# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/b4380201-c5c2-452a-8111-6adcdbb3fa53/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 Rb2Zr(IO3)6 / R-3 (148) / materials id 560365](https://mdr.nims.go.jp/datasets/b3506a60-6165-4d89-84ab-8fc13ecb5d7b)

## 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:  - [     5.785995780000007,     3.340546193333330,     3.808279146666663 ] # a  - [    -5.785995759999994,     3.340546233333330,     3.808279146666663 ] # b  - [    -0.000000019999995,    -6.681092426666670,     3.808279146666663 ] # c  points:  - symbol: Rb # 1    coordinates: [  0.833853790000000,  0.833853780000000,  0.833853790000000 ]    mass: 85.467800  - symbol: Rb # 2    coordinates: [  0.166146210000000,  0.166146200000001,  0.166146210000000 ]    mass: 85.467800  - symbol: Zr # 3    coordinates: [  0.500000000000000,  0.499999990000002,  0.500000000000000 ]    mass: 91.224000  - symbol: I  # 4    coordinates: [  0.295948290000000,  0.662150910000003,  0.889108910000000 ]    mass: 126.904470  - symbol: I  # 5    coordinates: [  0.110891100000000,  0.704051710000002,  0.337849090000000 ]    mass: 126.904470  - symbol: I  # 6    coordinates: [  0.889108910000000,  0.295948280000003,  0.662150920000000 ]    mass: 126.904470  - symbol: I  # 7    coordinates: [  0.662150920000000,  0.889108900000003,  0.295948290000000 ]    mass: 126.904470  - symbol: I  # 8    coordinates: [  0.704051720000000,  0.337849080000002,  0.110891100000000 ]    mass: 126.904470  - symbol: I  # 9    coordinates: [  0.337849090000000,  0.110891090000002,  0.704051720000000 ]    mass: 126.904470  - symbol: O  # 10    coordinates: [  0.280067280000000,  0.902055400000003,  0.401025340000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.401025340000000,  0.280067260000003,  0.902055420000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.097944590000000,  0.598974670000002,  0.719932730000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.097905410000000,  0.079154700000002,  0.694026510000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.276848270000000,  0.546718960000002,  0.341185340000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.694026510000000,  0.097905420000002,  0.079154690000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.902055420000000,  0.401025320000003,  0.280067280000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.305973490000000,  0.902094590000000,  0.920845310000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.723151730000000,  0.453281040000003,  0.658814670000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.341185340000000,  0.276848270000002,  0.546718960000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.719932730000000,  0.097944590000002,  0.598974670000000 ]    mass: 15.999400  - symbol: O  # 21    coordinates: [  0.658814670000000,  0.723151720000003,  0.453281050000000 ]    mass: 15.999400  - symbol: O  # 22    coordinates: [  0.598974670000000,  0.719932730000002,  0.097944590000000 ]    mass: 15.999400  - symbol: O  # 23    coordinates: [  0.079154690000000,  0.694026520000002,  0.097905410000000 ]    mass: 15.999400  - symbol: O  # 24    coordinates: [  0.920845310000000,  0.305973480000000,  0.902094600000000 ]    mass: 15.999400  - symbol: O  # 25    coordinates: [  0.546718960000000,  0.341185340000002,  0.276848270000000 ]    mass: 15.999400  - symbol: O  # 26    coordinates: [  0.902094600000000,  0.920845300000000,  0.305973490000000 ]    mass: 15.999400  - symbol: O  # 27    coordinates: [  0.453281050000000,  0.658814660000003,  0.723151730000000 ]    mass: 15.999400  reciprocal_lattice: # without 2pi  - [     0.086415549003735,     0.049892040151184,     0.087528597693553 ] # a*  - [    -0.086415548658820,     0.049892040668557,     0.087528597693553 ] # b*  - [    -0.000000000344916,    -0.099784080819741,     0.087528597693553 ] # c*unit_cell:  lattice:  - [    11.571991540000001,    -0.000000040000000,     0.000000000000000 ] # a  - [    -5.785995740000000,    10.021638660000001,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.424837439999999 ] # c  points:  - symbol: Rb # 1    coordinates: [  0.666666670000000,  0.333333330000000,  0.167187120000000 ]    mass: 85.467800    reduced_to: 1  - symbol: Rb # 2    coordinates: [  0.666666670000000,  0.333333330000000,  0.499479540000000 ]    mass: 85.467800    reduced_to: 2  - symbol: Rb # 3    coordinates: [  0.333333330000000,  0.666666670000000,  0.500520460000000 ]    mass: 85.467800    reduced_to: 1  - symbol: Rb # 4    coordinates: [  0.333333330000000,  0.666666670000000,  0.832812880000000 ]    mass: 85.467800    reduced_to: 2  - symbol: Rb # 5    coordinates: [  0.000000000000000,  0.000000000000000,  0.833853790000000 ]    mass: 85.467800    reduced_to: 1  - symbol: Rb # 6    coordinates: [  0.000000000000000,  0.000000000000000,  0.166146210000000 ]    mass: 85.467800    reduced_to: 2  - symbol: Zr # 7    coordinates: [  0.666666670000000,  0.333333330000000,  0.833333330000000 ]    mass: 91.224000    reduced_to: 7  - symbol: Zr # 8    coordinates: [  0.333333330000000,  0.666666670000000,  0.166666670000000 ]    mass: 91.224000    reduced_to: 7  - symbol: Zr # 9    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 91.224000    reduced_to: 7  - symbol: I  # 10    coordinates: [  0.346878920000000,  0.059960460000000,  0.949069370000000 ]    mass: 126.904470    reduced_to: 10  - symbol: I  # 11    coordinates: [  0.393293800000000,  0.379748210000000,  0.717597300000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 12    coordinates: [  0.940039540000000,  0.286918450000000,  0.949069370000000 ]    mass: 126.904470    reduced_to: 12  - symbol: I  # 13    coordinates: [  0.713081550000000,  0.653121080000000,  0.949069370000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 14    coordinates: [  0.986454420000000,  0.606706200000000,  0.717597300000000 ]    mass: 126.904470    reduced_to: 14  - symbol: I  # 15    coordinates: [  0.620251790000000,  0.013545580000000,  0.717597300000000 ]    mass: 126.904470    reduced_to: 15  - symbol: I  # 16    coordinates: [  0.013545580000000,  0.393293800000000,  0.282402700000000 ]    mass: 126.904470    reduced_to: 10  - symbol: I  # 17    coordinates: [  0.059960460000000,  0.713081550000000,  0.050930630000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 18    coordinates: [  0.606706200000000,  0.620251790000000,  0.282402700000000 ]    mass: 126.904470    reduced_to: 12  - symbol: I  # 19    coordinates: [  0.379748210000000,  0.986454420000000,  0.282402700000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 20    coordinates: [  0.653121080000000,  0.940039540000000,  0.050930630000000 ]    mass: 126.904470    reduced_to: 14  - symbol: I  # 21    coordinates: [  0.286918450000000,  0.346878920000000,  0.050930630000000 ]    mass: 126.904470    reduced_to: 15  - symbol: I  # 22    coordinates: [  0.680212250000000,  0.726627130000000,  0.615736040000000 ]    mass: 126.904470    reduced_to: 10  - symbol: I  # 23    coordinates: [  0.726627130000000,  0.046414880000000,  0.384263960000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 24    coordinates: [  0.273372870000000,  0.953585120000000,  0.615736040000000 ]    mass: 126.904470    reduced_to: 12  - symbol: I  # 25    coordinates: [  0.046414880000000,  0.319787750000000,  0.615736040000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 26    coordinates: [  0.319787750000000,  0.273372870000000,  0.384263960000000 ]    mass: 126.904470    reduced_to: 14  - symbol: I  # 27    coordinates: [  0.953585120000000,  0.680212250000000,  0.384263960000000 ]    mass: 126.904470    reduced_to: 15  - symbol: O  # 28    coordinates: [  0.419017940000000,  0.460024000000000,  0.861049340000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 29    coordinates: [  0.539976000000000,  0.958993920000000,  0.861049340000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.292327260000000,  0.085684600000000,  0.805617330000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 31    coordinates: [  0.474209870000000,  0.929669030000000,  0.623695540000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.555264080000000,  0.380398850000000,  0.721584190000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 33    coordinates: [  0.070330970000000,  0.544540850000000,  0.623695540000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.041006080000000,  0.580982060000000,  0.861049340000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 35    coordinates: [  0.263002360000000,  0.122125820000000,  0.042971130000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.778069250000000,  0.286267810000000,  0.945082480000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 37    coordinates: [  0.619601150000000,  0.174865230000000,  0.721584190000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.914315400000000,  0.206642660000000,  0.805617330000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 39    coordinates: [  0.713732190000000,  0.491801430000000,  0.945082480000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.793357340000000,  0.707672740000000,  0.805617330000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 41    coordinates: [  0.455459150000000,  0.525790130000000,  0.623695540000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.877874180000000,  0.140876530000000,  0.042971130000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 43    coordinates: [  0.825134770000000,  0.444735920000000,  0.721584190000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.859123470000000,  0.736997640000000,  0.042971130000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 45    coordinates: [  0.508198570000000,  0.221930750000000,  0.945082480000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.085684600000000,  0.793357340000000,  0.194382670000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 47    coordinates: [  0.206642660000000,  0.292327260000000,  0.194382670000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 48    coordinates: [  0.958993920000000,  0.419017940000000,  0.138950660000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 49    coordinates: [  0.140876530000000,  0.263002360000000,  0.957028870000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 50    coordinates: [  0.221930750000000,  0.713732190000000,  0.054917520000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 51    coordinates: [  0.736997640000000,  0.877874180000000,  0.957028870000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 52    coordinates: [  0.707672740000000,  0.914315400000000,  0.194382670000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 53    coordinates: [  0.929669030000000,  0.455459150000000,  0.376304460000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 54    coordinates: [  0.444735920000000,  0.619601150000000,  0.278415810000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 55    coordinates: [  0.286267810000000,  0.508198570000000,  0.054917520000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 56    coordinates: [  0.580982060000000,  0.539976000000000,  0.138950660000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 57    coordinates: [  0.380398850000000,  0.825134770000000,  0.278415810000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 58    coordinates: [  0.460024000000000,  0.041006080000000,  0.138950660000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 59    coordinates: [  0.122125820000000,  0.859123470000000,  0.957028870000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 60    coordinates: [  0.544540850000000,  0.474209870000000,  0.376304460000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 61    coordinates: [  0.491801430000000,  0.778069250000000,  0.054917520000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 62    coordinates: [  0.525790130000000,  0.070330970000000,  0.376304460000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 63    coordinates: [  0.174865230000000,  0.555264080000000,  0.278415810000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 64    coordinates: [  0.752351270000000,  0.126690670000000,  0.527716010000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 65    coordinates: [  0.873309330000000,  0.625660590000000,  0.527716010000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 66    coordinates: [  0.625660590000000,  0.752351270000000,  0.472283990000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 67    coordinates: [  0.807543200000000,  0.596335690000000,  0.290362200000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 68    coordinates: [  0.888597410000000,  0.047065520000000,  0.388250860000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 69    coordinates: [  0.403664310000000,  0.211207520000000,  0.290362200000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 70    coordinates: [  0.374339410000000,  0.247648730000000,  0.527716010000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 71    coordinates: [  0.596335690000000,  0.788792480000000,  0.709637800000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 72    coordinates: [  0.111402590000000,  0.952934480000000,  0.611749140000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 73    coordinates: [  0.952934480000000,  0.841531900000000,  0.388250860000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 74    coordinates: [  0.247648730000000,  0.873309330000000,  0.472283990000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 75    coordinates: [  0.047065520000000,  0.158468100000000,  0.611749140000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 76    coordinates: [  0.126690670000000,  0.374339410000000,  0.472283990000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 77    coordinates: [  0.788792480000000,  0.192456800000000,  0.290362200000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 78    coordinates: [  0.211207520000000,  0.807543200000000,  0.709637800000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 79    coordinates: [  0.158468100000000,  0.111402590000000,  0.388250860000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 80    coordinates: [  0.192456800000000,  0.403664310000000,  0.709637800000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 81    coordinates: [  0.841531900000000,  0.888597410000000,  0.611749140000000 ]    mass: 15.999400    reduced_to: 45supercell:  lattice:  - [    11.571991540000001,    -0.000000040000000,     0.000000000000000 ] # a  - [    -5.785995740000000,    10.021638660000001,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.424837439999999 ] # c  points:  - symbol: Rb # 1    coordinates: [  0.666666670000000,  0.333333330000000,  0.167187120000000 ]    mass: 85.467800    reduced_to: 1  - symbol: Rb # 2    coordinates: [  0.666666670000000,  0.333333330000000,  0.499479540000000 ]    mass: 85.467800    reduced_to: 2  - symbol: Rb # 3    coordinates: [  0.333333330000000,  0.666666670000000,  0.500520460000000 ]    mass: 85.467800    reduced_to: 1  - symbol: Rb # 4    coordinates: [  0.333333330000000,  0.666666670000000,  0.832812880000000 ]    mass: 85.467800    reduced_to: 2  - symbol: Rb # 5    coordinates: [  0.000000000000000,  0.000000000000000,  0.833853790000000 ]    mass: 85.467800    reduced_to: 1  - symbol: Rb # 6    coordinates: [  0.000000000000000,  0.000000000000000,  0.166146210000000 ]    mass: 85.467800    reduced_to: 2  - symbol: Zr # 7    coordinates: [  0.666666670000000,  0.333333330000000,  0.833333330000000 ]    mass: 91.224000    reduced_to: 7  - symbol: Zr # 8    coordinates: [  0.333333330000000,  0.666666670000000,  0.166666670000000 ]    mass: 91.224000    reduced_to: 7  - symbol: Zr # 9    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 91.224000    reduced_to: 7  - symbol: I  # 10    coordinates: [  0.346878920000000,  0.059960460000000,  0.949069370000000 ]    mass: 126.904470    reduced_to: 10  - symbol: I  # 11    coordinates: [  0.393293800000000,  0.379748210000000,  0.717597300000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 12    coordinates: [  0.940039540000000,  0.286918450000000,  0.949069370000000 ]    mass: 126.904470    reduced_to: 12  - symbol: I  # 13    coordinates: [  0.713081550000000,  0.653121080000000,  0.949069370000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 14    coordinates: [  0.986454420000000,  0.606706200000000,  0.717597300000000 ]    mass: 126.904470    reduced_to: 14  - symbol: I  # 15    coordinates: [  0.620251790000000,  0.013545580000000,  0.717597300000000 ]    mass: 126.904470    reduced_to: 15  - symbol: I  # 16    coordinates: [  0.013545580000000,  0.393293800000000,  0.282402700000000 ]    mass: 126.904470    reduced_to: 10  - symbol: I  # 17    coordinates: [  0.059960460000000,  0.713081550000000,  0.050930630000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 18    coordinates: [  0.606706200000000,  0.620251790000000,  0.282402700000000 ]    mass: 126.904470    reduced_to: 12  - symbol: I  # 19    coordinates: [  0.379748210000000,  0.986454420000000,  0.282402700000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 20    coordinates: [  0.653121080000000,  0.940039540000000,  0.050930630000000 ]    mass: 126.904470    reduced_to: 14  - symbol: I  # 21    coordinates: [  0.286918450000000,  0.346878920000000,  0.050930630000000 ]    mass: 126.904470    reduced_to: 15  - symbol: I  # 22    coordinates: [  0.680212250000000,  0.726627130000000,  0.615736040000000 ]    mass: 126.904470    reduced_to: 10  - symbol: I  # 23    coordinates: [  0.726627130000000,  0.046414880000000,  0.384263960000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 24    coordinates: [  0.273372870000000,  0.953585120000000,  0.615736040000000 ]    mass: 126.904470    reduced_to: 12  - symbol: I  # 25    coordinates: [  0.046414880000000,  0.319787750000000,  0.615736040000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 26    coordinates: [  0.319787750000000,  0.273372870000000,  0.384263960000000 ]    mass: 126.904470    reduced_to: 14  - symbol: I  # 27    coordinates: [  0.953585120000000,  0.680212250000000,  0.384263960000000 ]    mass: 126.904470    reduced_to: 15  - symbol: O  # 28    coordinates: [  0.419017940000000,  0.460024000000000,  0.861049340000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 29    coordinates: [  0.539976000000000,  0.958993920000000,  0.861049340000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.292327260000000,  0.085684600000000,  0.805617330000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 31    coordinates: [  0.474209870000000,  0.929669030000000,  0.623695540000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.555264080000000,  0.380398850000000,  0.721584190000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 33    coordinates: [  0.070330970000000,  0.544540850000000,  0.623695540000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.041006080000000,  0.580982060000000,  0.861049340000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 35    coordinates: [  0.263002360000000,  0.122125820000000,  0.042971130000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.778069250000000,  0.286267810000000,  0.945082480000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 37    coordinates: [  0.619601150000000,  0.174865230000000,  0.721584190000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.914315400000000,  0.206642660000000,  0.805617330000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 39    coordinates: [  0.713732190000000,  0.491801430000000,  0.945082480000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.793357340000000,  0.707672740000000,  0.805617330000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 41    coordinates: [  0.455459150000000,  0.525790130000000,  0.623695540000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.877874180000000,  0.140876530000000,  0.042971130000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 43    coordinates: [  0.825134770000000,  0.444735920000000,  0.721584190000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.859123470000000,  0.736997640000000,  0.042971130000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 45    coordinates: [  0.508198570000000,  0.221930750000000,  0.945082480000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.085684600000000,  0.793357340000000,  0.194382670000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 47    coordinates: [  0.206642660000000,  0.292327260000000,  0.194382670000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 48    coordinates: [  0.958993920000000,  0.419017940000000,  0.138950660000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 49    coordinates: [  0.140876530000000,  0.263002360000000,  0.957028870000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 50    coordinates: [  0.221930750000000,  0.713732190000000,  0.054917520000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 51    coordinates: [  0.736997640000000,  0.877874180000000,  0.957028870000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 52    coordinates: [  0.707672740000000,  0.914315400000000,  0.194382670000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 53    coordinates: [  0.929669030000000,  0.455459150000000,  0.376304460000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 54    coordinates: [  0.444735920000000,  0.619601150000000,  0.278415810000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 55    coordinates: [  0.286267810000000,  0.508198570000000,  0.054917520000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 56    coordinates: [  0.580982060000000,  0.539976000000000,  0.138950660000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 57    coordinates: [  0.380398850000000,  0.825134770000000,  0.278415810000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 58    coordinates: [  0.460024000000000,  0.041006080000000,  0.138950660000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 59    coordinates: [  0.122125820000000,  0.859123470000000,  0.957028870000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 60    coordinates: [  0.544540850000000,  0.474209870000000,  0.376304460000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 61    coordinates: [  0.491801430000000,  0.778069250000000,  0.054917520000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 62    coordinates: [  0.525790130000000,  0.070330970000000,  0.376304460000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 63    coordinates: [  0.174865230000000,  0.555264080000000,  0.278415810000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 64    coordinates: [  0.752351270000000,  0.126690670000000,  0.527716010000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 65    coordinates: [  0.873309330000000,  0.625660590000000,  0.527716010000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 66    coordinates: [  0.625660590000000,  0.752351270000000,  0.472283990000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 67    coordinates: [  0.807543200000000,  0.596335690000000,  0.290362200000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 68    coordinates: [  0.888597410000000,  0.047065520000000,  0.388250860000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 69    coordinates: [  0.403664310000000,  0.211207520000000,  0.290362200000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 70    coordinates: [  0.374339410000000,  0.247648730000000,  0.527716010000000 ]    mass: 15.999400    reduced_to: 34  - symbol: O  # 71    coordinates: [  0.596335690000000,  0.788792480000000,  0.709637800000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 72    coordinates: [  0.111402590000000,  0.952934480000000,  0.611749140000000 ]    mass: 15.999400    reduced_to: 36  - symbol: O  # 73    coordinates: [  0.952934480000000,  0.841531900000000,  