624638920000000,  0.554975390000000,  0.626786900000000 ]    mass: 208.980400    reduced_to: 11  - symbol: Bi # 18    coordinates: [  0.445024610000000,  0.069663540000000,  0.626786900000000 ]    mass: 208.980400    reduced_to: 12  - symbol: Bi # 19    coordinates: [  0.554975390000000,  0.930336460000000,  0.373213100000000 ]    mass: 208.980400    reduced_to: 7  - symbol: Bi # 20    coordinates: [  0.375361080000000,  0.445024610000000,  0.373213100000000 ]    mass: 208.980400    reduced_to: 8  - symbol: Bi # 21    coordinates: [  0.597003120000000,  0.708694410000000,  0.960120240000000 ]    mass: 208.980400    reduced_to: 9  - symbol: Bi # 22    coordinates: [  0.069663540000000,  0.624638920000000,  0.373213100000000 ]    mass: 208.980400    reduced_to: 10  - symbol: Bi # 23    coordinates: [  0.291305590000000,  0.888308720000000,  0.960120240000000 ]    mass: 208.980400    reduced_to: 11  - symbol: Bi # 24    coordinates: [  0.111691280000000,  0.402996880000000,  0.960120240000000 ]    mass: 208.980400    reduced_to: 12  - symbol: O  # 25    coordinates: [  0.495499150000000,  0.128741520000000,  0.436453730000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.366757640000000,  0.495499150000000,  0.563546270000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 27    coordinates: [  0.182310540000000,  0.027233030000000,  0.626801330000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.128741520000000,  0.633242360000000,  0.563546270000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 29    coordinates: [  0.972766970000000,  0.155077500000000,  0.626801330000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.155077500000000,  0.182310540000000,  0.373198670000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 31    coordinates: [  0.844922500000000,  0.817689460000000,  0.626801330000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.027233030000000,  0.844922500000000,  0.373198670000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 33    coordinates: [  0.871258480000000,  0.366757640000000,  0.436453730000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.817689460000000,  0.972766970000000,  0.373198670000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 35    coordinates: [  0.633242360000000,  0.504500850000000,  0.436453730000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.504500850000000,  0.871258480000000,  0.563546270000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 37    coordinates: [  0.162165820000000,  0.462074850000000,  0.769787070000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 38    coordinates: [  0.033424300000000,  0.828832490000000,  0.896879600000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 39    coordinates: [  0.848977200000000,  0.360566370000000,  0.960134660000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 40    coordinates: [  0.795408180000000,  0.966575700000000,  0.896879600000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 41    coordinates: [  0.639433630000000,  0.488410840000000,  0.960134660000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 42    coordinates: [  0.821744170000000,  0.515643870000000,  0.706532010000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 43    coordinates: [  0.511589160000000,  0.151022800000000,  0.960134660000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 44    coordinates: [  0.693899700000000,  0.178255830000000,  0.706532010000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 45    coordinates: [  0.537925150000000,  0.700090970000000,  0.769787070000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 46    coordinates: [  0.484356130000000,  0.306100300000000,  0.706532010000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 47    coordinates: [  0.299909030000000,  0.837834180000000,  0.769787070000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 48    coordinates: [  0.171167510000000,  0.204591820000000,  0.896879600000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 49    coordinates: [  0.828832490000000,  0.795408180000000,  0.103120400000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 50    coordinates: [  0.700090970000000,  0.162165820000000,  0.230212930000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 51    coordinates: [  0.515643870000000,  0.693899700000000,  0.293467990000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 52    coordinates: [  0.462074850000000,  0.299909030000000,  0.230212930000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 53    coordinates: [  0.306100300000000,  0.821744170000000,  0.293467990000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 54    coordinates: [  0.488410840000000,  0.848977200000000,  0.039865340000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 55    coordinates: [  0.178255830000000,  0.484356130000000,  0.293467990000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 56    coordinates: [  0.360566370000000,  0.511589160000000,  0.039865340000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 57    coordinates: [  0.204591820000000,  0.033424300000000,  0.103120400000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 58    coordinates: [  0.151022800000000,  0.639433630000000,  0.039865340000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 59    coordinates: [  0.966575700000000,  0.171167510000000,  0.103120400000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 60    coordinates: [  0.837834180000000,  0.537925150000000,  0.230212930000000 ]    mass: 15.999400    reduced_to: 36supercell:  lattice:  - [    10.045236770000001,     0.000000000000000,     0.000000000000000 ] # a  - [    -5.022618390000000,     8.699430230000001,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.234275280000000 ] # c  points:  - symbol: Er # 1    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 167.259000    reduced_to: 1  - symbol: Er # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 167.259000    reduced_to: 2  - symbol: Er # 3    coordinates: [  0.666666670000000,  0.333333330000000,  0.333333330000000 ]    mass: 167.259000    reduced_to: 1  - symbol: Er # 4    coordinates: [  0.666666670000000,  0.333333330000000,  0.833333330000000 ]    mass: 167.259000    reduced_to: 2  - symbol: Er # 5    coordinates: [  0.333333330000000,  0.666666670000000,  0.666666670000000 ]    mass: 167.259000    reduced_to: 1  - symbol: Er # 6    coordinates: [  0.333333330000000,  0.666666670000000,  0.166666670000000 ]    mass: 167.259000    reduced_to: 2  - symbol: Bi # 7    coordinates: [  0.221642060000000,  0.263669790000000,  0.706546430000000 ]    mass: 208.980400    reduced_to: 7  - symbol: Bi # 8    coordinates: [  0.042027740000000,  0.778357940000000,  0.706546430000000 ]    mass: 208.980400    reduced_to: 8  - symbol: Bi # 9    coordinates: [  0.263669790000000,  0.042027740000000,  0.293453570000000 ]    mass: 208.980400    reduced_to: 9  - symbol: Bi # 10    coordinates: [  0.736330210000000,  0.957972260000000,  0.706546430000000 ]    mass: 208.980400    reduced_to: 10  - symbol: Bi # 11    coordinates: [  0.957972260000000,  0.221642060000000,  0.293453570000000 ]    mass: 208.980400    reduced_to: 11  - symbol: Bi # 12    coordinates: [  0.778357940000000,  0.736330210000000,  0.293453570000000 ]    mass: 208.980400    reduced_to: 12  - symbol: Bi # 13    coordinates: [  0.888308720000000,  0.597003120000000,  0.039879760000000 ]    mass: 208.980400    reduced_to: 7  - symbol: Bi # 14    coordinates: [  0.708694410000000,  0.111691280000000,  0.039879760000000 ]    mass: 208.980400    reduced_to: 8  - symbol: Bi # 15    coordinates: [  0.930336460000000,  0.375361080000000,  0.626786900000000 ]    mass: 208.980400    reduced_to: 9  - symbol: Bi # 16    coordinates: [  0.402996880000000,  0.291305590000000,  0.039879760000000 ]    mass: 208.980400    reduced_to: 10  - symbol: Bi # 17    coordinates: [  0.624638920000000,  0.554975390000000,  0.626786900000000 ]    mass: 208.980400    reduced_to: 11  - symbol: Bi # 18    coordinates: [  0.445024610000000,  0.069663540000000,  0.626786900000000 ]    mass: 208.980400    reduced_to: 12  - symbol: Bi # 19    coordinates: [  0.554975390000000,  0.930336460000000,  0.373213100000000 ]    mass: 208.980400    reduced_to: 7  - symbol: Bi # 20    coordinates: [  0.375361080000000,  0.445024610000000,  0.373213100000000 ]    mass: 208.980400    reduced_to: 8  - symbol: Bi # 21    coordinates: [  0.597003120000000,  0.708694410000000,  0.960120240000000 ]    mass: 208.980400    reduced_to: 9  - symbol: Bi # 22    coordinates: [  0.069663540000000,  0.624638920000000,  0.373213100000000 ]    mass: 208.980400    reduced_to: 10  - symbol: Bi # 23    coordinates: [  0.291305590000000,  0.888308720000000,  0.960120240000000 ]    mass: 208.980400    reduced_to: 11  - symbol: Bi # 24    coordinates: [  0.111691280000000,  0.402996880000000,  0.960120240000000 ]    mass: 208.980400    reduced_to: 12  - symbol: O  # 25    coordinates: [  0.495499150000000,  0.128741520000000,  0.436453730000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.366757640000000,  0.495499150000000,  0.563546270000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 27    coordinates: [  0.182310540000000,  0.027233030000000,  0.626801330000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.128741520000000,  0.633242360000000,  0.563546270000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 29    coordinates: [  0.972766970000000,  0.155077500000000,  0.626801330000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.155077500000000,  0.182310540000000,  0.373198670000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 31    coordinates: [  0.844922500000000,  0.817689460000000,  0.626801330000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.027233030000000,  0.844922500000000,  0.373198670000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 33    coordinates: [  0.871258480000000,  0.366757640000000,  0.436453730000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.817689460000000,  0.972766970000000,  0.373198670000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 35    coordinates: [  0.633242360000000,  0.504500850000000,  0.436453730000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.504500850000000,  0.871258480000000,  0.563546270000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 37    coordinates: [  0.162165820000000,  0.462074850000000,  0.769787070000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 38    coordinates: [  0.033424300000000,  0.828832490000000,  0.896879600000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 39    coordinates: [  0.848977200000000,  0.360566370000000,  0.960134660000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 40    coordinates: [  0.795408180000000,  0.966575700000000,  0.896879600000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 41    coordinates: [  0.639433630000000,  0.488410840000000,  0.960134660000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 42    coordinates: [  0.821744170000000,  0.515643870000000,  0.706532010000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 43    coordinates: [  0.511589160000000,  0.151022800000000,  0.960134660000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 44    coordinates: [  0.693899700000000,  0.178255830000000,  0.706532010000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 45    coordinates: [  0.537925150000000,  0.700090970000000,  0.769787070000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 46    coordinates: [  0.484356130000000,  0.306100300000000,  0.706532010000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 47    coordinates: [  0.299909030000000,  0.837834180000000,  0.769787070000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 48    coordinates: [  0.171167510000000,  0.204591820000000,  0.896879600000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 49    coordinates: [  0.828832490000000,  0.795408180000000,  0.103120400000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 50    coordinates: [  0.700090970000000,  0.162165820000000,  0.230212930000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 51    coordinates: [  0.515643870000000,  0.693899700000000,  0.293467990000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 52    coordinates: [  0.462074850000000,  0.299909030000000,  0.230212930000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 53    coordinates: [  0.306100300000000,  0.821744170000000,  0.293467990000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 54    coordinates: [  0.488410840000000,  0.848977200000000,  0.039865340000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 55    coordinates: [  0.178255830000000,  0.484356130000000,  0.293467990000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 56    coordinates: [  0.360566370000000,  0.511589160000000,  0.039865340000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 57    coordinates: [  0.204591820000000,  0.033424300000000,  0.103120400000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 58    coordinates: [  0.151022800000000,  0.639433630000000,  0.039865340000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 59    coordinates: [  0.966575700000000,  0.171167510000000,  0.103120400000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 60    coordinates: [  0.837834180000000,  0.537925150000000,  0.230212930000000 ]    mass: 15.999400    reduced_to: 36displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.1454726300000000, -0.0000025700000000, -0.0000087800000000 ]  - [  -0.0047084200000000, -0.0000428600000000,  0.0000086700000000 ]  - [   0.0033405100000000, -0.0000009500000000,  0.0000031000000000 ]  - [   0.0023948500000000, -0.0008256900000000, -0.0000050500000000 ]  - [   0.0033438800000000,  0.0000027500000000, -0.0000033100000000 ]  - [   0.0023859000000000, -0.0008310800000000,  0.0000166900000000 ]  - [  -0.0022927900000000,  0.0036821900000000, -0.0060053300000000 ]  - [  -0.0008094300000000, -0.0042620100000000, -0.0112321600000000 ]  - [   0.0054262300000000,  0.0010618600000000,  0.0174180300000000 ]  - [   0.0054719000000000,  0.0011485700000000,  0.0175029000000000 ]  - [  -0.0006440000000000, -0.0042974400000000, -0.0114257200000000 ]  - [  -0.0023064600000000,  0.0038514700000000, -0.0062538300000000 ]  - [  -0.0057593400000000, -0.0067916400000000,  0.0069609900000000 ]  - [   0.0264819000000000, -0.0068961900000000, -0.0052165500000000 ]  - [   0.0000526300000000, -0.0026241200000000, -0.0003917100000000 ]  - [   0.0107489600000000,  0.0213471700000000, -0.0013956000000000 ]  - [  -0.0006232700000000,  0.0018292200000000,  0.0001746000000000 ]  - [   0.0035163400000000,  0.0004058600000000, -0.0001033600000000 ]  - [   0.0035579600000000,  0.0002611000000000,  0.0001172200000000 ]  - [  -0.0007632300000000,  0.0018719900000000,  0.0003933900000000 ]  - [   0.0106009700000000,  0.0210767100000000, -0.0015906700000000 ]  - [   0.0001517700000000, -0.0025156400000000, -0.0001813600000000 ]  - [   0.0268665100000000, -0.0070642800000000, -0.0055177800000000 ]  - [  -0.0057375500000000, -0.0067045200000000,  0.0067327800000000 ]  - [  -0.0043762300000000, -0.0008679200000000, -0.0013894100000000 ]  - [  -0.0005191500000000, -0.0015872800000000,  0.0001155900000000 ]  - [   0.0003295500000000, -0.0011996300000000,  0.0014288500000000 ]  - [  -0.0019960000000000,  0.0022404300000000,  0.0012522400000000 ]  - [   0.0031630800000000,  0.0025493800000000, -0.0007780900000000 ]  - [   0.0050985200000000, -0.0019189900000000, -0.0006067700000000 ]  - [   0.0053203600000000, -0.0021878300000000, -0.0004759600000000 ]  - [   0.0035097000000000,  0.0026120800000000, -0.0009026300000000 ]  - [  -0.0016583800000000,  0.0019674100000000,  0.0012594700000000 ]  - [   0.0002027500000000, -0.0015269000000000,  0.0013093000000000 ]  - [  -0.0004516000000000, -0.0011715000000000,  0.0001318300000000 ]  - [  -0.0039537700000000, -0.0006962400000000, -0.0013929900000000 ]  - [   0.0012048700000000, -0.0009868500000000, -0.0023863900000000 ]  - [   0.0125800100000000, -0.0066502400000000, -0.0067341900000000 ]  - [  -0.0008530200000000,  0.0028244900000000, -0.0007166800000000 ]  - [   0.0197526200000000, -0.0004103300000000,  0.0093896700000000 ]  - [  -0.0014912100000000, -0.0052054800000000,  0.0017703300000000 ]  - [   0.0001904200000000,  0.0020233100000000,  0.0006650600000000 ]  - [  -0.0077863200000000, -0.0010318500000000, -0.0008616900000000 ]  - [  -0.0022112400000000,  0.0015333500000000, -0.0008471300000000 ]  - [  -0.0014914100000000, -0.0027769400000000, -0.0030717100000000 ]  - [  -0.0007593800000000, -0.0007972400000000, -0.0000347900000000 ]  - [  -0.0016132500000000,  0.0011611700000000,  0.0055555600000000 ]  - [   0.0118298400000000,  0.0040171400000000, -0.0034665700000000 ]  - [   0.0114144500000000,  0.0037817600000000, -0.0034166400000000 ]  - [  -0.0016811800000000,  0.0006939800000000,  0.0054728300000000 ]  - [  -0.0006471000000000, -0.0004607400000000,  0.0001137400000000 ]  - [  -0.0018571600000000, -0.0024998100000000, -0.0031146200000000 ]  - [  -0.0025684700000000,  0.0014763000000000, -0.0007019700000000 ]  - [  -0.0080088800000000, -0.0007523000000000, -0.0009922300000000 ]  - [   0.0004234500000000,  0.0017567500000000,  0.0008172100000000 ]  - [  -0.0011204100000000, -0.0051290300000000,  0.0016446700000000 ]  - [   0.0218103100000000, -0.0004385600000000,  0.0105709900000000 ]  - [  -0.0009694500000000,  0.0025259200000000, -0.0008406000000000 ]  - [   0.0123276600000000, -0.0057286500000000, -0.0063308300000000 ]  - [   0.0016328200000000, -0.0008190700000000, -0.0024326100000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.1105862600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0090412000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0007631500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025751900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0007435700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0026179200000000 ]  - [  -0.0022172000000000, -0.0076878400000000,  0.0114324100000000 ]  - [  -0.0055492600000000,  0.0057640700000000,  0.0114324100000000 ]  - [   0.0077339400000000,  0.0018363800000000,  0.0112528900000000 ]  - [   0.0077664700000000,  0.0019237600000000,  0.0114324100000000 ]  - [  -0.0054573200000000,  0.0057796000000000,  0.0112528900000000 ]  - [  -0.0022766200000000, -0.0076159800000000,  0.0112528900000000 ]  - [   0.0073583900000000, -0.0040559100000000, -0.0108595900000000 ]  - [  -0.0071917100000000, -0.0043446000000000, -0.0108595900000000 ]  - [   0.0009626700000000, -0.0012359200000000,  0.0025395200000000 ]  - [  -0.0001666800000000,  0.0084005100000000, -0.0108595900000000 ]  - [   0.0005890000000000,  0.0014516600000000,  0.0025395200000000 ]  - [  -0.0015516700000000, -0.0002157400000000,  0.0025395200000000 ]  - [  -0.0015346900000000, -0.0003629600000000,  0.0027564700000000 ]  - [   0.0004530200000000,  0.0015105600000000,  0.0027564700000000 ]  - [  -0.0002392500000000,  0.0083337800000000, -0.0110447100000000 ]  - [   0.0010816800000000, -0.0011476100000000,  0.0027564700000000 ]  - [  -0.0070976400000000, -0.0043740900000000, -0.0110447100000000 ]  - [   0.0073368900000000, -0.0039596900000000, -0.0110447100000000 ]  - [  -0.0013642000000000, -0.0003906800000000, -0.0029017100000000 ]  - [   0.0002887000000000,  0.0009407200000000, -0.0029167500000000 ]  - [   0.0009537500000000,  0.0005695000000000, -0.0034274300000000 ]  - [   0.0006703400000000, -0.0007203800000000, -0.0029167500000000 ]  - [  -0.0009700800000000,  0.0005412200000000, -0.0034274300000000 ]  - [  -0.0001971400000000, -0.0008350600000000, -0.0035618400000000 ]  - [   0.0000163300000000, -0.0011107300000000, -0.0034274300000000 ]  - [  -0.0006246100000000,  0.0005882600000000, -0.0035618400000000 ]  - [   0.0010204400000000, -0.0009860900000000, -0.0029017100000000 ]  - [   0.0008217500000000,  0.0002468000000000, -0.0035618400000000 ]  - [   0.0003437600000000,  0.0013767700000000, -0.0029017100000000 ]  - [  -0.0009590400000000, -0.0002203400000000, -0.0029167500000000 ]  - [  -0.0018471300000000,  0.0015311300000000,  0.0024125400000000 ]  - [  -0.0041119100000000,  0.0075796800000000,  0.0171953700000000 ]  - [  -0.0005193000000000,  0.0012167000000000,  0.0013812100000000 ]  - [   0.0086201500000000, -0.0002288200000000,  0.0171953700000000 ]  - [  -0.0007940500000000, -0.0010580700000000,  0.0013812100000000 ]  - [  -0.0007985800000000, -0.0012466100000000, -0.0002222900000000 ]  - [   0.0013133400000000, -0.0001586300000000,  0.0013812100000000 ]  - [  -0.0006803000000000,  0.0013149000000000, -0.0002222900000000 ]  - [  -0.0004024300000000, -0.0023652300000000,  0.0024125400000000 ]  - [   0.0014788800000000, -0.0000682900000000, -0.0002222900000000 ]  - [   0.0022495700000000,  0.0008341000000000,  0.0024125400000000 ]  - [  -0.0045082400000000, -0.0073508600000000,  0.0171953700000000 ]  - [  -0.0051481300000000, -0.0080741200000000,  0.0174636800000000 ]  - [   0.0021977400000000,  0.0003827800000000,  0.0023840700000000 ]  - [   0.0016247400000000,  0.0002653200000000, -0.0000615800000000 ]  - [  -0.0007673700000000, -0.0020946800000000,  0.0023840700000000 ]  - [  -0.0010421400000000,  0.0012744000000000, -0.0000615800000000 ]  - [   0.0010967700000000,  0.0001254300000000,  0.0012549000000000 ]  - [  -0.0005825900000000, -0.0015397200000000, -0.0000615800000000 ]  - [  -0.0004397600000000, -0.0010125500000000,  0.0012549000000000 ]  - [   0.0095664600000000, -0.0004213500000000,  0.0174636800000000 ]  - [  -0.0006570100000000,  0.0008871200000000,  0.0012549000000000 ]  - [  -0.0044183300000000,  0.0084954700000000,  0.0174636800000000 ]  - [  -0.0014303600000000,  0.0017119100000000,  0.0023840700000000 ]- atom:    2  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0047289600000000,  0.0000687100000000,  0.0000152500000000 ]  - [  -0.1300145900000000,  0.0000051000000000, -0.0000280400000000 ]  - [   0.0023893800000000,  0.0008281700000000, -0.0000054400000000 ]  - [   0.0006505500000000, -0.0000012300000000,  0.0000036600000000 ]  - [   0.0023881600000000,  0.0008323600000000,  0.0000124100000000 ]  - [   0.0006633900000000, -0.0000044300000000,  0.0000007700000000 ]  - [  -0.0152216400000000,  0.0129085500000000,  0.0073847300000000 ]  - [  -0.0065447900000000, -0.0188699600000000,  0.0114773100000000 ]  - [   0.0167546400000000,  0.0046229200000000, -0.0188454500000000 ]  - [   0.0168095700000000,  0.0046814900000000, -0.0184503500000000 ]  - [  -0.0062896200000000, -0.0188539800000000,  0.0112326700000000 ]  - [  -0.0151427800000000,  0.0130778200000000,  0.0072040700000000 ]  - [  -0.0005397900000000, -0.0009104300000000,  0.0009652900000000 ]  - [   0.0018229000000000, -0.0004141400000000,  0.0007181400000000 ]  - [   0.0047415400000000, -0.0082113400000000, -0.0019831500000000 ]  - [   0.0003848600000000,  0.0015428300000000, -0.0013561200000000 ]  - [   0.0014165100000000,  0.0062869600000000, -0.0002946600000000 ]  - [   0.0155884500000000,  0.0021238800000000,  0.0019793800000000 ]  - [   0.0155613900000000,  0.0019670900000000,  0.0021486900000000 ]  - [   0.0012645100000000,  0.0062886400000000, -0.0000746300000000 ]  - [   0.0002764000000000,  0.0014290300000000, -0.0015768000000000 ]  - [   0.0048241400000000, -0.0081033600000000, -0.0017718000000000 ]  - [   0.0019766800000000, -0.0004522400000000,  0.0004942200000000 ]  - [  -0.0005646400000000, -0.0007688400000000,  0.0007401900000000 ]  - [  -0.0037631600000000,  0.0005204500000000,  0.0011245800000000 ]  - [  -0.0009641700000000, -0.0013347400000000, -0.0004534600000000 ]  - [   0.0273773100000000,  0.0035555300000000,  0.0126716600000000 ]  - [  -0.0009479200000000,  0.0021375200000000, -0.0006828000000000 ]  - [   0.0150537300000000, -0.0089730500000000, -0.0072967600000000 ]  - [   0.0100429700000000,  0.0070292500000000, -0.0044978800000000 ]  - [   0.0103395600000000,  0.0066969600000000, -0.0042935300000000 ]  - [   0.0155465900000000, -0.0093343200000000, -0.0078478100000000 ]  - [  -0.0005766300000000,  0.0018686700000000, -0.0006499300000000 ]  - [   0.0258740600000000,  0.0029912600000000,  0.0112530000000000 ]  - [  -0.0009185200000000, -0.0008976000000000, -0.0004300500000000 ]  - [  -0.0033381900000000,  0.0007128700000000,  0.0010900900000000 ]  - [   0.0023342200000000, -0.0010367200000000, -0.0007675700000000 ]  - [   0.0008306500000000, -0.0004584600000000, -0.0027647500000000 ]  - [   0.0000089700000000,  0.0006123300000000, -0.0001967300000000 ]  - [   0.0008684900000000, -0.0002516500000000,  0.0035923000000000 ]  - [  -0.0003697200000000, -0.0006786000000000,  0.0004971300000000 ]  - [   0.0003720800000000,  0.0039531600000000,  0.0015293000000000 ]  - [  -0.0009879000000000, -0.0001690100000000, -0.0000567200000000 ]  - [  -0.0050463600000000, -0.0002105900000000, -0.0012899700000000 ]  - [  -0.0008350400000000, -0.0025711200000000,  0.0010040800000000 ]  - [   0.0010067600000000, -0.0033211600000000, -0.0005127500000000 ]  - [  -0.0005572400000000,  0.0016526100000000, -0.0001270600000000 ]  - [   0.0012976400000000, -0.0000481800000000, -0.0008895200000000 ]  - [   0.0008863200000000, -0.0002261500000000, -0.0008610900000000 ]  - [  -0.0005942200000000,  0.0011813000000000, -0.0002059100000000 ]  - [   0.0011722500000000, -0.0029712200000000, -0.0003245600000000 ]  - [  -0.0012360100000000, -0.0023189700000000,  0.0009329500000000 ]  - [  -0.0054309500000000, -0.0002238000000000, -0.0010973000000000 ]  - [  -0.0011950700000000,  0.0001519400000000, -0.0002153200000000 ]  - [   0.0005734500000000,  0.0036287200000000,  0.0017088400000000 ]  - [   0.0000119300000000, -0.0006632200000000,  0.0003363300000000 ]  - [   0.0012332000000000, -0.0005261900000000,  0.0036536500000000 ]  - [  -0.0001567600000000,  0.0002839300000000, -0.0003571100000000 ]  - [   0.0008780400000000, -0.0000056100000000, -0.0027238900000000 ]  - [   0.0027433900000000, -0.0008297400000000, -0.0008418000000000 ]- atom:    2  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0089988500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1731005400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0026151800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0072876300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025832800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0072637100000000 ]  - [   0.0081181600000000,  0.0239073700000000,  0.0152579400000000 ]  - [   0.0166453100000000, -0.0189842200000000,  0.0152579400000000 ]  - [  -0.0246814400000000, -0.0050027900000000,  0.0149992400000000 ]  - [  -0.0247634700000000, -0.0049231500000000,  0.0152579400000000 ]  - [   0.0166732700000000, -0.0188733600000000,  0.0149992400000000 ]  - [   0.0080081800000000,  0.0238761500000000,  0.0149992400000000 ]  - [  -0.0012752400000000, -0.0001275400000000,  0.0065176900000000 ]  - [   0.0005271700000000,  0.0011681600000000,  0.0065176900000000 ]  - [  -0.0066888300000000,  0.0097367000000000, -0.0067855000000000 ]  - [   0.0007480700000000, -0.0010406200000000,  0.0065176900000000 ]  - [  -0.0050878200000000, -0.0106610400000000, -0.0067855000000000 ]  - [   0.0117766400000000,  0.0009243400000000, -0.0067855000000000 ]  - [   0.0118032900000000,  0.0007652800000000, -0.0065873400000000 ]  - [  -0.0052388900000000, -0.0106045900000000, -0.0065873400000000 ]  - [   0.0006301900000000, -0.0011504800000000,  0.0063203000000000 ]  - [  -0.0065644000000000,  0.0098393100000000, -0.0065873400000000 ]  - [   0.0006812500000000,  0.0011210000000000,  0.0063203000000000 ]  - [  -0.0013114400000000,  0.0000294800000000,  0.0063203000000000 ]  - [  -0.0004728000000000,  0.0010043900000000,  0.0084208300000000 ]  - [   0.0009764300000000, -0.0004954000000000,  0.0084843800000000 ]  - [   0.0135812500000000,  0.0024276700000000,  0.0173734900000000 ]  - [  -0.0009172400000000, -0.0005979100000000,  0.0084843800000000 ]  - [  -0.0088930500000000,  0.0105478800000000,  0.0173734900000000 ]  - [  -0.0045943200000000, -0.0118853400000000,  0.0166115600000000 ]  - [  -0.0046882000000000, -0.0129755500000000,  0.0173734900000000 ]  - [  -0.0079958500000000,  0.0099214700000000,  0.0166115600000000 ]  - [  -0.0006334300000000, -0.0009116500000000,  0.0084208300000000 ]  - [   0.0125901700000000,  0.0019638700000000,  0.0166115600000000 ]  - [   0.0011062300000000, -0.0000927400000000,  0.0084208300000000 ]  - [  -0.0000591800000000,  0.0010933100000000,  0.0084843800000000 ]  - [   0.0026722400000000, -0.0028406000000000, -0.0036997400000000 ]  - [   0.0001849900000000, -0.0008755500000000, -0.0070541800000000 ]  - [  -0.0004961400000000,  0.0000313200000000, -0.0023613100000000 ]  - [  -0.0008507500000000,  0.0002775700000000, -0.0070541800000000 ]  - [   0.0002209400000000, -0.0004453300000000, -0.0023613100000000 ]  - [   0.0037178000000000,  0.0026463300000000, -0.0013703200000000 ]  - [   0.0002751900000000,  0.0004140100000000, -0.0023613100000000 ]  - [   0.0004328900000000, -0.0045428700000000, -0.0013703200000000 ]  - [   0.0011239100000000,  0.0037345300000000, -0.0036997400000000 ]  - [  -0.0041506900000000,  0.0018965400000000, -0.0013703200000000 ]  - [  -0.0037961500000000, -0.0008939300000000, -0.0036997400000000 ]  - [   0.0006657600000000,  0.0005979800000000, -0.0070541800000000 ]  - [   0.0002674500000000,  0.0005496300000000, -0.0071279100000000 ]  - [  -0.0038983500000000, -0.0013122000000000, -0.0036933400000000 ]  - [  -0.0040945100000000,  0.0022347800000000, -0.0012904400000000 ]  - [   0.0008127700000000,  0.0040321700000000, -0.0036933400000000 ]  - [   0.0001118800000000, -0.0046633400000000, -0.0012904400000000 ]  - [   0.0000188500000000,  0.0006345300000000, -0.0024324000000000 ]  - [   0.0039826300000000,  0.0024285600000000, -0.0012904400000000 ]  - [   0.0005400900000000, -0.0003335900000000, -0.0024324000000000 ]  - [  -0.0006097200000000, -0.0000432000000000, -0.0071279100000000 ]  - [  -0.0005589400000000, -0.0003009300000000, -0.0024324000000000 ]  - [   0.0003422700000000, -0.0005064300000000, -0.0071279100000000 ]  - [   0.0030855700000000, -0.0027199700000000, -0.0036933400000000 ]- atom:    7  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0022792200000000,  0.0034091000000000, -0.0022665600000000 ]  - [  -0.0151261700000000,  0.0138257700000000,  0.0080807500000000 ]  - [   0.0035361100000000,  0.0005788200000000, -0.0015644800000000 ]  - [   0.0156386600000000,  0.0019427000000000,  0.0118485200000000 ]  - [  -0.0057243500000000, -0.0117498100000000,  0.0073488800000000 ]  - [  -0.0005370500000000, -0.0009787300000000, -0.0013005100000000 ]  - [  -0.0948334400000000, -0.0061436700000000,  0.0047203100000000 ]  - [  -0.0013895300000000, -0.0091434100000000,  0.0034206200000000 ]  - [  -0.0014611000000000, -0.0005344000000000, -0.0022275500000000 ]  - [   0.0119902500000000,  0.0169065200000000, -0.0039770500000000 ]  - [  -0.0004196500000000, -0.0000507800000000,  0.0015951400000000 ]  - [   0.0001843100000000,  0.0020374200000000, -0.0012389000000000 ]  - [   0.0017788200000000, -0.0003962100000000,  0.0007852100000000 ]  - [   0.0032729800000000, -0.0002364200000000, -0.0002332100000000 ]  - [   0.0292645800000000, -0.0138766600000000,  0.0071890200000000 ]  - [  -0.0032270500000000,  0.0002733100000000,  0.0032499000000000 ]  - [   0.0089598100000000,  0.0258449700000000, -0.0066210000000000 ]  - [   0.0255167800000000, -0.0199963600000000, -0.0082826200000000 ]  - [   0.0017790000000000, -0.0002483700000000, -0.0012419700000000 ]  - [  -0.0027508700000000, -0.0005455100000000, -0.0043863700000000 ]  - [  -0.0008065900000000,  0.0014994600000000, -0.0000570800000000 ]  - [  -0.0000219200000000, -0.0016570000000000,  0.0010208100000000 ]  - [   0.0006556800000000, -0.0023532200000000,  0.0022996200000000 ]  - [   0.0049264600000000, -0.0006497800000000, -0.0220894100000000 ]  - [  -0.0018473500000000,  0.0000941800000000,  0.0044784200000000 ]  - [   0.0070827900000000, -0.0025735200000000,  0.0006063300000000 ]  - [   0.0089893600000000,  0.0067066100000000,  0.0031945600000000 ]  - [  -0.0009994000000000,  0.0032342800000000, -0.0016381500000000 ]  - [   0.0113818900000000,  0.0009427700000000, -0.0004890900000000 ]  - [   0.0027768100000000,  0.0002015200000000, -0.0007952100000000 ]  - [  -0.0000368000000000, -0.0077811400000000, -0.0004275300000000 ]  - [   0.0015782700000000, -0.0007655300000000, -0.0007989100000000 ]  - [  -0.0016078700000000,  0.0008823700000000, -0.0049383700000000 ]  - [   0.0001923600000000, -0.0022577500000000, -0.0014992300000000 ]  - [  -0.0004787600000000,  0.0002905900000000,  0.0040990700000000 ]  - [  -0.0042854800000000,  0.0039947100000000, -0.0005232400000000 ]  - [   0.0048697400000000,  0.0024421900000000,  0.0025252700000000 ]  - [   0.0008310900000000, -0.0011855300000000, -0.0025288900000000 ]  - [  -0.0048658800000000, -0.0000604400000000, -0.0018307400000000 ]  - [  -0.0008182600000000, -0.0014017700000000,  0.0028022700000000 ]  - [  -0.0002627600000000, -0.0014497400000000, -0.0031525300000000 ]  - [  -0.0088310600000000,  0.0024969700000000,  0.0026735700000000 ]  - [  -0.0009914400000000,  0.0010845300000000, -0.0034889400000000 ]  - [  -0.0107178200000000, -0.0001175800000000,  0.0008095700000000 ]  - [   0.0018522400000000, -0.0054152100000000, -0.0007547900000000 ]  - [   0.0024135900000000, -0.0032940700000000,  0.0039343300000000 ]  - [  -0.0012800500000000,  0.0042036400000000, -0.0025978400000000 ]  - [   0.0152152100000000,  0.0011048600000000, -0.0039866100000000 ]  - [   0.0000280300000000, -0.0006235200000000,  0.0008672500000000 ]  - [  -0.0009943700000000, -0.0002603900000000,  0.0007263500000000 ]  - [   0.0002644000000000,  0.0002076000000000,  0.0010043700000000 ]  - [  -0.0005183500000000,  0.0002625100000000,  0.0015740300000000 ]  - [   0.0002967400000000,  0.0006701100000000,  0.0002783600000000 ]  - [  -0.0005816800000000,  0.0003808100000000, -0.0001763700000000 ]  - [   0.0015235800000000,  0.0001202600000000,  0.0005939000000000 ]  - [   0.0024536800000000,  0.0007316100000000,  0.0009173800000000 ]  - [   0.0012458300000000, -0.0002854900000000,  0.0011867700000000 ]  - [  -0.0014324100000000,  0.0024658900000000,  0.0007425700000000 ]  - [  -0.0010148100000000, -0.0025748200000000,  0.0008883400000000 ]  - [  -0.0003575700000000, -0.0002292400000000, -0.0003483200000000 ]- atom:    7  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0023221800000000, -0.0033326600000000,  0.0022311600000000 ]  - [   0.0152294800000000, -0.0137751300000000, -0.0080448600000000 ]  - [  -0.0035447500000000, -0.0005969200000000,  0.0015178200000000 ]  - [  -0.0154997800000000, -0.0019173700000000, -0.0117354300000000 ]  - [   0.0057569700000000,  0.0117176700000000, -0.0073399300000000 ]  - [   0.0005677900000000,  0.0009706600000000,  0.0012812100000000 ]  - [   0.0952596700000000,  0.0062721800000000, -0.0038910000000000 ]  - [   0.0012741300000000,  0.0092428000000000, -0.0031965600000000 ]  - [   0.0013345400000000,  0.0004278000000000,  0.0019921200000000 ]  - [  -0.0119441100000000, -0.0168436500000000,  0.0041943500000000 ]  - [   0.0005922300000000,  0.0000128800000000, -0.0018331600000000 ]  - [  -0.0002232600000000, -0.0018803800000000,  0.0010004300000000 ]  - [  -0.0017260600000000,  0.0002673500000000, -0.0005629100000000 ]  - [  -0.0033981600000000,  0.0002709500000000,  0.0004597600000000 ]  - [  -0.0295933900000000,  0.0138721800000000, -0.0075108400000000 ]  - [   0.0032381200000000, -0.0001929200000000, -0.0030541000000000 ]  - [  -0.0087885600000000, -0.0256305000000000,  0.0063010700000000 ]  - [  -0.0253826300000000,  0.0198774600000000,  0.0079382000000000 ]  - [  -0.0017254200000000,  0.0000911900000000,  0.0014516200000000 ]  - [   0.0025686700000000,  0.0005773900000000,  0.0046534300000000 ]  - [   0.0007002600000000, -0.0016062200000000, -0.0001661300000000 ]  - [   0.0001286100000000,  0.0017725600000000, -0.0008008200000000 ]  - [  -0.0005343800000000,  0.0023112000000000, -0.0025171200000000 ]  - [  -0.0048882200000000,  0.0007452600000000,  0.0219236300000000 ]  - [   0.0014274800000000, -0.0002875000000000, -0.0043878800000000 ]  - [  -0.0070734500000000,  0.0021300800000000, -0.0007022400000000 ]  - [  -0.0086543900000000, -0.0065473700000000, -0.0031328900000000 ]  - [   0.0006098600000000, -0.0029957500000000,  0.0015976200000000 ]  - [  -0.0132665600000000, -0.0017232100000000,  0.0000433400000000 ]  - [  -0.0029882200000000,  0.0001299700000000,  0.0006122500000000 ]  - [   0.0001876500000000,  0.0073921700000000,  0.0005964100000000 ]  - [  -0.0012013900000000,  0.0007760900000000,  0.0006245400000000 ]  - [   0.0019836000000000, -0.0011418600000000,  0.0050198200000000 ]  - [  -0.0003886100000000,  0.0019037000000000,  0.0013299300000000 ]  - [   0.0005308300000000,  0.0001777900000000, -0.0040009400000000 ]  - [   0.0046663800000000, -0.0037682500000000,  0.0004871100000000 ]  - [  -0.0057628400000000, -0.0022282600000000, -0.0022553300000000 ]  - [  -0.0008734600000000,  0.0007067200000000,  0.0024890700000000 ]  - [   0.0050339500000000,  0.0003811100000000,  0.0019780100000000 ]  - [   0.0004444100000000,  0.0016868800000000, -0.0028487900000000 ]  - [  -0.0001230800000000,  0.0014370600000000,  0.0032718400000000 ]  - [   0.0086493600000000, -0.0021952700000000, -0.0028917200000000 ]  - [   0.0011870500000000, -0.0014150800000000,  0.0036206100000000 ]  - [   0.0110967900000000,  0.0001505400000000, -0.0009986500000000 ]  - [  -0.0014339900000000,  0.0051348300000000,  0.0008359100000000 ]  - [  -0.0013789900000000,  0.0030756900000000, -0.0040771000000000 ]  - [   0.0013201200000000, -0.0037019700000000,  0.0026720400000000 ]  - [  -0.0147649600000000, -0.0009035400000000,  0.0039744300000000 ]  - [  -0.0004558500000000,  0.0004148800000000, -0.0007948100000000 ]  - [   0.0009488300000000, -0.0002114300000000, -0.0008115900000000 ]  - [  -0.0000765800000000,  0.0001679300000000, -0.0007992800000000 ]  - [   0.0001458900000000, -0.0000098300000000, -0.0016437900000000 ]  - [  -0.0006890700000000, -0.0006715000000000, -0.0000728400000000 ]  - [   0.0003884100000000, -0.0000342900000000,  0.0000014600000000 ]  - [  -0.0013295500000000, -0.0004768100000000, -0.0003796900000000 ]  - [  -0.0020665300000000, -0.0007096800000000, -0.0010701200000000 ]  - [  -0.0008615100000000,  0.0000084900000000, -0.0011201800000000 ]  - [   0.0012199600000000, -0.0027765200000000, -0.0009036000000000 ]  - [   0.0010425400000000,  0.0030373600000000, -0.0008190400000000 ]  - [   0.0007820200000000,  0.0004330500000000,  0.0002641300000000 ]- atom:    7  displacement:    [  -0.0050000000036683,  0.0086602540357265,  0.0000000000000000 ]  forces:  - [   0.0044267900000000,  0.0017489300000000, -0.0055127500000000 ]  - [   0.0187837400000000,  0.0034932100000000,  0.0166186900000000 ]  - [  -0.0014960500000000, -0.0016618500000000,  0.0004934000000000 ]  - [  -0.0060331400000000, -0.0019153900000000, -0.0051711600000000 ]  - [  -0.0029821200000000,  0.0292696200000000, -0.0071660600000000 ]  - [  -0.0004417500000000,  0.0019358300000000,  0.0005941100000000 ]  - [   0.0421761100000000, -0.0815975100000000, -0.0057927900000000 ]  - [  -0.0000568100000000,  0.0237142400000000, -0.0054145200000000 ]  - [  -0.0000754700000000, -0.0006429800000000,  0.0030264500000000 ]  - [   0.0013950300000000, -0.0006777600000000,  0.0004209800000000 ]  - [   0.0005978900000000, -0.0016205000000000,  0.0003170100000000 ]  - [   0.0015778100000000,  0.0009980700000000,  0.0005563900000000 ]  - [  -0.0010159900000000,  0.0018485900000000, -0.0011820900000000 ]  - [  -0.0021173300000000, -0.0005579800000000, -0.0004348000000000 ]  - [  -0.0210216700000000, -0.0019149100000000, -0.0098543800000000 ]  - [  -0.0005699800000000, -0.0033679300000000, -0.0040846100000000 ]  - [   0.0121055500000000, -0.0038805900000000,  0.0030220900000000 ]  - [  -0.0298988800000000,  