0.388250860000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 74    coordinates: [  0.247648730000000,  0.873309330000000,  0.472283990000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 75    coordinates: [  0.047065520000000,  0.158468100000000,  0.611749140000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 76    coordinates: [  0.126690670000000,  0.374339410000000,  0.472283990000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 77    coordinates: [  0.788792480000000,  0.192456800000000,  0.290362200000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 78    coordinates: [  0.211207520000000,  0.807543200000000,  0.709637800000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 79    coordinates: [  0.158468100000000,  0.111402590000000,  0.388250860000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 80    coordinates: [  0.192456800000000,  0.403664310000000,  0.709637800000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 81    coordinates: [  0.841531900000000,  0.888597410000000,  0.611749140000000 ]    mass: 15.999400    reduced_to: 45displacements:- atom:    1  displacement:    [   0.0100000000000000, -0.0000000000345662,  0.0000000000000000 ]  forces:  - [  -0.0204767900000000, -0.0000008600000000,  0.0003296000000000 ]  - [  -0.0013115600000000,  0.0000004100000000, -0.0003729000000000 ]  - [   0.0002539500000000,  0.0000820800000000,  0.0003650200000000 ]  - [   0.0001281300000000,  0.0000006200000000, -0.0003649600000000 ]  - [   0.0002541700000000, -0.0000827500000000,  0.0003643600000000 ]  - [   0.0004284900000000, -0.0000012800000000, -0.0003645500000000 ]  - [  -0.0049536700000000,  0.0002496100000000,  0.0000213100000000 ]  - [   0.0023351500000000,  0.0007392700000000, -0.0000007600000000 ]  - [   0.0016918500000000,  0.0002854000000000, -0.0000001900000000 ]  - [   0.0016089300000000,  0.0031601400000000,  0.0017066800000000 ]  - [   0.0008431700000000, -0.0007816800000000,  0.0002286300000000 ]  - [   0.0046888100000000, -0.0004752800000000, -0.0041405100000000 ]  - [  -0.0006913400000000, -0.0029215100000000,  0.0015285500000000 ]  - [  -0.0009016400000000,  0.0003359700000000,  0.0001462400000000 ]  - [  -0.0002979500000000, -0.0001496600000000,  0.0005021500000000 ]  - [   0.0088668100000000,  0.0021108000000000,  0.0045276100000000 ]  - [   0.0000811900000000,  0.0015890900000000, -0.0005656700000000 ]  - [   0.0013280000000000, -0.0048462700000000, -0.0032430400000000 ]  - [  -0.0016456500000000,  0.0035369200000000, -0.0021465700000000 ]  - [  -0.0011875400000000, -0.0022237600000000, -0.0002026200000000 ]  - [   0.0034350500000000,  0.0001611500000000,  0.0016341300000000 ]  - [   0.0002305000000000, -0.0003331000000000, -0.0006400700000000 ]  - [   0.0005504400000000, -0.0035002700000000,  0.0026364000000000 ]  - [  -0.0006151100000000,  0.0010161700000000, -0.0003572800000000 ]  - [   0.0002766300000000, -0.0005008400000000,  0.0001171800000000 ]  - [   0.0037809400000000,  0.0006325300000000, -0.0026383700000000 ]  - [  -0.0007280800000000,  0.0029476600000000,  0.0008962100000000 ]  - [  -0.0003011800000000, -0.0001937300000000, -0.0007718600000000 ]  - [   0.0006983900000000,  0.0000795400000000, -0.0004790700000000 ]  - [  -0.0001344000000000, -0.0004859600000000, -0.0002302400000000 ]  - [   0.0002333300000000,  0.0001525000000000, -0.0000551300000000 ]  - [   0.0000476900000000, -0.0002577000000000, -0.0000362600000000 ]  - [   0.0000596300000000, -0.0002886700000000, -0.0002740500000000 ]  - [  -0.0001035200000000, -0.0000187700000000, -0.0001631600000000 ]  - [  -0.0005615000000000, -0.0005205000000000, -0.0004644500000000 ]  - [   0.0018623500000000, -0.0003062000000000,  0.0008100000000000 ]  - [   0.0009289600000000, -0.0003762300000000, -0.0002192800000000 ]  - [  -0.0002058200000000,  0.0008701600000000,  0.0016299900000000 ]  - [   0.0005307900000000,  0.0002015200000000, -0.0002302200000000 ]  - [  -0.0000499400000000,  0.0002446400000000,  0.0000165900000000 ]  - [   0.0000435600000000,  0.0002642600000000, -0.0000892500000000 ]  - [  -0.0008541500000000,  0.0007909100000000,  0.0006707100000000 ]  - [   0.0005012200000000,  0.0005554700000000, -0.0002332900000000 ]  - [   0.0007280300000000,  0.0002346700000000,  0.0002199400000000 ]  - [   0.0014979500000000, -0.0005710700000000, -0.0001399400000000 ]  - [  -0.0002372900000000, -0.0006451000000000, -0.0003725900000000 ]  - [  -0.0006562000000000,  0.0001789100000000, -0.0008611900000000 ]  - [   0.0014087600000000,  0.0007202200000000, -0.0004828700000000 ]  - [  -0.0017836900000000, -0.0001599600000000, -0.0006324300000000 ]  - [  -0.0007920500000000, -0.0005506700000000, -0.0001569900000000 ]  - [  -0.0002663300000000,  0.0004722700000000,  0.0000764600000000 ]  - [  -0.0002737900000000,  0.0010334000000000, -0.0001839700000000 ]  - [  -0.0003742600000000, -0.0011678700000000, -0.0013063000000000 ]  - [  -0.0014060400000000,  0.0008481800000000, -0.0001653400000000 ]  - [  -0.0004101900000000,  0.0001808300000000, -0.0000339700000000 ]  - [   0.0019141900000000,  0.0006482300000000,  0.0009303200000000 ]  - [   0.0001289000000000, -0.0008912100000000,  0.0000890100000000 ]  - [   0.0004976400000000,  0.0000451700000000,  0.0009633800000000 ]  - [  -0.0001996200000000, -0.0009851300000000,  0.0001417700000000 ]  - [  -0.0006295600000000,  0.0010318300000000,  0.0011052500000000 ]  - [   0.0001436100000000,  0.0011179200000000, -0.0002937600000000 ]  - [   0.0017000500000000, -0.0000095200000000,  0.0006169500000000 ]  - [  -0.0022551200000000, -0.0029776200000000,  0.0005638800000000 ]  - [   0.0000213700000000, -0.0002554700000000, -0.0018858500000000 ]  - [   0.0005671800000000, -0.0001513200000000, -0.0005559600000000 ]  - [   0.0000948600000000,  0.0003304900000000,  0.0011755700000000 ]  - [   0.0013860500000000, -0.0001141200000000, -0.0000554500000000 ]  - [  -0.0020101400000000,  0.0004156400000000, -0.0008753700000000 ]  - [   0.0016097100000000,  0.0005070100000000, -0.0004530500000000 ]  - [  -0.0001605100000000,  0.0002293700000000,  0.0010126500000000 ]  - [  -0.0001879400000000,  0.0003778000000000,  0.0003550000000000 ]  - [   0.0002306400000000,  0.0001666000000000,  0.0000937100000000 ]  - [   0.0007733000000000, -0.0009073000000000, -0.0003152000000000 ]  - [   0.0001309800000000,  0.0001229200000000,  0.0006732200000000 ]  - [  -0.0008218300000000,  0.0006505400000000,  0.0002703500000000 ]  - [  -0.0011208700000000,  0.0001776600000000, -0.0004265900000000 ]  - [   0.0024174500000000,  0.0000963600000000,  0.0001721900000000 ]  - [  -0.0001421300000000, -0.0003984600000000,  0.0002416100000000 ]  - [  -0.0016599900000000, -0.0010288100000000,  0.0007062200000000 ]  - [  -0.0005433100000000, -0.0002042800000000, -0.0001811800000000 ]  - [   0.0000119000000000, -0.0003098500000000,  0.0001229200000000 ]- atom:    1  displacement:    [  -0.0100000000000000,  0.0000000000345662,  0.0000000000000000 ]  forces:  - [   0.0202851300000000, -0.0000004500000000,  0.0003286500000000 ]  - [   0.0013106400000000,  0.0000004100000000, -0.0003728000000000 ]  - [  -0.0002538000000000, -0.0000810700000000,  0.0003649600000000 ]  - [  -0.0001277800000000,  0.0000006500000000, -0.0003648800000000 ]  - [  -0.0002535900000000,  0.0000804100000000,  0.0003643000000000 ]  - [  -0.0004280900000000, -0.0000012500000000, -0.0003644900000000 ]  - [   0.0049438500000000, -0.0002419300000000,  0.0000213700000000 ]  - [  -0.0023316100000000, -0.0007239700000000, -0.0000007600000000 ]  - [  -0.0016891800000000, -0.0002917200000000, -0.0000001900000000 ]  - [  -0.0004423900000000, -0.0030331300000000, -0.0023016100000000 ]  - [  -0.0001603500000000, -0.0001487300000000,  0.0003524000000000 ]  - [  -0.0053627200000000,  0.0014015800000000,  0.0035109600000000 ]  - [   0.0002459800000000,  0.0018480700000000, -0.0021144100000000 ]  - [  -0.0002512600000000, -0.0004536800000000,  0.0004424300000000 ]  - [   0.0007578700000000,  0.0012044400000000,  0.0000822700000000 ]  - [  -0.0076267500000000, -0.0019726800000000, -0.0050727800000000 ]  - [   0.0005887400000000, -0.0025101200000000,  0.0011452900000000 ]  - [  -0.0019960100000000,  0.0058039900000000,  0.0026613400000000 ]  - [   0.0012051200000000, -0.0045844500000000,  0.0015490200000000 ]  - [   0.0000404000000000,  0.0020942400000000,  0.0007835400000000 ]  - [  -0.0029865800000000,  0.0008945800000000, -0.0010629500000000 ]  - [   0.0009145000000000,  0.0004513200000000,  0.0000515200000000 ]  - [   0.0001249800000000,  0.0025726500000000, -0.0020434100000000 ]  - [  -0.0000583500000000, -0.0000904700000000, -0.0002310800000000 ]  - [  -0.0007411000000000, -0.0005519500000000, -0.0007006800000000 ]  - [  -0.0049380200000000, -0.0007657600000000,  0.0032527800000000 ]  - [   0.0011702800000000, -0.0018970600000000, -0.0003149600000000 ]  - [  -0.0000427600000000, -0.0004188500000000, -0.0001668200000000 ]  - [   0.0000035700000000, -0.0000691200000000, -0.0004658200000000 ]  - [   0.0004899900000000, -0.0001180900000000,  0.0011751600000000 ]  - [  -0.0004278000000000, -0.0000512300000000, -0.0002221000000000 ]  - [  -0.0010301800000000, -0.0002210800000000, -0.0002900600000000 ]  - [  -0.0000415600000000,  0.0000618800000000, -0.0000093600000000 ]  - [  -0.0002555300000000,  0.0006199100000000, -0.0007816200000000 ]  - [   0.0005469500000000,  0.0007531500000000,  0.0007518200000000 ]  - [  -0.0008300200000000,  0.0007776700000000, -0.0005345000000000 ]  - [  -0.0000195900000000, -0.0002379300000000, -0.0001061000000000 ]  - [   0.0005525000000000, -0.0002565600000000, -0.0006825500000000 ]  - [  -0.0014463600000000,  0.0004166500000000,  0.0005468400000000 ]  - [  -0.0006529200000000, -0.0002507700000000,  0.0009239100000000 ]  - [   0.0001422900000000, -0.0001470300000000, -0.0001871800000000 ]  - [   0.0006640200000000, -0.0009052100000000, -0.0003842300000000 ]  - [  -0.0004238500000000,  0.0005309600000000, -0.0000928100000000 ]  - [  -0.0005305000000000, -0.0003312700000000,  0.0000587400000000 ]  - [  -0.0015890600000000, -0.0005410800000000,  0.0004279200000000 ]  - [  -0.0001023600000000,  0.0000329600000000, -0.0005738900000000 ]  - [   0.0013586800000000, -0.0001678800000000, -0.0000829400000000 ]  - [  -0.0008324800000000, -0.0012598800000000,  0.0014144200000000 ]  - [   0.0015907100000000,  0.0002625200000000,  0.0003558800000000 ]  - [  -0.0001842300000000,  0.0000683000000000, -0.0001646700000000 ]  - [   0.0002730200000000, -0.0006893900000000, -0.0003519500000000 ]  - [  -0.0000865300000000, -0.0004290500000000, -0.0007610300000000 ]  - [   0.0003694400000000,  0.0013880400000000,  0.0015796600000000 ]  - [   0.0023762700000000, -0.0003716700000000,  0.0004907600000000 ]  - [   0.0013191800000000, -0.0007965600000000, -0.0002911200000000 ]  - [  -0.0016685300000000,  0.0000625700000000,  0.0000123600000000 ]  - [  -0.0010336400000000,  0.0014903600000000,  0.0002331100000000 ]  - [  -0.0012065000000000, -0.0000735600000000, -0.0000157300000000 ]  - [   0.0003852100000000,  0.0011006300000000, -0.0004183200000000 ]  - [   0.0004316300000000, -0.0011543800000000, -0.0008294400000000 ]  - [  -0.0000701800000000, -0.0000325300000000, -0.0000290600000000 ]  - [  -0.0015041000000000, -0.0000993600000000, -0.0003340700000000 ]  - [   0.0021735700000000,  0.0018855500000000, -0.0002362900000000 ]  - [  -0.0003612200000000, -0.0003595000000000,  0.0009307700000000 ]  - [   0.0001376000000000,  0.0001637100000000, -0.0003896500000000 ]  - [   0.0002671600000000, -0.0009335300000000, -0.0002269500000000 ]  - [  -0.0015750400000000,  0.0002111000000000, -0.0002232800000000 ]  - [   0.0010375400000000, -0.0008965200000000,  0.0005522800000000 ]  - [  -0.0017333600000000, -0.0007857100000000,  0.0002622000000000 ]  - [  -0.0002036300000000,  0.0003755500000000, -0.0019703900000000 ]  - [   0.0001762500000000, -0.0001544100000000, -0.0000767700000000 ]  - [   0.0007424900000000,  0.0003136700000000,  0.0002302700000000 ]  - [   0.0001340100000000,  0.0003037200000000, -0.0000062300000000 ]  - [   0.0002090100000000,  0.0004904000000000,  0.0002797100000000 ]  - [  -0.0000857000000000, -0.0000367200000000,  0.0000551900000000 ]  - [   0.0004171800000000, -0.0001889600000000,  0.0013696200000000 ]  - [  -0.0021353400000000, -0.0000562600000000, -0.0003750600000000 ]  - [  -0.0000447800000000,  0.0002808500000000,  0.0000356800000000 ]  - [   0.0017294100000000,  0.0021136200000000, -0.0010304700000000 ]  - [   0.0007368000000000,  0.0001005400000000,  0.0004567400000000 ]  - [  -0.0000866800000000, -0.0007740800000000,  0.0002016200000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0238136300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042411800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0005618200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002819400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0005624000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0008174500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0121583400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0018578000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016319400000000 ]  - [   0.0036756300000000,  0.0047519900000000, -0.0000911400000000 ]  - [   0.0012219700000000, -0.0003585800000000,  0.0019475300000000 ]  - [  -0.0059531600000000,  0.0008071900000000, -0.0000911400000000 ]  - [   0.0022775300000000, -0.0055591900000000, -0.0000911400000000 ]  - [  -0.0009215200000000, -0.0008789600000000,  0.0019475300000000 ]  - [  -0.0003004500000000,  0.0012375400000000,  0.0019475300000000 ]  - [   0.0044901600000000,  0.0008112800000000, -0.0027837400000000 ]  - [  -0.0009336600000000, -0.0009381800000000, -0.0012370800000000 ]  - [  -0.0029476700000000,  0.0034829500000000, -0.0027837400000000 ]  - [  -0.0015424900000000, -0.0042942300000000, -0.0027837400000000 ]  - [  -0.0003456600000000,  0.0012776600000000, -0.0012370800000000 ]  - [   0.0012793100000000, -0.0003394800000000, -0.0012370800000000 ]  - [   0.0005987400000000, -0.0002165500000000,  0.0012204600000000 ]  - [   0.0020157600000000, -0.0026337800000000,  0.0016498300000000 ]  - [  -0.0001118300000000,  0.0006267900000000,  0.0012204600000000 ]  - [  -0.0004869000000000, -0.0004102500000000,  0.0012204600000000 ]  - [  -0.0032888000000000, -0.0004288100000000,  0.0016498300000000 ]  - [   0.0012730400000000,  0.0030625900000000,  0.0016498300000000 ]  - [  -0.0005091100000000, -0.0004907900000000, -0.0010208100000000 ]  - [   0.0006795900000000, -0.0001955100000000, -0.0010208100000000 ]  - [  -0.0004152800000000, -0.0008147500000000, -0.0007075200000000 ]  - [  -0.0003552300000000, -0.0001234300000000, -0.0006014100000000 ]  - [  -0.0015803800000000, -0.0000719700000000, -0.0016492600000000 ]  - [   0.0002845100000000, -0.0002459200000000, -0.0006014100000000 ]  - [  -0.0001704800000000,  0.0006863000000000, -0.0010208100000000 ]  - [  -0.0009161600000000,  0.0000422500000000,  0.0006801500000000 ]  - [   0.0021462800000000,  0.0006666800000000,  0.0020430300000000 ]  - [   0.0008525100000000, -0.0013326600000000, -0.0016492600000000 ]  - [   0.0009132300000000,  0.0000477300000000, -0.0007075200000000 ]  - [  -0.0016505000000000,  0.0015253900000000,  0.0020430300000000 ]  - [  -0.0004979500000000,  0.0007670200000000, -0.0007075200000000 ]  - [   0.0000707200000000,  0.0003693500000000, -0.0006014100000000 ]  - [   0.0004214900000000, -0.0008145400000000,  0.0006801500000000 ]  - [   0.0007278600000000,  0.0014046300000000, -0.0016492600000000 ]  - [   0.0004946700000000,  0.0007722900000000,  0.0006801500000000 ]  - [  -0.0004957800000000, -0.0021920700000000,  0.0020430300000000 ]  - [  -0.0002335100000000, -0.0001366200000000,  0.0006169000000000 ]  - [   0.0002350700000000, -0.0001339200000000,  0.0006169000000000 ]  - [   0.0000423800000000, -0.0004999800000000,  0.0026944300000000 ]  - [   0.0006883700000000,  0.0002769500000000,  0.0002896000000000 ]  - [   0.0001546600000000, -0.0002332200000000,  0.0003142500000000 ]  - [  -0.0005840400000000,  0.0004576700000000,  0.0002896000000000 ]  - [  -0.0000015600000000,  0.0002705400000000,  0.0006169000000000 ]  - [  -0.0022689400000000, -0.0000772400000000,  0.0004636100000000 ]  - [   0.0012795200000000,  0.0000985900000000,  0.0008552300000000 ]  - [   0.0001246400000000,  0.0002505500000000,  0.0003142500000000 ]  - [   0.0004118000000000,  0.0002866900000000,  0.0026944300000000 ]  - [  -0.0007251500000000,  0.0010588000000000,  0.0008552300000000 ]  - [  -0.0004541800000000,  0.0002132800000000,  0.0026944300000000 ]  - [  -0.0001043400000000, -0.0007346300000000,  0.0002896000000000 ]  - [   0.0012013700000000, -0.0019263400000000,  0.0004636100000000 ]  - [  -0.0002793100000000, -0.0000173300000000,  0.0003142500000000 ]  - [   0.0010675800000000,  0.0020035800000000,  0.0004636100000000 ]  - [  -0.0005543800000000, -0.0011574000000000,  0.0008552300000000 ]  - [  -0.0002848600000000, -0.0001092900000000, -0.0015629300000000 ]  - [   0.0002370800000000, -0.0001920500000000, -0.0015629300000000 ]  - [   0.0000079300000000, -0.0002036500000000, -0.0001316200000000 ]  - [  -0.0002617600000000,  0.0008000300000000,  0.0006537800000000 ]  - [  -0.0014415600000000,  0.0000143000000000, -0.0005566900000000 ]  - [  -0.0005619600000000, -0.0006267000000000,  0.0006537800000000 ]  - [   0.0000477800000000,  0.0003013500000000, -0.0015629300000000 ]  - [   0.0002107600000000, -0.0000661700000000, -0.0002055800000000 ]  - [   0.0000896700000000,  0.0002578400000000, -0.0003426000000000 ]  - [   0.0007083900000000, -0.0012555800000000, -0.0005566900000000 ]  - [   0.0001724000000000,  0.0001087000000000, -0.0001316200000000 ]  - [  -0.0002681300000000, -0.0000512600000000, -0.0003426000000000 ]  - [  -0.0001803300000000,  0.0000949500000000, -0.0001316200000000 ]  - [   0.0008237200000000, -0.0001733200000000,  0.0006537800000000 ]  - [  -0.0000480800000000,  0.0002156100000000, -0.0002055800000000 ]  - [   0.0007331700000000,  0.0012412800000000, -0.0005566900000000 ]  - [  -0.0001626800000000, -0.0001494400000000, -0.0002055800000000 ]  - [   0.0001784600000000, -0.0002065700000000, -0.0003426000000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0250363300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0049075000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001666100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0004473800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001670100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000889300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0123099800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018627700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0016378200000000 ]  - [  -0.0025496400000000, -0.0046511400000000, -0.0004882100000000 ]  - [  -0.0005566300000000, -0.0005714800000000, -0.0013683200000000 ]  - [   0.0053028300000000,  0.0001175200000000, -0.0004882100000000 ]  - [  -0.0027531900000000,  0.0045336200000000, -0.0004882100000000 ]  - [  -0.0002166000000000,  0.0007678000000000, -0.0013683200000000 ]  - [   0.0007732300000000, -0.0001963200000000, -0.0013683200000000 ]  - [  -0.0033558200000000, -0.0006966000000000,  0.0021693700000000 ]  - [   0.0016154000000000,  0.0000071900000000,  0.0018314100000000 ]  - [   0.0022811900000000, -0.0025579300000000,  0.0021693700000000 ]  - [   0.0010746300000000,  0.0032545300000000,  0.0021693700000000 ]  - [  -0.0008014800000000, -0.0014025700000000,  0.0018314100000000 ]  - [  -0.0008139300000000,  0.0013953900000000,  0.0018314100000000 ]  - [   0.0005414900000000,  0.0003420000000000, -0.0018147300000000 ]  - [  -0.0013315700000000,  0.0017084600000000, -0.0010724600000000 ]  - [  -0.0005669300000000,  0.0002979500000000, -0.0018147300000000 ]  - [   0.0000254300000000, -0.0006399500000000, -0.0018147300000000 ]  - [   0.0021453500000000,  0.0002989400000000, -0.0010724600000000 ]  - [  -0.0008137900000000, -0.0020074000000000, -0.0010724600000000 ]  - [   0.0001714000000000, -0.0001219400000000,  0.0000750300000000 ]  - [   0.0000199000000000,  0.0002094100000000,  0.0000750300000000 ]  - [   0.0007737100000000,  0.0002134500000000,  0.0016532900000000 ]  - [   0.0001592000000000,  0.0002268500000000,  0.0003244800000000 ]  - [   0.0006145200000000, -0.0004083900000000,  0.0013293300000000 ]  - [  -0.0002760500000000,  0.0000244500000000,  0.0003244800000000 ]  - [  -0.0001913100000000, -0.0000874700000000,  0.0000750300000000 ]  - [   0.0009116400000000,  0.0001781900000000, -0.0004091400000000 ]  - [  -0.0010935900000000, -0.0002093400000000, -0.0018718900000000 ]  - [   0.0000464100000000,  0.0007363800000000,  0.0013293300000000 ]  - [  -0.0005717100000000,  0.0005633300000000,  0.0016532900000000 ]  - [   0.0007280900000000, -0.0008424100000000, -0.0018718900000000 ]  - [  -0.0002020000000000, -0.0007767800000000,  0.0016532900000000 ]  - [   0.0001168500000000, -0.0002512900000000,  0.0003244800000000 ]  - [  -0.0006101400000000,  0.0007004100000000, -0.0004091400000000 ]  - [  -0.0006609300000000, -0.0003280000000000,  0.0013293300000000 ]  - [  -0.0003015000000000, -0.0008786000000000, -0.0004091400000000 ]  - [   0.0003655000000000,  0.0010517500000000, -0.0018718900000000 ]  - [  -0.0001079000000000, -0.0004768800000000, -0.0015645700000000 ]  - [   0.0004669400000000,  0.0001450000000000, -0.0015645700000000 ]  - [   0.0003218200000000, -0.0001059900000000, -0.0017469800000000 ]  - [  -0.0008902500000000, -0.0001750700000000, -0.0005694900000000 ]  - [  -0.0011361900000000, -0.0002459000000000, -0.0006398700000000 ]  - [   0.0005967400000000, -0.0006834400000000, -0.0005694900000000 ]  - [  -0.0003590400000000,  0.0003318900000000, -0.0015645700000000 ]  - [   0.0022550800000000,  0.0003018800000000, -0.0001714300000000 ]  - [  -0.0003062000000000,  0.0003797800000000, -0.0005304500000000 ]  - [   0.0007810500000000, -0.0008610200000000, -0.0006398700000000 ]  - [  -0.0000691200000000,  0.0003316900000000, -0.0017469800000000 ]  - [  -0.0001758000000000, -0.0004550700000000, -0.0005304500000000 ]  - [  -0.0002526900000000, -0.0002257100000000, -0.0017469800000000 ]  - [   0.0002935000000000,  0.0008585100000000, -0.0005694900000000 ]  - [  -0.0013889700000000,  0.0018020100000000, -0.0001714300000000 ]  - [   0.0003551400000000,  0.0011069200000000, -0.0006398700000000 ]  - [  -0.0008661000000000, -0.0021038900000000, -0.0001714300000000 ]  - [   0.0004820000000000,  0.0000752900000000, -0.0005304500000000 ]  - [  -0.0000590200000000, -0.0005016200000000,  0.0006198300000000 ]  - [   0.0004639200000000,  0.0001997000000000,  0.0006198300000000 ]  - [   0.0003548900000000, -0.0003992800000000,  0.0010869100000000 ]  - [   0.0000768700000000, -0.0006417600000000, -0.0009054500000000 ]  - [   0.0004690000000000, -0.0004965900000000,  0.0002358800000000 ]  - [   0.0005173500000000,  0.0003874500000000, -0.0009054500000000 ]  - [  -0.0004049100000000,  0.0003019200000000,  0.0006198300000000 ]  - [  -0.0002212300000000,  0.0002891100000000,  0.0004849900000000 ]  - [   0.0008888400000000,  0.0002214000000000,  0.0006694500000000 ]  - [   0.0001955600000000,  0.0006544700000000,  0.0002358800000000 ]  - [   0.0001683400000000,  0.0005069800000000,  0.0010869100000000 ]  - [  -0.0006361600000000,  0.0006590600000000,  0.0006694500000000 ]  - [  -0.0005232300000000, -0.0001077000000000,  0.0010869100000000 ]  - [  -0.0005942200000000,  0.0002543100000000, -0.0009054500000000 ]  - [  -0.0001397600000000, -0.0003361400000000,  0.0004849900000000 ]  - [  -0.0006645600000000, -0.0001578700000000,  0.0002358800000000 ]  - [   0.0003609900000000,  0.0000470300000000,  0.0004849900000000 ]  - [  -0.0002526900000000, -0.0008804600000000,  0.0006694500000000 ]- atom:    7  displacement:    [   0.0100000000000000, -0.0000000000345662,  0.0000000000000000 ]  forces:  - [  -0.0049525300000000, -0.0002416200000000,  