0.0059728100000000,  0.0041974300000000 ]  - [  -0.0011426300000000,  0.0017682100000000,  0.0009681000000000 ]  - [   0.0031783600000000, -0.0034974200000000, -0.0094556900000000 ]  - [   0.0023560500000000,  0.0020164100000000,  0.0018865500000000 ]  - [  -0.0012400000000000,  0.0031665000000000, -0.0004112300000000 ]  - [  -0.0029210100000000,  0.0028327700000000, -0.0028113400000000 ]  - [  -0.0030621600000000, -0.0083787700000000,  0.0271376200000000 ]  - [   0.0016359900000000,  0.0001711000000000, -0.0037153500000000 ]  - [  -0.0085994300000000,  0.0031995900000000,  0.0057740600000000 ]  - [  -0.0028323100000000,  0.0055725700000000, -0.0012479100000000 ]  - [   0.0043702700000000, -0.0026731200000000,  0.0012553300000000 ]  - [  -0.0024214400000000,  0.0121381400000000,  0.0033757400000000 ]  - [  -0.0012135300000000,  0.0034953200000000, -0.0025126900000000 ]  - [  -0.0030503300000000, -0.0013104400000000,  0.0006621200000000 ]  - [  -0.0003393600000000, -0.0019951600000000, -0.0027807100000000 ]  - [   0.0010497300000000, -0.0006795100000000,  0.0052131200000000 ]  - [  -0.0024965700000000,  0.0004233700000000, -0.0023230600000000 ]  - [  -0.0017021000000000, -0.0001190900000000, -0.0001839400000000 ]  - [   0.0019449900000000, -0.0058078900000000,  0.0005621500000000 ]  - [   0.0028807800000000,  0.0049089100000000, -0.0057712900000000 ]  - [   0.0001658300000000, -0.0015276600000000,  0.0046442900000000 ]  - [   0.0033131400000000,  0.0002497400000000,  0.0002068000000000 ]  - [  -0.0018557400000000, -0.0009670300000000, -0.0002998700000000 ]  - [  -0.0002721700000000,  0.0013030900000000,  0.0006774500000000 ]  - [  -0.0011285700000000, -0.0036962400000000, -0.0025085200000000 ]  - [   0.0010955200000000, -0.0006150100000000,  0.0018383800000000 ]  - [   0.0087717600000000,  0.0039516200000000,  0.0005385800000000 ]  - [  -0.0036106200000000, -0.0032211500000000, -0.0008151700000000 ]  - [  -0.0037679900000000,  0.0087430600000000, -0.0012059600000000 ]  - [   0.0042414100000000, -0.0055192200000000,  0.0010885700000000 ]  - [  -0.0076054800000000,  0.0155181900000000, -0.0046352100000000 ]  - [  -0.0010982400000000, -0.0003027300000000, -0.0001750200000000 ]  - [   0.0001377300000000, -0.0000796800000000, -0.0001208800000000 ]  - [  -0.0005162500000000, -0.0020321000000000,  0.0000217800000000 ]  - [  -0.0015178600000000,  0.0021962700000000,  0.0022718100000000 ]  - [  -0.0001138500000000, -0.0012128400000000, -0.0002965000000000 ]  - [   0.0010200200000000, -0.0006444400000000,  0.0003512600000000 ]  - [   0.0014057700000000, -0.0005180600000000,  0.0000426600000000 ]  - [  -0.0027498400000000, -0.0007419800000000, -0.0012739700000000 ]  - [   0.0001842300000000,  0.0001845600000000, -0.0003100400000000 ]  - [   0.0011742900000000, -0.0019072000000000, -0.0003067700000000 ]  - [   0.0002939700000000,  0.0045228900000000, -0.0010264300000000 ]  - [   0.0006839100000000, -0.0000594600000000,  0.0010378200000000 ]- atom:    7  displacement:    [   0.0050000000036683, -0.0086602540357265,  0.0000000000000000 ]  forces:  - [  -0.0044005900000000, -0.0016672900000000,  0.0054959200000000 ]  - [  -0.0188998600000000, -0.0034403000000000, -0.0166869300000000 ]  - [   0.0014670600000000,  0.0016547900000000, -0.0005354000000000 ]  - [   0.0059863000000000,  0.0019281100000000,  0.0051555400000000 ]  - [   0.0029496300000000, -0.0289054000000000,  0.0071101400000000 ]  - [   0.0004503900000000, -0.0019378100000000, -0.0006177900000000 ]  - [  -0.0421340500000000,  0.0817908300000000,  0.0064828500000000 ]  - [  -0.0000688900000000, -0.0238316600000000,  0.0056360700000000 ]  - [  -0.0000387800000000,  0.0005519200000000, -0.0032711900000000 ]  - [  -0.0012456100000000,  0.0008567400000000, -0.0002083900000000 ]  - [  -0.0004540200000000,  0.0015643200000000, -0.0005342600000000 ]  - [  -0.0016071900000000, -0.0008529700000000, -0.0007894400000000 ]  - [   0.0010247900000000, -0.0019882300000000,  0.0013991400000000 ]  - [   0.0019790600000000,  0.0005980300000000,  0.0006431600000000 ]  - [   0.0207778200000000,  0.0017419700000000,  0.0095535400000000 ]  - [   0.0005866700000000,  0.0034383000000000,  0.0042112500000000 ]  - [  -0.0119559200000000,  0.0037607400000000, -0.0032128500000000 ]  - [   0.0300965300000000, -0.0058367500000000, -0.0044740200000000 ]  - [   0.0011740200000000, -0.0019039400000000, -0.0007557900000000 ]  - [  -0.0032967000000000,  0.0035202900000000,  0.0096414900000000 ]  - [  -0.0024328600000000, -0.0021152900000000, -0.0020905600000000 ]  - [   0.0013355500000000, -0.0030582800000000,  0.0006119200000000 ]  - [   0.0030534700000000, -0.0028561800000000,  0.0026292700000000 ]  - [   0.0030646100000000,  0.0083684800000000, -0.0271729800000000 ]  - [  -0.0020348600000000, -0.0003529800000000,  0.0037761800000000 ]  - [   0.0085122200000000, -0.0033915900000000, -0.0059368800000000 ]  - [   0.0035905400000000, -0.0068305600000000,  0.0007843200000000 ]  - [  -0.0047115100000000,  0.0029079000000000, -0.0012668100000000 ]  - [   0.0020494200000000, -0.0121129100000000, -0.0032403300000000 ]  - [   0.0010125900000000, -0.0031848000000000,  0.0023454200000000 ]  - [   0.0032666700000000,  0.0010029900000000, -0.0004959200000000 ]  - [   0.0007073700000000,  0.0020131800000000,  0.0026198000000000 ]  - [  -0.0006816900000000,  0.0004337900000000, -0.0051352300000000 ]  - [   0.0023399200000000, -0.0007597400000000,  0.0021722700000000 ]  - [   0.0017524700000000,  0.0005549000000000,  0.0002337900000000 ]  - [  -0.0015539900000000,  0.0059758000000000, -0.0005733500000000 ]  - [  -0.0040164100000000, -0.0042512500000000,  0.0061016900000000 ]  - [  -0.0002163200000000,  0.0010972800000000, -0.0046896700000000 ]  - [  -0.0031216900000000,  0.0000776700000000, -0.0000375200000000 ]  - [   0.0014817300000000,  0.0012150900000000,  0.0002643500000000 ]  - [  -0.0000842300000000, -0.0012916600000000, -0.0005280800000000 ]  - [   0.0009423900000000,  0.0040314100000000,  0.0022877300000000 ]  - [  -0.0008884100000000,  0.0002810200000000, -0.0016821600000000 ]  - [  -0.0084139100000000, -0.0039488800000000, -0.0007578700000000 ]  - [   0.0039591400000000,  0.0029165700000000,  0.0008685800000000 ]  - [   0.0038415500000000, -0.0090232100000000,  0.0009787700000000 ]  - [  -0.0041963100000000,  0.0059784600000000, -0.0010331500000000 ]  - [   0.0079837100000000, -0.0153300000000000,  0.0047859300000000 ]  - [   0.0006793700000000,  0.0001106700000000,  0.0002343600000000 ]  - [  -0.0001863500000000, -0.0003856200000000,  0.0000560700000000 ]  - [   0.0006923200000000,  0.0023657000000000,  0.0001753000000000 ]  - [   0.0011406900000000, -0.0019288200000000, -0.0022847500000000 ]  - [  -0.0002669100000000,  0.0011926000000000,  0.0004904200000000 ]  - [  -0.0012254700000000,  0.0009718800000000, -0.0005147800000000 ]  - [  -0.0012002700000000,  0.0001898400000000,  0.0001691100000000 ]  - [   0.0030924100000000,  0.0007614800000000,  0.0011218900000000 ]  - [   0.0001937300000000, -0.0004713800000000,  0.0003638800000000 ]  - [  -0.0013509500000000,  0.0015905700000000,  0.0001603000000000 ]  - [  -0.0002437700000000, -0.0040414600000000,  0.0010654200000000 ]  - [  -0.0002566200000000,  0.0002556400000000, -0.0010997800000000 ]- atom:    7  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0061634900000000, -0.0167203700000000,  0.0114222500000000 ]  - [   0.0072641700000000,  0.0172436200000000,  0.0151443300000000 ]  - [  -0.0000000700000000,  0.0003218700000000,  0.0026313900000000 ]  - [   0.0020472100000000,  0.0009799900000000, -0.0067473800000000 ]  - [   0.0068571500000000, -0.0022340300000000, -0.0109352200000000 ]  - [   0.0008752000000000,  0.0012004100000000,  0.0064135300000000 ]  - [   0.0047423100000000, -0.0039820900000000, -0.1376793800000000 ]  - [   0.0002456900000000,  0.0045772500000000, -0.0077064800000000 ]  - [  -0.0021793900000000,  0.0006758800000000,  0.0059360400000000 ]  - [   0.0022740500000000,  0.0051785300000000, -0.0077046300000000 ]  - [   0.0032018300000000,  0.0005948400000000,  0.0059300400000000 ]  - [  -0.0011399500000000,  0.0002005900000000,  0.0037293000000000 ]  - [  -0.0013365000000000,  0.0001445300000000,  0.0018301900000000 ]  - [  -0.0005847400000000, -0.0007414700000000,  0.0021514500000000 ]  - [   0.0033131200000000, -0.0056061200000000, -0.0041338100000000 ]  - [   0.0141880100000000,  0.0029683100000000,  0.0179425800000000 ]  - [  -0.0096542500000000, -0.0029316500000000, -0.0041275700000000 ]  - [  -0.0081788300000000,  0.0004179900000000, -0.0019899800000000 ]  - [   0.0006912100000000, -0.0011721500000000,  0.0018479300000000 ]  - [  -0.0042048600000000, -0.0011706400000000,  0.0178597200000000 ]  - [   0.0002651300000000,  0.0029172000000000, -0.0026369200000000 ]  - [   0.0009354600000000,  0.0001633000000000,  0.0021676700000000 ]  - [   0.0020701100000000, -0.0012282200000000, -0.0026348800000000 ]  - [  -0.0221707100000000,  0.0188303700000000,  0.0190634300000000 ]  - [  -0.0002625600000000,  0.0002153000000000, -0.0016514900000000 ]  - [   0.0029318200000000,  0.0063363000000000, -0.0015672100000000 ]  - [   0.0003568700000000, -0.0013755200000000,  0.0104990600000000 ]  - [  -0.0004066200000000,  0.0008509200000000,  0.0001048900000000 ]  - [   0.0031622500000000,  0.0023414400000000,  0.0138158100000000 ]  - [  -0.0004418700000000, -0.0013443800000000, -0.0071889000000000 ]  - [  -0.0009070300000000, -0.0013997700000000,  0.0010958200000000 ]  - [   0.0010395400000000, -0.0011816400000000, -0.0023665400000000 ]  - [  -0.0001166500000000, -0.0006793000000000,  0.0000731600000000 ]  - [  -0.0015552700000000, -0.0006264700000000, -0.0021821200000000 ]  - [   0.0024355500000000,  0.0003214700000000, -0.0022755300000000 ]  - [  -0.0003160600000000,  0.0002609700000000, -0.0002757700000000 ]  - [  -0.0002071200000000, -0.0016196600000000,  0.0119659800000000 ]  - [  -0.0012087200000000,  0.0046313500000000,  0.0044839700000000 ]  - [   0.0043280500000000,  0.0015348500000000,  0.0012970900000000 ]  - [   0.0038909100000000,  0.0018798900000000,  0.0038334100000000 ]  - [  -0.0022354200000000, -0.0018357300000000,  0.0022657000000000 ]  - [  -0.0000339200000000, -0.0028165600000000,  0.0021481100000000 ]  - [  -0.0026543600000000,  0.0002717900000000,  0.0014883600000000 ]  - [   0.0006163700000000,  0.0017623000000000,  0.0017979000000000 ]  - [  -0.0001744600000000, -0.0030747900000000,  0.0051118600000000 ]  - [   0.0011682900000000, -0.0004504200000000,  0.0097652400000000 ]  - [   0.0003038200000000,  0.0007408400000000,  0.0044825300000000 ]  - [  -0.0043807000000000, -0.0205493400000000,  0.0612321000000000 ]  - [   0.0016059800000000,  0.0028296700000000, -0.0039513700000000 ]  - [  -0.0001046100000000, -0.0005127500000000, -0.0027352700000000 ]  - [  -0.0003740200000000,  0.0022042200000000, -0.0024856900000000 ]  - [   0.0004891300000000, -0.0003740600000000, -0.0104478100000000 ]  - [  -0.0001159300000000, -0.0010548700000000, -0.0015178600000000 ]  - [  -0.0002862800000000,  0.0000953900000000, -0.0008399900000000 ]  - [  -0.0012867200000000,  0.0005137800000000, -0.0022766600000000 ]  - [  -0.0010640500000000, -0.0043538400000000, -0.0035178900000000 ]  - [  -0.0023386600000000,  0.0021247900000000, -0.0058517100000000 ]  - [   0.0013635700000000, -0.0067329000000000, -0.0031455000000000 ]  - [   0.0028362300000000,  0.0003121100000000, -0.0062553300000000 ]  - [   0.0005847800000000,  0.0001266800000000, -0.0027019300000000 ]- atom:    7  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0060879100000000,  0.0165440400000000, -0.0112757600000000 ]  - [  -0.0073145500000000, -0.0173975600000000, -0.0150932800000000 ]  - [  -0.0000105100000000, -0.0003392400000000, -0.0026544500000000 ]  - [  -0.0020722600000000, -0.0009819400000000,  0.0066361700000000 ]  - [  -0.0068386100000000,  0.0022301000000000,  0.0109506800000000 ]  - [  -0.0008388000000000, -0.0011862800000000, -0.0064042200000000 ]  - [  -0.0039078600000000,  0.0051499100000000,  0.1338415600000000 ]  - [  -0.0003841200000000, -0.0044773500000000,  0.0078555300000000 ]  - [   0.0020930400000000, -0.0008119100000000, -0.0061224300000000 ]  - [  -0.0021491900000000, -0.0050229000000000,  0.0078571100000000 ]  - [  -0.0030931900000000, -0.0006549100000000, -0.0061296200000000 ]  - [   0.0011030300000000, -0.0000491400000000, -0.0039228000000000 ]  - [   0.0013441800000000, -0.0003001600000000, -0.0016176900000000 ]  - [   0.0004360800000000,  0.0007816500000000, -0.0019423000000000 ]  - [  -0.0033841500000000,  0.0054461400000000,  0.0039683100000000 ]  - [  -0.0139368200000000, -0.0028362400000000, -0.0175764000000000 ]  - [   0.0097603600000000,  0.0028230000000000,  0.0039720700000000 ]  - [   0.0080527300000000, -0.0002213500000000,  0.0018332000000000 ]  - [  -0.0006606100000000,  0.0010208900000000, -0.0015997800000000 ]  - [   0.0040934600000000,  0.0013183100000000, -0.0176665100000000 ]  - [  -0.0003648300000000, -0.0030048800000000,  0.0023867900000000 ]  - [  -0.0008307800000000, -0.0000532600000000, -0.0019306800000000 ]  - [  -0.0019033900000000,  0.0011816700000000,  0.0023855800000000 ]  - [   0.0218566900000000, -0.0184656200000000, -0.0190956900000000 ]  - [  -0.0001420400000000, -0.0003403100000000,  0.0015982500000000 ]  - [  -0.0029783300000000, -0.0064463100000000,  0.0012376100000000 ]  - [  -0.0001447500000000,  0.0013763700000000, -0.0105078000000000 ]  - [   0.0000911700000000, -0.0005645300000000, -0.0001153800000000 ]  - [  -0.0038376900000000, -0.0026064500000000, -0.0137680500000000 ]  - [   0.0001996200000000,  0.0015962300000000,  0.0071469100000000 ]  - [   0.0011553900000000,  0.0011698900000000, -0.0010121600000000 ]  - [  -0.0007085200000000,  0.0012794200000000,  0.0022470300000000 ]  - [   0.0004191500000000,  0.0003888600000000, -0.0001131900000000 ]  - [   0.0014668500000000,  0.0002998300000000,  0.0020553500000000 ]  - [  -0.0023398100000000,  0.0000727600000000,  0.0022235400000000 ]  - [   0.0007300700000000, -0.0001233400000000,  0.0002569900000000 ]  - [  -0.0002398700000000,  0.0014556400000000, -0.0118470300000000 ]  - [   0.0010899300000000, -0.0049845400000000, -0.0044358000000000 ]  - [  -0.0041816900000000, -0.0011927400000000, -0.0011636900000000 ]  - [  -0.0041447400000000, -0.0015653000000000, -0.0037794100000000 ]  - [   0.0018892700000000,  0.0017533800000000, -0.0021230500000000 ]  - [  -0.0002145100000000,  0.0030713400000000, -0.0022608600000000 ]  - [   0.0028747700000000, -0.0005221900000000, -0.0013609700000000 ]  - [  -0.0002441000000000, -0.0016823400000000, -0.0019098400000000 ]  - [   0.0005218500000000,  0.0027964200000000, -0.0050434500000000 ]  - [  -0.0011834400000000,  0.0001201100000000, -0.0098479500000000 ]  - [  -0.0002303200000000, -0.0002978200000000, -0.0044105100000000 ]  - [   0.0043030600000000,  0.0194949600000000, -0.0571974300000000 ]  - [  -0.0019963300000000, -0.0029259500000000,  0.0039301100000000 ]  - [   0.0000328100000000,  0.0000839400000000,  0.0026885100000000 ]  - [   0.0004774700000000, -0.0018692400000000,  0.0026084300000000 ]  - [  -0.0008309900000000,  0.0006544800000000,  0.0103410200000000 ]  - [  -0.0002344500000000,  0.0009779200000000,  0.0016379200000000 ]  - [   0.0000477200000000,  0.0001646200000000,  0.0007427500000000 ]  - [   0.0015401900000000, -0.0007724900000000,  0.0023981700000000 ]  - [   0.0014048600000000,  0.0043988000000000,  0.0034021500000000 ]  - [   0.0026250700000000, -0.0023955400000000,  0.0058183300000000 ]  - [  -0.0014482500000000,  0.0063389500000000,  0.0030295000000000 ]  - [  -0.0027251400000000,  0.0000825500000000,  0.0062283000000000 ]  - [  -0.0001821000000000,  0.0000196100000000,  0.0026502900000000 ]- atom:   25  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0041647600000000, -0.0007453300000000, -0.0011527200000000 ]  - [  -0.0035439900000000, -0.0003927300000000, -0.0002750100000000 ]  - [   0.0116059700000000,  0.0057961800000000, -0.0049035400000000 ]  - [   0.0010932300000000,  0.0003751500000000,  0.0004688800000000 ]  - [   0.0014283200000000,  0.0008349100000000, -0.0016489000000000 ]  - [   0.0025643900000000,  0.0003783500000000,  0.0028756100000000 ]  - [  -0.0016250700000000,  0.0011054000000000,  0.0000563400000000 ]  - [  -0.0009933800000000, -0.0015012000000000, -0.0002202000000000 ]  - [  -0.0000972200000000, -0.0017997700000000, -0.0071563200000000 ]  - [  -0.0013079400000000, -0.0005064600000000, -0.0011843800000000 ]  - [  -0.0046141100000000, -0.0008974900000000,  0.0006330900000000 ]  - [  -0.0045013400000000, -0.0004792500000000, -0.0006316900000000 ]  - [   0.0002541600000000, -0.0009586000000000,  0.0019049500000000 ]  - [   0.0002164600000000,  0.0006168900000000,  0.0033092500000000 ]  - [  -0.0014882300000000, -0.0004184000000000, -0.0037074300000000 ]  - [   0.0009523500000000,  0.0039594400000000, -0.0013867100000000 ]  - [  -0.0000436800000000,  0.0012358200000000, -0.0006198600000000 ]  - [   0.0149920600000000, -0.0002721200000000, -0.0045417800000000 ]  - [   0.0055024500000000,  0.0068436300000000,  0.0000649000000000 ]  - [  -0.0008353700000000,  0.0066711800000000, -0.0022608900000000 ]  - [  -0.0003431100000000,  0.0003634600000000,  0.0001794100000000 ]  - [  -0.0000506500000000, -0.0031996300000000, -0.0004702400000000 ]  - [   0.0025097000000000, -0.0017444100000000, -0.0008612500000000 ]  - [  -0.0005842900000000,  0.0002790800000000,  0.0002659800000000 ]  - [  -0.0361421800000000, -0.0065640200000000,  0.0142167100000000 ]  - [   0.0000222200000000, -0.0004064300000000,  0.0011665100000000 ]  - [  -0.0001950400000000,  0.0009147700000000, -0.0021921900000000 ]  - [  -0.0004686100000000,  0.0001301100000000,  0.0013914600000000 ]  - [   0.0008007800000000,  0.0002679900000000,  0.0000959300000000 ]  - [   0.0033807900000000, -0.0031373800000000, -0.0013858700000000 ]  - [   0.0009631900000000, -0.0002480300000000, -0.0001110700000000 ]  - [   0.0038298300000000,  0.0050036300000000, -0.0027520600000000 ]  - [   0.0054970600000000,  0.0050872400000000,  0.0005885000000000 ]  - [   0.0053429600000000,  0.0017804500000000,  0.0008880600000000 ]  - [  -0.0014673300000000, -0.0010479600000000,  0.0018090300000000 ]  - [  -0.0007838700000000, -0.0025915800000000,  0.0066456700000000 ]  - [   0.0001667500000000, -0.0005957800000000,  0.0003098700000000 ]  - [   0.0002549600000000,  0.0006953500000000,  0.0001465800000000 ]  - [  -0.0001101000000000,  0.0005196200000000, -0.0003196400000000 ]  - [   0.0011626400000000, -0.0001760700000000,  0.0005148100000000 ]  - [  -0.0011976800000000, -0.0011140300000000,  0.0002353200000000 ]  - [  -0.0002091300000000,  0.0005959300000000,  0.0002270400000000 ]  - [  -0.0013802000000000, -0.0001560300000000, -0.0000560000000000 ]  - [  -0.0041310700000000, -0.0028935800000000,  0.0014262200000000 ]  - [   0.0004095000000000, -0.0002202600000000,  0.0004409100000000 ]  - [   0.0002693700000000, -0.0008747400000000, -0.0012767100000000 ]  - [   0.0007743700000000,  0.0026411100000000,  0.0003787800000000 ]  - [   0.0012127100000000, -0.0006825400000000,  0.0008177500000000 ]  - [   0.0001730700000000,  0.0005781900000000, -0.0003621500000000 ]  - [   0.0036653000000000,  0.0001797600000000, -0.0062085700000000 ]  - [   0.0040125100000000, -0.0139714300000000, -0.0043935700000000 ]  - [  -0.0016528200000000, -0.0032453000000000,  0.0021773900000000 ]  - [  -0.0059309800000000,  0.0018835000000000, -0.0011875000000000 ]  - [  -0.0012041300000000,  0.0001051400000000, -0.0012890500000000 ]  - [   0.0001561600000000, -0.0000047300000000,  0.0001007100000000 ]  - [   0.0004993100000000, -0.0007988500000000, -0.0007858000000000 ]  - [   0.0021300700000000, -0.0017846200000000,  0.0157882000000000 ]  - [  -0.0003696000000000,  0.0003507000000000, -0.0010232000000000 ]  - [   0.0010805100000000, -0.0001722400000000, -0.0011526800000000 ]  - [   0.0025127100000000,  0.0044080200000000, -0.0036068600000000 ]- atom:   25  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0041645800000000,  0.0007386800000000,  0.0011865100000000 ]  - [   0.0035684200000000,  0.0004042600000000,  0.0002801600000000 ]  - [  -0.0116581200000000, -0.0056289300000000,  0.0047367700000000 ]  - [  -0.0010796600000000, -0.0003683700000000, -0.0004506700000000 ]  - [  -0.0014235400000000, -0.0008499800000000,  0.0016360800000000 ]  - [  -0.0025186300000000, -0.0003665900000000, -0.0028760000000000 ]  - [   0.0016467000000000, -0.0012494500000000,  0.0001665300000000 ]  - [   0.0008320500000000,  0.0015520000000000,  0.0004335700000000 ]  - [  -0.0002507100000000,  0.0015879600000000,  0.0068665000000000 ]  - [   0.0014159000000000,  0.0005980700000000,  0.0014120200000000 ]  - [   0.0047591300000000,  0.0008464000000000, -0.0008444600000000 ]  - [   0.0044515600000000,  0.0006381000000000,  0.0004105000000000 ]  - [  -0.0002308700000000,  0.0008166300000000, -0.0017015100000000 ]  - [  -0.0003548100000000, -0.0005684500000000, -0.0030819900000000 ]  - [   0.0013871000000000,  0.0003239200000000,  0.0034680300000000 ]  - [  -0.0008582200000000, -0.0038773300000000,  0.0015997400000000 ]  - [   0.0001763000000000, -0.0012553700000000,  0.0004061300000000 ]  - [  -0.0149926900000000,  0.0004151700000000,  0.0041276800000000 ]  - [  -0.0051357700000000, -0.0072766700000000,  0.0000283100000000 ]  - [   0.0007021400000000, -0.0066509500000000,  0.0024702000000000 ]  - [   0.0002461900000000, -0.0004641500000000, -0.0003949000000000 ]  - [   0.0001501900000000,  0.0033082500000000,  0.0006899000000000 ]  - [  -0.0023902200000000,  0.0017333000000000,  0.0006954400000000 ]  - [   0.0005562600000000, -0.0001540900000000, -0.0004878100000000 ]  - [   0.0356563900000000,  0.0067251000000000, -0.0135008500000000 ]  - [  -0.0000884600000000, -0.0000015100000000, -0.0011556800000000 ]  - [   0.0003472100000000, -0.0006099100000000,  0.0023819100000000 ]  - [   0.0001336600000000,  0.0001306100000000, -0.0013894100000000 ]  - [  -0.0011518400000000, -0.0003072400000000,  0.0000363900000000 ]  - [  -0.0036203800000000,  0.0034159200000000,  0.0012319900000000 ]  - [  -0.0007541300000000, -0.0000571300000000,  0.0002476300000000 ]  - [  -0.0034844100000000, -0.0049640300000000,  0.0026309400000000 ]  - [  -0.0051453800000000, -0.0052980300000000, -0.0005761000000000 ]  - [  -0.0055007100000000, -0.0021165500000000, -0.0010272300000000 ]  - [   0.0015624500000000,  0.0014414400000000, -0.0017821700000000 ]  - [   0.0011716900000000,  0.0027286400000000, -0.0066327800000000 ]  - [  -0.0005837100000000,  0.0004203300000000, -0.0002670600000000 ]  - [  -0.0003309900000000, -0.0011312700000000, -0.0001702500000000 ]  - [   0.0002465400000000, -0.0001833100000000,  0.0004544500000000 ]  - [  -0.0014934900000000,  0.0004552800000000, -0.0005409300000000 ]  - [   0.0008528000000000,  0.0010774600000000, -0.0001067200000000 ]  - [  -0.0000148500000000, -0.0003037900000000, -0.0003993000000000 ]  - [   0.0015949400000000, -0.0001284000000000,  0.0001856800000000 ]  - [   0.0044539900000000,  0.0029121800000000, -0.0015717400000000 ]  - [  -0.0000477900000000, -0.0000483700000000, -0.0004089200000000 ]  - [  -0.0003937500000000,  0.0004971700000000,  0.0011190000000000 ]  - [  -0.0007062300000000, -0.0020927100000000, -0.0004002800000000 ]  - [  -0.0008135500000000,  0.0008232500000000, -0.0008360800000000 ]  - [  -0.0005759700000000, -0.0007227100000000,  0.0003785300000000 ]  - [  -0.0037233200000000, -0.0006217200000000,  0.0060884200000000 ]  - [  -0.0038220900000000,  0.0142260500000000,  0.0045372400000000 ]  - [   0.0013219200000000,  0.0035340000000000, -0.0022249600000000 ]  - [   0.0055354900000000, -0.0019324900000000,  0.0013698000000000 ]  - [   0.0009847000000000,  0.0001966000000000,  0.0011446700000000 ]  - [   0.0000705300000000, -0.0002915200000000,  0.0000783000000000 ]  - [  -0.0001422000000000,  0.0008315200000000,  0.0006466800000000 ]  - [  -0.0018181500000000,  0.0015180900000000, -0.0159437400000000 ]  - [   0.0002196900000000, -0.0006785700000000,  0.0008774700000000 ]  - [  -0.0009991800000000,  0.0005940100000000,  0.0011565000000000 ]  - [  -0.0021047000000000, -0.0042908200000000,  0.0035918500000000 ]- atom:   25  displacement:    [  -0.0050000000036683,  0.0086602540357265,  0.0000000000000000 ]  forces:  - [   0.0013786900000000,  0.0002341400000000,  0.0003281700000000 ]  - [   0.0022941000000000,  0.0002452000000000,  0.0010351300000000 ]  - [  -0.0022655400000000,  0.0131898100000000, -0.0045114900000000 ]  - [  -0.0006633600000000,  0.0006077300000000,  0.0002751000000000 ]  - [  -0.0014708600000000, -0.0027351200000000,  0.0022220200000000 ]  - [  -0.0020327500000000, -0.0018356200000000, -0.0038260000000000 ]  - [   0.0009805500000000, -0.0003164400000000,  0.0003751700000000 ]  - [  -0.0000536900000000, -0.0000107600000000,  0.0006924700000000 ]  - [   0.0013837500000000,  0.0089854100000000,  0.0028398500000000 ]  - [   0.0023016400000000,  0.0007408800000000,  0.0024869500000000 ]  - [   0.0002347600000000,  0.0025047400000000, -0.0005915600000000 ]  - [   0.0055631600000000, -0.0035778200000000,  0.0003317000000000 ]  - [  -0.0005758700000000, -0.0001170100000000,  0.0016973000000000 ]  - [  -0.0003593600000000,  0.0006608500000000, -0.0006077000000000 ]  - [  -0.0011048000000000,  0.0003363600000000, -0.0012591900000000 ]  - [   0.0008329600000000, -0.0006774000000000,  0.0028897600000000 ]  - [   0.0018539300000000, -0.0029757000000000, -0.0036214400000000 ]  - [  -0.0066552400000000,  0.0162148800000000, -0.0152942800000000 ]  - [  -0.0002871600000000,  0.0017766500000000, -0.0013888900000000 ]  - [   0.0045058700000000, -0.0069188700000000,  0.0028147500000000 ]  - [   0.0007449300000000, -0.0007007900000000, -0.0001728200000000 ]  - [  -0.0028484600000000, -0.0031248800000000,  0.0003600300000000 ]  - [  -0.0010341600000000,  0.0005619500000000,  0.0000284500000000 ]  - [  -0.0000072200000000, -0.0003545600000000, -0.0002528500000000 ]  - [   0.0114435100000000, -0.0591611300000000,  0.0266587700000000 ]  - [  -0.0007443700000000,  0.0000260300000000, -0.0002834900000000 ]  - [   0.0007500400000000, -0.0001767500000000,  0.0011702600000000 ]  - [   0.0004784200000000,  0.0005767900000000,  0.0000881500000000 ]  - [  -0.0008345700000000, -0.0008555000000000,  0.0000200100000000 ]  - [  -0.0005883600000000,  0.0006976200000000, -0.0001616200000000 ]  - [  -0.0004885700000000,  0.0002795500000000, -0.0000304100000000 ]  - [  -0.0019918700000000, -0.0011588600000000,  0.0011434000000000 ]  - [   0.0044765500000000,  0.0005883800000000,  0.0015041100000000 ]  - [  -0.0091549200000000, -0.0024926300000000, -0.0002541900000000 ]  - [  -0.0027691200000000,  0.0101552500000000,  0.0005526900000000 ]  - [  -0.0015771300000000,  0.0049150100000000, -0.0087155000000000 ]  - [   0.0001632900000000,  0.0006881200000000, -0.0003645000000000 ]  - [   0.0001677000000000,  0.0001252700000000, -0.0004282600000000 ]  - [   0.0004700800000000, -0.0004276100000000,  0.0001396600000000 ]  - [  -0.0006595300000000,  0.0001895300000000, -0.0014233400000000 ]  - [  -0.0002193800000000,  0.0004421700000000, -0.0002177100000000 ]  - [   0.0000766400000000,  0.0001802900000000, -0.0000593800000000 ]  - [   0.0010144700000000, -0.0006255200000000, -0.0001037800000000 ]  - [  -0.0004502800000000, -0.0008166200000000, -0.0004302300000000 ]  - [  -0.0006638100000000,  0.0005831500000000, -0.0007082500000000 ]  - [   0.0006168500000000, -0.0042682000000000,  0.0020496100000000 ]  - [  -0.0000163800000000, -0.0001978600000000,  0.0001385300000000 ]  - [  -0.0009679700000000,  0.0001819800000000, -0.0009172500000000 ]  - [  -0.0008255100000000,  0.0001447700000000, -0.0008849400000000 ]  - [   0.0018100600000000, -0.0055375600000000,  0.0001624900000000 ]  - [  -0.0045132900000000,  0.0170454800000000,  0.0047332000000000 ]  - [  -0.0057318300000000,  0.0011995000000000, -0.0078772700000000 ]  - [   0.0052407500000000,  0.0035970100000000,  0.0031729900000000 ]  - [   0.0000902300000000, -0.0001773500000000,  0.0011185100000000 ]  - [  -0.0001466600000000,  0.0005375400000000, -0.0005480600000000 ]  - [  -0.0002266100000000,  0.0012379700000000,  0.0009915400000000 ]  - [  -0.0005237000000000,  0.0003106200000000, -0.0033487000000000 ]  - [   0.0009141200000000,  0.0000553100000000,  0.0008241200000000 ]  - [  -0.0001450600000000,  0.0003559100000000,  0.0001862800000000 ]  - [   0.0028103600000000,  0.0090687000000000, -0.0047480700000000 ]- atom:   25  displacement:    [   0.0050000000036683, -0.0086602540357265,  0.0000000000000000 ]  forces:  - [  -0.0014262000000000, -0.0002532200000000, -0.0003061800000000 ]  - [  -0.0023127100000000, -0.0002340300000000, -0.0010362300000000 ]  - [   0.0025998600000000, -0.0127482300000000,  0.0040104800000000 ]  - [   0.0006623300000000, -0.0005922200000000, -0.0002613500000000 ]  - [   0.0015035200000000,  0.0027665800000000, -0.0022296100000000 ]  - [   0.0020976700000000,  0.0018642400000000,  0.0038504900000000 ]  - [  -0.0009594100000000,  0.0001837100000000, -0.0001640500000000 ]  - [  -0.0001230200000000,  0.0000518000000000, -0.0004897700000000 ]  - [  -0.0015438300000000, -0.0090645100000000, -0.0030789200000000 ]  - [  -0.0021957900000000, -0.0006717800000000, -0.0022858100000000 ]  - [  -0.0000830100000000, -0.0025905400000000,  0.0003842000000000 ]  - [  -0.0056505200000000,  0.0037292400000000, -0.0005254700000000 ]  - [   0.0005819100000000, -0.0000365400000000, -0.0014849600000000 ]  - [   0.0002236100000000, -0.0006161200000000,  0.0008272000000000 ]  - [   0.0010134400000000, -0.0004163300000000,  0.0010398900000000 ]  - [  -0.0007102500000000,  0.0008173700000000, -0.0026708400000000 ]  - [  -0.0017243300000000,  0.0029298800000000,  0.0033788200000000 ]  - [   0.0065829900000000, -0.0160187800000000,  0.0150248200000000 ]  - [   0.0010049700000000, -0.0026276800000000,  0.0012875900000000 ]  - [  -0.0045797900000000,  0.0069590400000000, -0.0026174500000000 ]  - [  -0.0008435600000000,  0.0005978500000000, -0.0000375500000000 ]  - [   0.0029591600000000,  0.0032523700000000, -0.0001714400000000 ]  - [   0.0011864100000000, -0.0005952000000000, -0.0002057000000000 ]  - [  -0.0000198200000000,  0.0004814100000000,  0.0000371800000000 ]  - [  -0.0129564400000000,  0.0593026300000000, -0.0257674300000000 ]  - [   0.0006585700000000, -0.0004308200000000,  0.0003180200000000 ]  - [  -0.0006058400000000,  0.0004816700000000, -0.0010575700000000 ]  - [  -0.0008142100000000, -0.0003042100000000, -0.0000644000000000 ]  - [   0.0005139200000000,  0.0007824500000000,  0.0000793100000000 ]  - [   0.0003489600000000, -0.0004904100000000,  0.0000218400000000 ]  - [   0.0007249300000000, -0.0005310600000000,  0.0001408700000000 ]  - [   0.0023471500000000,  0.0012769800000000, -0.0012645700000000 ]  - [  -0.0041695400000000, -0.0009049500000000, -0.0014736500000000 ]  - [   0.0091478200000000,  0.0022096600000000,  0.0001578900000000 ]  - [   0.0028582700000000, -0.0096238000000000, -0.0005553900000000 ]  - [   0.0020565100000000, -0.0048685500000000,  0.0088366400000000 ]  - [  -0.0005853000000000, -0.0008653600000000,  0.0004014200000000 ]  - [  -0.0002592900000000, -0.0005369500000000,  0.0004250100000000 ]  - [  -0.0003733400000000,  0.0007518900000000, -0.0000321900000000 ]  - [   0.0003559900000000,  0.0001005200000000,  0.0014394500000000 ]  - [  -0.0001076200000000, -0.0005185700000000,  0.0003272400000000 ]  - [  -0.0003004000000000,  0.0000820100000000, -0.0000735700000000 ]  - [  -0.0007824500000000,  0.0003666400000000,  0.0002089800000000 ]  - [   0.0007310300000000,  0.0008364900000000,  0.0002766600000000 ]  - [   0.0010227100000000, -0.0008478700000000,  0.0007446100000000 ]  - [  -0.0007188000000000,  0.0039235500000000, -0.0021501200000000 ]  - [   0.0001011500000000,  0.0007565000000000, -0.0001662200000000 ]  - [   0.0013616500000000, -0.0000702700000000,  0.0009232900000000 ]  - [   0.0004317400000000, -0.0002613300000000,  0.0008602500000000 ]  - [  -0.0018952000000000,  0.0050995900000000, -0.0001974600000000 ]  - [   0.0046756600000000, -0.0168901200000000, -0.0046354400000000 ]  - [   0.0053626900000000, -0.0009235900000000,  0.0077480500000000 ]  - [  -0.0056384400000000, -0.0037111700000000, -0.0030595300000000 ]  - [  -0.0003309200000000,  0.0004566000000000, -0.0012509900000000 ]  - [   0.0003751200000000, -0.0008014400000000,  0.0006976900000000 ]  - [   0.0005708300000000, -0.0011838900000000, -0.0011079900000000 ]  - [   0.0008444200000000, -0.0006084400000000,  0.0034248900000000 ]  - [  -0.0010316500000000, -0.0003707900000000, -0.0009538400000000 ]  - [   0.0002443500000000,  0.0000419600000000, -0.0002048400000000 ]  - [  -0.0024076600000000, -0.0088938500000000,  0.0047077500000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0014081600000000, -0.0006560800000000, -0.0029156200000000 ]  - [   0.0011190500000000,  0.0001332800000000,  0.0084935400000000 ]  - [  -0.0033020000000000, -0.0091395200000000,  0.0171733600000000 ]  - [  -0.0008838000000000, -0.0037030900000000, -0.0070973800000000 ]  - [  -0.0024235400000000,  0.0049780300000000,  0.0024064600000000 ]  - [  -0.0007981700000000, -0.0006596400000000, -0.0037379900000000 ]  - [   0.0044661700000000, -0.0018323200000000, -0.0015187600000000 ]  - [   0.0051231300000000,  0.0027882800000000,  0.0002008000000000 ]  - [  -0.0066437300000000, -0.0030758700000000, -0.0016181300000000 ]  - [  -0.0038091500000000,  0.0025151100000000, -0.0021413100000000 ]  - [   0.0013227300000000,  0.0011163400000000, -0.0000074200000000 ]  - [  -0.0005022900000000,  0.0004360200000000, -0.0003756800000000 ]  - [   0.0008485500000000,  0.0001792000000000, -0.0038554500000000 ]  - [  -0.0004086300000000, -0.0011145300000000, -0.0057443900000000 ]  - [  -0.0021894300000000, -0.0042033500000000,  0.0043859900000000 ]  - [   0.0002474600000000,  0.0011521400000000, -0.0061486100000000 ]  - [  -0.0002270500000000, -0.0031040400000000,  0.0037290000000000 ]  - [  -0.0042161900000000, -0.0081645200000000,  0.0610723000000000 ]  - [   0.0024911900000000, -0.0056564600000000,  0.0119868400000000 ]  - [  -0.0009215700000000,  0.0014115600000000,  0.0051857500000000 ]  - [  -0.0007189500000000,  0.0004443300000000, -0.0028240100000000 ]  - [   0.0016134600000000, -0.0020798800000000,  0.0045572200000000 ]  - [   0.0023522000000000, -0.0031834400000000, -0.0105244800000000 ]  - [  -0.0003301800000000,  0.0011165700000000, -0.0027885200000000 ]  - [   0.0137605900000000,  0.0384544700000000, -0.1096732800000000 ]  - [   0.0000357100000000, -0.0018560200000000, -0.0041506600000000 ]  - [  -0.0091918400000000, -0.0000316100000000, -0.0028875900000000 ]  - [  -0.0010170100000000,  0.0009809600000000, -0.0041531200000000 ]  - [  -0.0001691200000000, -0.0004784300000000, -0.0017261800000000 ]  - [   0.0026458800000000, -0.0018827500000000, -0.0041680700000000 ]  - [   0.0004109600000000,  0.0009742400000000, -0.0017427500000000 ]  - [   0.0033178400000000,  0.0044190200000000, -0.0047922400000000 ]  - [  -0.0022193000000000,  0.0005526900000000, -0.0063666700000000 ]  - [  -0.0043445400000000, -0.0018229300000000, -0.0017135500000000 ]  - [   0.0015308100000000, -0.0013537600000000, -0.0063690500000000 ]  - [   0.0068578000000000, -0.0062475200000000, -0.0052964900000000 ]  - [  -0.0005761400000000, -0.0013025800000000,  0.0018582800000000 ]  - [  -0.0014878900000000,  0.0000139500000000,  0.0031308700000000 ]  - [   0.0005447400000000,  0.0004404400000000,  0.0020440600000000 ]  - [   0.0001227200000000,  0.0004817200000000,  0.0031299200000000 ]  - [  -0.0006392000000000,  0.0002757300000000,  0.0021892600000000 ]  - [  -0.0002203400000000,  0.0002436900000000,  0.0001830700000000 ]  - [  -0.0001651100000000,  0.0006739200000000,  0.0029829100000000 ]  - [   0.0107838200000000,  0.0063101700000000,  0.0021445700000000 ]  - [   0.0011325600000000, -0.0009160800000000,  0.0019315400000000 ]  - [  -0.0033934000000000,  0.0098152500000000,  0.0015793400000000 ]  - [  -0.0033670500000000, -0.0162114000000000,  0.0129530200000000 ]  - [   0.0010237600000000, -0.0005330000000000,  0.0031580900000000 ]  - [   0.0000885800000000, -0.0003353600000000,  0.0018526300000000 ]  - [  -0.0077894400000000,  0.0017587500000000,  0.0081309600000000 ]  - [  -0.0004989100000000,  0.0059817600000000,  0.0026401600000000 ]  - [   0.0057653100000000, -0.0034798800000000,  0.0081352300000000 ]  - [  -0.0006258500000000,  0.0039941200000000,  0.0007782400000000 ]  - [   0.0005245500000000,  0.0001062100000000,  0.0012698300000000 ]  - [   0.0001803300000000, -0.0003594200000000,  0.0003471300000000 ]  - [   0.0006071800000000,  0.0000366800000000,  0.0012712000000000 ]  - [  -0.0003767200000000, -0.0000039300000000,  0.0129279400000000 ]  - [   0.0000278600000000, -0.0010493200000000,  0.0016580600000000 ]  - [  -0.0006735000000000,  0.0001258400000000,  0.0019184200000000 ]  - [  -0.0034067200000000, -0.0074737500000000,  0.0069313900000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0013744600000000,  0.0006549500000000,  0.0029015300000000 ]  - [  -0.0011009600000000, -0.0001227400000000, -0.0084350900000000 ]  - [   0.0035865000000000,  0.0099151600000000, -0.0174779900000000 ]  - [   0.0008714200000000,  0.0036549800000000,  0.0070758300000000 ]  - [   0.0024012700000000, -0.0049561600000000, -0.0023799300000000 ]  - [   0.0008013800000000,  0.0006504100000000,  0.0036799400000000 ]  - [  -0.0044144500000000,  0.0016699700000000,  0.0017433900000000 ]  - [  -0.0052364500000000, -0.0027173400000000,  0.0000222800000000 ]  - [   0.0063691300000000,  0.0029178700000000,  0.0011832600000000 ]  - [   0.0039029500000000, -0.0023982100000000,  0.0023670100000000 ]  - [  -0.0011894300000000, -0.0011692000000000, -0.0002372800000000 ]  - [   0.0005086700000000, -0.0002779800000000,  0.0001490500000000 ]  - [  -0.0008229900000000, -0.0003324200000000,  0.0040372600000000 ]  - [   0.0002573600000000,  0.0011714300000000,  0.0059410200000000 ]  - [   0.0020926300000000,  0.0040803500000000, -0.0045455100000000 ]  - [  -0.0001203900000000, -0.0010337700000000,  0.0063469000000000 ]  - [   0.0003564500000000,  0.0030631300000000, -0.0038921300000000 ]  - [   0.0037654200000000,  0.0073564200000000, -0.0573590900000000 ]  - [  -0.0022944200000000,  0.0052866600000000, -0.0118159700000000 ]  - [   0.0007540900000000, -0.0013937300000000, -0.0049614400000000 ]  - [   0.0006189300000000, -0.0005490500000000,  0.0025898400000000 ]  - [  -0.0015156100000000,  0.0021924400000000, -0.0043277000000000 ]  - [  -0.0021964300000000,  0.0031466300000000,  0.0102512900000000 ]  - [   0.0002926300000000, -0.0009838800000000,  0.0025530500000000 ]  - [  -0.0139669000000000, -0.0381413600000000,  0.1063628000000000 ]  - [  -0.0000941600000000,  0.0014156200000000,  0.0041121900000000 ]  - [   0.0092588700000000,  0.0003598800000000,  0.0029812700000000 ]  - [   0.0006650500000000, -0.0007116700000000,  0.0041113700000000 ]  - [  -0.0001859700000000,  0.0004218800000000,  0.0018411800000000 ]  - [  -0.0028577500000000,  0.0021864000000000,  0.0040408500000000 ]  - [  -0.0001973600000000, -0.0012478600000000,  0.0018652400000000 ]  - [  -0.0029830700000000, -0.0043955100000000,  0.0046597500000000 ]  - [   0.0025165300000000, -0.0008658600000000,  0.0063738900000000 ]  - [   0.0041617800000000,  0.0014667100000000,  0.0015541900000000 ]  - [  -0.0014707000000000,  0.0017332500000000,  0.0063736900000000 ]  - [  -0.0064070000000000,  0.0063799600000000,  0.0052221600000000 ]  - [   0.0001542600000000,  0.0011058500000000, -0.0018050300000000 ]  - [   0.0014035900000000, -0.0004461800000000, -0.0031375000000000 ]  - [  -0.0004103000000000, -0.0001052400000000, -0.0018993200000000 ]  - [  -0.0004485600000000, -0.0002075200000000, -0.0031404200000000 ]  - [   0.0002883800000000, -0.0003157400000000, -0.0020452900000000 ]  - [  -0.0000019400000000,  0.0000476900000000, -0.0003550600000000 ]  - [   0.0003915600000000, -0.0009435600000000, -0.0028189100000000 ]  - [  -0.0103638000000000, -0.0062342500000000, -0.0023062500000000 ]  - [  -0.0007507900000000,  0.0006511500000000, -0.0018792200000000 ]  - [   0.0032356900000000, -0.0100881300000000, -0.0017403300000000 ]  - [   0.0033887300000000,  0.0165429800000000, -0.0128171300000000 ]  - [  -0.0006216200000000,  0.0006741000000000, -0.0031654300000000 ]  - [  -0.0004969800000000,  0.0001877200000000, -0.0018135800000000 ]  - [   0.0078553500000000, -0.0022054800000000, -0.0082551700000000 ]  - [   0.0006048500000000, -0.0055025700000000, -0.0024349000000000 ]  - [  -0.0062061200000000,  0.0038247400000000, -0.0082481600000000 ]  - [   0.0002644000000000, -0.0040519700000000, -0.0005895300000000 ]  - [  -0.0007404300000000,  0.0001866700000000, -0.0013910400000000 ]  - [   0.0000587200000000,  0.0000689300000000, -0.0001693300000000 ]  - [  -0.0002487500000000,  0.0000125900000000, -0.0013887900000000 ]  - [   0.0007405600000000, -0.0002691400000000, -0.0128463600000000 ]  - [  -0.0001667900000000,  0.0007134500000000, -0.0017761700000000 ]  - [   0.0007602000000000,  0.0002990300000000, -0.0018923600000000 ]  - [   0.0038082800000000,  0.0076274800000000, -0.0069928200000000 ]- atom:   27  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0002646400000000, -0.0008066800000000,  0.0009121000000000 ]  - [   0.0260241300000000,  0.0025066600000000,  0.0123785700000000 ]  - [  -0.0007107700000000, -0.0024969700000000,  0.0015555700000000 ]  - [   0.0010948000000000, -0.0034672000000000, -0.0041118800000000 ]  - [  -0.0009033800000000,  0.0049670100000000, -0.0005901500000000 ]  - [  -0.0000573900000000,  0.0006185000000000, -0.0005299000000000 ]  - [   0.0087836600000000,  0.0014613600000000,  0.0004102800000000 ]  - [   0.0115456500000000, -0.0009550000000000,  0.0004931600000000 ]  - [   0.0037879100000000,  0.0004577000000000,  0.0013274800000000 ]  - [  -0.0091913700000000,  0.0024041200000000,  0.0017193600000000 ]  - [  -0.0014243500000000,  0.0024082300000000, -0.0016029100000000 ]  - [   0.0002688000000000, -0.0025694800000000, -0.0016137800000000 ]  - [   0.0001848900000000, -0.0006591700000000, -0.0003037200000000 ]  - [  -0.0011368900000000,  0.0002409200000000, -0.0008023200000000 ]  - [  -0.0062205600000000, -0.0009896400000000,  0.0023961700000000 ]  - [   0.0013532400000000, -0.0003202100000000,  0.0002642800000000 ]  - [  -0.0008354200000000, -0.0056486400000000,  0.0011634100000000 ]  - [   0.0024363000000000, -0.0031926300000000,  0.0010403000000000 ]  - [  -0.0049382000000000,  0.0008199500000000,  0.0043820200000000 ]  - [   0.0011196000000000,  0.0007385500000000, -0.0004240600000000 ]  - [  -0.0002301000000000, -0.0000849000000000,  0.0000004800000000 ]  - [   0.0006698400000000, -0.0002081200000000,  0.0011425400000000 ]  - [   0.0008860600000000,  0.0001124500000000, -0.0032821200000000 ]  - [  -0.0013518300000000,  0.0007361900000000,  0.0013156700000000 ]  - [  -0.0004823200000000,  0.0005538000000000, -0.0092313100000000 ]  - [  -0.0000066800000000, -0.0031124000000000,  0.0022228000000000 ]  - [  -0.0878475800000000, -0.0046161100000000, -0.0282672400000000 ]  - [  -0.0009886800000000,  0.0009331000000000,  0.0003715800000000 ]  - [   0.0123390200000000, -0.0090437600000000, -0.0025794000000000 ]  - [  -0.0021516100000000, -0.0026314200000000,  0.0040240700000000 ]  - [   0.0087832100000000,  0.0111275300000000, -0.0030440900000000 ]  - [  -0.0031788200000000,  0.0020405900000000,  0.0030278800000000 ]  - [   0.0005579600000000, -0.0003070500000000, -0.0010875400000000 ]  - [   0.0118633900000000,  0.0014905100000000,  0.0089771000000000 ]  - [  -0.0003347300000000,  0.0006984400000000, -0.0003569600000000 ]  - [   0.0056361300000000, -0.0074065500000000, -0.0043055500000000 ]  - [   0.0037604300000000, -0.0031709300000000, -0.0005196100000000 ]  - [  -0.0004506400000000,  0.0004328700000000,  0.0000767500000000 ]  - [   0.0009091100000000,  0.0009637300000000,  0.0013625900000000 ]  - [   0.0003218900000000,  0.0000168700000000, -0.0000487600000000 ]  - [  -0.0005673000000000,  0.0006706900000000,  0.0010751700000000 ]  - [   0.0012748800000000, -0.0006343600000000, -0.0010239200000000 ]  - [  -0.0000681600000000, -0.0000737800000000,  0.0013767700000000 ]  - [   0.0189413300000000,  0.0109558700000000,  0.0081229100000000 ]  - [   0.0007690000000000,  0.0000394900000000,  0.0002079700000000 ]  - [  -0.0022822600000000,  0.0098386000000000,  0.0016147800000000 ]  - [   0.0004709900000000, -0.0052941300000000,  0.0037877200000000 ]  - [   0.0005394100000000,  0.0010491600000000, -0.0033701800000000 ]  - [  -0.0003721000000000,  0.0003153100000000,  0.0005098500000000 ]  - [   0.0012230600000000,  0.0000652800000000, -0.0002591700000000 ]  - [   0.0009057000000000, -0.0010054600000000, -0.0000371900000000 ]  - [  -0.0009341500000000,  0.0003807300000000, -0.0003352100000000 ]  - [   0.0000192200000000,  0.0001236800000000,  0.0001654900000000 ]  - [   0.0002403600000000, -0.0000832400000000,  0.0001801000000000 ]  - [  -0.0001730100000000, -0.0008902100000000,  0.0002444100000000 ]  - [  -0.0000562900000000, -0.0000837600000000, -0.0001765100000000 ]  - [  -0.0005773100000000,  0.0003101300000000, -0.0005426500000000 ]  - [   0.0000927100000000, -0.0012225400000000,  0.0000436600000000 ]  - [   0.0004880800000000,  0.0004532100000000,  0.0005121000000000 ]  - [  -0.0000835200000000,  0.0010430900000000,  0.0000410000000000 ]- atom:   27  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0002954500000000,  0.0008022200000000, -0.0008566400000000 ]  - [  -0.0272308200000000, -0.0027284900000000, -0.0137808200000000 ]  - [   0.0007028700000000,  0.0024445600000000, -0.0015785400000000 ]  - [  -0.0010697500000000,  0.0034102200000000,  0.0041125100000000 ]  - [   0.0009175100000000, -0.0048769700000000,  0.0005923000000000 ]  - [   0.0000913100000000, -0.0005900400000000,  0.0005188100000000 ]  - [  -0.0088786100000000, -0.0013857100000000, -0.0000970700000000 ]  - [  -0.0117282400000000,  0.0009323800000000, -0.0002974800000000 ]  - [  -0.0038852000000000, -0.0005642600000000, -0.0015369100000000 ]  - [   0.0092829400000000, -0.0022423600000000, -0.0015374500000000 ]  - [   0.0015600400000000, -0.0024828300000000,  0.0014039500000000 ]  - [  -0.0003131300000000,  0.0027403200000000,  0.0014090600000000 ]  - [  -0.0001742600000000,  0.0004895600000000,  0.0005401800000000 ]  - [   0.0009923600000000, -0.0002008400000000,  0.0010087400000000 ]  - [   0.0061316600000000,  0.0007434500000000, -0.0026047500000000 ]  - [  -0.0012295200000000,  0.0004265200000000, -0.0000414900000000 ]  - [   0.0009461000000000,  0.0056479100000000, -0.0013808600000000 ]  - [  -0.0013376100000000,  0.0034578000000000, -0.0013008000000000 ]  - [   0.0049650400000000, -0.0009477700000000, -0.0041317700000000 ]  - [  -0.0012571100000000, -0.0006997600000000,  0.0006139300000000 ]  - [   0.0001293100000000, -0.0000092800000000, -0.0002226000000000 ]  - [  -0.0005731100000000,  0.0003239100000000, -0.0009410800000000 ]  - [  -0.0007038900000000, -0.0001443600000000,  0.0030695200000000 ]  - [   0.0013040200000000, -0.0006100900000000, -0.0014962200000000 ]  - [   0.0000560900000000, -0.0007089400000000,  0.0091651400000000 ]  - [  -0.0000624500000000,  0.0026497200000000, -0.0022022800000000 ]  - [   0.0881805500000000,  0.0047802400000000,  0.0297138400000000 ]  - [   0.0006132000000000, -0.0006297000000000, -0.0003496600000000 ]  - [  -0.0128948700000000,  0.0091399100000000,  0.0027412600000000 ]  - [   0.0019617900000000,  0.0029362800000000, -0.0041543100000000 ]  - [  -0.0086461000000000, -0.0115473800000000,  0.0031967200000000 ]  - [   0.0035781900000000, -0.0020057500000000, -0.0031582400000000 ]  - [  -0.0002269500000000,  0.0000341000000000,  0.0010922300000000 ]  - [  -0.0120935200000000, -0.0018298400000000, -0.0091710100000000 ]  - [   0.0003977900000000, -0.0002745000000000,  0.0003719700000000 ]  - [  -0.0051982200000000,  0.0074909300000000,  0.0042561700000000 ]  - [  -0.0040891700000000,  0.0028996600000000,  0.0005402100000000 ]  - [   0.0003799700000000, -0.0008951800000000, -0.0001759600000000 ]  - [  -0.0007648600000000, -0.0006112100000000, -0.0012064300000000 ]  - [  -0.0006379700000000,  0.0002570300000000,  0.0000624300000000 ]  - [   0.0002076500000000, -0.0006971800000000, -0.0009140100000000 ]  - [  -0.0014302400000000,  0.0010927500000000,  0.0008873100000000 ]  - [   0.0002831600000000, -0.0002101500000000, -0.0012281100000000 ]  - [  -0.0183407700000000, -0.0107620700000000, -0.0081757100000000 ]  - [  -0.0003988700000000, -0.0003143200000000, -0.0001486200000000 ]  - [   0.0021193100000000, -0.0101065900000000, -0.0017607200000000 ]  - [  -0.0004264300000000,  0.0056734500000000, -0.0036732500000000 ]  - [  -0.0001358700000000, -0.0008893000000000,  0.0033037800000000 ]  - [  -0.0000311500000000, -0.0004570700000000, -0.0004978500000000 ]  - [  -0.0012694200000000, -0.0005112300000000,  0.0001886300000000 ]  - [  -0.0007529800000000,  0.0013315300000000,  0.0002045700000000 ]  - [   0.0005612700000000, -0.0000975000000000,  0.0002669900000000 ]  - [  -0.0004096500000000, -0.0001734000000000,  0.0000013700000000 ]  - [  -0.0004625300000000,  0.0003916400000000, -0.0003243100000000 ]  - [   0.0004095300000000,  0.0005974300000000, -0.0000708500000000 ]  - [   0.0004181400000000,  0.0001088300000000,  0.0000416400000000 ]  - [   0.0009005200000000, -0.0005899000000000,  0.0005343300000000 ]  - [  -0.0002418900000000,  0.0008820000000000, -0.0001911600000000 ]  - [  -0.0004046300000000, -0.0000372500000000, -0.0005129000000000 ]  - [   0.0005049100000000, -0.0008531400000000, -0.0001177000000000 ]- atom:   27  displacement:    [  -0.0050000000036683,  0.0086602540357265,  0.0000000000000000 ]  forces:  - [  -0.0013132900000000,  0.0052730300000000, -0.0000961200000000 ]  - [  -0.0105213900000000,  0.0056553800000000, -0.0047359200000000 ]  - [  -0.0001839900000000,  0.0002330200000000, -0.0007074400000000 ]  - [  -0.0032729700000000, -0.0013329600000000,  0.0038636300000000 ]  - [   0.0027674900000000, -0.0075321400000000,  0.0012270400000000 ]  - [   0.0004271200000000, -0.0010125500000000,  0.0001300900000000 ]  - [   0.0011507600000000,  0.0094242900000000, -0.0009333300000000 ]  - [  -0.0094746600000000,  0.0132627200000000, -0.0035382100000000 ]  - [  -0.0018337000000000,  0.0022512900000000, -0.0004539300000000 ]  - [   0.0033415200000000,  0.0018204300000000, -0.0009165000000000 ]  - [   0.0020768100000000, -0.0011435600000000,  0.0005164300000000 ]  - [  -0.0019614700000000,  0.0009399500000000,  0.0002391500000000 ]  - [  -0.0000559200000000, -0.0019737900000000,  0.0020732800000000 ]  - [   0.0009250500000000,  0.0004003300000000,  0.0009518600000000 ]  - [   0.0097284300000000, -0.0044906500000000, -0.0000105100000000 ]  - [  -0.0026744300000000,  0.0001288300000000, -0.0013204500000000 ]  - [  -0.0076479700000000, -0.0020131500000000, -0.0018022800000000 ]  - [  -0.0035673200000000,  0.0090582100000000, -0.0009512700000000 ]  - [   0.0022944100000000, -0.0005356700000000, -0.0008469600000000 ]  - [  -0.0011571100000000, -0.0008319500000000,  0.0027023600000000 ]  - [  -0.0006977000000000, -0.0009845500000000, -0.0002810400000000 ]  - [   0.0001631600000000, -0.0011500700000000, -0.0026497100000000 ]  - [   0.0021903800000000,  0.0007716300000000,  0.0043000300000000 ]  - [   0.0029228700000000, -0.0007068500000000, -0.0064908900000000 ]  - [   0.0005832200000000, -0.0003840100000000,  0.0044815300000000 ]  - [   0.0021344800000000,  0.0056225100000000, -0.0054317200000000 ]  - [   0.0402954600000000, -0.0542115500000000,  0.0131250900000000 ]  - [  -0.0032495400000000,  0.0024047400000000,  0.0027377900000000 ]  - [  -0.0118582200000000,  0.0033840700000000, -0.0001587600000000 ]  - [  -0.0010876400000000,  0.0008210300000000, -0.0049343500000000 ]  - [   0.0029649800000000, -0.0035992000000000,  0.0028721900000000 ]  - [   0.0032437800000000, -0.0006054900000000,  0.0018330700000000 ]  - [  -0.0000479300000000,  0.0007272700000000,  0.0003174800000000 ]  - [  -0.0046240200000000, -0.0005171700000000, -0.0034878500000000 ]  - [   0.0010605600000000,  0.0004836800000000,  0.0004057900000000 ]  - [  -0.0008284900000000,  0.0024930300000000,  0.0006926300000000 ]  - [  -0.0144560200000000,  0.0113633400000000,  0.0053049600000000 ]  - [   0.0009990500000000, -0.0061709000000000, -0.0107104500000000 ]  - [  -0.0013190900000000,  0.0002368000000000, -0.0002804700000000 ]  - [  -0.0002883300000000, -0.0000329000000000, -0.0001290500000000 ]  - [   0.0009052400000000,  0.0003204800000000, -0.0007106100000000 ]  - [   0.0073105700000000,  0.0174799900000000,  0.0027671400000000 ]  - [   0.0007377200000000, -0.0002871200000000, -0.0011194800000000 ]  - [  -0.0086165800000000, -0.0035594200000000, -0.0038850800000000 ]  - [   0.0004441200000000,  0.0000514400000000,  0.0000996800000000 ]  - [   0.0096248400000000,  0.0000100200000000, -0.0006087700000000 ]  - [  -0.0058520700000000,  0.0022429900000000, -0.0031901400000000 ]  - [  -0.0005408400000000, -0.0048483600000000,  0.0102998400000000 ]  - [   0.0001847000000000, -0.0007102700000000,  0.0000297900000000 ]  - [  -0.0008592000000000, -0.0003896100000000, -0.0002601400000000 ]  - [   0.0003746100000000,  0.0012275100000000, -0.0003392200000000 ]  - [   0.0006816000000000, -0.0006310100000000,  