0.0003524400000000 ]  - [  -0.0049449900000000, -0.0002497100000000, -0.0003523700000000 ]  - [   0.0016908800000000, -0.0002851900000000,  0.0003642700000000 ]  - [   0.0023338200000000, -0.0007250900000000, -0.0003643700000000 ]  - [   0.0023328300000000, -0.0007382100000000,  0.0003642800000000 ]  - [   0.0016898100000000, -0.0002917800000000, -0.0003642600000000 ]  - [  -0.2114922700000000,  0.0000007200000000, -0.0000227600000000 ]  - [   0.0011771400000000,  0.0000128600000000,  0.0000004100000000 ]  - [   0.0011738300000000, -0.0000126300000000, -0.0000011200000000 ]  - [   0.0233762600000000,  0.0376874900000000, -0.0091703500000000 ]  - [   0.0638210100000000, -0.0074743100000000,  0.0137459300000000 ]  - [   0.0636128800000000, -0.0065399400000000,  0.0134436600000000 ]  - [   0.0043113900000000, -0.0206691900000000, -0.0049703300000000 ]  - [   0.0221897800000000,  0.0377876900000000, -0.0086901500000000 ]  - [   0.0046926900000000, -0.0194983500000000, -0.0043558500000000 ]  - [   0.0042021900000000,  0.0002908200000000,  0.0041271700000000 ]  - [  -0.0040597600000000,  0.0074172900000000,  0.0020227000000000 ]  - [  -0.0008362100000000, -0.0014761700000000, -0.0006938600000000 ]  - [  -0.0005510300000000,  0.0021930400000000, -0.0043044300000000 ]  - [  -0.0031213800000000, -0.0100507800000000,  0.0017715900000000 ]  - [   0.0122563600000000,  0.0010806700000000, -0.0029031800000000 ]  - [  -0.0019742600000000, -0.0099187600000000,  0.0012048500000000 ]  - [  -0.0001655800000000, -0.0024072000000000, -0.0000988400000000 ]  - [  -0.0047095400000000,  0.0083606100000000,  0.0014364300000000 ]  - [   0.0117686800000000,  0.0000103200000000, -0.0035421900000000 ]  - [   0.0030591400000000,  0.0001751900000000,  0.0047016200000000 ]  - [  -0.0000901900000000,  0.0032511200000000, -0.0037230200000000 ]  - [  -0.0093655800000000,  0.0029192700000000,  0.0074504800000000 ]  - [   0.0024276700000000,  0.0023234900000000, -0.0024670400000000 ]  - [  -0.0041690600000000, -0.0072855700000000, -0.0054298100000000 ]  - [   0.0016237800000000,  0.0022746400000000,  0.0017304400000000 ]  - [   0.0205627200000000, -0.0124450500000000,  0.0245292300000000 ]  - [  -0.0078240900000000,  0.0008441100000000,  0.0040766800000000 ]  - [  -0.0045237500000000, -0.0067352400000000, -0.0063248200000000 ]  - [  -0.0078642800000000,  0.0010992700000000,  0.0043643400000000 ]  - [   0.0236023400000000, -0.0127233800000000,  0.0269147000000000 ]  - [   0.0081622100000000, -0.0045937500000000, -0.0068400600000000 ]  - [  -0.0090889400000000,  0.0035244400000000,  0.0083407300000000 ]  - [   0.0074168300000000, -0.0042012100000000, -0.0066452700000000 ]  - [   0.0017214500000000,  0.0023416700000000, -0.0015688700000000 ]  - [  -0.0040623000000000,  0.0099651700000000, -0.0062394400000000 ]  - [  -0.0042305700000000,  0.0098270300000000, -0.0059603000000000 ]  - [   0.0224063100000000,  0.0048559900000000, -0.0196549500000000 ]  - [   0.0018402300000000,  0.0021867300000000,  0.0020265200000000 ]  - [   0.0216249100000000,  0.0029132800000000, -0.0182812900000000 ]  - [  -0.0005081300000000, -0.0014452200000000,  0.0002425300000000 ]  - [  -0.0021497600000000,  0.0002620800000000, -0.0004963700000000 ]  - [  -0.0016554900000000, -0.0019057600000000, -0.0057211600000000 ]  - [  -0.0137825400000000, -0.0013877000000000, -0.0030013100000000 ]  - [   0.0003870100000000, -0.0013189900000000, -0.0004500000000000 ]  - [  -0.0019537500000000,  0.0039514700000000,  0.0008670200000000 ]  - [  -0.0003865000000000,  0.0017301000000000, -0.0011621700000000 ]  - [   0.0006788900000000, -0.0003811700000000, -0.0006004500000000 ]  - [  -0.0007081900000000,  0.0008069600000000, -0.0002714100000000 ]  - [  -0.0023784500000000,  0.0011017000000000,  0.0010696200000000 ]  - [  -0.0000789100000000,  0.0011504600000000,  0.0020495100000000 ]  - [   0.0001952200000000, -0.0015259300000000,  0.0002326200000000 ]  - [   0.0007296800000000, -0.0017588400000000,  0.0050839200000000 ]  - [  -0.0029660300000000, -0.0087682600000000,  0.0017026400000000 ]  - [   0.0004071000000000,  0.0007018300000000, -0.0005125300000000 ]  - [   0.0012119800000000,  0.0039104100000000, -0.0011060800000000 ]  - [   0.0017776200000000,  0.0002438000000000,  0.0015321500000000 ]  - [  -0.0023841000000000, -0.0027674400000000,  0.0005246800000000 ]  - [  -0.0004114400000000,  0.0005412800000000,  0.0010890000000000 ]  - [   0.0014350200000000, -0.0017471300000000,  0.0041363900000000 ]  - [  -0.0000292500000000,  0.0011275600000000, -0.0002212800000000 ]  - [   0.0015832300000000,  0.0003453000000000,  0.0012562400000000 ]  - [  -0.0016765600000000,  0.0003292500000000, -0.0005956700000000 ]  - [   0.0006873100000000, -0.0006010000000000, -0.0008784300000000 ]  - [  -0.0020121700000000, -0.0012992500000000, -0.0066466400000000 ]  - [  -0.0019498000000000,  0.0041445600000000,  0.0011367100000000 ]  - [   0.0013512500000000, -0.0008389000000000, -0.0001296100000000 ]  - [   0.0011011400000000, -0.0021294900000000, -0.0000905700000000 ]  - [  -0.0001694000000000, -0.0008367800000000,  0.0011860600000000 ]  - [  -0.0032843500000000,  0.0017262900000000,  0.0014060500000000 ]  - [  -0.0028507400000000,  0.0002501500000000,  0.0004593800000000 ]  - [   0.0005968200000000,  0.0008272200000000, -0.0007963500000000 ]  - [  -0.0031541500000000, -0.0088980200000000,  0.0019886600000000 ]  - [  -0.0023088800000000, -0.0016787300000000,  0.0001988100000000 ]  - [  -0.0135393800000000, -0.0014784000000000, -0.0026936100000000 ]  - [   0.0011448500000000,  0.0028368700000000, -0.0007878700000000 ]- atom:    7  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0126676700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0117999200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020008800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022247200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0014953400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0012691100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2062438400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0028956900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029149000000000 ]  - [  -0.0231878100000000, -0.0331414000000000, -0.0045487600000000 ]  - [   0.0408229700000000, -0.0044607900000000, -0.0039527500000000 ]  - [   0.0402952000000000, -0.0035105300000000, -0.0045487600000000 ]  - [  -0.0171074000000000,  0.0366519300000000, -0.0045487600000000 ]  - [  -0.0242746400000000, -0.0331233400000000, -0.0039527500000000 ]  - [  -0.0165483300000000,  0.0375841200000000, -0.0039527500000000 ]  - [   0.0013735500000000, -0.0006623300000000,  0.0081900700000000 ]  - [   0.0078568900000000, -0.0023541400000000,  0.0004276800000000 ]  - [  -0.0001131800000000,  0.0015206900000000,  0.0081900700000000 ]  - [  -0.0012603700000000, -0.0008583600000000,  0.0081900700000000 ]  - [  -0.0059671900000000, -0.0056272000000000,  0.0004276800000000 ]  - [  -0.0018897000000000,  0.0079813400000000,  0.0004276800000000 ]  - [  -0.0048243600000000, -0.0055165300000000, -0.0001394400000000 ]  - [   0.0005733000000000,  0.0005725900000000,  0.0087695100000000 ]  - [   0.0071896400000000, -0.0014197600000000, -0.0001394400000000 ]  - [  -0.0023652700000000,  0.0069362900000000, -0.0001394400000000 ]  - [   0.0002092300000000, -0.0007827900000000,  0.0087695100000000 ]  - [  -0.0007825300000000,  0.0002102000000000,  0.0087695100000000 ]  - [  -0.0037802800000000,  0.0029297500000000,  0.0127547100000000 ]  - [  -0.0006471000000000, -0.0047386900000000,  0.0127547100000000 ]  - [   0.0047854100000000,  0.0012169700000000,  0.0136542200000000 ]  - [  -0.0026066400000000, -0.0050154100000000, -0.0030939700000000 ]  - [   0.0120778200000000, -0.0107600500000000,  0.0283417300000000 ]  - [   0.0056468000000000,  0.0002502900000000, -0.0030939700000000 ]  - [   0.0044273800000000,  0.0018089400000000,  0.0127547100000000 ]  - [   0.0056045000000000,  0.0004823800000000, -0.0027844800000000 ]  - [   0.0143917400000000, -0.0106895900000000,  0.0295457500000000 ]  - [   0.0032795700000000,  0.0158397200000000,  0.0283417300000000 ]  - [  -0.0034466300000000,  0.0035358000000000,  0.0136542200000000 ]  - [   0.0020615900000000,  0.0178084100000000,  0.0295457500000000 ]  - [  -0.0013387800000000, -0.0047527700000000,  0.0136542200000000 ]  - [  -0.0030401500000000,  0.0047651300000000, -0.0030939700000000 ]  - [  -0.0032200000000000,  0.0046124400000000, -0.0027844800000000 ]  - [  -0.0153573900000000, -0.0050796700000000,  0.0283417300000000 ]  - [  -0.0023844900000000, -0.0050948300000000, -0.0027844800000000 ]  - [  -0.0164533300000000, -0.0071188200000000,  0.0295457500000000 ]  - [  -0.0001367800000000, -0.0000023600000000, -0.0028329700000000 ]  - [   0.0000704400000000, -0.0001172800000000, -0.0028329700000000 ]  - [  -0.0027425500000000, -0.0004145100000000, -0.0054409900000000 ]  - [  -0.0063303800000000, -0.0012919900000000, -0.0012531600000000 ]  - [  -0.0027895400000000, -0.0000606400000000, -0.0001065600000000 ]  - [   0.0042840900000000, -0.0048362800000000, -0.0012531600000000 ]  - [   0.0000663400000000,  0.0001196400000000, -0.0028329700000000 ]  - [   0.0019394700000000, -0.0009204300000000, -0.0029510600000000 ]  - [   0.0005404900000000,  0.0001319700000000, -0.0015826700000000 ]  - [   0.0014472900000000, -0.0023855000000000, -0.0001065600000000 ]  - [   0.0017302500000000, -0.0021678600000000, -0.0054409900000000 ]  - [  -0.0003845300000000,  0.0004020900000000, -0.0015826700000000 ]  - [   0.0010122900000000,  0.0025823700000000, -0.0054409900000000 ]  - [   0.0020462900000000,  0.0061282700000000, -0.0012531600000000 ]  - [  -0.0001726200000000,  0.0021398500000000, -0.0029510600000000 ]  - [   0.0013422600000000,  0.0024461300000000, -0.0001065600000000 ]  - [  -0.0017668500000000, -0.0012194100000000, -0.0029510600000000 ]  - [  -0.0001559500000000, -0.0005340600000000, -0.0015826700000000 ]  - [   0.0013801400000000, -0.0027677900000000, -0.0063852800000000 ]  - [   0.0017069100000000,  0.0025791300000000, -0.0063852800000000 ]  - [   0.0004244500000000, -0.0004801500000000, -0.0018969500000000 ]  - [  -0.0019680500000000, -0.0011289000000000, -0.0032343600000000 ]  - [  -0.0004448700000000, -0.0003449300000000, -0.0019092600000000 ]  - [   0.0019616800000000, -0.0011399300000000, -0.0032343600000000 ]  - [  -0.0030870500000000,  0.0001886600000000, -0.0063852800000000 ]  - [   0.0042793900000000, -0.0046211500000000, -0.0009781400000000 ]  - [  -0.0018204800000000,  0.0004180500000000,  0.0002123700000000 ]  - [   0.0005211500000000, -0.0002128100000000, -0.0019092600000000 ]  - [   0.0002036000000000,  0.0006076600000000, -0.0018969500000000 ]  - [   0.0005482000000000, -0.0017856100000000,  0.0002123700000000 ]  - [  -0.0006280500000000, -0.0001275100000000, -0.0018969500000000 ]  - [   0.0000063700000000,  0.0022688300000000, -0.0032343600000000 ]  - [   0.0018623400000000,  0.0060166400000000, -0.0009781400000000 ]  - [  -0.0000762800000000,  0.0005577400000000, -0.0019092600000000 ]  - [  -0.0061417300000000, -0.0013954900000000, -0.0009781400000000 ]  - [   0.0012722800000000,  0.0013675600000000,  0.0002123700000000 ]- atom:   10  displacement:    [   0.0100000000000000, -0.0000000000345662,  0.0000000000000000 ]  forces:  - [   0.0010203700000000,  0.0032566100000000,  0.0034727200000000 ]  - [  -0.0003283700000000,  0.0007959300000000, -0.0007149300000000 ]  - [  -0.0003432900000000, -0.0005195500000000,  0.0003949500000000 ]  - [  -0.0006155600000000, -0.0018485800000000, -0.0001386800000000 ]  - [   0.0081999900000000,  0.0015111700000000,  0.0042586700000000 ]  - [   0.0043488400000000,  0.0006421600000000, -0.0030672600000000 ]  - [   0.0226799100000000,  0.0306335300000000, -0.0236519900000000 ]  - [  -0.0025450700000000, -0.0089820000000000, -0.0054021900000000 ]  - [   0.0036439900000000, -0.0004438300000000,  0.0007971600000000 ]  - [  -0.3335184200000000,  0.0107861400000000,  0.0181617400000000 ]  - [  -0.0054513600000000, -0.0043473200000000,  0.0026917500000000 ]  - [   0.0107716200000000,  0.0009878700000000,  0.0006258900000000 ]  - [  -0.0009065300000000,  0.0057383200000000,  0.0015626800000000 ]  - [   0.0038651400000000,  0.0059041400000000,  0.0026888400000000 ]  - [   0.0061334500000000, -0.0023376200000000, -0.0138495200000000 ]  - [   0.0024037800000000,  0.0014506000000000, -0.0012213800000000 ]  - [  -0.0033777800000000,  0.0120870100000000, -0.0096308900000000 ]  - [   0.0003668400000000, -0.0000843000000000, -0.0005328200000000 ]  - [  -0.0125222900000000, -0.0074226700000000,  0.0169701800000000 ]  - [   0.0077095700000000, -0.0030903100000000,  0.0044851700000000 ]  - [   0.0166167300000000, -0.0236355000000000, -0.0031928200000000 ]  - [   0.0023976100000000,  0.0003782900000000, -0.0014860000000000 ]  - [   0.0051604200000000, -0.0013107200000000, -0.0006262400000000 ]  - [  -0.0072738400000000,  0.0104698600000000,  0.0132222000000000 ]  - [   0.0014177600000000, -0.0005210000000000, -0.0005626300000000 ]  - [  -0.0019575000000000, -0.0014215600000000, -0.0017702300000000 ]  - [   0.0020853900000000,  0.0030778000000000, -0.0023599900000000 ]  - [   0.0017948100000000,  0.0000609300000000, -0.0031761700000000 ]  - [  -0.0073134100000000,  0.0021192200000000,  0.0062330300000000 ]  - [   0.0778467000000000, -0.0242229800000000,  0.0790242400000000 ]  - [   0.0048206600000000,  0.0023301300000000,  0.0032845300000000 ]  - [   0.0060012700000000, -0.0021570900000000,  0.0047449100000000 ]  - [  -0.0006129000000000, -0.0008612500000000, -0.0002777400000000 ]  - [  -0.0007211000000000, -0.0019388600000000, -0.0036283500000000 ]  - [   0.1568542800000000, -0.0656824500000000, -0.0968107800000000 ]  - [  -0.0096447700000000, -0.0012714900000000, -0.0021975700000000 ]  - [  -0.0025429700000000,  0.0004006700000000,  0.0050064400000000 ]  - [  -0.0018811000000000,  0.0004569800000000,  0.0010884800000000 ]  - [   0.0009781800000000, -0.0099606400000000, -0.0023619200000000 ]  - [  -0.0009480000000000, -0.0014326200000000,  0.0008109800000000 ]  - [   0.0008856300000000,  0.0011939600000000, -0.0005585700000000 ]  - [  -0.0023493500000000, -0.0004821600000000, -0.0001068700000000 ]  - [  -0.0052546400000000, -0.0069277600000000,  0.0040845000000000 ]  - [  -0.0037358500000000, -0.0025823300000000, -0.0016481900000000 ]  - [   0.0535101000000000,  0.0645491100000000,  0.0082764600000000 ]  - [   0.0001200800000000, -0.0004811500000000,  0.0056574700000000 ]  - [  -0.0011483800000000,  0.0002497200000000,  0.0021561400000000 ]  - [  -0.0000384100000000, -0.0017728000000000,  0.0008900700000000 ]  - [  -0.0066902700000000,  0.0019577400000000, -0.0004490400000000 ]  - [   0.0060826300000000,  0.0001310100000000,  0.0016411300000000 ]  - [  -0.0024919500000000,  0.0008048500000000, -0.0001734300000000 ]  - [  -0.0019512300000000,  0.0012682700000000, -0.0014512000000000 ]  - [  -0.0002793700000000, -0.0005313000000000,  0.0001401200000000 ]  - [   0.0009232500000000,  0.0008034000000000,  0.0005694300000000 ]  - [  -0.0056708900000000,  0.0087137400000000,  0.0025990800000000 ]  - [   0.0010001200000000,  0.0005251300000000,  0.0005943000000000 ]  - [  -0.0015030000000000,  0.0079770600000000,  0.0001716500000000 ]  - [   0.0104943900000000,  0.0057339400000000, -0.0142009100000000 ]  - [   0.0134037700000000, -0.0063130100000000,  0.0073687400000000 ]  - [   0.0002509000000000,  0.0002018400000000,  0.0000775900000000 ]  - [   0.0004704700000000,  0.0033656300000000, -0.0015857100000000 ]  - [  -0.0016705300000000, -0.0008990300000000, -0.0046011000000000 ]  - [  -0.0000373700000000, -0.0004791300000000,  0.0004960900000000 ]  - [  -0.0014577700000000, -0.0004058100000000,  0.0019191200000000 ]  - [  -0.0006523500000000, -0.0006909700000000,  0.0006990100000000 ]  - [  -0.0000291700000000, -0.0000375900000000,  0.0009710900000000 ]  - [  -0.0011097800000000, -0.0007964200000000, -0.0002266000000000 ]  - [  -0.0039195800000000, -0.0000169400000000, -0.0005806700000000 ]  - [   0.0027020100000000, -0.0009556200000000,  0.0009621400000000 ]  - [   0.0002040300000000,  0.0006697000000000, -0.0003286400000000 ]  - [  -0.0020956400000000,  0.0022745700000000,  0.0014574500000000 ]  - [   0.0001137900000000,  0.0003973600000000, -0.0016051800000000 ]  - [   0.0000806600000000, -0.0005962600000000,  0.0004924200000000 ]  - [   0.0008587700000000, -0.0028243700000000, -0.0069269100000000 ]  - [  -0.0013535400000000,  0.0009677200000000, -0.0001539700000000 ]  - [  -0.0005775600000000,  0.0000753000000000,  0.0006314500000000 ]  - [  -0.0012416200000000, -0.0010300000000000,  0.0001937900000000 ]  - [   0.0010805200000000, -0.0029294300000000, -0.0012713200000000 ]  - [   0.0000105200000000,  0.0009454100000000,  0.0006519700000000 ]  - [  -0.0000459800000000,  0.0001322100000000,  0.0000116000000000 ]  - [  -0.0015004600000000, -0.0017806200000000,  0.0002910700000000 ]- atom:   10  displacement:    [  -0.0100000000000000,  0.0000000000345662,  0.0000000000000000 ]  forces:  - [  -0.0010317200000000, -0.0032390400000000, -0.0027532600000000 ]  - [   0.0003241000000000, -0.0007901200000000, -0.0000092200000000 ]  - [   0.0003411800000000,  0.0005153100000000,  0.0003369300000000 ]  - [   0.0006107900000000,  0.0018351200000000, -0.0005938600000000 ]  - [  -0.0082962900000000, -0.0015366800000000, -0.0035890400000000 ]  - [  -0.0043710000000000, -0.0006428200000000,  0.0023675600000000 ]  - [  -0.0228913700000000, -0.0306475400000000,  0.0238114500000000 ]  - [   0.0025499900000000,  0.0089197800000000,  0.0053898600000000 ]  - [  -0.0036127900000000,  0.0004417100000000, -0.0007840100000000 ]  - [   0.3408719300000000, -0.0174529600000000, -0.0222422600000000 ]  - [   0.0061855400000000,  0.0033646800000000, -0.0020784900000000 ]  - [  -0.0114627400000000, -0.0000287300000000, -0.0012138700000000 ]  - [   0.0004718800000000, -0.0068779800000000, -0.0021497600000000 ]  - [  -0.0050269700000000, -0.0060315100000000, -0.0021120900000000 ]  - [  -0.0056308200000000,  0.0034610300000000,  0.0142365800000000 ]  - [  -0.0012494200000000, -0.0013270600000000,  0.0006347100000000 ]  - [   0.0040243900000000, -0.0131605900000000,  0.0102640000000000 ]  - [  -0.0010335700000000,  0.0009991400000000, -0.0000559200000000 ]  - [   0.0119649900000000,  0.0063165800000000, -0.0174050400000000 ]  - [  -0.0087888700000000,  0.0029551900000000, -0.0038516900000000 ]  - [  -0.0159571100000000,  0.0246909400000000,  0.0038470500000000 ]  - [  -0.0012552800000000, -0.0002885100000000,  0.0008901900000000 ]  - [  -0.0044658400000000,  0.0003810500000000,  0.0012122200000000 ]  - [   0.0065813600000000, -0.0094083600000000, -0.0136414300000000 ]  - [  -0.0018815800000000, -0.0005085200000000, -0.0000230600000000 ]  - [   0.0008180000000000,  0.0013085800000000,  0.0023761100000000 ]  - [  -0.0016219800000000, -0.0020314900000000,  0.0029620200000000 ]  - [  -0.0021485900000000, -0.0006628400000000,  0.0022313400000000 ]  - [   0.0079963700000000, -0.0021066700000000, -0.0070797000000000 ]  - [  -0.0779944500000000,  0.0241166900000000, -0.0804525000000000 ]  - [  -0.0049785100000000, -0.0022200400000000, -0.0035346300000000 ]  - [  -0.0069956500000000,  0.0016993500000000, -0.0051032300000000 ]  - [   0.0006394200000000,  0.0006323700000000, -0.0000090300000000 ]  - [   0.0003678700000000,  0.0025457100000000,  0.0026999600000000 ]  - [  -0.1630177400000000,  0.0697276200000000,  0.1029141100000000 ]  - [   0.0106551700000000,  0.0017188500000000,  0.0025512200000000 ]  - [   0.0034892200000000, -0.0011024600000000, -0.0053481800000000 ]  - [   0.0022250000000000,  0.0001395600000000, -0.0001482300000000 ]  - [  -0.0019009000000000,  0.0106658500000000,  0.0027095900000000 ]  - [   0.0002451900000000,  0.0014430500000000,  0.0001225300000000 ]  - [  -0.0006963600000000, -0.0010425300000000,  0.0002663700000000 ]  - [   0.0021616300000000,  0.0003409300000000,  0.0003929200000000 ]  - [   0.0053726100000000,  0.0080606500000000, -0.0044430700000000 ]  - [   0.0039272800000000,  0.0024983000000000,  0.0019391500000000 ]  - [  -0.0527889800000000, -0.0629695800000000, -0.0081044400000000 ]  - [  -0.0004667600000000, -0.0001035500000000, -0.0066083000000000 ]  - [   0.0018124700000000, -0.0002329800000000, -0.0030748400000000 ]  - [   0.0003990200000000,  0.0011681900000000,  0.0000548700000000 ]  - [   0.0064731200000000, -0.0019246300000000,  0.0001344800000000 ]  - [  -0.0070733900000000, -0.0005855800000000, -0.0019798100000000 ]  - [   0.0024882700000000, -0.0010061300000000, -0.0001079300000000 ]  - [   0.0015849200000000, -0.0006582700000000,  0.0004927100000000 ]  - [   0.0002651300000000,  0.0007542700000000,  0.0001397000000000 ]  - [   0.0000439800000000, -0.0003180600000000, -0.0002480300000000 ]  - [   0.0065042000000000, -0.0092459300000000, -0.0029064400000000 ]  - [  -0.0006585600000000,  0.0000947100000000,  0.0003591400000000 ]  - [   0.0005938400000000, -0.0073403900000000,  0.0001472800000000 ]  - [  -0.0110373800000000, -0.0056927200000000,  0.0150440000000000 ]  - [  -0.0134866400000000,  0.0062498600000000, -0.0076890200000000 ]  - [  -0.0004379800000000, -0.0003169600000000,  0.0001981500000000 ]  - [  -0.0003936700000000, -0.0022580200000000,  0.0012496400000000 ]  - [   0.0018637300000000,  0.0007971600000000,  0.0048611400000000 ]  - [  -0.0000353000000000, -0.0005999200000000, -0.0001731600000000 ]  - [   0.0011110200000000, -0.0002128300000000, -0.0028522300000000 ]  - [   0.0013554600000000,  0.0007064000000000, -0.0016574500000000 ]  - [   0.0003921900000000, -0.0005593000000000, -0.0000153000000000 ]  - [   0.0009127100000000,  0.0009005500000000, -0.0000523300000000 ]  - [   0.0029286700000000, -0.0004615200000000,  0.0002472600000000 ]  - [  -0.0026757900000000,  0.0007173600000000, -0.0012486800000000 ]  - [  -0.0005722500000000, -0.0000646500000000, -0.0006409000000000 ]  - [   0.0020697600000000, -0.0020353000000000, -0.0011669600000000 ]  - [   0.0008262600000000,  0.0000755100000000,  0.0019069000000000 ]  - [   0.0008231300000000, -0.0000116100000000, -0.0008215500000000 ]  - [  -0.0005198700000000,  0.0033953400000000,  0.0077835700000000 ]  - [   0.0004479800000000, -0.0003650800000000,  0.0004830100000000 ]  - [  -0.0001260600000000, -0.0000888600000000,  0.0003178800000000 ]  - [   0.0014231300000000,  0.0011382700000000, -0.0004666800000000 ]  - [  -0.0012669500000000,  0.0027849200000000,  0.0015375100000000 ]  - [   0.0000582000000000,  0.0001330600000000, -0.0009797200000000 ]  - [   0.0002241900000000, -0.0002397700000000,  0.0002619100000000 ]  - [   0.0014238200000000,  0.0007044200000000,  0.0000403400000000 ]- atom:   10  displacement:    [  -0.0049999999753248,  0.0086602540520906,  0.0000000000000000 ]  forces:  - [   0.0021711800000000,  0.0007092100000000,  0.0028773500000000 ]  - [   0.0005040500000000, -0.0003187000000000, -0.0008997500000000 ]  - [  -0.0001712300000000,  0.0004916400000000,  0.0001079500000000 ]  - [  -0.0015626800000000,  0.0028007800000000,  0.0006771000000000 ]  - [  -0.0023525500000000, -0.0030120300000000, -0.0009497500000000 ]  - [  -0.0015745200000000, -0.0020058000000000,  0.0006815100000000 ]  - [   0.0212776900000000,  0.0174503200000000, -0.0168065600000000 ]  - [  -0.0073672200000000,  0.0096173700000000, -0.0021033100000000 ]  - [  -0.0015978700000000, -0.0013040300000000, -0.0010116400000000 ]  - [   0.1835650100000000, -0.2691782200000000, -0.0244628200000000 ]  - [  -0.0056960600000000,  0.0028193000000000, -0.0073561900000000 ]  - [  -0.0003568600000000, -0.0003227600000000,  0.0008288000000000 ]  - [   0.0004537400000000,  0.0059976600000000,  0.0024116500000000 ]  - [   0.0023658600000000,  0.0043108000000000,  0.0038371300000000 ]  - [   0.0003849500000000, -0.0067492500000000,  0.0088035000000000 ]  - [  -0.0000558900000000,  0.0009394200000000, -0.0005636900000000 ]  - [   