0.0006004600000000 ]  - [  -0.0006761900000000, -0.0004570800000000,  0.0003337500000000 ]  - [  -0.0012957000000000,  0.0006529000000000, -0.0006861800000000 ]  - [  -0.0007327300000000,  0.0007472400000000,  0.0002868100000000 ]  - [   0.0010502300000000,  0.0008904400000000,  0.0003764700000000 ]  - [   0.0007843900000000, -0.0015098300000000, -0.0002497200000000 ]  - [  -0.0011106400000000,  0.0023623900000000,  0.0001955100000000 ]  - [  -0.0003668600000000, -0.0012356200000000,  0.0000003600000000 ]  - [   0.0008044600000000,  0.0001164200000000, -0.0008476300000000 ]- atom:   27  displacement:    [   0.0050000000036683, -0.0086602540357265,  0.0000000000000000 ]  forces:  - [   0.0013137900000000, -0.0052509900000000,  0.0000993500000000 ]  - [   0.0104207000000000, -0.0057869300000000,  0.0045823600000000 ]  - [   0.0001993300000000, -0.0002364700000000,  0.0006803700000000 ]  - [   0.0032731700000000,  0.0013603500000000, -0.0038401300000000 ]  - [  -0.0027862100000000,  0.0074987200000000, -0.0011878200000000 ]  - [  -0.0004195800000000,  0.0010135600000000, -0.0001577000000000 ]  - [  -0.0014932800000000, -0.0081892100000000,  0.0016837900000000 ]  - [   0.0093062400000000, -0.0144673800000000,  0.0042547800000000 ]  - [   0.0017212300000000, -0.0023488800000000,  0.0001878000000000 ]  - [  -0.0032211500000000, -0.0017016500000000,  0.0011399800000000 ]  - [  -0.0019347300000000,  0.0011070100000000, -0.0007415400000000 ]  - [   0.0019325000000000, -0.0008069800000000, -0.0004710500000000 ]  - [   0.0000843700000000,  0.0018308600000000, -0.0018803600000000 ]  - [  -0.0010634700000000, -0.0003562300000000, -0.0007533700000000 ]  - [  -0.0097978700000000,  0.0044064300000000, -0.0001861500000000 ]  - [   0.0027659600000000, -0.0000244900000000,  0.0015090900000000 ]  - [   0.0077716200000000,  0.0019507700000000,  0.0016110900000000 ]  - [   0.0038222900000000, -0.0088583200000000,  0.0007188300000000 ]  - [  -0.0022772500000000,  0.0003860700000000,  0.0010401000000000 ]  - [   0.0010132100000000,  0.0008825400000000, -0.0024743500000000 ]  - [   0.0005909300000000,  0.0008766100000000,  0.0000588700000000 ]  - [  -0.0000524400000000,  0.0012431300000000,  0.0028755500000000 ]  - [  -0.0020484600000000, -0.0008311800000000, -0.0045181700000000 ]  - [  -0.0029436300000000,  0.0008445500000000,  0.0062391300000000 ]  - [  -0.0009881800000000,  0.0002084500000000, -0.0044394600000000 ]  - [  -0.0021850100000000, -0.0060403000000000,  0.0053703100000000 ]  - [  -0.0396512600000000,  0.0544236700000000, -0.0141065800000000 ]  - [   0.0028853800000000, -0.0021659300000000, -0.0027452200000000 ]  - [   0.0113583100000000, -0.0034330200000000,  0.0002822900000000 ]  - [   0.0008673000000000, -0.0005565700000000,  0.0047931000000000 ]  - [  -0.0027338500000000,  0.0033962000000000, -0.0027601400000000 ]  - [  -0.0029023100000000,  0.0006797600000000, -0.0019551400000000 ]  - [   0.0003813500000000, -0.0009882600000000, -0.0003212100000000 ]  - [   0.0045571700000000,  0.0002122900000000,  0.0034232300000000 ]  - [  -0.0009907000000000, -0.0000635200000000, -0.0003952700000000 ]  - [   0.0011894100000000, -0.0022569400000000, -0.0006842600000000 ]  - [   0.0139041600000000, -0.0114546600000000, -0.0052201800000000 ]  - [  -0.0010746000000000,  0.0058108600000000,  0.0107582800000000 ]  - [   0.0014551700000000,  0.0000836700000000,  0.0004240900000000 ]  - [  -0.0000337400000000,  0.0003135800000000,  0.0001198600000000 ]  - [  -0.0012595000000000, -0.0003626400000000,  0.0008456200000000 ]  - [  -0.0075690800000000, -0.0172722200000000, -0.0029680900000000 ]  - [  -0.0005225700000000, -0.0000040600000000,  0.0012583000000000 ]  - [   0.0088901500000000,  0.0035152100000000,  0.0036969500000000 ]  - [  -0.0000661300000000, -0.0003101100000000, -0.0000502000000000 ]  - [  -0.0097606000000000, -0.0003445700000000,  0.0004472100000000 ]  - [   0.0059567800000000, -0.0017994600000000,  0.0033006800000000 ]  - [   0.0009510100000000,  0.0049172000000000, -0.0102256500000000 ]  - [  -0.0005865300000000,  0.0005637800000000,  0.0000021400000000 ]  - [   0.0007954700000000, -0.0000588500000000,  0.0002172900000000 ]  - [  -0.0002254800000000, -0.0008782600000000,  0.0005166500000000 ]  - [  -0.0010232200000000,  0.0008933500000000, -0.0006355800000000 ]  - [   0.0003185600000000,  0.0004266300000000, -0.0001633600000000 ]  - [   0.0010839900000000, -0.0003513300000000,  0.0005543900000000 ]  - [   0.0009486500000000, -0.0010520300000000, -0.0001080300000000 ]  - [  -0.0006936400000000, -0.0008490400000000, -0.0004964000000000 ]  - [  -0.0004574800000000,  0.0012339000000000,  0.0002825100000000 ]  - [   0.0009615900000000, -0.0026846400000000, -0.0003199100000000 ]  - [   0.0004451900000000,  0.0016476400000000,  0.0000224300000000 ]  - [  -0.0004030100000000,  0.0000583300000000,  0.0008088900000000 ]- atom:   27  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0013763200000000,  0.0001727000000000, -0.0034874800000000 ]  - [   0.0114794200000000,  0.0017749900000000,  0.0167539000000000 ]  - [   0.0000298000000000,  0.0008599000000000, -0.0001617300000000 ]  - [  -0.0004331800000000,  0.0016288100000000, -0.0013244500000000 ]  - [  -0.0007837100000000, -0.0015093200000000,  0.0013110200000000 ]  - [  -0.0002645500000000, -0.0003185600000000, -0.0024164400000000 ]  - [   0.0031378100000000,  0.0006557700000000,  0.0106536600000000 ]  - [   0.0032266000000000, -0.0016764400000000,  0.0139389700000000 ]  - [   0.0030823000000000,  0.0009444000000000, -0.0072445100000000 ]  - [  -0.0000191400000000, -0.0005903300000000,  0.0011699800000000 ]  - [  -0.0026215500000000,  0.0023635800000000, -0.0024152000000000 ]  - [  -0.0014271700000000, -0.0033399000000000, -0.0022261800000000 ]  - [   0.0009222800000000,  0.0003798000000000, -0.0024301700000000 ]  - [  -0.0004540300000000,  0.0000322200000000, -0.0014588900000000 ]  - [  -0.0004038200000000,  0.0029471500000000,  0.0020781200000000 ]  - [  -0.0003969100000000,  0.0003628500000000, -0.0022208200000000 ]  - [   0.0006984100000000, -0.0014249200000000,  0.0017323200000000 ]  - [   0.0039587100000000,  0.0011001500000000,  0.0096774300000000 ]  - [  -0.0018815700000000, -0.0010140800000000,  0.0013350900000000 ]  - [   0.0005342600000000,  0.0033655400000000,  0.0023002100000000 ]  - [  -0.0003737100000000, -0.0003494700000000, -0.0009014300000000 ]  - [   0.0018235100000000, -0.0030088500000000,  0.0015323900000000 ]  - [  -0.0011445100000000, -0.0004548600000000, -0.0035756700000000 ]  - [   0.0008044100000000,  0.0002474300000000, -0.0031880300000000 ]  - [  -0.0024693500000000, -0.0001167400000000, -0.0028964300000000 ]  - [   0.0011764000000000,  0.0021980600000000, -0.0047501700000000 ]  - [  -0.0283170900000000, -0.0007481700000000, -0.0478543700000000 ]  - [   0.0012248000000000, -0.0005784900000000, -0.0041259000000000 ]  - [   0.0001549900000000, -0.0034258200000000, -0.0047490000000000 ]  - [   0.0017901800000000, -0.0045076400000000,  0.0069999300000000 ]  - [  -0.0001316900000000,  0.0030541600000000, -0.0047437000000000 ]  - [   0.0009205300000000,  0.0051449500000000,  0.0069993100000000 ]  - [   0.0004409700000000, -0.0001896400000000, -0.0017601600000000 ]  - [   0.0089771500000000,  0.0010961500000000,  0.0087171500000000 ]  - [  -0.0000005900000000,  0.0002031400000000, -0.0017439100000000 ]  - [   0.0011541800000000,  0.0004146600000000, -0.0016472600000000 ]  - [  -0.0046553600000000,  0.0027213800000000,  0.0025722500000000 ]  - [  -0.0003853100000000, -0.0017827000000000,  0.0021812300000000 ]  - [  -0.0000522000000000, -0.0004298100000000,  0.0004809300000000 ]  - [  -0.0004894500000000,  0.0003162000000000,  0.0002328000000000 ]  - [  -0.0004980300000000, -0.0000333600000000,  0.0003981600000000 ]  - [  -0.0038639400000000, -0.0070623900000000, -0.0006717000000000 ]  - [   0.0003361300000000, -0.0003705800000000,  0.0007896700000000 ]  - [  -0.0017975900000000, -0.0022142800000000, -0.0006934300000000 ]  - [   0.0007956400000000,  0.0002299000000000,  0.0003009000000000 ]  - [   0.0016184300000000,  0.0002292700000000, -0.0011130100000000 ]  - [   0.0031487200000000, -0.0001115200000000,  0.0007254800000000 ]  - [  -0.0010056000000000,  0.0018400100000000,  0.0016247400000000 ]  - [  -0.0005884300000000, -0.0002019400000000,  0.0019962100000000 ]  - [   0.0010183500000000, -0.0000083900000000,  0.0012753100000000 ]  - [   0.0013519400000000,  0.0004795500000000,  0.0005032200000000 ]  - [  -0.0001487300000000, -0.0012471900000000,  0.0012772600000000 ]  - [  -0.0002682600000000,  0.0014259800000000,  0.0008076400000000 ]  - [   0.0003564700000000,  0.0000059800000000,  0.0006134900000000 ]  - [  -0.0006853700000000, -0.0008464500000000,  0.0004268300000000 ]  - [   0.0005194700000000,  0.0005104200000000,  0.0006168500000000 ]  - [   0.0004445500000000, -0.0001160000000000,  0.0029160100000000 ]  - [   0.0000403100000000,  0.0002306300000000,  0.0010549100000000 ]  - [  -0.0002430800000000,  0.0001745500000000,  0.0021392400000000 ]  - [  -0.0007391100000000,  0.0005675700000000,  0.0016674200000000 ]- atom:   27  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0013755000000000, -0.0001803700000000,  0.0035029400000000 ]  - [  -0.0124364700000000, -0.0018959200000000, -0.0172252700000000 ]  - [  -0.0000522500000000, -0.0008871100000000,  0.0001124500000000 ]  - [   0.0004253400000000, -0.0016246200000000,  0.0013618000000000 ]  - [   0.0007774500000000,  0.0015462400000000, -0.0013094200000000 ]  - [   0.0002958000000000,  0.0003200000000000,  0.0024035900000000 ]  - [  -0.0032062500000000, -0.0006714400000000, -0.0103629000000000 ]  - [  -0.0034076600000000,  0.0015449200000000, -0.0136562200000000 ]  - [  -0.0032273900000000, -0.0010559500000000,  0.0071019000000000 ]  - [   0.0001507600000000,  0.0006793700000000, -0.0009466000000000 ]  - [   0.0027972200000000, -0.0024313300000000,  0.0022051600000000 ]  - [   0.0014149400000000,  0.0035121000000000,  0.0020146700000000 ]  - [  -0.0009020500000000, -0.0005190900000000,  0.0026541300000000 ]  - [   0.0003141100000000,  0.0000084600000000,  0.0016845600000000 ]  - [   0.0003149600000000, -0.0030501100000000, -0.0023265000000000 ]  - [   0.0005015000000000, -0.0002625700000000,  0.0024441700000000 ]  - [  -0.0005751400000000,  0.0013963400000000, -0.0019660500000000 ]  - [  -0.0040374700000000, -0.0009705300000000, -0.0099295800000000 ]  - [   0.0019210000000000,  0.0008754900000000, -0.0011360800000000 ]  - [  -0.0006809900000000, -0.0033497200000000, -0.0020984500000000 ]  - [   0.0002757500000000,  0.0002454900000000,  0.0006910600000000 ]  - [  -0.0017345600000000,  0.0031428700000000, -0.0013292600000000 ]  - [   0.0012763400000000,  0.0004306700000000,  0.0033575200000000 ]  - [  -0.0008278400000000, -0.0001307500000000,  0.0029914400000000 ]  - [   0.0021001400000000, -0.0000408900000000,  0.0029329000000000 ]  - [  -0.0012315300000000, -0.0026282600000000,  0.0047434900000000 ]  - [   0.0296409700000000,  0.0013135900000000,  0.0485822300000000 ]  - [  -0.0015754500000000,  0.0008290800000000,  0.0041261800000000 ]  - [  -0.0005013900000000,  0.0033967800000000,  0.0049164600000000 ]  - [  -0.0020492300000000,  0.0048426300000000, -0.0072146800000000 ]  - [   0.0003571900000000, -0.0033460900000000,  0.0049166900000000 ]  - [  -0.0005845600000000, -0.0051554000000000, -0.0072173000000000 ]  - [  -0.0000970300000000, -0.0000834400000000,  0.0018038700000000 ]  - [  -0.0091483400000000, -0.0014371100000000, -0.0089289200000000 ]  - [   0.0000667400000000,  0.0002303400000000,  0.0017812400000000 ]  - [  -0.0007617600000000, -0.0002152800000000,  0.0016564300000000 ]  - [   0.0042715000000000, -0.0029490800000000, -0.0025363800000000 ]  - [   0.0003109400000000,  0.0012669500000000, -0.0022304300000000 ]  - [   0.0001852300000000,  0.0007571200000000, -0.0003551200000000 ]  - [   0.0001498000000000, -0.0000366300000000, -0.0002578500000000 ]  - [   0.0001469400000000, -0.0000110300000000, -0.0002696100000000 ]  - [   0.0036691800000000,  0.0073998100000000,  0.0005216800000000 ]  - [  -0.0001089700000000,  0.0000889100000000, -0.0006576200000000 ]  - [   0.0020971800000000,  0.0022148600000000,  0.0004916400000000 ]  - [  -0.0004166900000000, -0.0004926800000000, -0.0002544000000000 ]  - [  -0.0017661300000000, -0.0005610400000000,  0.0009327900000000 ]  - [  -0.0030853700000000,  0.0005372600000000, -0.0006767600000000 ]  - [   0.0013907900000000, -0.0016258100000000, -0.0016564200000000 ]  - [   0.0001800400000000,  0.0000499100000000, -0.0019851000000000 ]  - [  -0.0010821000000000, -0.0004524500000000, -0.0013449600000000 ]  - [  -0.0012142200000000, -0.0001302100000000, -0.0003310200000000 ]  - [  -0.0002120000000000,  0.0015310400000000, -0.0013410000000000 ]  - [  -0.0000989500000000, -0.0014768600000000, -0.0006379700000000 ]  - [  -0.0005698900000000,  0.0002979000000000, -0.0007571400000000 ]  - [   0.0009200800000000,  0.0005480600000000, -0.0002541600000000 ]  - [  -0.0001539100000000, -0.0004745700000000, -0.0007532800000000 ]  - [  -0.0001142800000000, -0.0001624300000000, -0.0029257500000000 ]  - [  -0.0001925400000000, -0.0005610300000000, -0.0011977800000000 ]  - [   0.0003163000000000,  0.0002511600000000, -0.0021301400000000 ]  - [   0.0011597300000000, -0.0003875500000000, -0.0017309000000000 ]