0.0023861000000000,  0.0194634700000000, -0.0151682100000000 ]  - [  -0.0012903400000000,  0.0018156000000000,  0.0002540700000000 ]  - [   0.0081409800000000,  0.0005520200000000, -0.0149994900000000 ]  - [  -0.0072993200000000, -0.0026075100000000, -0.0015996100000000 ]  - [  -0.0181715900000000,  0.0216524000000000,  0.0088559200000000 ]  - [   0.0008649900000000,  0.0014723600000000, -0.0001498900000000 ]  - [  -0.0033819500000000, -0.0004724700000000,  0.0001885200000000 ]  - [   0.0034916400000000, -0.0113823400000000, -0.0069496400000000 ]  - [  -0.0009267000000000, -0.0002649200000000, -0.0018861600000000 ]  - [  -0.0010571100000000,  0.0010634700000000,  0.0017090000000000 ]  - [   0.0021005400000000,  0.0013848100000000, -0.0027820000000000 ]  - [   0.0006706000000000, -0.0022909900000000,  0.0016883200000000 ]  - [   0.0069163600000000,  0.0025453300000000, -0.0067711600000000 ]  - [  -0.0556704800000000,  0.0487823600000000, -0.0652667400000000 ]  - [  -0.0022440100000000, -0.0000339000000000, -0.0015970600000000 ]  - [   0.0017369200000000, -0.0027697200000000,  0.0037157100000000 ]  - [  -0.0000850600000000, -0.0010419500000000, -0.0005158300000000 ]  - [  -0.0009032200000000, -0.0019016800000000, -0.0038980400000000 ]  - [  -0.1411153400000000,  0.0942039000000000,  0.0932446000000000 ]  - [  -0.0056894900000000,  0.0006310800000000, -0.0017999500000000 ]  - [  -0.0040347800000000,  0.0060247200000000,  0.0032238300000000 ]  - [   0.0001457500000000,  0.0008505700000000,  0.0014832900000000 ]  - [   0.0008277400000000, -0.0049415300000000, -0.0018559300000000 ]  - [  -0.0005312500000000, -0.0004552600000000, -0.0002367500000000 ]  - [   0.0003495900000000, -0.0017702300000000,  0.0011858900000000 ]  - [   0.0009776500000000,  0.0020185300000000, -0.0008396800000000 ]  - [  -0.0048587500000000, -0.0049956700000000,  0.0032406400000000 ]  - [  -0.0056830400000000, -0.0024349900000000, -0.0009669600000000 ]  - [   0.0192609600000000,  0.1018907900000000,  0.0035370600000000 ]  - [  -0.0018850400000000,  0.0008495400000000,  0.0060170300000000 ]  - [   0.0019834400000000,  0.0002523400000000, -0.0025598000000000 ]  - [   0.0003924200000000, -0.0019448500000000,  0.0003252300000000 ]  - [   0.0033192500000000, -0.0015593100000000, -0.0010576700000000 ]  - [   0.0045654200000000, -0.0058283700000000,  0.0041329800000000 ]  - [   0.0015720900000000, -0.0006699100000000, -0.0004126900000000 ]  - [   0.0010169900000000,  0.0002122400000000,  0.0003352400000000 ]  - [  -0.0000488700000000, -0.0002319100000000,  0.0001147300000000 ]  - [   0.0027159500000000, -0.0007382200000000,  0.0010471400000000 ]  - [   0.0061152400000000, -0.0090844100000000, -0.0031894900000000 ]  - [  -0.0003277700000000, -0.0014604100000000, -0.0002955700000000 ]  - [   0.0003428100000000, -0.0025797800000000,  0.0009065900000000 ]  - [  -0.0053140500000000,  0.0012947900000000,  0.0134920400000000 ]  - [  -0.0057668300000000, -0.0151686600000000,  0.0096762400000000 ]  - [  -0.0001751800000000, -0.0008871800000000,  0.0004306700000000 ]  - [   0.0022239200000000,  0.0007115700000000,  0.0002452600000000 ]  - [   0.0022979400000000,  0.0011657800000000,  0.0047534200000000 ]  - [  -0.0001936500000000, -0.0021889000000000,  0.0008922900000000 ]  - [   0.0005424300000000,  0.0002538700000000, -0.0012909500000000 ]  - [  -0.0004331300000000, -0.0003165800000000,  0.0003114000000000 ]  - [   0.0003247000000000, -0.0006523800000000,  0.0003546500000000 ]  - [  -0.0007415800000000, -0.0004291500000000,  0.0001105900000000 ]  - [   0.0014027200000000, -0.0001234600000000,  0.0002094400000000 ]  - [  -0.0015760900000000,  0.0011541200000000, -0.0016951400000000 ]  - [  -0.0000048300000000,  0.0003999200000000, -0.0000834300000000 ]  - [   0.0006669700000000, -0.0004454500000000, -0.0004179900000000 ]  - [   0.0006929000000000,  0.0010190200000000,  0.0013550600000000 ]  - [  -0.0000938700000000,  0.0006372200000000,  0.0004730900000000 ]  - [   0.0001130400000000,  0.0034402400000000,  0.0052792300000000 ]  - [  -0.0002075700000000,  0.0005493800000000,  0.0006761000000000 ]  - [  -0.0002476100000000, -0.0003108100000000,  0.0012854100000000 ]  - [   0.0006107800000000,  0.0006855000000000, -0.0004889400000000 ]  - [  -0.0014550000000000,  0.0021883400000000, -0.0022950800000000 ]  - [   0.0007323100000000,  0.0011944400000000, -0.0008970000000000 ]  - [   0.0016145400000000, -0.0002019900000000,  0.0008604600000000 ]  - [   0.0003102200000000, -0.0004205500000000,  0.0002844400000000 ]- atom:   10  displacement:    [   0.0049999999753248, -0.0086602540520906,  0.0000000000000000 ]  forces:  - [  -0.0021663100000000, -0.0007134400000000, -0.0021534900000000 ]  - [  -0.0005043800000000,  0.0003188800000000,  0.0001730700000000 ]  - [   0.0001670400000000, -0.0004898400000000,  0.0006208800000000 ]  - [   0.0015639400000000, -0.0028111100000000, -0.0014164500000000 ]  - [   0.0023582000000000,  0.0030000900000000,  0.0016681900000000 ]  - [   0.0015744100000000,  0.0020034400000000, -0.0014054600000000 ]  - [  -0.0212988500000000, -0.0175280100000000,  0.0168525200000000 ]  - [   0.0073766500000000, -0.0096100500000000,  0.0021498900000000 ]  - [   0.0016268200000000,  0.0012971200000000,  0.0010283200000000 ]  - [  -0.1780628600000000,  0.2649211600000000,  0.0202684500000000 ]  - [   0.0063935300000000, -0.0037846600000000,  0.0078566600000000 ]  - [  -0.0003719200000000,  0.0012611900000000, -0.0014209100000000 ]  - [  -0.0009096500000000, -0.0070689800000000, -0.0030105300000000 ]  - [  -0.0035247000000000, -0.0044350700000000, -0.0032601400000000 ]  - [   0.0000593300000000,  0.0078695400000000, -0.0083176500000000 ]  - [   0.0011939200000000, -0.0008267500000000, -0.0000197500000000 ]  - [  -0.0018094300000000, -0.0205701000000000,  0.0158164900000000 ]  - [   0.0006245700000000, -0.0008875400000000, -0.0008228400000000 ]  - [  -0.0086541200000000, -0.0016298300000000,  0.0144259500000000 ]  - [   0.0061848300000000,  0.0025064700000000,  0.0022156400000000 ]  - [   0.0185981400000000, -0.0205481200000000, -0.0081576800000000 ]  - [   0.0002857300000000, -0.0013495200000000, -0.0004464200000000 ]  - [   0.0040592500000000, -0.0004569300000000,  0.0003938900000000 ]  - [  -0.0042002700000000,  0.0124528500000000,  0.0064937700000000 ]  - [   0.0004575000000000, -0.0007887000000000,  0.0012939400000000 ]  - [  -0.0000810500000000, -0.0011922100000000, -0.0011012200000000 ]  - [  -0.0016332300000000, -0.0003241200000000,  0.0033771200000000 ]  - [  -0.0010090300000000,  0.0016706500000000, -0.0025857700000000 ]  - [  -0.0062259400000000, -0.0025845700000000,  0.0058902300000000 ]  - [   0.0555558000000000, -0.0495505000000000,  0.0647982500000000 ]  - [   0.0020788700000000,  0.0001374800000000,  0.0013335400000000 ]  - [  -0.0027536400000000,  0.0023070200000000, -0.0040528000000000 ]  - [   0.0001125500000000,  0.0008155700000000,  0.0002295300000000 ]  - [   0.0005535500000000,  0.0025042800000000,  0.0029656700000000 ]  - [   0.1352688600000000, -0.0918890100000000, -0.0880169400000000 ]  - [   0.0067063400000000, -0.0001607800000000,  0.0021433800000000 ]  - [   0.0049788700000000, -0.0066727100000000, -0.0035614400000000 ]  - [   0.0002013600000000, -0.0002417900000000, -0.0005422400000000 ]  - [  -0.0017580100000000,  0.0055877800000000,  0.0021979500000000 ]  - [  -0.0001740200000000,  0.0004479200000000,  0.0011836600000000 ]  - [  -0.0001648700000000,  0.0018960600000000, -0.0014588200000000 ]  - [  -0.0011607200000000, -0.0021452900000000,  0.0011215300000000 ]  - [   0.0049678200000000,  0.0061257400000000, -0.0035884700000000 ]  - [   0.0058934900000000,  0.0023474200000000,  0.0012500000000000 ]  - [  -0.0173663800000000, -0.1003423500000000, -0.0033270900000000 ]  - [   0.0015450600000000, -0.0014473000000000, -0.0069639700000000 ]  - [  -0.0012884300000000, -0.0002244000000000,  0.0016141900000000 ]  - [  -0.0000275300000000,  0.0013414200000000,  0.0006208500000000 ]  - [  -0.0034950400000000,  0.0016383900000000,  0.0007572400000000 ]  - [  -0.0055057500000000,  0.0053917200000000, -0.0044893200000000 ]  - [  -0.0015687900000000,  0.0004481900000000,  0.0001327000000000 ]  - [  -0.0013823100000000,  0.0003899400000000, -0.0012911600000000 ]  - [   0.0000374100000000,  0.0004535000000000,  0.0001642100000000 ]  - [  -0.0017455500000000,  0.0012163600000000, -0.0007298900000000 ]  - [  -0.0052300700000000,  0.0084950100000000,  0.0028543700000000 ]  - [   0.0006654500000000,  0.0020641700000000,  0.0012312300000000 ]  - [  -0.0012409700000000,  0.0031558500000000, -0.0005897600000000 ]  - [   0.0047019500000000, -0.0013295400000000, -0.0125609800000000 ]  - [   0.0059716200000000,  0.0152314000000000, -0.0099573900000000 ]  - [  -0.0000128900000000,  0.0007744700000000, -0.0001568100000000 ]  - [  -0.0021615400000000,  0.0003716700000000, -0.0005779000000000 ]  - [  -0.0020882000000000, -0.0012541100000000, -0.0044716900000000 ]  - [   0.0001246600000000,  0.0011103600000000, -0.0005754700000000 ]  - [  -0.0008854300000000, -0.0008688600000000,  0.0003545500000000 ]  - [   0.0011341400000000,  0.0003286800000000, -0.0012645800000000 ]  - [   0.0000373200000000,  0.0000481700000000,  0.0005965500000000 ]  - [   0.0005381300000000,  0.0005303800000000, -0.0003908000000000 ]  - [  -0.0023877800000000, -0.0003542500000000, -0.0005381300000000 ]  - [   0.0015901500000000, -0.0013730900000000,  0.0014089400000000 ]  - [  -0.0003626000000000,  0.0002121700000000, -0.0008689900000000 ]  - [  -0.0006825800000000,  0.0006676400000000,  0.0007005500000000 ]  - [   0.0002533900000000, -0.0005516300000000, -0.0010679800000000 ]  - [   0.0009992900000000, -0.0012510400000000, -0.0008011000000000 ]  - [   0.0002212800000000, -0.0028680800000000, -0.0043797500000000 ]  - [  -0.0007027700000000,  0.0000682000000000, -0.0003490700000000 ]  - [  -0.0004542600000000,  0.0002995400000000, -0.0003346900000000 ]  - [  -0.0004235100000000, -0.0005686400000000,  0.0002145700000000 ]  - [   0.0012791100000000, -0.0023445000000000,  0.0025936400000000 ]  - [  -0.0006581200000000, -0.0001022600000000,  0.0005678800000000 ]  - [  -0.0014140900000000,  0.0001018700000000, -0.0005778800000000 ]  - [  -0.0003926800000000, -0.0006700500000000,  0.0000434800000000 ]- atom:   10  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0020123400000000,  0.0032788900000000,  0.0005564300000000 ]  - [  -0.0001473900000000,  0.0001621200000000,  0.0012967200000000 ]  - [  -0.0003434500000000,  0.0002679500000000,  0.0018853200000000 ]  - [  -0.0004929200000000,  0.0012710700000000, -0.0018960400000000 ]  - [   0.0047947600000000,  0.0006391700000000, -0.0021072100000000 ]  - [  -0.0029531300000000, -0.0010000900000000,  0.0009930900000000 ]  - [  -0.0089874000000000, -0.0105742700000000, -0.0041596700000000 ]  - [   0.0014967800000000, -0.0029145100000000,  0.0001076100000000 ]  - [   0.0044093600000000, -0.0020908500000000,  0.0084920900000000 ]  - [   0.0261417600000000, -0.0159639100000000, -0.3703407900000000 ]  - [   0.0058155900000000, -0.0135448700000000,  0.0039352800000000 ]  - [  -0.0049017800000000, -0.0000178600000000, -0.0038123800000000 ]  - [   0.0009031900000000, -0.0022573300000000, -0.0038098800000000 ]  - [   0.0018171600000000,  0.0054061900000000, -0.0012483600000000 ]  - [  -0.0073510700000000,  0.0021540200000000,  0.0039213200000000 ]  - [  -0.0006133400000000, -0.0004534700000000,  0.0017045500000000 ]  - [  -0.0046620300000000, -0.0074233200000000, -0.0020306800000000 ]  - [   0.0015263300000000,  0.0012269300000000,  0.0017067100000000 ]  - [  -0.0069811600000000, -0.0122344000000000,  0.0394070400000000 ]  - [   0.0036222900000000,  0.0001467200000000, -0.0064187100000000 ]  - [  -0.0151954300000000,  0.0208940100000000, -0.0020188400000000 ]  - [  -0.0003605700000000, -0.0008022600000000,  0.0017159300000000 ]  - [   0.0061059600000000, -0.0002217400000000,  0.0044167500000000 ]  - [  -0.0028316500000000,  0.0189662900000000,  0.0391488800000000 ]  - [   0.0003080500000000, -0.0005576500000000,  0.0017209800000000 ]  - [  -0.0026714300000000,  0.0003805000000000,  0.0099731900000000 ]  - [   0.0001282500000000,  0.0016420900000000,  0.0044137400000000 ]  - [  -0.0012344700000000,  0.0010029400000000,  0.0038195000000000 ]  - [   0.0042696100000000, -0.0012485100000000,  0.0028816400000000 ]  - [   0.0901736700000000, -0.0417852000000000,  0.1899581000000000 ]  - [   0.0029827300000000, -0.0001992600000000, -0.0008702100000000 ]  - [  -0.0003865600000000,  0.0030304000000000, -0.0002316500000000 ]  - [  -0.0003003800000000, -0.0013341500000000, -0.0001898100000000 ]  - [   0.0000592400000000,  0.0002730900000000,  0.0019659300000000 ]  - [  -0.1045347600000000,  0.0505034300000000,  0.1081992800000000 ]  - [   0.0040377300000000,  0.0003412200000000,  0.0024005100000000 ]  - [   0.0050028500000000,  0.0014098900000000, -0.0007838300000000 ]  - [   0.0005871300000000,  0.0014173700000000,  0.0021729900000000 ]  - [  -0.0011559900000000,  0.0029432100000000,  0.0018587500000000 ]  - [  -0.0010254600000000, -0.0002764900000000,  0.0019402000000000 ]  - [   0.0006447100000000,  0.0031571400000000, -0.0009754200000000 ]  - [   0.0000740600000000, -0.0011308500000000,  0.0012364500000000 ]  - [  -0.0004694300000000, -0.0010971400000000,  0.0006979100000000 ]  - [   0.0013261600000000,  0.0006718000000000,  0.0012550900000000 ]  - [  -0.0014159900000000, -0.0037913200000000,  0.0279485800000000 ]  - [   0.0015090000000000,  0.0030659700000000, -0.0001820200000000 ]  - [   0.0013871000000000,  0.0000754300000000, -0.0025225500000000 ]  - [   0.0001871400000000, -0.0000440000000000,  0.0005503100000000 ]  - [   0.0058083300000000, -0.0009059500000000,  0.0034766500000000 ]  - [   0.0016492600000000,  0.0015076100000000,  0.0010649500000000 ]  - [  -0.0014213900000000,  0.0009101700000000,  0.0016965900000000 ]  - [  -0.0000895400000000, -0.0000288700000000,  0.0003210000000000 ]  - [   0.0007020200000000, -0.0005812800000000, -0.0006572500000000 ]  - [  -0.0016715800000000,  0.0005494800000000, -0.0010536900000000 ]  - [   0.0054956100000000, -0.0057719400000000, -0.0010480400000000 ]  - [  -0.0007225000000000, -0.0009547200000000,  0.0002687700000000 ]  - [  -0.0022432100000000,  0.0083461500000000, -0.0019894100000000 ]  - [   0.0030617200000000,  0.0089048900000000, -0.0105945500000000 ]  - [   0.0013632500000000,  0.0013108900000000,  0.0059690200000000 ]  - [  -0.0003401500000000, -0.0003312900000000, -0.0005431200000000 ]  - [  -0.0019234500000000, -0.0003260800000000,  0.0016316300000000 ]  - [  -0.0046288100000000, -0.0018833700000000, -0.0068340500000000 ]  - [   0.0011763400000000,  0.0009051300000000, -0.0012150000000000 ]  - [  -0.0002262500000000, -0.0007509900000000, -0.0036082300000000 ]  - [   0.0007163400000000,  0.0000226700000000, -0.0021742700000000 ]  - [  -0.0002131900000000, -0.0001581700000000, -0.0017238600000000 ]  - [  -0.0011199800000000, -0.0004578700000000, -0.0012220200000000 ]  - [  -0.0032462300000000, -0.0001851600000000, -0.0023130800000000 ]  - [   0.0039342400000000, -0.0038090700000000, -0.0052972500000000 ]  - [  -0.0016451900000000,  0.0017456400000000, -0.0069982000000000 ]  - [   0.0013416300000000, -0.0010370700000000, -0.0004140000000000 ]  - [  -0.0051973500000000, -0.0004508000000000, -0.0064313600000000 ]  - [   0.0004889900000000, -0.0011124000000000, -0.0019781100000000 ]  - [   0.0006165600000000, -0.0050799200000000, -0.0142411000000000 ]  - [  -0.0012727100000000,  0.0008452300000000, -0.0007814400000000 ]  - [   0.0000300900000000,  0.0003612600000000, -0.0014530000000000 ]  - [  -0.0009680700000000,  0.0003488600000000, -0.0012236800000000 ]  - [  -0.0008029900000000, -0.0069742700000000, -0.0052214800000000 ]  - [   0.0014596300000000,  0.0022520300000000, -0.0030376000000000 ]  - [  -0.0020575600000000, -0.0001910500000000, -0.0003928900000000 ]  - [  -0.0003610200000000, -0.0003841400000000, -0.0006647000000000 ]- atom:   10  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0019964400000000, -0.0032424200000000,  0.0001593600000000 ]  - [   0.0001490600000000, -0.0001521900000000, -0.0020188800000000 ]  - [   0.0003481000000000, -0.0002771300000000, -0.0011495800000000 ]  - [   0.0004935200000000, -0.0012739300000000,  0.0011714900000000 ]  - [  -0.0048059100000000, -0.0006358300000000,  0.0028445100000000 ]  - [   0.0029379900000000,  0.0010025600000000, -0.0017295500000000 ]  - [   0.0088755500000000,  0.0105069700000000,  0.0043403600000000 ]  - [  -0.0014831500000000,  0.0028029400000000, -0.0001834000000000 ]  - [  -0.0044176000000000,  0.0020851300000000, -0.0084645900000000 ]  - [  -0.0141113400000000,  0.0123149800000000,  0.3782065200000000 ]  - [  -0.0051484200000000,  0.0125557900000000, -0.0032905500000000 ]  - [   0.0042328500000000,  0.0009692600000000,  0.0032204400000000 ]  - [  -0.0013468800000000,  0.0011657000000000,  0.0032229700000000 ]  - [  -0.0029838100000000, -0.0055611400000000,  0.0018561700000000 ]  - [   0.0078608800000000, -0.0011208400000000, -0.0033035300000000 ]  - [   0.0017634600000000,  0.0005755000000000, -0.0023087000000000 ]  - [   0.0053116800000000,  0.0064632300000000,  0.0025173600000000 ]  - [  -0.0021931300000000, -0.0002972100000000, -0.0023019600000000 ]  - [   0.0064612800000000,  0.0110245700000000, -0.0394640200000000 ]  - [  -0.0047140800000000, -0.0002607800000000,  0.0069583800000000 ]  - [   0.0157906100000000, -0.0199668400000000,  0.0025286800000000 ]  - [   0.0014951300000000,  0.0008980800000000, -0.0022975800000000 ]  - [  -0.0053751300000000, -0.0007051100000000, -0.0038163100000000 ]  - [   0.0021169700000000, -0.0178718100000000, -0.0397210000000000 ]  - [  -0.0007682700000000, -0.0004871100000000, -0.0022875800000000 ]  - [   0.0014751600000000, -0.0004707800000000, -0.0093485600000000 ]  - [   0.0003337000000000, -0.0005987200000000, -0.0038196100000000 ]  - [   0.0008866300000000, -0.0016018000000000, -0.0047682300000000 ]  - [  -0.0035104900000000,  0.0012481000000000, -0.0038620000000000 ]  - [  -0.0961144800000000,  0.0434674000000000, -0.2000348800000000 ]  - [  -0.0031919100000000,  0.0002974300000000,  0.0005893100000000 ]  - [  -0.0005892600000000, -0.0035029100000000, -0.0001272900000000 ]  - [   0.0003232600000000,  0.0011154600000000, -0.0000984400000000 ]  - [  -0.0004195100000000,  0.0003316900000000, -0.0029185300000000 ]  - [   0.1001724400000000, -0.0481398100000000, -0.1058761100000000 ]  - [  -0.0030262000000000,  0.0001313800000000, -0.0020628200000000 ]  - [  -0.0041341900000000, -0.0020535200000000,  0.0004354700000000 ]  - [  -0.0002460100000000, -0.0008122100000000, -0.0012404500000000 ]  - [   0.0002419600000000, -0.0022828500000000, -0.0015222400000000 ]  - [   0.0003229000000000,  0.0002726400000000, -0.0010031300000000 ]  - [  -0.0004454400000000, -0.0029902300000000,  0.0006712400000000 ]  - [  -0.0002686900000000,  0.0009919000000000, -0.0009492000000000 ]  - [   0.0005732200000000,  0.0022171900000000, -0.0010494500000000 ]  - [  -0.0011365800000000, -0.0007710200000000, -0.0009727700000000 ]  - [   0.0009130600000000,  0.0019924700000000, -0.0276705600000000 ]  - [  -0.0018332500000000, -0.0036183800000000, -0.0007310300000000 ]  - [  -0.0006960900000000, -0.0000743300000000,  0.0016284400000000 ]  - [   0.0001763300000000, -0.0005640900000000,  0.0004134300000000 ]  - [  -0.0060610100000000,  0.0010169300000000, -0.0037745500000000 ]  - [  -0.0026064000000000, -0.0019693300000000, -0.0013675500000000 ]  - [   0.0014182400000000, -0.0011205500000000, -0.0019643100000000 ]  - [  -0.0002734300000000,  0.0006314900000000, -0.0012573100000000 ]  - [  -0.0007206100000000,  0.0008061600000000,  0.0009408400000000 ]  - [   0.0026378100000000, -0.0000631600000000,  0.0013798400000000 ]  - [  -0.0046536100000000,  0.0052489900000000,  0.0007541500000000 ]  - [   0.0010658600000000,  0.0015711300000000,  0.0006921700000000 ]  - [   0.0013101700000000, -0.0076370800000000,  0.0023071200000000 ]  - [  -0.0035351200000000, -0.0087577800000000,  0.0117382300000000 ]  - [  -0.0011321600000000, -0.0011339200000000, -0.0062210900000000 ]  - [   0.0001518200000000,  0.0002001000000000,  0.0008217800000000 ]  - [   0.0019879700000000,  0.0014199500000000, -0.0019449800000000 ]  - [   0.0047892100000000,  0.0017768000000000,  0.0070952400000000 ]  - [  -0.0012448400000000, -0.0019771700000000,  0.0015404400000000 ]  - [  -0.0001214400000000,  0.0001344500000000,  0.0026481800000000 ]  - [  -0.0000124300000000, -0.0000087100000000,  0.0012178700000000 ]  - [   0.0005726900000000, -0.0004389800000000,  0.0026675100000000 ]  - [   0.0009228700000000,  0.0005601200000000,  0.0009439800000000 ]  - [   0.0022517300000000, -0.0002952700000000,  0.0019818200000000 ]  - [  -0.0038710300000000,  0.0035332600000000,  0.0049631300000000 ]  - [   0.0012871800000000, -0.0011538500000000,  0.0060220800000000 ]  - [  -0.0013546200000000,  0.0012673100000000,  0.0006911100000000 ]  - [   0.0061649800000000,  0.0009155200000000,  0.0067296000000000 ]  - [   0.0004190900000000,  0.0005041000000000,  0.0016516700000000 ]  - [  -0.0002643100000000,  0.0056405100000000,  0.0150460600000000 ]  - [   0.0003686500000000, -0.0002419700000000,  0.0010983200000000 ]  - [  -0.0007270600000000, -0.0003721600000000,  0.0023948500000000 ]  - [   0.0011404400000000, -0.0002405600000000,  0.0009463200000000 ]  - [   0.0006282300000000,  0.0068526900000000,  0.0055410800000000 ]  - [  -0.0013679600000000, -0.0011603500000000,  0.0027015400000000 ]  - [   0.0022374700000000,  0.0000839100000000,  0.0006606100000000 ]  - [   0.0002921500000000, -0.0006899300000000,  0.0009826500000000 ]- atom:   28  displacement:    [   0.0100000000000000, -0.0000000000345662,  0.0000000000000000 ]  forces:  - [  -0.0001284400000000,  0.0002017000000000,  0.0000222300000000 ]  - [  -0.0003754600000000,  0.0001455800000000,  0.0003779700000000 ]  - [   0.0001865700000000,  0.0001723400000000,  0.0002501700000000 ]  - [   0.0017505500000000, -0.0005567500000000, -0.0001279400000000 ]  - [  -0.0000681100000000, -0.0007163200000000,  0.0003038600000000 ]  - [  -0.0000396300000000, -0.0006046100000000, -0.0003644800000000 ]  - [  -0.0092340400000000,  0.0042044000000000, -0.0036034000000000 ]  - [  -0.0002462700000000,  0.0025157400000000,  0.0015443400000000 ]  - [  -0.0003407900000000, -0.0015032100000000,  0.0000344200000000 ]  - [   0.0025449900000000,  0.0021723900000000, -0.0013483400000000 ]  - [   0.0330482200000000, -0.0020962900000000, -0.0088871700000000 ]  - [  -0.0048184000000000,  0.0004317900000000, -0.0003844900000000 ]  - [  -0.0012993100000000, -0.0064653700000000, -0.0033269400000000 ]  - [  -0.0026258600000000, -0.0012780600000000,  0.0007155100000000 ]  - [  -0.0000736300000000,  0.0018003300000000,  0.0003954400000000 ]  - [  -0.0007107600000000,  0.0001405200000000, -0.0003489000000000 ]  - [  -0.0023662800000000, -0.0004293600000000,  0.0000602100000000 ]  - [   0.0003450100000000,  0.0002690900000000, -0.0008262600000000 ]  - [  -0.0001155900000000, -0.0004797900000000, -0.0004630500000000 ]  - [   0.0002604800000000, -0.0001563300000000, -0.0006049800000000 ]  - [   0.0038962100000000, -0.0010483900000000,  0.0062382000000000 ]  - [   0.0008860000000000, -0.0017219600000000,  0.0013811300000000 ]  - [   0.0002239300000000, -0.0006648100000000,  0.0003671600000000 ]  - [   0.0001387400000000,  0.0007880800000000, -0.0000493000000000 ]  - [  -0.0008651200000000, -0.0012692500000000, -0.0007567400000000 ]  - [   0.0000939900000000,  0.0002802800000000,  0.0006978800000000 ]  - [  -0.0000826700000000,  0.0004935300000000,  0.0004209700000000 ]  - [  -0.0420084800000000,  0.0096029000000000,  0.0247676700000000 ]  - [   0.0001352400000000, -0.0005926400000000, -0.0001316100000000 ]  - [  -0.0002719300000000, -0.0006612500000000,  0.0002237500000000 ]  - [  -0.0003870600000000, -0.0002751800000000, -0.0002917500000000 ]  - [   0.0077210000000000, -0.0117946500000000, -0.0153846900000000 ]  - [   0.0009357100000000, -0.0005764900000000, -0.0005418900000000 ]  - [   0.0005607300000000,  0.0003474400000000, -0.0003454500000000 ]  - [  -0.0015659800000000,  0.0013926300000000,  0.0009498600000000 ]  - [   0.0033555200000000, -0.0001111800000000,  0.0012473700000000 ]  - [   0.0017206500000000, -0.0025343400000000, -0.0008525600000000 ]  - [   0.0007778700000000,  0.0004922600000000,  0.0001540900000000 ]  - [   0.0018425000000000,  0.0014812900000000,  0.0011457000000000 ]  - [   0.0000005300000000,  0.0008237600000000, -0.0002092200000000 ]  - [  -0.0035566500000000,  0.0000457900000000, -0.0018219800000000 ]  - [   0.0007828400000000,  0.0004534200000000,  0.0000799000000000 ]  - [   0.0017897500000000,  0.0019963900000000, -0.0007480600000000 ]  - [   0.0023533400000000,  0.0009283500000000,  0.0010869100000000 ]  - [   0.0000423900000000, -0.0033322700000000,  0.0012004500000000 ]  - [   0.0001330000000000, -0.0002179400000000, -0.0003680100000000 ]  - [   0.0012699400000000,  0.0006552400000000, -0.0029075200000000 ]  - [   0.0005783800000000, -0.0004980500000000,  0.0005859200000000 ]  - [   0.0028239800000000,  0.0030954200000000, -0.0035805800000000 ]  - [   0.0008632700000000, -0.0003800400000000, -0.0000727900000000 ]  - [  -0.0011371300000000,  0.0014728500000000,  0.0004561600000000 ]  - [  -0.0001898500000000,  0.0003352800000000, -0.0002352000000000 ]  - [   0.0005016100000000, -0.0001669100000000, -0.0000359800000000 ]  - [  -0.0003396700000000,  0.0001612200000000, -0.0001559000000000 ]  - [   0.0014486300000000, -0.0018721500000000, -0.0043131400000000 ]  - [  -0.0004889400000000, -0.0000456200000000,  0.0016327800000000 ]  - [  -0.0002827400000000, -0.0002576900000000, -0.0001263500000000 ]  - [  -0.0004903200000000, -0.0001182400000000,  0.0007444600000000 ]  - [   0.0002999500000000, -0.0000016500000000, -0.0000787700000000 ]  - [  -0.0003396100000000, -0.0004266300000000,  0.0003141300000000 ]  - [  -0.0005780100000000, -0.0001874600000000, -0.0000500500000000 ]  - [   0.0000441200000000, -0.0001500700000000,  0.0000736800000000 ]  - [   0.0002389100000000, -0.0006270700000000, -0.0000498700000000 ]  - [   0.0001319300000000, -0.0001396400000000, -0.0005273800000000 ]  - [   0.0006355300000000,  0.0001429000000000, -0.0007052600000000 ]  - [  -0.0000134300000000, -0.0000325300000000,  0.0001004900000000 ]  - [  -0.0000285400000000,  0.0000885700000000, -0.0000370300000000 ]  - [  -0.0003197900000000, -0.0000925100000000, -0.0001774100000000 ]  - [  -0.0003914500000000,  0.0000525100000000,  0.0001371900000000 ]  - [  -0.0006638400000000,  0.0004693100000000,  0.0007722300000000 ]  - [  -0.0004147700000000,  0.0002067800000000,  0.0000270700000000 ]  - [   0.0003182100000000,  0.0003409400000000,  0.0000730800000000 ]  - [   0.0004254000000000,  0.0000643500000000, -0.0000722400000000 ]  - [   0.0001301500000000,  0.0002618800000000,  0.0004617300000000 ]  - [  -0.0006988600000000,  0.0015108700000000,  0.0005766400000000 ]  - [  -0.0004057700000000, -0.0002009800000000,  0.0017930300000000 ]  - [   0.0003110700000000,  0.0002836000000000, -0.0002460200000000 ]  - [   0.0002120400000000, -0.0001646200000000,  0.0002617900000000 ]  - [   0.0000801700000000,  0.0008139800000000, -0.0003805500000000 ]  - [   0.0018017800000000,  0.0030122800000000,  0.0041207100000000 ]  - [   0.0003223800000000,  0.0003003200000000, -0.0002570600000000 ]- atom:   28  displacement:    [  -0.0100000000000000,  0.0000000000345662,  0.0000000000000000 ]  forces:  - [   0.0001300300000000, -0.0002001500000000,  0.0007026900000000 ]  - [   0.0003831800000000, -0.0001450100000000, -0.0011066900000000 ]  - [  -0.0001959500000000, -0.0001696200000000,  0.0004764100000000 ]  - [  -0.0018322200000000,  0.0006475900000000, -0.0006091800000000 ]  - [   0.0000669900000000,  0.0007159800000000,  0.0004294200000000 ]  - [   0.0000385500000000,  0.0006046700000000, -0.0003688600000000 ]  - [   0.0092200100000000, -0.0041809000000000,  0.0036239500000000 ]  - [   0.0002441900000000, -0.0025234400000000, -0.0015662000000000 ]  - [   0.0003367200000000,  0.0015054100000000, -0.0000322700000000 ]  - [  -0.0013982500000000, -0.0020446500000000,  0.0007735900000000 ]  - [  -0.0325682500000000,  0.0016615200000000,  0.0103960700000000 ]  - [   0.0041542600000000,  0.0004977000000000, -0.0001972400000000 ]  - [   0.0008301900000000,  0.0053712400000000,  0.0027250400000000 ]  - [   0.0014797500000000,  0.0011566200000000, -0.0001173900000000 ]  - [   0.0005297500000000, -0.0007342300000000,  0.0001963400000000 ]  - [   0.0018598300000000, -0.0000246800000000, -0.0002441700000000 ]  - [   0.0030368300000000, -0.0005037400000000,  0.0005168600000000 ]  - [  -0.0010204700000000,  0.0006631600000000,  0.0002190000000000 ]  - [  -0.0003409100000000, -0.0005885800000000, -0.0001261500000000 ]  - [  -0.0013969400000000,  0.0000326700000000,  0.0011835600000000 ]  - [  -0.0033846600000000,  0.0021504700000000, -0.0057616300000000 ]  - [   0.0003001100000000,  0.0019006500000000, -0.0019616800000000 ]  - [   0.0004491600000000, -0.0002574100000000,  0.0002173900000000 ]  - [  -0.0008073300000000,  0.0001257700000000, -0.0005290600000000 ]  - [   0.0003579400000000,  0.0002168400000000,  0.0001549900000000 ]  - [  -0.0012847100000000, -0.0003910800000000, -0.0001824900000000 ]  - [   0.0005489400000000,  0.0005528000000000,  0.0001642400000000 ]  - [   0.0417963400000000, -0.0105801000000000, -0.0263477200000000 ]  - [   0.0005683300000000,  0.0006051900000000, -0.0008172300000000 ]  - [   0.0006258100000000,  0.0000648100000000,  0.0007110400000000 ]  - [   0.0001894400000000,  0.0003747800000000,  0.0000113500000000 ]  - [  -0.0084570000000000,  0.0111688300000000,  0.0147548500000000 ]  - [  -0.0009209400000000,  0.0003531900000000,  0.0002591700000000 ]  - [  -0.0009230900000000,  0.0002564100000000, -0.0006054600000000 ]  - [   0.0015615200000000, -0.0011777200000000, -0.0006743300000000 ]  - [  -0.0023798200000000,  0.0005873000000000, -0.0009259300000000 ]  - [  -0.0008103100000000,  0.0019145500000000,  0.0005221300000000 ]  - [  -0.0004369900000000,  0.0001182600000000,  0.0007876300000000 ]  - [  -0.0027046600000000, -0.0008610700000000, -0.0008096200000000 ]  - [  -0.0007010500000000, -0.0008256600000000,  0.0011396900000000 ]  - [   0.0037128600000000,  0.0000188400000000,  0.0015863900000000 ]  - [  -0.0009737300000000, -0.0005748400000000,  0.0001996900000000 ]  - [  -0.0017154200000000, -0.0009110200000000,  0.0004201900000000 ]  - [  -0.0021384300000000, -0.0010223000000000, -0.0008020200000000 ]  - [  -0.0001147000000000,  0.0022285100000000, -0.0008729300000000 ]  - [  -0.0004734000000000, -0.0003920100000000, -0.0005713800000000 ]  - [  -0.0005786200000000, -0.0006502400000000,  0.0020013600000000 ]  - [  -0.0002172300000000, -0.0001044400000000,  0.0003647300000000 ]  - [  -0.0030658300000000, -0.0030538800000000,  0.0033434400000000 ]  - [  -0.0018403500000000, -0.0000984600000000, -0.0002470700000000 ]  - [   0.0011412800000000, -0.0016866400000000, -0.0007320100000000 ]  - [  -0.0001699600000000,  0.0002661300000000, -0.0007070300000000 ]  - [  -0.0005198600000000,  0.0003935500000000,  0.0003194300000000 ]  - [   0.0013207800000000,  0.0003165900000000,  0.0004876300000000 ]  - [  -0.0005632700000000,  0.0012788300000000,  0.0040431600000000 ]  - [   0.0008296600000000,  0.0006579500000000, -0.0006736500000000 ]  - [  -0.0006272200000000,  0.0008745100000000,  0.0004549200000000 ]  - [  -0.0002132900000000,  0.0001078200000000,  0.0002039800000000 ]  - [  -0.0001123900000000,  0.0001200200000000, -0.0001986000000000 ]  - [   0.0001481400000000,  0.0002977800000000, -0.0000228200000000 ]  - [   0.0006511800000000,  0.0012744200000000, -0.0002705100000000 ]  - [   0.0001485100000000,  0.0000498700000000,  0.0002043600000000 ]  - [  -0.0003117800000000, -0.0004560600000000,  0.0003767100000000 ]  - [  -0.0004744100000000, -0.0004777300000000, -0.0004243500000000 ]  - [   0.0000632000000000, -0.0001297100000000, -0.0002466300000000 ]  - [   0.0003733500000000, -0.0005792800000000,  0.0008583600000000 ]  - [  -0.0001688600000000,  0.0000143200000000, -0.0002387600000000 ]  - [  -0.0006513700000000, -0.0003889800000000, -0.0001437700000000 ]  - [   0.0003952400000000, -0.0002683300000000, -0.0003938800000000 ]  - [   0.0003110000000000,  0.0001449000000000, -0.0016285000000000 ]  - [   0.0004069800000000, -0.0000056200000000,  0.0002463700000000 ]  - [   0.0006540400000000,  0.0001410200000000,  0.0002485900000000 ]  - [   0.0004794400000000, -0.0006715500000000, -0.0002496500000000 ]  - [   0.0002108000000000,  0.0003523700000000,  0.0004864400000000 ]  - [  -0.0001956400000000, -0.0009131600000000, -0.0002557100000000 ]  - [  -0.0002883100000000,  0.0001903900000000, -0.0008580400000000 ]  - [  -0.0001251300000000, -0.0001694400000000, -0.0000288600000000 ]  - [  -0.0003995700000000,  0.0000552200000000,  0.0000101400000000 ]  - [   0.0000082400000000,  0.0002822700000000,  0.0000568900000000 ]  - [  -0.0016547800000000, -0.0031453200000000, -0.0039136700000000 ]  - [  -0.0004054200000000, -0.0014047100000000,  0.0005849600000000 ]- atom:   28  displacement:    [  -0.0049999999753248,  0.0086602540520906,  0.0000000000000000 ]  forces:  - [   0.0001625600000000,  0.0001809300000000,  0.0003745800000000 ]  - [   0.0006796800000000,  0.0000311600000000, -0.0009589300000000 ]  - [  -0.0000523300000000, -0.0000024900000000,  0.0005918400000000 ]  - [  -0.0007260900000000,  0.0009996800000000, -0.0005172800000000 ]  - [  -0.0002594300000000, -0.0002596800000000,  0.0005438800000000 ]  - [  -0.0001394100000000, -0.0001814100000000, -0.0005391000000000 ]  - [   0.0074066100000000, -0.0007521500000000,  0.0046076100000000 ]  - [   0.0008554000000000, -0.0016232400000000, -0.0029248200000000 ]  - [  -0.0008201000000000, -0.0007184400000000,  0.0002468300000000 ]  - [  -0.0001030400000000, -0.0027896000000000,  0.0013627000000000 ]  - [  -0.0220886400000000,  0.0764907000000000,  0.0923177200000000 ]  - [   0.0009296300000000,  0.0005719200000000, -0.0000512800000000 ]  - [  -0.0057632800000000,  0.0003521500000000, -0.0011540600000000 ]  - [   0.0005935200000000,  0.0011772100000000,  0.0010567900000000 ]  - [   0.0007107600000000, -0.0015378400000000,  0.0008693700000000 ]  - [   0.0011305900000000,  0.0005324800000000, -0.0006535300000000 ]  - [   0.0003492800000000, -0.0007113800000000,  0.0002949800000000 ]  - [  -0.0009051800000000,  0.0005874200000000, -0.0017623200000000 ]  - [   0.0004417000000000, -0.0021979200000000, -0.0004888500000000 ]  - [  -0.0008001400000000, -0.0016738500000000, -0.0003576100000000 ]  - [   0.0015998100000000,  0.0117075000000000, -0.0090107000000000 ]  - [   0.0002582500000000,  0.0020274800000000,  0.0017691800000000 ]  - [   0.0004042200000000, -0.0006662800000000, -0.0001002100000000 ]  - [   0.0002339200000000, -0.0012542100000000, -0.0001951200000000 ]  - [  -0.0012623100000000, -0.0005535900000000, -0.0008853100000000 ]  - [  -0.0036195000000000,  0.0013729200000000, -0.0045829900000000 ]  - [   0.0004449400000000,  0.0003545700000000, -0.0002131200000000 ]  - [   0.0296829000000000, -0.0750094000000000, -0.0900182700000000 ]  - [   0.0004809000000000,  0.0009390200000000, -0.0010300600000000 ]  - [  -0.0001401100000000,  0.0009069600000000,  0.0003230200000000 ]  - [  -0.0003310100000000,  0.0004438600000000, -0.0003117200000000 ]  - [  -0.0091813700000000,  0.0022379100000000,  0.0061570100000000 ]  - [  -0.0001793100000000, -0.0004036100000000, -0.0001621700000000 ]  - [  -0.0010538400000000,  0.0000789600000000, -0.0010708300000000 ]  - [   0.0010786800000000, -0.0007719600000000, -0.0006302900000000 ]  - [  -0.0011097600000000,  0.0003731900000000, -0.0006493900000000 ]  - [  -0.0006660600000000,  0.0014615500000000,  0.0001827000000000 ]  - [   0.0000299300000000,  0.0003317700000000,  0.0004201300000000 ]  - [  -0.0003563300000000, -0.0023199200000000, -0.0013892000000000 ]  - [   0.0004205000000000, -0.0000805700000000, -0.0001594100000000 ]  - [   0.0010069300000000, -0.0125019700000000, -0.0090314900000000 ]  - [  -0.0000641400000000,  0.0004665300000000, -0.0000440200000000 ]  - [  -0.0015670800000000, -0.0009793100000000,  0.0000667600000000 ]  - [   0.0020974500000000,  0.0001982800000000,  0.0004912200000000 ]  - [  -0.0009580000000000,  0.0014252000000000, -0.0005727200000000 ]  - [  -0.0001758800000000, -0.0001460200000000, -0.0000806000000000 ]  - [   0.0001038400000000, -0.0006993200000000,  0.0015804700000000 ]  - [   0.0000350500000000, -0.0004107800000000,  0.0004940400000000 ]  - [   0.0000940700000000, -0.0013240100000000, -0.0007382600000000 ]  - [  -0.0011235500000000, -0.0000540000000000,  0.0002132400000000 ]  - [  -0.0002587000000000,  0.0007265200000000,  0.0000852100000000 ]  - [   0.0000474900000000,  0.0004720500000000,  0.0001201900000000 ]  - [  -0.0002972100000000,  0.0001618800000000,  0.0003282500000000 ]  - [   0.0009886700000000,  0.0002345500000000,  0.0006880900000000 ]  - [  -0.0008350000000000, -0.0010817300000000,  0.0052227800000000 ]  - [   0.0001947400000000,  0.0001411300000000,  0.0017102900000000 ]  - [  -0.0010272600000000,  0.0014365300000000,  0.0007809100000000 ]  - [  -0.0006024700000000,  0.0003088900000000,  0.0003029100000000 ]  - [   0.0003678900000000,  0.0008004000000000, -0.0004112900000000 ]  - [  -0.0001265100000000, -0.0010829900000000,  0.0007285400000000 ]  - [   0.0001367500000000,  0.0015958200000000,  0.0005377300000000 ]  - [  -0.0000858000000000,  0.0002431800000000,  0.0002237700000000 ]  - [  -0.0005221700000000, -0.0009469100000000,  0.0006962000000000 ]  - [  -0.0002459300000000, -0.0001881600000000, -0.0004656300000000 ]  - [   0.0001341100000000, -0.0001304800000000, -0.0003265000000000 ]  - [   0.0001416000000000, -0.0005105300000000,  0.0004351800000000 ]  - [   0.0000467100000000,  0.0000356300000000,  0.0000501200000000 ]  - [  -0.0002250500000000, -0.0002380200000000,  0.0000281600000000 ]  - [  -0.0006041000000000,  0.0004382400000000,  0.0015055900000000 ]  - [   0.0005630100000000,  0.0010579500000000,  0.0069056400000000 ]  - [   0.0006602500000000,  0.0005793900000000, -0.0014923400000000 ]  - [   0.0003104900000000,  0.0005676900000000,  0.0000681500000000 ]  - [   0.0003903100000000, -0.0000239200000000,  0.0000246600000000 ]  - [   0.0001513900000000,  0.0005727500000000,  0.0004554000000000 ]  - [   0.0001038100000000, -0.0000624400000000,  0.0001054500000000 ]  - [  -0.0001171200000000, -0.0000951900000000,  0.0001013900000000 ]  - [  -0.0000363100000000, -0.0000315400000000, -0.0000246600000000 ]  - [  -0.0005232400000000,  0.0007932300000000, -0.0003920900000000 ]  - [   0.0011937200000000,  0.0014940200000000, -0.0000631700000000 ]  - [   0.0019925000000000, -0.0021192100000000, -0.0015887600000000 ]  - [   0.0002982000000000, -0.0007751100000000, -0.0000206100000000 ]- atom:   28  displacement:    [   0.0049999999753248, -0.0086602540520906,  0.0000000000000000 ]  forces:  - [  -0.0001616900000000, -0.0001814900000000,  0.0003539800000000 ]  - [  -0.0006754600000000, -0.0000300100000000,  0.0002295900000000 ]  - [   0.0000490800000000,  0.0000059600000000,  0.0001393700000000 ]  - [   0.0005596800000000, -0.0008463900000000, -0.0002375200000000 ]  - [   0.0002603300000000,  0.0002567000000000,  0.0001866000000000 ]  - [   0.0001395400000000,  0.0001789900000000, -0.0001921500000000 ]  - [  -0.0074010200000000,  0.0007363800000000, -0.0046054800000000 ]  - [  -0.0008559600000000,  0.0016225000000000,  0.0029043700000000 ]  - [   0.0008186900000000,  0.0007092700000000, -0.0002431300000000 ]  - [   0.0012404700000000,  0.0029205700000000, -0.0019552600000000 ]  - [   0.0225232400000000, -0.0776978500000000, -0.0938602800000000 ]  - [  -0.0016166200000000,  0.0003597300000000, -0.0005301500000000 ]  - [   0.0052510400000000, -0.0013947100000000,  0.0005725100000000 ]  - [  -0.0017341300000000, -0.0012920500000000, -0.0004583400000000 ]  - [  -0.0002494800000000,  0.0025802700000000, -0.0002794600000000 ]  - [   0.0000122100000000, -0.0004120400000000,  0.0000601600000000 ]  - [   0.0003314000000000, -0.0002166600000000,  0.0002828100000000 ]  - [   0.0002289800000000,  0.0003459700000000,  0.0011701600000000 ]  - [  -0.0009005000000000,  0.0011344100000000, -0.0000976700000000 ]  - [  -0.0003435100000000,  0.0015408000000000,  0.0009355100000000 ]  - [  -0.0011347000000000, -0.0105719700000000,  0.0095813200000000 ]  - [   0.0008781800000000, -0.0018902400000000, -0.0023486300000000 ]  - [   0.0002690900000000, -0.0002600400000000,  0.0006859100000000 ]  - [  -0.0009033100000000,  0.0021727800000000, -0.0003797200000000 ]  - [   0.0007871200000000, -0.0005093900000000,  0.0002869300000000 ]  - [   0.0024566200000000, -0.0014884400000000,  0.0051410000000000 ]  - [   0.0000188400000000,  0.0006960900000000,  0.0008010100000000 ]  - [  -0.0296971500000000,  0.0743156700000000,  0.0913701900000000 ]  - [   0.0002238200000000, -0.0009227700000000,  0.0000825800000000 ]  - [   0.0005008000000000, -0.0015176000000000,  0.0006142600000000 ]  - [   0.0001354200000000, -0.0003400800000000,  0.0000324800000000 ]  - [   0.0082926100000000, -0.0027259600000000, -0.0066572500000000 ]  - [   0.0001984200000000,  0.0001738000000000, -0.0001231800000000 ]  - [   0.0006871400000000,  0.0005217000000000,  0.0001210600000000 ]  - [  -0.0010928900000000,  0.0009915200000000,  0.0009126200000000 ]  - [   0.0020899800000000,  0.0001058400000000,  0.0009722500000000 ]  - [   0.0015690900000000, -0.0020643400000000, -0.0005064500000000 ]  - [   0.0003134700000000,  0.0002802400000000,  0.0005212700000000 ]  - [  -0.0005505300000000,  0.0029235700000000,  0.0017069800000000 ]  - [  -0.0011179300000000,  0.0000677400000000,  0.0010985300000000 ]  - [  -0.0007972700000000,  0.0127450300000000,  0.0087418000000000 ]  - [  -0.0001193600000000, -0.0005805300000000,  0.0003197300000000 ]  - [   0.0016428900000000,  0.0020635000000000, -0.0003913600000000 ]  - [  -0.0018815500000000, -0.0002963900000000, -0.0002074700000000 ]  - [   0.0009039800000000, -0.0025176100000000,  0.0008984200000000 ]  - [  -0.0001654000000000, -0.0004643600000000, -0.0008590200000000 ]  - [   0.0005990800000000,  0.0007122500000000, -0.0025207100000000 ]  - [   0.0003271400000000, -0.0001935100000000,  0.0004545300000000 ]  - [  -0.0002890400000000,  0.0014304700000000,  0.0004484400000000 ]  - [   0.0001431600000000, -0.0004256800000000, -0.0005304000000000 ]  - [   0.0002673600000000, -0.0009451000000000, -0.0003607300000000 ]  - [  -0.0004061100000000,  0.0001307800000000, -0.0010624000000000 ]  - [   0.0002824800000000,  0.0000619800000000, -0.0000462400000000 ]  - [  -0.0000087200000000,  0.0002426800000000, -0.0003597700000000 ]  - [   0.0017070500000000,  0.0004830700000000, -0.0054932300000000 ]  - [   0.0001448700000000,  0.0004668300000000, -0.0007613800000000 ]  - [   0.0001186800000000, -0.0008228400000000, -0.0004545800000000 ]  - [  -0.0000987600000000, -0.0003190300000000,  0.0006449800000000 ]  - [  -0.0001815100000000, -0.0006824100000000,  0.0001347000000000 ]  - [  -0.0000634400000000,  0.0009582400000000, -0.0004437300000000 ]  - [  -0.0000612200000000, -0.0005056000000000, -0.0008564800000000 ]  - [   0.0002803300000000, -0.0003436800000000,  0.0000536100000000 ]  - [   0.0004477600000000, -0.0001400700000000, -0.0003691200000000 ]  - [  -0.0000935800000000, -0.0004244600000000, -0.0004845800000000 ]  - [   0.0005679200000000,  0.0001427600000000, -0.0006256900000000 ]  - [   0.0002207300000000, -0.0000970200000000,  0.0005133000000000 ]  - [  -0.0002427800000000,  0.0000670000000000, -0.0003264100000000 ]  - [  -0.0007477500000000, -0.0002409900000000, -0.0003512800000000 ]  - [   0.0006129400000000, -0.0006572300000000, -0.0017766900000000 ]  - [  -0.0009076200000000, -0.0004659300000000, -0.0078298000000000 ]  - [  -0.0006647500000000, -0.0003501500000000,  0.0017611300000000 ]  - [   0.0006581700000000, -0.0000854800000000,  0.0002523000000000 ]  - [   0.0005157100000000, -0.0005840100000000, -0.0003479800000000 ]  - [   0.0001895100000000,  0.0000403100000000,  0.0004898500000000 ]  - [  -0.0010106100000000,  0.0006743000000000,  0.0002196600000000 ]  - [  -0.0005828300000000,  0.0000823900000000,  0.0008531800000000 ]  - [   0.0002238700000000,  0.0001484100000000, -0.0002516400000000 ]  - [   0.0003323000000000, -0.0009050300000000,  0.0006617200000000 ]  - [  -0.0011139400000000, -0.0004025500000000, -0.0002630400000000 ]  - [  -0.0017799700000000,  0.0020313600000000,  0.0018936400000000 ]  - [  -0.0003700900000000, -0.0003101900000000,  0.0003439500000000 ]- atom:   28  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0003044300000000,  0.0001827300000000, -0.0001831000000000 ]  - [   0.0011573400000000, -0.0001424200000000, -0.0015472700000000 ]  - [  -0.0014047500000000,  0.0009073100000000, -0.0007297400000000 ]  - [   0.0004531800000000, -0.0008231900000000,  0.0018623900000000 ]  - [   0.0000999000000000,  0.0003905100000000,  0.0014564100000000 ]  - [   0.0001974500000000,  0.0009275100000000, -0.0009734700000000 ]  - [   0.0079171700000000, -0.0022364300000000,  0.0132062000000000 ]  - [   0.0015781800000000, -0.0062535200000000, -0.0059202800000000 ]  - [   0.0007137200000000, -0.0003917800000000, -0.0023753600000000 ]  - [  -0.0021355200000000,  0.0009542800000000,  0.0040232500000000 ]  - [  -0.0137726400000000,  0.0800927100000000,  0.1898681700000000 ]  - [   0.0062660700000000,  0.0006201600000000,  0.0021594800000000 ]  - [  -0.0065666500000000, -0.0045417300000000,  0.0031211800000000 ]  - [   0.0000427600000000,  0.0014684400000000,  0.0020002100000000 ]  - [  -0.0004785300000000,  0.0005400500000000,  0.0017615600000000 ]  - [   0.0029730200000000,  0.0004843200000000, -0.0034304900000000 ]  - [   0.0000732700000000, -0.0001372000000000,  0.0003641600000000 ]  - [  -0.0008894300000000,  0.0003266700000000, -0.0068048200000000 ]  - [   0.0005571300000000, -0.0023452000000000, -0.0019879000000000 ]  - [  -0.0004540200000000, -0.0008762400000000,  0.0000851200000000 ]  - [   0.0133595900000000,  0.0099278100000000, -0.0108326800000000 ]  - [   0.0067019200000000,  0.0110741800000000, -0.0000544000000000 ]  - [  -0.0000343700000000, -0.0001099500000000, -0.0019074700000000 ]  - [  -0.0001800100000000, -0.0005678100000000,  0.0004887800000000 ]  - [  -0.0023212300000000, -0.0023479700000000, -0.0023797900000000 ]  - [  -0.0079581400000000,  0.0012859100000000, -0.0143939400000000 ]  - [   0.0010424800000000, -0.0001267100000000, -0.0016331500000000 ]  - [   0.0247507600000000, -0.0872395800000000, -0.2192564000000000 ]  - [   0.0008155300000000,  0.0004230300000000, -0.0020838100000000 ]  - [  -0.0004558900000000,  0.0008540500000000, -0.0031278200000000 ]  - [  -0.0000083000000000, -0.0000590100000000, -0.0003557500000000 ]  - [  -0.0183785000000000,  0.0051469500000000, -0.0044555500000000 ]  - [   0.0007212800000000, -0.0008839500000000, -0.0004760100000000 ]  - [  -0.0007348100000000,  0.0002265300000000, -0.0020844700000000 ]  - [   0.0042030300000000, -0.0048921700000000, -0.0023336200000000 ]  - [  -0.0032335800000000,  0.0003120200000000, -0.0017721300000000 ]  - [  -0.0004160200000000,  0.0011596100000000, -0.0004392200000000 ]  - [  -0.0001466400000000,  0.0000635600000000, -0.0013992200000000 ]  - [   0.0017335600000000, -0.0010364700000000, -0.0022486400000000 ]  - [   0.0000388200000000, -0.0000669700000000, -0.0031272300000000 ]  - [  -0.0014798900000000, -0.0058553400000000,  0.0146448800000000 ]  - [  -0.0013174000000000,  0.0000968300000000, -0.0002868400000000 ]  - [  -0.0016765700000000, -0.0008450600000000, -0.0004930700000000 ]  - [   0.0025118800000000,  0.0004132400000000,  0.0002611900000000 ]  - [   0.0022088400000000, -0.0000204000000000, -0.0019745000000000 ]  - [  -0.0002224100000000, -0.0003249500000000,  0.0004138600000000 ]  - [  -0.0082956800000000, -0.0035826700000000,  0.0130277500000000 ]  - [   0.0000081500000000, -0.0005150700000000,  0.0011197600000000 ]  - [  -0.0064067800000000, -0.0031962200000000, -0.0005149000000000 ]  - [  -0.0014548000000000,  0.0003011100000000, -0.0004153900000000 ]  - [  -0.0006094500000000,  0.0009529900000000, -0.0001110000000000 ]  - [  -0.0000311200000000,  0.0004807000000000,  0.0004563200000000 ]  - [  -0.0010775600000000,  0.0008154200000000,  0.0010809700000000 ]  - [   0.0016410500000000,  0.0005266400000000,  0.0019628600000000 ]  - [  -0.0049307200000000,  0.0048030600000000,  0.0069212000000000 ]  - [   0.0013302500000000,  0.0024063900000000,  0.0043459100000000 ]  - [  -0.0012947900000000,  0.0022313600000000,  0.0016814900000000 ]  - [  -0.0004807300000000,  0.0000477800000000,  0.0011184500000000 ]  - [   0.0000978100000000, -0.0004377200000000, -0.0004101500000000 ]  - [  -0.0004674900000000, -0.0017509400000000,  0.0028319000000000 ]  - [   0.0004172700000000,  0.0019417900000000, -0.0002318200000000 ]  - [   0.0003553100000000,  0.0004580900000000,  0.0007575800000000 ]  - [  -0.0010944100000000, -0.0009111600000000,  0.0016655700000000 ]  - [  -0.0000686600000000,  0.0002031000000000,  0.0004161700000000 ]  - [  -0.0004761800000000, -0.0001995100000000,  0.0004586500000000 ]  - [  -0.0001911400000000, -0.0016080400000000,  0.0025201500000000 ]  - [   0.0002574400000000,  0.0002458000000000,  0.0004647400000000 ]  - [   0.0000006500000000, -0.0004655400000000,  0.0007379600000000 ]  - [  -0.0007150800000000,  0.0006067500000000,  0.0034989700000000 ]  - [   0.0018897800000000,  0.0019300300000000,  0.0129263200000000 ]  - [   0.0003160800000000, -0.0023146500000000, -0.0005166200000000 ]  - [   0.0000999700000000,  0.0005795300000000, -0.0000854800000000 ]  - [   0.0000066500000000,  0.0004379100000000,  0.0006790600000000 ]  - [   0.0001578700000000,  0.0002811000000000,  0.0008352700000000 ]  - [  -0.0002974800000000,  0.0011691600000000,  0.0005354100000000 ]  - [   0.0000648400000000, -0.0002040500000000,  0.0025281800000000 ]  - [  -0.0002514100000000, -0.0009235600000000,  0.0005726400000000 ]  - [  -0.0001311500000000,  0.0001721600000000, -0.0002081900000000 ]  - [   0.0014125600000000,  0.0011745700000000,  0.0015161000000000 ]  - [   0.0061660500000000,  0.0023470200000000,  0.0023028900000000 ]  - [  -0.0014942400000000, -0.0037576900000000,  0.0008825800000000 ]- atom:   28  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0003007500000000, -0.0001819400000000,  0.0009140100000000 ]  - [  -0.0011549300000000,  0.0001451000000000,  0.0008137600000000 ]  - [   0.0014118800000000, -0.0009108400000000,  0.0014540200000000 ]  - [  -0.0004643600000000,  0.0008370000000000, -0.0025786900000000 ]  - [  -0.0001016300000000, -0.0003918300000000, -0.0007244200000000 ]  - [  -0.0001963500000000, -0.0009192900000000,  0.0002451900000000 ]  - [  -0.0078745100000000,  0.0022205100000000, -0.0132028800000000 ]  - [  -0.0015627900000000,  0.0062107200000000,  0.0059041600000000 ]  - [  -0.0007128000000000,  0.0003852900000000,  0.0023583200000000 ]  - [   0.0032724400000000, -0.0008580900000000, -0.0045633600000000 ]  - [   0.0156505200000000, -0.0871769900000000, -0.2001183500000000 ]  - [  -0.0069278900000000,  0.0003091700000000, -0.0027243600000000 ]  - [   0.0060946200000000,  0.0035174600000000, -0.0036231500000000 ]  - [  -0.0011934000000000, -0.0015862900000000, -0.0014139000000000 ]  - [   0.0009405200000000,  0.0005152800000000, -0.0011823500000000 ]  - [  -0.0017989200000000, -0.0003702300000000,  0.0028256800000000 ]  - [   0.0006139800000000, -0.0007907700000000,  0.0002264600000000 ]  - [   0.0002081400000000,  0.0005992100000000,  0.0062156000000000 ]  - [  -0.0010184600000000,  0.0012855300000000,  0.0014043300000000 ]  - [  -0.0006887500000000,  0.0007499200000000,  0.0005102400000000 ]  - [  -0.0126954800000000, -0.0087975100000000,  0.0115007300000000 ]  - [  -0.0055641100000000, -0.0109965700000000, -0.0006012900000000 ]  - [   0.0007106500000000, -0.0008179200000000,  0.0024845000000000 ]  - [  -0.0004975400000000,  0.0014925900000000, -0.0010894000000000 ]  - [   0.0018543600000000,  0.0012835200000000,  0.0017706300000000 ]  - [   0.0067531200000000, -0.0013748800000000,  0.0148938700000000 ]  - [  -0.0005790700000000,  0.0011710300000000,  0.0022147000000000 ]  - [  -0.0263913500000000,  0.0928003300000000,  0.2291411800000000 ]  - [  -0.0001153900000000, -0.0004134900000000,  0.0011349400000000 ]  - [   0.0008043200000000, -0.0014299100000000,  0.0040587400000000 ]  - [  -0.0001844200000000,  0.0001631800000000,  0.0000817800000000 ]  - [   0.0174718800000000, -0.0056457200000000,  0.0042174000000000 ]  - [  -0.0007021800000000,  0.0006545700000000,  0.0001965400000000 ]  - [   0.0003759800000000,  0.0003761700000000,  0.0011343700000000 ]  - [  -0.0041754800000000,  0.0050734500000000,  0.0025809200000000 ]  - [   0.0042044400000000,  0.0001665600000000,  0.0020883300000000 ]  - [   0.0013188600000000, -0.0017661200000000,  0.0001168800000000 ]  - [   0.0004858800000000,  0.0005481700000000,  0.0023334700000000 ]  - [  -0.0026422800000000,  0.0016428500000000,  0.0025565900000000 ]  - [  -0.0007408300000000,  0.0000445800000000,  0.0040589600000000 ]  - [   0.0016739600000000,  0.0060100600000000, -0.0152720200000000 ]  - [   0.0011270200000000, -0.0002113200000000,  0.0005590200000000 ]  - [   0.0017523900000000,  0.0019325900000000,  0.0001696000000000 ]  - [  -0.0023092700000000, -0.0005188500000000,  0.0000168900000000 ]  - [  -0.0022890400000000, -0.0010535800000000,  0.0022881400000000 ]  - [  -0.0001182600000000, -0.0002894500000000, -0.0013602500000000 ]  - [   0.0088425100000000,  0.0035407300000000, -0.0137539200000000 ]  - [   0.0003519900000000, -0.0000880100000000, -0.0001758300000000 ]  - [   0.0061793300000000,  0.0032867300000000,  0.0001474600000000 ]  - [   0.0004653000000000, -0.0007763200000000,  0.0000831500000000 ]  - [   0.0006185200000000, -0.0011785900000000, -0.0001686000000000 ]  - [  -0.0003326400000000,  0.0001241600000000, -0.0014058300000000 ]  - [   0.0010547400000000, -0.0005822000000000, -0.0007942200000000 ]  - [  -0.0006633600000000, -0.0000437900000000, -0.0016402000000000 ]  - [   0.0057464000000000, -0.0053608700000000, -0.0071432400000000 ]  - [  -0.0009773100000000, -0.0017773400000000, -0.0033926100000000 ]  - [   0.0003813600000000, -0.0016072000000000, -0.0013518000000000 ]  - [  -0.0002208000000000, -0.0000587200000000, -0.0001772600000000 ]  - [   0.0000891000000000,  0.0005526000000000,  0.0001303900000000 ]  - [   0.0002810100000000,  0.0016274900000000, -0.0025543000000000 ]  - [  -0.0003389800000000, -0.0008462000000000, -0.0000998000000000 ]  - [  -0.0001605700000000, -0.0005605400000000, -0.0004802700000000 ]  - [   0.0010129900000000, -0.0001734900000000, -0.0013359300000000 ]  - [  -0.0002712800000000, -0.0008149500000000, -0.0013576400000000 ]  - [   0.0011793500000000,  0.0002124900000000, -0.0014032000000000 ]  - [   0.0005623000000000,  0.0010192800000000, -0.0015587900000000 ]  - [  -0.0004472000000000, -0.0001382600000000, -0.0007383700000000 ]  - [  -0.0009761500000000, -0.0000139600000000, -0.0010579200000000 ]  - [   0.0007341800000000, -0.0008367900000000, -0.0037643300000000 ]  - [  -0.0022138700000000, -0.0013700800000000, -0.0138536800000000 ]  - [  -0.0003391000000000,  0.0025261400000000,  0.0008129100000000 ]  - [   0.0008790500000000, -0.0001003100000000,  0.0004127700000000 ]  - [   0.0008990500000000, -0.0010453900000000, -0.0009994700000000 ]  - [   0.0001818100000000,  0.0003371000000000,  0.0001208400000000 ]  - [  -0.0006148600000000, -0.0005417000000000, -0.0002028200000000 ]  - [  -0.0007720500000000,  0.0001869700000000, -0.0015505800000000 ]  - [   0.0004377600000000,  0.0010332300000000, -0.0008447600000000 ]  - [  -0.0000556400000000, -0.0002911700000000,  0.0004885300000000 ]  - [  -0.0013366600000000, -0.0000974300000000, -0.0018272500000000 ]  - [  -0.0059237200000000, -0.0024614000000000, -0.0020234500000000 ]  - [   0.0014211800000000,  0.0026845000000000, -0.0005555000000000 ]- atom:   31  displacement:    [   0.0100000000000000, -0.0000000000345662,  0.0000000000000000 ]  forces:  - [   0.0003290000000000,  0.0000146000000000,  0.0001086200000000 ]  - [   0.0006265500000000, -0.0000407400000000,  0.0000303600000000 ]  - [   0.0014722800000000, -0.0005408400000000,  0.0001913700000000 ]  - [   0.0015961600000000,  0.0001249700000000,  0.0006091400000000 ]  - [  -0.0016838400000000,  0.0002359500000000,  0.0011476500000000 ]  - [  -0.0006374400000000, -0.0000014400000000, -0.0006255500000000 ]  - [   0.0017240600000000, -0.0064665900000000, -0.0024832900000000 ]  - [   0.0016736800000000, -0.0000890600000000, -0.0018634400000000 ]  - [  -0.0135922200000000,  0.0026944200000000, -0.0061891500000000 ]  - [   0.0054534700000000,  0.0003905900000000,  0.0027902200000000 ]  - [   0.0011882800000000,  0.0017342200000000,  0.0011182100000000 ]  - [  -0.0004337300000000, -0.0011596800000000, -0.0032206800000000 ]  - [  -0.0009836600000000,  0.0002943700000000, -0.0012009100000000 ]  - [  -0.0043894000000000, -0.0089005100000000,  0.0015218500000000 ]  - [   0.1520204600000000,  0.0761054200000000,  0.0965870300000000 ]  - [  -0.0004371800000000, -0.0012629900000000, -0.0013108100000000 ]  - [  -0.0000257600000000, -0.0011304000000000,  0.0006414700000000 ]  - [  -0.0011338400000000,  0.0018481100000000, -0.0000165500000000 ]  - [   0.0016346000000000,  0.0007685000000000, -0.0054086100000000 ]  - [  -0.0023159300000000,  0.0014379600000000, -0.0043994400000000 ]  - [  -0.0000401600000000,  0.0011655400000000, -0.0006615400000000 ]  - [  -0.0059888700000000,  0.0001948600000000,  0.0056468600000000 ]  - [  -0.0002472600000000,  0.0013707900000000,  0.0066206500000000 ]  - [  -0.0152535600000000, -0.0094181500000000, -0.0019732000000000 ]  - [  -0.0014988500000000, -0.0021401900000000,  0.0012909600000000 ]  - [  -0.0007091900000000,  0.0016014200000000, -0.0018408200000000 ]  - [  -0.0005864500000000, -0.0023434400000000, -0.0013662300000000 ]  - [  -0.0004590800000000, -0.0007388100000000, -0.0003812600000000 ]  - [  -0.0120274600000000, -0.0050655700000000,  0.0054056700000000 ]  - [  -0.0011185700000000, -0.0017292700000000, -0.0059181600000000 ]  - [  -0.1531469700000000, -0.0708788900000000, -0.0961958400000000 ]  - [  -0.0022224100000000,  0.0001440000000000, -0.0006747500000000 ]  - [  -0.0000784800000000,  0.0015088300000000, -0.0000877600000000 ]  - [  -0.0003335100000000,  0.0013851300000000, -0.0014873800000000 ]  - [   0.0001517000000000, -0.0001121500000000, -0.0008998400000000 ]  - [   0.0001225000000000,  0.0010003000000000,  0.0002969500000000 ]  - [  -0.0125965100000000,  0.0042382100000000, -0.0014750900000000 ]  - [   0.0024174100000000,  0.0038999100000000,  0.0028794100000000 ]  - [  -0.0006382300000000,  0.0010197100000000,  0.0006479600000000 ]  - [   0.0009981500000000, -0.0002472200000000,  0.0009530300000000 ]  - [  -0.0004270900000000, -0.0013175100000000, -0.0003274300000000 ]  - [   0.0003871300000000, -0.0000269300000000,  0.0004011300000000 ]  - [   0.0020803900000000,  0.0050688900000000, -0.0016123100000000 ]  - [   0.0009267600000000,  0.0001192000000000,  0.0005861600000000 ]  - [  -0.0021837900000000, -0.0017959500000000,  0.0008651100000000 ]  - [  -0.0000996200000000, -0.0000981800000000, -0.0001215900000000 ]  - [   0.0005113200000000, -0.0002520100000000,  0.0005437900000000 ]  - [   0.0003675200000000,  0.0001646000000000,  0.0016072100000000 ]  - [   0.0009131900000000,  0.0001961900000000,  0.0002857900000000 ]  - [  -0.0010753500000000, -0.0000753600000000, -0.0002787300000000 ]  - [   0.0007366900000000, -0.0007572900000000,  0.0004826500000000 ]  - [   0.0005892300000000, -0.0005285800000000,  0.0005048700000000 ]  - [  -0.0004354200000000,  0.0010727300000000,  0.0006439000000000 ]  - [   0.0002097300000000,  0.0000747800000000,  0.0003906600000000 ]  - [   0.0004484900000000, -0.0004301200000000,  0.0000054900000000 ]  - [   0.0001176700000000,  0.0000643000000000,  0.0007282900000000 ]  - [  -0.0013120600000000,  0.0011875200000000,  0.0014990700000000 ]  - [  -0.0016779400000000, -0.0002726200000000,  0.0021185500000000 ]  - [   0.0001481500000000,  0.0001469700000000, -0.0007103000000000 ]  - [  -0.0003177000000000, -0.0011375200000000,  0.0003467200000000 ]  - [  -0.0008938900000000, -0.0010536100000000,  0.0012202000000000 ]  - [  -0.0015851900000000, -0.0008140300000000,  0.0015809800000000 ]  - [   0.0001318300000000,  0.0000299800000000,  0.0005194800000000 ]  - [   0.0027689800000000,  0.0016218100000000, -0.0067548200000000 ]  - [   0.0011792900000000,  0.0004242300000000, -0.0000514900000000 ]  - [   0.0002419500000000, -0.0006837800000000, -0.0017890900000000 ]  - [   0.0009106400000000,  0.0005087600000000,  0.0004674400000000 ]  - [   0.0038844200000000, -0.0009927400000000,  0.0010060300000000 ]  - [  -0.0002846600000000, -0.0004033900000000,  0.0001774000000000 ]  - [   0.0006722600000000, -0.0024170700000000,  0.0007495900000000 ]  - [   0.0118046400000000, -0.0081805500000000, -0.0008307000000000 ]  - [   0.0225387000000000,  0.0033751800000000,  0.0064989500000000 ]  - [   0.0011765000000000,  0.0006656100000000,  0.0008789200000000 ]  - [   0.0018831100000000,  0.0034520700000000,  0.0064708800000000 ]  - [   0.0010090900000000, -0.0010516400000000, -0.0007057500000000 ]  - [   0.0002273100000000,  0.0002639700000000,  0.0002910000000000 ]  - [   0.0002511000000000,  0.0010414800000000, -0.0014000900000000 ]  - [   0.0094683100000000,  0.0093186400000000, -0.0036551600000000 ]  - [   0.0004766300000000, -0.0004375600000000,  0.0006771600000000 ]  - [   0.0002069200000000,  0.0001234400000000, -0.0002468400000000 ]  - [   0.0051950400000000,  0.0028942400000000, -0.0018702200000000 ]- atom:   31  displacement:    [  -0.0100000000000000,  0.0000000000345662,  0.0000000000000000 ]  forces:  - [  -0.0003317300000000, -0.0000129700000000,  0.0006231300000000 ]  - [  -0.0006315100000000,  0.0000520100000000, -0.0007657500000000 ]  - [  -0.0014884200000000,  0.0005309400000000,  0.0005300400000000 ]  - [  -0.0016071300000000, -0.0001517400000000, -0.0013245000000000 ]  - [   0.0016906500000000, -0.0002393700000000, -0.0004310100000000 ]  - [   0.0006427100000000,  0.0000019200000000, -0.0001017200000000 ]  - [  -0.0017393900000000,  0.0065378100000000,  0.0025069200000000 ]  - [  -0.0016872800000000,  0.0000787600000000,  0.0018722600000000 ]  - [   0.0137304900000000, -0.0027315900000000,  0.0062840600000000 ]  - [  -0.0043447500000000, -0.0002757000000000, -0.0033843800000000 ]  - [  -0.0005199200000000, -0.0026787700000000, -0.0005482600000000 ]  - [  -0.0002423900000000,  0.0020996600000000,  0.0026473800000000 ]  - [   0.0005233300000000, -0.0013484200000000,  0.0006092800000000 ]  - [   0.0032731000000000,  0.0088915000000000, -0.0009420300000000 ]  - [  -0.1473246000000000, -0.0711259000000000, -0.0912090500000000 ]  - [   0.0015856500000000,  0.0013820700000000,  0.0007320700000000 ]  - [   0.0007018000000000,  0.0002057500000000, -0.0000632200000000 ]  - [   0.0004743300000000, -0.0009303600000000, -0.0005597000000000 ]  - [  -0.0021381500000000, -0.0018316400000000,  0.0048523100000000 ]  - [   0.0012199100000000, -0.0015864700000000,  0.0050185200000000 ]  - [   0.0005091400000000, -0.0001231300000000,  0.0012515800000000 ]  - [   0.0071731300000000, -0.0000728100000000, -0.0062223400000000 ]  - [   0.0009694700000000, -0.0022854000000000, -0.0060691900000000 ]  - [   0.0143718400000000,  0.0106553400000000,  0.0013922900000000 ]  - [   0.0010414000000000,  0.0010794300000000, -0.0018876300000000 ]  - [  -0.0004387500000000, -0.0017399300000000,  0.0024539900000000 ]  - [   0.0010500700000000,  0.0034247100000000,  0.0019758500000000 ]  - [   0.0001176100000000,  0.0001321200000000, -0.0005584800000000 ]  - [   0.0125464200000000,  0.0049524200000000, -0.0064470900000000 ]  - [   0.0014952800000000,  0.0011375700000000,  0.0069019800000000 ]  - [   0.1496642500000000,  0.0673385300000000,  0.0911827100000000 ]  - [   0.0012561200000000, -0.0006234700000000,  0.0003564400000000 ]  - [   0.0001004200000000, -0.0017449600000000, -0.0001972900000000 ]  - [  -0.0000223400000000, -0.0007959300000000,  0.0005557000000000 ]  - [  -0.0001655500000000,  0.0003385200000000,  0.0011886100000000 ]  - [   0.0008540900000000, -0.0005292100000000,  0.0000221000000000 ]  - [   0.0133791000000000, -0.0049486900000000,  0.0010291500000000 ]  - [  -0.0020737700000000, -0.0032875700000000, -0.0019414000000000 ]  - [  -0.0002647600000000, -0.0004256500000000, -0.0003315400000000 ]  - [  -0.0017049200000000,  0.0002344900000000, -0.0000015200000000 ]  - [   0.0006120900000000,  0.0014391200000000,  0.0000510100000000 ]  - [  -0.0005829500000000, -0.0001010700000000, -0.0001180000000000 ]  - [  -0.0020337300000000, -0.0040505100000000,  0.0013063100000000 ]  - [  -0.0007359300000000, -0.0002235400000000, -0.0003095400000000 ]  - [   0.0021297000000000,  0.0007200100000000, -0.0005482500000000 ]  - [  -0.0002397500000000, -0.0005140800000000, -0.0008270200000000 ]  - [   0.0001875300000000,  0.0002656200000000, -0.0014962900000000 ]  - [  -0.0000083200000000, -0.0007685800000000, -0.0006684700000000 ]  - [  -0.0011150600000000, -0.0000933400000000, -0.0005646500000000 ]  - [   0.0001062600000000, -0.0004049800000000, -0.0000429400000000 ]  - [  -0.0007449200000000,  0.0005433200000000, -0.0007546900000000 ]  - [  -0.0009677400000000,  0.0011455500000000, -0.0014707700000000 ]  - [   0.0004251800000000, -0.0008566900000000, -0.0003672400000000 ]  - [   0.0007584500000000,  0.0004066800000000, -0.0000697800000000 ]  - [   0.0004544900000000, -0.0001720800000000, -0.0003300300000000 ]  - [   0.0002223500000000,  0.0005474200000000,  0.0002132000000000 ]  - [   0.0004149200000000, -0.0005811000000000, -0.0011781900000000 ]  - [   0.0009923400000000,  0.0002629200000000, -0.0011803500000000 ]  - [   0.0000399600000000, -0.0000298000000000,  0.0004367600000000 ]  - [   0.0001319500000000,  0.0010289800000000, -0.0000732900000000 ]  - [   0.0009749900000000,  0.0021543200000000, -0.0015533200000000 ]  - [   0.0018039500000000,  0.0007131000000000, -0.0012904500000000 ]  - [  -0.0002019000000000, -0.0011103400000000, -0.0001972800000000 ]  - [  -0.0031203300000000, -0.0022211600000000,  0.0058304500000000 ]  - [  -0.0004798300000000, -0.0004175200000000, -0.0009054000000000 ]  - [   0.0001001600000000,  0.0000847800000000,  0.0027314700000000 ]  - [  -0.0011174700000000, -0.0004115100000000, -0.0007520100000000 ]  - [  -0.0049116400000000,  0.0005185900000000, -0.0013500200000000 ]  - [   0.0003058400000000,  0.0001766900000000, -0.0004634200000000 ]  - [  -0.0010380400000000,  0.0030451500000000, -0.0017113800000000 ]  - [  -0.0117176700000000,  0.0083215800000000,  0.0011795300000000 ]  - [  -0.0219760600000000, -0.0029728300000000, -0.0062576600000000 ]  - [  -0.0002716700000000, -0.0012926200000000, -0.0012200600000000 ]  - [  -0.0015739900000000, -0.0028994900000000, -0.0056193700000000 ]  - [  -0.0019309600000000,  0.0016875600000000,  0.0010394200000000 ]  - [  -0.0009310300000000, -0.0002715000000000,  0.0006554400000000 ]  - [  -0.0000687200000000, -0.0009300800000000,  0.0011235100000000 ]  - [  -0.0098168600000000, -0.0096312100000000,  0.0040309500000000 ]  - [  -0.0003973700000000,  0.0015389900000000, -0.0010165200000000 ]  - [  -0.0000099100000000, -0.0002226100000000,  0.0005285400000000 ]  - [  -0.0053132600000000, -0.0040075900000000,  0.0022095200000000 ]- atom:   31  displacement:    [  -0.0049999999753248,  0.0086602540520906,  0.0000000000000000 ]  forces:  - [  -0.0000780500000000, -0.0001013200000000,  0.0003424200000000 ]  - [  -0.0000715000000000, -0.0009180400000000,  0.0001516200000000 ]  - [  -0.0008924300000000,  0.0020705600000000,  0.0010405400000000 ]  - [  -0.0007615400000000, -0.0010597100000000,  0.0009292300000000 ]  - [   0.0006628900000000,  0.0000421000000000,  0.0001635700000000 ]  - [   0.0001898400000000,  0.0000520700000000, -0.0003181200000000 ]  - [   0.0010603200000000, -0.0041613000000000, -0.0031301200000000 ]  - [  -0.0005894200000000,  0.0002376100000000, -0.0000759800000000 ]  - [   0.0056068900000000, -0.0003152600000000,  0.0019677800000000 ]  - [   0.0000805300000000,  0.0009488400000000, -0.0020507700000000 ]  - [   0.0015222400000000, -0.0023818900000000,  0.0004577100000000 ]  - [  -0.0013892500000000,  0.0007765600000000,  0.0002585600000000 ]  - [   0.0006242600000000, -0.0021302700000000,  0.0009188400000000 ]  - [  -0.0008538200000000,  0.0007375400000000,  0.0003009900000000 ]  - [  -0.0116161100000000,  0.0314527300000000,  0.0084122300000000 ]  - [   0.0003466400000000, -0.0001808200000000, -0.0002212300000000 ]  - [   0.0000756100000000, -0.0002186200000000,  0.0000457500000000 ]  - [   0.0004799000000000, -0.0006045800000000, -0.0013381800000000 ]  - [  -0.0005396300000000,  0.0003609600000000,  0.0009489900000000 ]  - [  -0.0004008000000000, -0.0000437500000000,  0.0010852900000000 ]  - [   0.0005518900000000, -0.0004552500000000,  0.0005386800000000 ]  - [   0.0055470600000000, -0.0006423700000000, -0.0040863600000000 ]  - [   0.0005328500000000,  0.0009919800000000, -0.0004334300000000 ]  - [  -0.0079880300000000,  0.0115932300000000,  0.0009366600000000 ]  - [  -0.0005266600000000, -0.0008801700000000, -0.0004673900000000 ]  - [  -0.0003408500000000, -0.0009557200000000,  0.0012545600000000 ]  - [   0.0003761600000000,  0.0014000700000000,  0.0006232800000000 ]  - [  -0.0003078800000000,  0.0001411900000000, -0.0006092300000000 ]  - [   0.0030825600000000, -0.0026093200000000, -0.0020888100000000 ]  - [   0.0004037800000000, -0.0000462700000000,  0.0026961400000000 ]  - [   0.0160936600000000, -0.0483073200000000, -0.0161569100000000 ]  - [  -0.0016267500000000,  0.0001990800000000, -0.0005585500000000 ]  - [   0.0005962600000000, -0.0003754300000000, -0.0004552000000000 ]  - [   0.0001643700000000,  0.0001709000000000, -0.0001597600000000 ]  - [  -0.0004712300000000,  0.0003991900000000,  0.0007890200000000 ]  - [   0.0015917400000000,  0.0002356900000000,  0.0009429700000000 ]  - [   0.0126203400000000,  0.0130250400000000,  0.0124738900000000 ]  - [  -0.0001107500000000, -0.0007641300000000, -0.0003347300000000 ]  - [  -0.0012976100000000,  0.0025946500000000,  0.0011513100000000 ]  - [  -0.0012536000000000,  0.0004840500000000, -0.0007434800000000 ]  - [   0.0000244300000000,  0.0016697700000000, -0.0005744400000000 ]  - [  -0.0001128400000000, -0.0001862800000000,  0.0001649900000000 ]  - [   0.0007093800000000,  0.0015290600000000, -0.0004655100000000 ]  - [  -0.0001694500000000,  0.0001301700000000, -0.0000122000000000 ]  - [  -0.0000863800000000, -0.0006174100000000,  0.0008001700000000 ]  - [  -0.0001729600000000, -0.0004072400000000, -0.0004834500000000 ]  - [   0.0002621900000000,  0.0002063400000000, -0.0008182000000000 ]  - [   0.0002818000000000, -0.0003466700000000,  0.0003971400000000 ]  - [  -0.0002088000000000,  0.0001374900000000, -0.0002157300000000 ]  - [  -0.0000124700000000, -0.0003316300000000, -0.0001404700000000 ]  - [  -0.0001220800000000,  0.0000102300000000, -0.0004024400000000 ]  - [  -0.0003568700000000,  0.0003387300000000, -0.0007447600000000 ]  - [   0.0002215100000000, -0.0000188400000000, -0.0000150600000000 ]  - [   0.0003611600000000,  0.0003290300000000,  0.0005572400000000 ]  - [   0.0002583200000000,  0.0001212600000000, -0.0002593200000000 ]  - [   0.0001100700000000,  0.0006688200000000,  0.0007817100000000 ]  - [   0.0001313200000000, -0.0005808700000000,  0.0000633100000000 ]  - [  -0.0000711900000000, -0.0001276700000000,  0.0000908000000000 ]  - [  -0.0000048400000000, -0.0003430800000000,  0.0001068200000000 ]  - [  -0.0000958000000000,  0.0006598000000000,  0.0001008500000000 ]  - [   0.0001661900000000,  0.0005533800000000, -0.0003908000000000 ]  - [   0.0002871100000000, -0.0002680100000000, -0.0013694800000000 ]  - [   0.0002063400000000, -0.0002995900000000,  0.0004072900000000 ]  - [   0.0010108700000000, -0.0011122400000000, -0.0001169400000000 ]  - [  -0.0001276100000000, -0.0000343300000000, -0.0004715800000000 ]  - [  -0.0005540600000000, -0.0000083300000000,  0.0023976800000000 ]  - [  -0.0004812000000000, -0.0000199600000000, -0.0003052000000000 ]  - [  -0.0013889200000000, -0.0003873400000000, -0.0006443500000000 ]  - [   0.0000518900000000, -0.0000237200000000, -0.0002654400000000 ]  - [  -0.0007747700000000,  0.0015685600000000, -0.0010931000000000 ]  - [  -0.0115909300000000,  0.0044536300000000, -0.0009463400000000 ]  - [  -0.0086124400000000, -0.0019147000000000, -0.0025804900000000 ]  - [   0.0002007000000000, -0.0007934900000000, -0.0005583700000000 ]  - [   0.0019621600000000, -0.0018207400000000, -0.0004846100000000 ]  - [  -0.0009836200000000,  0.0009165600000000,  0.0004539000000000 ]  - [  -0.0002310100000000,  0.0004159200000000,  0.0004372100000000 ]  - [   0.0000533700000000, -0.0001424900000000, -0.0000199100000000 ]  - [   0.0019462000000000, -0.0027049500000000,  0.0001714300000000 ]  - [  -0.0002200700000000,  0.0007897600000000, -0.0004206800000000 ]  - [   0.0001910800000000,  0.0002787300000000,  0.0002463400000000 ]  - [  -0.0031517000000000, -0.0030501400000000,  0.0014202700000000 ]- atom:   31  displacement:    [   0.0049999999753248, -0.0086602540520906,  0.0000000000000000 ]  forces:  - [   0.0000757400000000,  0.0001025300000000,  0.0003888000000000 ]  - [   0.0000673000000000,  0.0009151300000000, -0.0008801600000000 ]  - [   0.0008691000000000, -0.0021687200000000, -0.0003780200000000 ]  - [   0.0007620700000000,  0.0010459600000000, -0.0016609900000000 ]  - [  -0.0006584400000000, -0.0000453200000000,  0.0005614600000000 ]  - [  -0.0001863700000000, -0.0000524600000000, -0.0004097700000000 ]  - [  -0.0010717400000000,  0.0041845400000000,  0.0031297300000000 ]  - [   0.0005811400000000, -0.0002454300000000,  0.0000907400000000 ]  - [  -0.0055727000000000,  0.0002971300000000, -0.0019410400000000 ]  - [   0.0010384400000000, -0.0008216400000000,  0.0014670200000000 ]  - [  -0.0008495300000000,  0.0014562200000000,  0.0001148100000000 ]  - [   0.0007060300000000,  0.0001621500000000, -0.0008305500000000 ]  - [  -0.0010817700000000,  0.0010702800000000, -0.0015154300000000 ]  - [  -0.0002852900000000, -0.0008356700000000,  0.0002831300000000 ]  - [   0.0113839300000000, -0.0311168200000000, -0.0085095300000000 ]  - [   0.0008044400000000,  0.0003046500000000, -0.0003611900000000 ]  - [   0.0006023600000000, -0.0007099300000000,  0.0005377900000000 ]  - [  -0.0011511500000000,  0.0015311800000000,  0.0007703500000000 ]  - [   0.0000668200000000, -0.0014211200000000, -0.0015069400000000 ]  - [  -0.0006999600000000, -0.0001031900000000, -0.0004539400000000 ]  - [  -0.0000847100000000,  0.0015110900000000,  0.0000479100000000 ]  - [  -0.0043947000000000,  0.0007478600000000,  0.0035136200000000 ]  - [   0.0001467400000000, -0.0019425800000000,  0.0009977800000000 ]  - [   0.0071643300000000, -0.0107110500000000, -0.0015592800000000 ]  - [   0.0000744600000000, -0.0001629600000000, -0.0001285900000000 ]  - [  -0.0007981100000000,  0.0008320500000000, -0.0006535700000000 ]  - [   0.0000872800000000, -0.0003390800000000, -0.0000238700000000 ]  - [  -0.0000336400000000, -0.0007532800000000, -0.0003304600000000 ]  - [  -0.0023826200000000,  0.0026297000000000,  0.0010641300000000 ]  - [  -0.0000380800000000, -0.0005559100000000, -0.0017435400000000 ]  - [  -0.0156350900000000,  0.0492017000000000,  0.0164386200000000 ]  - [   0.0006586900000000, -0.0006821800000000,  0.0002390800000000 ]  - [  -0.0005808400000000,  0.0001450000000000,  0.0001739900000000 ]  - [  -0.0005247700000000,  0.0004264500000000, -0.0007819800000000 ]  - [   0.0004648400000000, -0.0001806900000000, -0.0005110900000000 ]  - [  -0.0006059100000000,  0.0002383500000000, -0.0006158400000000 ]  - [  -0.0115945900000000, -0.0133583900000000, -0.0126222100000000 ]  - [   0.0004454100000000,  0.0013596600000000,  0.0012699400000000 ]  - [   0.0003911500000000, -0.0019840700000000, -0.0008246600000000 ]  - [   0.0005579800000000, -0.0004980400000000,  0.0017026700000000 ]  - [   0.0001619300000000, -0.0015597000000000,  0.0003014200000000 ]  - [  -0.0000790400000000,  0.0000616200000000,  0.0001144600000000 ]  - [  -0.0006389300000000, -0.0004558000000000,  0.0001448600000000 ]  - [   0.0003649000000000, -0.0002299300000000,  0.0002922900000000 ]  - [   0.0000168500000000, -0.0004721800000000, -0.0004750400000000 ]  - [  -0.0001674200000000, -0.0002051100000000, -0.0004652900000000 ]  - [   0.0004379300000000, -0.0001956500000000, -0.0001308200000000 ]  - [   0.0000781400000000, -0.0002585200000000,  0.0005429000000000 ]  - [   0.0000080200000000, -0.0000373400000000, -0.0000629800000000 ]  - [  -0.0009634000000000, -0.0001474700000000, -0.0001826500000000 ]  - [   0.0001170700000000, -0.0002209400000000,  0.0001257400000000 ]  - [  -0.0000170200000000,  0.0002757300000000, -0.0002208800000000 ]  - [  -0.0002335000000000,  0.0002377800000000,  0.0002933300000000 ]  - [   0.0006106200000000,  0.0001510400000000, -0.0002391600000000 ]  - [   0.0006481100000000, -0.0007311500000000, -0.0000641800000000 ]  - [   0.0002306600000000, -0.0000593700000000,  0.0001589700000000 ]  - [  -0.0010347100000000,  0.0011879700000000,  0.0002529700000000 ]  - [  -0.0006220700000000,  0.0001177500000000,  0.0008408400000000 ]  - [   0.0001933900000000,  0.0004635300000000, -0.0003839100000000 ]  - [  -0.0000908700000000, -0.0007757300000000,  0.0001726200000000 ]  - [  -0.0000857400000000,  0.0005485100000000,  0.0000565000000000 ]  - [  -0.0000847600000000,  0.0001668200000000,  0.0016338900000000 ]  - [  -0.0002798900000000, -0.0007860100000000, -0.0000875100000000 ]  - [  -0.0013696200000000,  0.0004893400000000, -0.0007970800000000 ]  - [   0.0008338700000000,  0.0000448900000000, -0.0004820400000000 ]  - [   0.0009130600000000, -0.0005935100000000, -0.0014654700000000 ]  - [   0.0002822300000000,  0.0001207200000000,  0.0000251900000000 ]  - [   0.0003936900000000, -0.0000865300000000,  0.0003137400000000 ]  - [  -0.0000383600000000, -0.0002007400000000, -0.0000164800000000 ]  - [   0.0004098000000000, -0.0009595300000000,  0.0001373000000000 ]  - [   0.0117648700000000, -0.0043295700000000,  0.0013032400000000 ]  - [   0.0094822100000000,  0.0023764600000000,  0.0028918200000000 ]  - [   0.0007052300000000,  0.0001798700000000,  0.0002296800000000 ]  - [  -0.0016423900000000,  0.0024270900000000,  0.0013978100000000 ]  - [   0.0000713600000000, -0.0002991200000000, -0.0001252400000000 ]  - [  -0.0004751100000000, -0.0004308600000000,  0.0005141900000000 ]  - [   0.0001337000000000,  0.0002561200000000, -0.0002512700000000 ]  - [  -0.0021254700000000,  0.0025669000000000,  0.0001309600000000 ]  - [   0.0002940200000000,  0.0002987900000000,  0.0000912500000000 ]  - [  -0.0000002300000000, -0.0003848600000000,  0.0000317400000000 ]  - [   0.0030785900000000,  0.0019756100000000, -0.0010966300000000 ]- atom:   31  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000834000000000,  0.0001036000000000, -0.0000980100000000 ]  - [   0.0000800500000000,  0.0006562500000000,  0.0001785600000000 ]  - [   0.0000805500000000,  0.0003353200000000,  0.0011362300000000 ]  - [   0.0004765600000000,  0.0013881000000000, -0.0000407500000000 ]  - [  -0.0004956600000000,  0.0000381600000000,  0.0007961800000000 ]  - [  -0.0003199200000000, -0.0000652800000000, -0.0007106700000000 ]  - [   0.0018754300000000, -0.0059569400000000, -0.0029299800000000 ]  - [   0.0013980500000000,  0.0000549300000000, -0.0030958400000000 ]  - [  -0.0028548100000000,  0.0004921400000000, -0.0011246500000000 ]  - [   0.0039834400000000,  0.0003370000000000, -0.0010201300000000 ]  - [   0.0015671800000000, -0.0000427900000000,  0.0013870700000000 ]  - [  -0.0012491200000000, -0.0005409700000000, -0.0011121700000000 ]  - [  -0.0006096300000000, -0.0001499300000000, -0.0003337000000000 ]  - [  -0.0023649300000000, -0.0023786400000000,  0.0014099600000000 ]  - [   0.0927602300000000,  0.0647644800000000,  0.1083470000000000 ]  - [   0.0004864700000000,  0.0002983200000000, -0.0013790400000000 ]  - [   0.0001065100000000, -0.0006689900000000, -0.0003904900000000 ]  - [  -0.0003190200000000,  0.0008592700000000, -0.0013792500000000 ]  - [  -0.0017784100000000, -0.0009029400000000, -0.0054218300000000 ]  - [  -0.0053300100000000,  0.0025455300000000, -0.0067059700000000 ]  - [   0.0002071100000000,  0.0005402900000000, -0.0005067500000000 ]  - [   0.0002830300000000, -0.0011610000000000,  0.0033234500000000 ]  - [   0.0041771400000000,  0.0001230000000000, -0.0051011400000000 ]  - [  -0.0176000600000000, -0.0008901600000000,  0.0057585700000000 ]  - [  -0.0005039000000000, -0.0003298400000000,  0.0015353700000000 ]  - [  -0.0006946500000000,  0.0006999900000000, -0.0002337300000000 ]  - [  -0.0003259500000000, -0.0006676500000000, -0.0002601600000000 ]  - [  -0.0003225600000000, -0.0005918700000000, -0.0006906300000000 ]  - [   0.0110720300000000,  0.0042064900000000,  0.0146970900000000 ]  - [  -0.0005939000000000, -0.0007919800000000, -0.0019842400000000 ]  - [  -0.0958422900000000, -0.0741516300000000, -0.1206624500000000 ]  - [  -0.0021391100000000,  0.0001731500000000, -0.0008721500000000 ]  - [   0.0006339100000000,  0.0000319200000000, -0.0006184800000000 ]  - [  -0.0002005000000000,  0.0007749500000000, -0.0008100700000000 ]  - [  -0.0002893000000000,  0.0002462800000000,  0.0000060200000000 ]  - [   0.0009884800000000,  0.0008715000000000,  0.0006064000000000 ]  - [  -0.0002130800000000,  0.0094520800000000,  0.0010349400000000 ]  - [   0.0011179700000000,  0.0012573100000000,  0.0005921200000000 ]  - [  -0.0008268800000000,  0.0015255000000000,  0.0008158100000000 ]  - [  -0.0001086300000000,  0.0000651300000000,  0.0000469600000000 ]  - [  -0.0002205300000000,  0.0001788000000000, -0.0006166200000000 ]  - [   0.0005576900000000,  0.0007760200000000,  0.0000050400000000 ]  - [   0.0012788800000000,  0.0027562700000000, -0.0010937500000000 ]  - [   0.0005461100000000,  0.0000301500000000,  0.0003613200000000 ]  - [  -0.0014976500000000, -0.0011575000000000,  0.0010501000000000 ]  - [  -0.0000701900000000, -0.0000302400000000,  0.0001308500000000 ]  - [   0.0003455800000000, -0.0001232500000000,  0.0002383700000000 ]  - [   0.0003674400000000, -0.0002039300000000,  0.0014108600000000 ]  - [   0.0005128100000000,  0.0002127300000000,  0.0001037100000000 ]  - [  -0.0006369200000000, -0.0002275000000000,  0.0002080500000000 ]  - [   0.0011571700000000, -0.0009112900000000,  0.0003535700000000 ]  - [   0.0014694100000000, -0.0009598600000000,  0.0031746400000000 ]  - [  -0.0001824300000000,  0.0002546000000000,  0.0004201500000000 ]  - [   0.0002408000000000,  0.0001783600000000,  0.0007642400000000 ]  - [   0.0003754500000000, -0.0002949100000000,  0.0002355900000000 ]  - [   0.0001059800000000,  0.0003661900000000,  0.0010910500000000 ]  - [  -0.0007091100000000,  0.0013937200000000,  0.0017951300000000 ]  - [  -0.0011063400000000, -0.0002469700000000,  0.0031599500000000 ]  - [  -0.0000314600000000, -0.0002398000000000, -0.0000957200000000 ]  - [  -0.0002477300000000, -0.0005547100000000,  0.0004179000000000 ]  - [  -0.0008129200000000, -0.0011042800000000,  0.0014416600000000 ]  - [   0.0015268100000000, -0.0009458600000000,  0.0045899900000000 ]  - [  -0.0000861400000000, -0.0005560400000000,  0.0008231000000000 ]  - [  -0.0036334600000000, -0.0029846400000000, -0.0007935100000000 ]  - [   0.0005639100000000,  0.0001985200000000, -0.0007427700000000 ]  - [  -0.0014434100000000,  0.0007636600000000, -0.0001843500000000 ]  - [   0.0003283600000000,  0.0002092400000000,  0.0001046000000000 ]  - [  -0.0007880400000000, -0.0002038600000000,  0.0003190900000000 ]  - [   0.0003316000000000, -0.0005828900000000, -0.0000950900000000 ]  - [   0.0000426800000000, -0.0005160000000000, -0.0004441300000000 ]  - [   0.0038099300000000, -0.0021101500000000, -0.0029573900000000 ]  - [   0.0072565700000000,  0.0013641600000000,  0.0015156900000000 ]  - [   0.0006023400000000,  0.0002550500000000,  0.0002707700000000 ]  - [   0.0041565300000000,  0.0006108400000000,  0.0026094800000000 ]  - [  -0.0000964700000000, -0.0003063100000000, -0.0003837700000000 ]  - [   0.0000493100000000,  0.0003694000000000,  0.0001276400000000 ]  - [  -0.0001692900000000, -0.0005019600000000,  0.0003561100000000 ]  - [  -0.0012140500000000,  0.0017544300000000, -0.0029455200000000 ]  - [   0.0000400900000000,  0.0000889500000000,  0.0001486700000000 ]  - [  -0.0002896900000000, -0.0001515400000000, -0.0003874600000000 ]  - [   0.0011752200000000,  0.0006023400000000, -0.0006766900000000 ]- atom:   31  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0000836100000000, -0.0001055200000000,  0.0008274700000000 ]  - [  -0.0000810100000000, -0.0006550700000000, -0.0009109900000000 ]  - [  -0.0000871000000000, -0.0003930000000000, -0.0004235900000000 ]  - [  -0.0004746000000000, -0.0013947500000000, -0.0006761900000000 ]  - [   0.0004927600000000, -0.0000379000000000, -0.0000635300000000 ]  - [   0.0003180100000000,  0.0000652500000000, -0.0000204000000000 ]  - [  -0.0018812400000000,  0.0059613000000000,  0.0029473200000000 ]  - [  -0.0013906400000000, -0.0000439600000000,  0.0030903100000000 ]  - [   0.0028396000000000, -0.0004826100000000,  0.0011060800000000 ]  - [  -0.0028359800000000, -0.0002156500000000,  0.0004402100000000 ]  - [  -0.0008931000000000, -0.0008857800000000, -0.0008012500000000 ]  - [   0.0005700200000000,  0.0014633100000000,  0.0005347600000000 ]  - [   0.0001367800000000, -0.0008912900000000, -0.0002434100000000 ]  - [   0.0012212500000000,  0.0022512800000000, -0.0008182800000000 ]  - [  -0.0884720400000000, -0.0611676600000000, -0.1057294700000000 ]  - [   0.0006607800000000, -0.0001801600000000,  0.0007873600000000 ]  - [   0.0005751900000000, -0.0002592900000000,  0.0009745100000000 ]  - [  -0.0003613200000000,  0.0000717200000000,  0.0007909800000000 ]  - [   0.0013258800000000, -0.0001420800000000,  0.0048366900000000 ]  - [   0.0041329600000000, -0.0026438200000000,  0.0072224500000000 ]  - [   0.0002567300000000,  0.0005123900000000,  0.0010904700000000 ]  - [   0.0008664700000000,  0.0012714300000000, -0.0039290200000000 ]  - [  -0.0035213400000000, -0.0010777700000000,  0.0056614900000000 ]  - [   0.0170897200000000,  0.0017524900000000, -0.0064320900000000 ]  - [   0.0000417900000000, -0.0007201500000000, -0.0021247100000000 ]  - [  -0.0004443500000000, -0.0008155600000000,  0.0008178900000000 ]  - [   0.0007909400000000,  0.0017163200000000,  0.0008428000000000 ]  - [  -0.0000192600000000, -0.0000196700000000, -0.0002553700000000 ]  - [  -0.0101114200000000, -0.0040873100000000, -0.0152233300000000 ]  - [   0.0009491400000000,  0.0001924300000000,  0.0029300800000000 ]  - [   0.0915161800000000,  0.0716593500000000,  0.1182454100000000 ]  - [   0.0011631700000000, -0.0006519200000000,  0.0005483000000000 ]  - [  -0.0006205600000000, -0.0002551700000000,  0.0003376300000000 ]  - [  -0.0001618400000000, -0.0001721900000000, -0.0001399400000000 ]  - [   0.0002803700000000, -0.0000245000000000,  0.0002697600000000 ]  - [  -0.0000127600000000, -0.0003897600000000, -0.0002890600000000 ]  - [   0.0011065700000000, -0.0100303400000000, -0.0014110100000000 ]  - [  -0.0007708500000000, -0.0006398100000000,  0.0003478100000000 ]  - [  -0.0000756800000000, -0.0009212700000000, -0.0004969100000000 ]  - [  -0.0005921100000000, -0.0000756400000000,  0.0008928200000000 ]  - [   0.0004085700000000, -0.0000581400000000,  0.0003394300000000 ]  - [  -0.0007422400000000, -0.0008851700000000,  0.0002689400000000 ]  - [  -0.0012047200000000, -0.0016698900000000,  0.0007680700000000 ]  - [  -0.0003495600000000, -0.0001352700000000, -0.0000851500000000 ]  - [   0.0014222900000000,  0.0000755000000000, -0.0007299200000000 ]  - [  -0.0002718600000000, -0.0005819800000000, -0.0010745300000000 ]  - [   0.0003557700000000,  0.0001333800000000, -0.0011815600000000 ]  - [  -0.0000068700000000, -0.0003982200000000, -0.0004642300000000 ]  - [  -0.0007069100000000, -0.0001099500000000, -0.0003812400000000 ]  - [  -0.0003457300000000, -0.0002522100000000, -0.0005334600000000 ]  - [  -0.0011351000000000,  0.0006794600000000, -0.0006309800000000 ]  - [  -0.0018132400000000,  0.0015487100000000, -0.0040909500000000 ]  - [   0.0001657900000000, -0.0000293000000000, -0.0001375100000000 ]  - [   0.0007378400000000,  0.0002992600000000, -0.0004390900000000 ]  - [   0.0005312600000000, -0.0003180400000000, -0.0005608500000000 ]  - [   0.0002365100000000,  0.0002453200000000, -0.0001468400000000 ]  - [  -0.0001992100000000, -0.0007866400000000, -0.0014727700000000 ]  - [   0.0004028100000000,  0.0002351900000000, -0.0022261800000000 ]  - [   0.0002174900000000,  0.0003568400000000, -0.0001823800000000 ]  - [   0.0000605900000000,  0.0004348700000000, -0.0001397300000000 ]  - [   0.0008815700000000,  0.0021793600000000, -0.0017562100000000 ]  - [  -0.0013451300000000,  0.0008640500000000, -0.0043570900000000 ]  - [   0.0000105900000000, -0.0005300400000000, -0.0004979800000000 ]  - [   0.0032903700000000,  0.0023830700000000, -0.0001336700000000 ]  - [   0.0001378800000000, -0.0001858900000000, -0.0002041700000000 ]  - [   0.0018102100000000, -0.0013681500000000,  0.0011455900000000 ]  - [  -0.0005218000000000, -0.0001050000000000, -0.0003799500000000 ]  - [  -0.0001818100000000, -0.0002729100000000, -0.0006361400000000 ]  - [  -0.0003251200000000,  0.0003628700000000, -0.0001810900000000 ]  - [  -0.0004030900000000,  0.0011139000000000, -0.0005035700000000 ]  - [  -0.0038347600000000,  0.0023501100000000,  0.0032179100000000 ]  - [  -0.0062543600000000, -0.0008795800000000, -0.0011875200000000 ]  - [   0.0003036800000000, -0.0008635200000000, -0.0005916000000000 ]  - [  -0.0038784500000000, -0.0000067100000000, -0.0017172800000000 ]  - [  -0.0008079500000000,  0.0009126000000000,  0.0007069100000000 ]  - [  -0.0007528400000000, -0.0003841400000000,  0.0008246200000000 ]  - [   0.0003590800000000,  0.0006215000000000, -0.0006279800000000 ]  - [   0.0010354300000000, -0.0018653900000000,  0.0032294600000000 ]  - [   0.0000323700000000,  0.0009914100000000, -0.0004701600000000 ]  - [   0.0004856600000000,  0.0000482900000000,  0.0006641700000000 ]  - [  -0.0012484900000000, -0.0016872400000000,  0.0010026400000000 ]- atom:   32  displacement:    [   0.0100000000000000, -0.0000000000345662,  0.0000000000000000 ]  forces:  - [   0.0005412800000000,  0.0000322600000000, -0.0007355000000000 ]  - [   0.0013756200000000, -0.0001066600000000,  0.0012210700000000 ]  - [  -0.0015207400000000,  0.0016686100000000, -0.0005883800000000 ]  - [  -0.0018886500000000,  0.0026188300000000,  0.0004286100000000 ]  - [  -0.0003069100000000, -0.0008106500000000,  0.0010106100000000 ]  - [  -0.0002580300000000, -0.0004074900000000, -0.0007652300000000 ]  - [   0.0230395000000000, -0.0042022100000000,  0.0141902300000000 ]  - [  -0.0011912600000000,  0.0028860200000000,  0.0000408900000000 ]  - [   0.0008637100000000, -0.0035514700000000, -0.0023012500000000 ]  - [   0.0070663200000000,  0.0063857500000000, -0.0001594600000000 ]  - [   0.1724417100000000,  0.0080925700000000,  0.0031025900000000 ]  - [  -0.0167848700000000,  0.0015541100000000,  0.0014078900000000 ]  - [   0.0075094100000000, -0.0074832000000000, -0.0010455000000000 ]  - [  -0.0107348400000000, -0.0131070100000000,  0.0038349200000000 ]  - [  -0.0049693300000000,  0.0146896100000000,  0.0029123200000000 ]  - [  -0.0028505200000000,  0.0002693800000000, -0.0030489700000000 ]  - [  -0.0011134400000000, -0.0013712100000000, -0.0015651900000000 ]  - [   0.0009071900000000,  0.0007985600000000, -0.0024778900000000 ]  - [   0.0008603500000000, -0.0010848300000000, -0.0010077500000000 ]  - [  -0.0001285300000000,  0.0027753000000000, -0.0018680000000000 ]  - [  -0.0026428900000000, -0.0060581600000000,  0.0080820600000000 ]  - [   0.0071113700000000,  0.0096708600000000,  0.0018202300000000 ]  - [  -0.0011850700000000,  0.0007429500000000,  0.0003239300000000 ]  - [   0.0035650000000000, -0.0003673600000000,  0.0014346600000000 ]  - [  -0.0107180200000000, -0.0069983700000000, -0.0076110200000000 ]  - [  -0.0009340200000000, -0.0000117600000000, -0.0054006900000000 ]  - [   0.0003172900000000, -0.0007100100000000,  0.0011721200000000 ]  - [   0.0078888300000000, -0.0056872600000000, -0.0182866700000000 ]  - [   0.0003626700000000, -0.0024578000000000,  0.0015957500000000 ]  - [  -0.0021361100000000,  0.0012044700000000, -0.0017976000000000 ]  - [  -0.0018464400000000, -0.0022774900000000, -0.0017955700000000 ]  - [  -0.2672154800000000,  0.0202835200000000, -0.0394333200000000 ]  - [   0.0061978900000000, -0.0022949800000000, -0.0026883600000000 ]  - [   0.0019090800000000,  0.0020593900000000,  0.0012384900000000 ]  - [  -0.0022561000000000,  0.0013047200000000,  0.0013975100000000 ]  - [   0.0287750700000000, -0.0035305700000000,  0.0138128500000000 ]  - [   0.0116986300000000, -0.0216912100000000, -0.0073032800000000 ]  - [   0.0030428100000000,  0.0001107300000000, -0.0032592100000000 ]  - [  -0.0044129600000000,  0.0125342500000000,  0.0107314100000000 ]  - [  -0.0014788700000000,  0.0020696100000000, -0.0011128800000000 ]  - [   0.0054189500000000, -0.0150213900000000,  0.0085639700000000 ]  - [   0.0023187200000000, -0.0022916000000000,  0.0013944500000000 ]  - [   0.0210943000000000,  0.0163468100000000, -0.0058924000000000 ]  - [  -0.0002642800000000,  0.0010080100000000,  0.0006395400000000 ]  - [  -0.0086503600000000, -0.0100529500000000,  0.0069012900000000 ]  - [  -0.0000051600000000,  0.0000929900000000,  0.0000176900000000 ]  - [   0.0019934800000000,  0.0006660400000000, -0.0016976700000000 ]  - [   0.0014455900000000, -0.0003643700000000,  0.0025608700000000 ]  - [   0.0043086000000000,  0.0015598800000000, -0.0004392200000000 ]  - [   0.0010909000000000, -0.0004000600000000,  0.0004306500000000 ]  - [  -0.0005481700000000,  0.0003048700000000,  0.0002506400000000 ]  - [   0.0000938600000000, -0.0002416400000000,  0.0003949400000000 ]  - [   0.0008968500000000, -0.0000280700000000,  0.0001792500000000 ]  - [   0.0003216700000000, -0.0001305300000000,  0.0007898100000000 ]  - [   0.0016476000000000, -0.0013973800000000, -0.0025689300000000 ]  - [  -0.0006589300000000,  0.0004022100000000,  0.0016259500000000 ]  - [  -0.0003150200000000, -0.0004398000000000,  0.0002340400000000 ]  - [  -0.0008802700000000, -0.0003821100000000,  0.0013150200000000 ]  - [  -0.0002010500000000, -0.0003252100000000,  0.0002692200000000 ]  - [  -0.0011492100000000, -0.0008374600000000,  0.0012141400000000 ]  - [  -0.0006922200000000, -0.0013389200000000,  0.0003955300000000 ]  - [  -0.0001788300000000, -0.0003513000000000, -0.0001098100000000 ]  - [   0.0008826400000000, -0.0002411000000000,  0.0004566800000000 ]  - [   0.0011802100000000, -0.0002560500000000, -0.0014373200000000 ]  - [   0.0003660500000000,  0.0011005200000000, -0.0018722800000000 ]  - [  -0.0004098900000000, -0.0013116300000000,  0.0011358700000000 ]  - [  -0.0006887900000000,  0.0002586700000000, -0.0002835900000000 ]  - [   0.0010965600000000, -0.0003282500000000,  0.0005515500000000 ]  - [  -0.0017880600000000,  0.0010001300000000,  0.0017098000000000 ]  - [  -0.0002161900000000,  0.0024817300000000,  0.0066109100000000 ]  - [   0.0018816500000000, -0.0052863900000000, -0.0014560900000000 ]  - [  -0.0017454800000000,  0.0008871200000000, -0.0006828300000000 ]  - [  -0.0002860500000000,  0.0015678000000000,  0.0004924300000000 ]  - [   0.0000021200000000,  0.0000119300000000,  0.0000859200000000 ]  - [  -0.0001781000000000,  0.0040061600000000,  0.0017030600000000 ]  - [   0.0005381500000000, -0.0005558100000000,  0.0039920200000000 ]  - [   0.0005583500000000, -0.0000833400000000, -0.0000886900000000 ]  - [   0.0006979000000000,  0.0017121300000000, -0.0005684100000000 ]  - [   0.0008992600000000,  0.0018410700000000,  0.0002663200000000 ]  - [   0.0222994600000000,  0.0023624400000000,  0.0068977300000000 ]  - [  -0.0010774400000000, -0.0034869500000000,  0.0005115300000000 ]- atom:   32  displacement:    [  -0.0100000000000000,  0.0000000000345662,  0.0000000000000000 ]  forces:  - [  -0.0005361200000000, -0.0000314300000000,  0.0014598000000000 ]  - [  -0.0013162700000000,  0.0000912500000000, -0.0020200200000000 ]  - [   0.0015271300000000, -0.0016709300000000,  0.0013227100000000 ]  - [   0.0018938400000000, -0.0026174800000000, -0.0011572600000000 ]  - [   0.0003011500000000,  0.0008142100000000, -0.0002797900000000 ]  - [   0.0002538700000000,  0.0004089400000000,  0.0000336700000000 ]  - [  -0.0211168100000000,  0.0035039000000000, -0.0122881300000000 ]  - [   0.0011938400000000, -0.0028940300000000, -0.0000548100000000 ]  - [  -0.0008768800000000,  0.0035504900000000,  0.0023080300000000 ]  - [  -0.0059303800000000, -0.0063012500000000, -0.0003619800000000 ]  - [  -0.1848025700000000, -0.0091481000000000, -0.0030800700000000 ]  - [   0.0160536000000000, -0.0006113000000000, -0.0019841000000000 ]  - [  -0.0079929400000000,  0.0064532200000000,  0.0005228800000000 ]  - [   0.0095633400000000,  0.0129238600000000, -0.0032288300000000 ]  - [   0.0054419400000000, -0.0136102200000000, -0.0023124800000000 ]  - [   0.0039976400000000, -0.0001528800000000,  0.0024486600000000 ]  - [   0.0018006300000000,  0.0004302300000000,  0.0021416600000000 ]  - [  -0.0015903800000000,  0.0001402000000000,  0.0018903700000000 ]  - [  -0.0013207300000000,  0.0000190600000000,  0.0004270700000000 ]  - [  -0.0010064900000000, -0.0028844200000000,  0.0024409900000000 ]  - [   0.0031167300000000,  0.0071452900000000, -0.0075367100000000 ]  - [  -0.0060455400000000, -0.0095541100000000, -0.0024356000000000 ]  - [   0.0018633400000000, -0.0016698500000000,  0.0002621200000000 ]  - [  -0.0042249200000000,  0.0012575600000000, -0.0020327900000000 ]  - [   0.0101787700000000,  0.0059257200000000,  0.0070080800000000 ]  - [  -0.0002206900000000, -0.0001087700000000,  0.0059621200000000 ]  - [   0.0001472600000000,  0.0017595600000000, -0.0005886300000000 ]  - [  -0.0082864100000000,  0.0051479300000000,  0.0175648700000000 ]  - [   0.0003330600000000,  0.0024569800000000, -0.0025242300000000 ]  - [   0.0025041300000000, -0.0017559400000000,  0.0027109500000000 ]  - [   0.0016325000000000,  0.0023722800000000,  0.0015080800000000 ]  - [   0.2773394300000000, -0.0202789900000000,  0.0377835500000000 ]  - [  -0.0061514700000000,  0.0020699300000000,  0.0023881500000000 ]  - [  -0.0022630800000000, -0.0014423100000000, -0.0021628600000000 ]  - [   0.0022596600000000, -0.0010954300000000, -0.0011318300000000 ]  - [  -0.0275497800000000,  0.0039878000000000, -0.0133991200000000 ]  - [  -0.0107771000000000,  0.0209340600000000,  0.0068887400000000 ]  - [  -0.0026929900000000,  0.0004956000000000,  0.0041789000000000 ]  - [   0.0034134000000000, -0.0118558400000000, -0.0103847300000000 ]  - [   0.0007739900000000, -0.0021002600000000,  0.0020303400000000 ]  - [  -0.0053196700000000,  0.0153626800000000, -0.0089680300000000 ]  - [  -0.0024927100000000,  0.0021477400000000, -0.0011014300000000 ]  - [  -0.0207530400000000, -0.0150962900000000,  0.0054867800000000 ]  - [   0.0004665800000000, -0.0011095800000000, -0.0003632500000000 ]  - [   0.0084586700000000,  0.0089772200000000, -0.0066247300000000 ]  - [  -0.0003355100000000, -0.0007037900000000, -0.0009595900000000 ]  - [  -0.0012979000000000, -0.0006603200000000,  0.0007781500000000 ]  - [  -0.0010815800000000, -0.0002349000000000, -0.0016012300000000 ]  - [  -0.0044864400000000, -0.0014570600000000,  0.0001687000000000 ]  - [  -0.0020744600000000, -0.0000765900000000, -0.0007513700000000 ]  - [   0.0005555700000000, -0.0005286500000000, -0.0005254900000000 ]  - [  -0.0004555800000000,  0.0008417300000000, -0.0013364600000000 ]  - [  -0.0009188500000000,  0.0002556900000000,  0.0001070700000000 ]  - [   0.0006605000000000,  0.0006082000000000, -0.0004641200000000 ]  - [  -0.0007480300000000,  0.0007903500000000,  0.0022590600000000 ]  - [   0.0010004800000000,  0.0002108100000000, -0.0006782700000000 ]  - [  -0.0005966000000000,  0.0010594700000000,  0.0000909100000000 ]  - [   0.0001753800000000,  0.0003730800000000, -0.0003772500000000 ]  - [   0.0003915700000000,  0.0004536700000000, -0.0005486700000000 ]  - [   0.0009634600000000,  0.0007089400000000, -0.0009305100000000 ]  - [   0.0007629700000000,  0.0024205300000000, -0.0007136500000000 ]  - [   0.0003690200000000,  0.0002508800000000,  0.0003858500000000 ]  - [  -0.0009558000000000, -0.0008416400000000, -0.0001318900000000 ]  - [  -0.0015221000000000, -0.0003560200000000,  0.0004827600000000 ]  - [   0.0003289500000000, -0.0010913500000000,  0.0009203000000000 ]  - [   0.0007874900000000,  0.0007129100000000, -0.0001873100000000 ]  - [   0.0004934900000000, -0.0001543600000000,  0.0000091300000000 ]  - [  -0.0020685900000000, -0.0001523200000000, -0.0008727300000000 ]  - [   0.0017915600000000, -0.0012191600000000, -0.0019794900000000 ]  - [  -0.0001332200000000, -0.0018788800000000, -0.0075278700000000 ]  - [  -0.0018792800000000,  0.0055098700000000,  0.0017373400000000 ]  - [   0.0027183400000000, -0.0004052200000000,  0.0010071200000000 ]  - [   0.0011930300000000, -0.0021774400000000, -0.0008148900000000 ]  - [   0.0003372900000000,  0.0006088700000000,  0.0008651700000000 ]  - [  -0.0007192400000000, -0.0034068500000000, -0.0013800200000000 ]  - [  -0.0012343600000000,  0.0005450000000000, -0.0030452600000000 ]  - [  -0.0003725600000000,  0.0001985100000000, -0.0001847800000000 ]  - [  -0.0008841500000000, -0.0018099500000000,  0.0008412400000000 ]  - [  -0.0008109400000000, -0.0007424900000000, -0.0005872700000000 ]  - [  -0.0222133400000000, -0.0024454400000000, -0.0066157000000000 ]  - [   0.0010118800000000,  0.0024075800000000, -0.0001860900000000 ]- atom:   32  displacement:    [  -0.0049999999753248,  0.0086602540520906,  0.0000000000000000 ]  forces:  - [  -0.0002846300000000,  0.0003673000000000,  0.0010575900000000 ]  - [  -0.0011309400000000,  0.0011235800000000, -0.0008088800000000 ]  - [   0.0013315200000000, -0.0011875100000000,  0.0010640400000000 ]  - [   0.0014735600000000, -0.0017010300000000, -0.0008824700000000 ]  - [  -0.0001169800000000,  0.0000549200000000,  0.0000492500000000 ]  - [   0.0000637600000000,  0.0000942900000000, -0.0001501100000000 ]  - [  -0.0214305200000000,  0.0127631100000000, -0.0154432600000000 ]  - [   0.0010884200000000, -0.0020798300000000, -0.0001191100000000 ]  - [  -0.0013703300000000,  0.0005592900000000,  0.0013045400000000 ]  - [  -0.0043339100000000, -0.0065943800000000,  0.0024886300000000 ]  - [  -0.0723633800000000,  0.0194148600000000, -0.0009663800000000 ]  - [   0.0098694800000000,  0.0002341000000000, -0.0008092200000000 ]  - [  -0.0034818500000000,  0.0003787900000000, -0.0040707900000000 ]  - [   0.0031953600000000,  0.0060802700000000, -0.0013723100000000 ]  - [   0.0041534500000000, -0.0111931900000000, -0.0016168700000000 ]  - [   0.0024739700000000,  0.0001803300000000,  0.0011207300000000 ]  - [   0.0005027100000000, -0.0003734400000000,  0.0014991900000000 ]  - [  -0.0010108600000000,  0.0000515200000000,  0.0011229800000000 ]  - [  -0.0007742300000000, -0.0007216100000000,  0.0003898900000000 ]  - [  -0.0003055200000000, -0.0021688800000000,  0.0016294800000000 ]  - [   0.0023261500000000,  0.0063753900000000, -0.0057458600000000 ]  - [  -0.0024145500000000, -0.0101743900000000,  0.0001498600000000 ]  - [   0.0014453700000000, -0.0015103000000000, -0.0000322800000000 ]  - [  -0.0029494300000000, -0.0005548500000000, -0.0022467400000000 ]  - [   0.0045144000000000,  0.0021591400000000,  0.0019142000000000 ]  - [  -0.0002577500000000,  0.0007862600000000,  0.0025281900000000 ]  - [  -0.0001001400000000,  0.0008628700000000,  0.0002342500000000 ]  - [  -0.0142503500000000, -0.0008878900000000,  0.0132415400000000 ]  - [   0.0002001800000000,  0.0019376800000000, -0.0021770000000000 ]  - [   0.0023939800000000,  0.0009015400000000,  0.0005336200000000 ]  - [   0.0010940800000000,  0.0018407500000000,  0.0010386000000000 ]  - [   0.1540660300000000, -0.0426444900000000,  0.0283192000000000 ]  - [  -0.0027101200000000,  0.0006796900000000,  0.0010966500000000 ]  - [  -0.0011449700000000, -0.0006306000000000, -0.0013039200000000 ]  - [   0.0022003600000000, -0.0011048200000000, -0.0013192300000000 ]  - [  -0.0167915800000000,  0.0031468700000000, -0.0084967600000000 ]  - [  -0.0114041400000000,  0.0168674800000000,  0.0043627600000000 ]  - [  -0.0015597600000000,  0.0003611800000000,  0.0023860200000000 ]  - [   0.0042932100000000, -0.0068052000000000, -0.0019269700000000 ]  - [   0.0005058500000000,  0.0005796500000000,  0.0027226200000000 ]  - [  -0.0175948300000000,  0.0072818600000000, -0.0083414100000000 ]  - [  -0.0016488000000000,  0.0014510700000000, -0.0007296500000000 ]  - [  -0.0089294300000000, -0.0090461000000000,  0.0038119300000000 ]  - [   0.0009422500000000, -0.0002008500000000,  0.0004342600000000 ]  - [   0.0037118500000000,  0.0071893700000000, -0.0081177700000000 ]  - [  -0.0001254200000000, -0.0004287900000000, -0.0009109800000000 ]  - [  -0.0008415000000000, -0.0006410800000000,  0.0009080000000000 ]  - [  -0.0005099700000000, -0.0003684000000000, -0.0007656900000000 ]  - [  -0.0029484200000000, -0.0012326700000000,  0.0000420300000000 ]  - [  -0.0013573500000000, -0.0000091300000000, -0.0005080100000000 ]  - [  -0.0001746100000000,  0.0002885500000000, -0.0001340000000000 ]  - [  -0.0003907900000000,  0.0007742900000000, -0.0008906100000000 ]  - [  -0.0004176600000000,  0.0000684000000000,  0.0000938500000000 ]  - [   0.0002542000000000,  0.0005376600000000, -0.0003797200000000 ]  - [  -0.0003430400000000,  0.0002256500000000,  0.0015959100000000 ]  - [   0.0005187600000000,  0.0002139000000000,  0.0001428400000000 ]  - [  -0.0007431100000000,  0.0011997800000000,  0.0001827300000000 ]  - [  -0.0001417600000000,  0.0004327000000000, -0.0005796700000000 ]  - [   0.0006395400000000,  0.0011374500000000, -0.0006965700000000 ]  - [   0.0003808200000000,  0.0000501300000000, -0.0006766000000000 ]  - [   0.0003680600000000,  0.0017946200000000, -0.0004999500000000 ]  - [   0.0000903500000000,  0.0001068900000000,  0.0002104400000000 ]  - [  -0.0006667600000000, -0.0008472500000000,  0.0000388100000000 ]  - [  -0.0009659300000000, -0.0002140400000000,  0.0004688400000000 ]  - [   0.0008663600000000, -0.0004060600000000, -0.0000985000000000 ]  - [   0.0002220100000000,  0.0007417300000000, -0.0003457400000000 ]  - [   0.0003402800000000, -0.0000619100000000, -0.0000547000000000 ]  - [  -0.0014160300000000, -0.0000455900000000, -0.0005391100000000 ]  - [   0.0008106400000000, -0.0007214700000000, -0.0009815100000000 ]  - [   0.0011354300000000, -0.0014459500000000, -0.0021874800000000 ]  - [  -0.0021376600000000,  0.0049327300000000,  0.0013486900000000 ]  - [   0.0021572700000000,  0.0001229300000000,  0.0008869000000000 ]  - [   0.0008484900000000, -0.0009150700000000, -0.0004475400000000 ]  - [   0.0003396200000000,  0.0008319200000000,  0.0009631800000000 ]  - [  -0.0005702300000000, -0.0009573200000000, -0.0002928300000000 ]  - [  -0.0010492200000000,  0.0000089500000000, -0.0009736700000000 ]  - [  -0.0001776600000000,  0.0000850300000000, -0.0001093100000000 ]  - [  -0.0003564500000000, -0.0004261200000000,  0.0004875700000000 ]  - [  -0.0000206300000000,  0.0001789900000000, -0.0002845700000000 ]  - [  -0.0082313300000000, -0.0018056800000000, -0.0022474800000000 ]  - [   0.0011267600000000,  0.0026504000000000, -0.0005886100000000 ]- atom:   32  displacement:    [   0.0049999999753248, -0.0086602540520906,  0.0000000000000000 ]  forces:  - [   0.0002855500000000, -0.0003708600000000, -0.0003316200000000 ]  - [   0.0011537600000000, -0.0011216500000000,  0.0000536300000000 ]  - [  -0.0013287700000000,  0.0011908100000000, -0.0003342000000000 ]  - [  -0.0014741100000000,  0.0017113200000000,  0.0001542200000000 ]  - [   0.0001150300000000, -0.0000576800000000,  0.0006829900000000 ]  - [  -0.0000650200000000, -0.0000937500000000, -0.0005810200000000 ]  - [   0.0224315000000000, -0.0127519100000000,  0.0163614400000000 ]  - [  -0.0010882200000000,  0.0020837100000000,  0.0001134100000000 ]  - [   0.0013684600000000, -0.0005803700000000, -0.0013094600000000 ]  - [   0.0055055000000000,  0.0067549700000000, -0.0030685200000000 ]  - [   0.0705581100000000, -0.0208145200000000,  0.0013641100000000 ]  - [  -0.0105847200000000,  0.0006972700000000,  0.0002339100000000 ]  - [   0.0030075100000000, -0.0013880700000000,  0.0034979600000000 ]  - [  -0.0043654700000000, -0.0062319700000000,  0.0019775900000000 ]  - [  -0.0036725700000000,  0.0122907400000000,  0.0022099300000000 ]  - [  -0.0013349600000000, -0.0000625400000000, -0.0017232200000000 ]  - [   0.0001811500000000, -0.0005553500000000, -0.0009217400000000 ]  - [   0.0003318700000000,  0.0008821200000000, -0.0017046900000000 ]  - [   0.0003144400000000, -0.0003373600000000, -0.0009761700000000 ]  - [  -0.0008376100000000,  0.0020547400000000, -0.0010562400000000 ]  - [  -0.0018495100000000, -0.0053205100000000,  0.0063195800000000 ]  - [   0.0035427700000000,  0.0103002200000000, -0.0007325700000000 ]  - [  -0.0007757300000000,  0.0005839200000000,  0.0006217200000000 ]  - [   0.0023014400000000,  0.0014792800000000,  0.0016651400000000 ]  - [  -0.0050370300000000, -0.0032571700000000, -0.0025557200000000 ]  - [  -0.0008933500000000, -0.0008972200000000, -0.0019695300000000 ]  - [   0.0005639200000000,  0.0001871100000000,  0.0003544000000000 ]  - [   0.0137247900000000,  0.0002117100000000, -0.0140316000000000 ]  - [   0.0004955600000000, -0.0019387200000000,  0.0012521400000000 ]  - [  -0.0020498800000000, -0.0014998800000000,  0.0004012800000000 ]  - [  -0.0013098400000000, -0.0017478200000000, -0.0013270600000000 ]  - [  -0.1532235500000000,  0.0427445500000000, -0.0293812800000000 ]  - [   0.0027520000000000, -0.0009173300000000, -0.0013869500000000 ]  - [   0.0007904500000000,  0.0012395300000000,  0.0003625400000000 ]  - [  -0.0022166400000000,  0.0013258700000000,  0.0016008100000000 ]  - [   0.0178820900000000, -0.0027129600000000,  0.0088758500000000 ]  - [   0.0124650000000000, -0.0176725600000000, -0.0047337500000000 ]  - [   0.0019125200000000,  0.0002518300000000, -0.0014587200000000 ]  - [  -0.0052689300000000,  0.0074300000000000,  0.0022018600000000 ]  - [  -0.0011991000000000, -0.0005859000000000, -0.0017748500000000 ]  - [   0.0173631900000000, -0.0070900700000000,  0.0078733900000000 ]  - [   0.0014720300000000, -0.0015804300000000,  0.0010137400000000 ]  - [   0.0090477800000000,  0.0102235300000000, -0.0041787200000000 ]  - [  -0.0007475600000000,  0.0000954000000000, -0.0001567500000000 ]  - [  -0.0038353000000000, -0.0083253400000000,  0.0085234300000000 ]  - [  -0.0002167400000000, -0.0001822000000000, -0.0000314300000000 ]  - [   0.0015379700000000,  0.0006498000000000, -0.0018410000000000 ]  - [   0.0008734100000000, -0.0002339500000000,  0.0017203300000000 ]  - [   0.0027581100000000,  0.0013332900000000, -0.0003211500000000 ]  - [   0.0003778000000000, -0.0004707100000000,  0.0001859000000000 ]  - [   0.0001858700000000, -0.0005129700000000, -0.0001419300000000 ]  - [   0.0000313600000000, -0.0001739300000000, -0.0000519600000000 ]  - [   0.0004016200000000,  0.0001563100000000,  0.0001906700000000 ]  - [   0.0007243100000000, -0.0000600700000000,  0.0007042700000000 ]  - [   0.0012447900000000, -0.0008321600000000, -0.0019157500000000 ]  - [  -0.0001768900000000,  0.0003965000000000,  0.0008009900000000 ]  - [  -0.0001647100000000, -0.0005894700000000,  0.0001410000000000 ]  - [  -0.0005611000000000, -0.0004448800000000,  0.0015275800000000 ]  - [  -0.0004560300000000, -0.0010239300000000,  0.0004213700000000 ]  - [  -0.0005678900000000, -0.0001736300000000,  0.0009567300000000 ]  - [  -0.0002957900000000, -0.0007137800000000,  0.0001790400000000 ]  - [   0.0001037400000000, -0.0002070400000000,  0.0000667700000000 ]  - [   0.0005934900000000, -0.0002377400000000,  0.0002874600000000 ]  - [   0.0006293800000000, -0.0003955800000000, -0.0014244000000000 ]  - [  -0.0001646900000000,  0.0004182300000000, -0.0008547800000000 ]  - [   0.0001411500000000, -0.0013449500000000,  0.0012945600000000 ]  - [  -0.0005361700000000,  0.0001649900000000, -0.0002220900000000 ]  - [   0.0004469400000000, -0.0004335200000000,  0.0002178300000000 ]  - [  -0.0008058800000000,  0.0005028300000000,  0.0007127100000000 ]  - [  -0.0014908000000000,  0.0020595600000000,  0.0012759100000000 ]  - [   0.0021400300000000, -0.0047311700000000, -0.0010750200000000 ]  - [  -0.0011940000000000,  0.0003584000000000, -0.0005663600000000 ]  - [   0.0000568000000000,  0.0003085900000000,  0.0001253600000000 ]  - [  -0.0000016200000000, -0.0002183800000000, -0.0000149900000000 ]  - [  -0.0003361900000000,  0.0015899000000000,  0.0006278000000000 ]  - [   0.0003465100000000, -0.0000253200000000,  0.0019422300000000 ]  - [   0.0003651900000000,  0.0000335400000000, -0.0001675400000000 ]  - [   0.0001686900000000,  0.0003121800000000, -0.0002120000000000 ]  - [   0.0001014000000000,  0.0009128200000000, -0.0000369600000000 ]  - [   0.0085275900000000,  0.0017148300000000,  0.0025657700000000 ]  - [  -0.0011962300000000, -0.0037330500000000,  0.0009124200000000 ]- atom:   32  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0001258500000000, -0.0000081000000000, -0.0011287000000000 ]  - [   0.0007172000000000,  0.0000459000000000,  0.0015256500000000 ]  - [  -0.0007173500000000,  0.0005944400000000, -0.0000350500000000 ]  - [  -0.0003322400000000,  0.0002789600000000,  0.0003301200000000 ]  - [   0.0000040300000000, -0.0001525900000000,  0.0008434500000000 ]  - [  -0.0000680100000000, -0.0000853500000000, -0.0008715700000000 ]  - [   0.0263700200000000, -0.0072222500000000,  0.0292147400000000 ]  - [  -0.0004361200000000,  0.0001747200000000, -0.0017455200000000 ]  - [  -0.0002810700000000, -0.0012658800000000,  0.0000391900000000 ]  - [   0.0055282900000000,  0.0074291500000000, -0.0003342100000000 ]  - [  -0.0109742300000000,  0.0022986700000000,  0.0280183500000000 ]  - [  -0.0080418000000000,  0.0009584000000000,  0.0005848500000000 ]  - [   0.0031842300000000, -0.0084976500000000, -0.0008876400000000 ]  - [  -0.0029671900000000, -0.0037256900000000,  0.0025342000000000 ]  - [  -0.0018063300000000,  0.0046417400000000,  0.0019844200000000 ]  - [   0.0001511500000000,  0.0002517700000000, -0.0024481000000000 ]  - [  -0.0007340200000000, -0.0006957900000000, -0.0010913700000000 ]  - [  -0.0004168200000000,  0.0013547400000000, -0.0031645600000000 ]  - [   0.0004046600000000, -0.0016483600000000, -0.0021100100000000 ]  - [  -0.0001607300000000,  0.0012042500000000, -0.0009274600000000 ]  - [   0.0009777000000000,  0.0000627100000000, -0.0018356200000000 ]  - [   0.0023948900000000,  0.0061085800000000,  0.0009171500000000 ]  - [   0.0000861100000000, -0.0004579300000000, -0.0005330800000000 ]  - [   0.0006723600000000, -0.0005918400000000,  0.0014952600000000 ]  - [  -0.0032824200000000, -0.0019824100000000, -0.0012220200000000 ]  - [  -0.0023211800000000,  0.0003208600000000, -0.0062873200000000 ]  - [   0.0007425100000000,  0.0005947100000000, -0.0006467500000000 ]  - [  -0.0152918100000000, -0.0015702700000000, -0.0047961200000000 ]  - [   0.0007067400000000, -0.0004667700000000, -0.0008038800000000 ]  - [  -0.0013744000000000, -0.0005317900000000, -0.0019470300000000 ]  - [  -0.0006130800000000, -0.0007109800000000, -0.0008507800000000 ]  - [  -0.0400545300000000,  0.0109428800000000, -0.0740408700000000 ]  - [   0.0017856800000000, -0.0007855100000000, -0.0010762900000000 ]  - [   0.0001677000000000,  0.0008973100000000, -0.0007516300000000 ]  - [  -0.0013584300000000,  0.0001536300000000,  0.0010329000000000 ]  - [   0.0141348500000000, -0.0019458300000000,  0.0084100700000000 ]  - [   0.0021395900000000, -0.0059091400000000, -0.0050677900000000 ]  - [   0.0012637300000000, -0.0000034500000000, -0.0014677200000000 ]  - [   0.0011305400000000,  0.0090805300000000,  0.0084054800000000 ]  - [  -0.0006538500000000,  0.0010185200000000, -0.0016716000000000 ]  - [   0.0125819700000000, -0.0057175700000000,  0.0010968200000000 ]  - [   0.0008978200000000, -0.0011970700000000,  0.0007954200000000 ]  - [   0.0046018600000000,  0.0061391700000000, -0.0050745400000000 ]  - [   0.0002332200000000,  0.0009336300000000,  0.0005872000000000 ]  - [  -0.0021170700000000, -0.0116346400000000,  0.0084094200000000 ]  - [  -0.0001873900000000, -0.0000960000000000,  0.0004274400000000 ]  - [   0.0004719600000000, -0.0001766400000000,  0.0011928200000000 ]  - [   0.0008012500000000, -0.0003231200000000,  0.0019929900000000 ]  - [   0.0010858300000000,  0.0001809800000000,  0.0003356600000000 ]  - [   0.0002270000000000, -0.0002660500000000,  0.0002608900000000 ]  - [  -0.0005882200000000,  0.0005281500000000,  0.0001708500000000 ]  - [   0.0000061900000000,  0.0000906100000000,  0.0003674500000000 ]  - [  -0.0006103400000000,  0.0001762600000000,  0.0008005300000000 ]  - [   0.0011120100000000, -0.0000245100000000,  0.0009836200000000 ]  - [   0.0001510600000000,  0.0000116600000000,  0.0005386600000000 ]  - [  -0.0001529100000000,  0.0007262400000000,  0.0022741400000000 ]  - [  -0.0006208800000000,  0.0005418800000000,  0.0007004300000000 ]  - [  -0.0006705100000000, -0.0004387600000000,  0.0019759700000000 ]  - [  -0.0003033900000000, -0.0009302300000000,  0.0002936600000000 ]  - [  -0.0001902500000000, -0.0015478100000000,  0.0017723000000000 ]  - [  -0.0002503700000000, -0.0000494600000000,  0.0002174100000000 ]  - [   0.0003288500000000,  0.0005404900000000,  0.0007398200000000 ]  - [  -0.0000139700000000, -0.0006355600000000,  0.0007019200000000 ]  - [  -0.0000799900000000,  0.0001727200000000, -0.0007225700000000 ]  - [  -0.0004561400000000, -0.0003302900000000, -0.0005415200000000 ]  - [   0.0001241800000000, -0.0007519500000000,  0.0008490700000000 ]  - [  -0.0002154600000000,  0.0000091900000000,  0.0002321800000000 ]  - [   0.0001065600000000, -0.0002989300000000,  0.0002613100000000 ]  - [  -0.0011575700000000,  0.0008188700000000,  0.0014571700000000 ]  - [   0.0051382600000000,  0.0020091700000000,  0.0065200700000000 ]  - [   0.0007770200000000, -0.0017993600000000, -0.0007021300000000 ]  - [  -0.0003629600000000,  0.0005916100000000, -0.0004603600000000 ]  - [   0.0002358300000000,  0.0002146700000000,  0.0002189100000000 ]  - [   0.0000823400000000,  0.0001486300000000,  0.0002256300000000 ]  - [  -0.0000524200000000,  0.0009512200000000,  0.0002016700000000 ]  - [   0.0002526300000000, -0.0001452800000000,  0.0012051400000000 ]  - [  -0.0000022200000000, -0.0000798100000000,  0.0002597800000000 ]  - [   0.0001971900000000,  0.0007826700000000, -0.0004082000000000 ]  - [   0.0017824100000000,  0.0023068900000000,  0.0005427500000000 ]  - [   0.0065360500000000,  0.0004789900000000,  0.0015087600000000 ]  - [  -0.0005016900000000, -0.0020655400000000,  0.0001983200000000 ]- atom:   32  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0001275600000000,  0.0000074900000000,  0.0018496900000000 ]  - [  -0.0006263100000000, -0.0000749900000000, -0.0023892000000000 ]  - [   0.0007106600000000, -0.0005867500000000,  0.0007575700000000 ]  - [   0.0003240700000000, -0.0002660000000000, -0.0010552900000000 ]  - [  -0.0000033200000000,  0.0001486000000000, -0.0001104000000000 ]  - [   0.0000687800000000,  0.0000842500000000,  0.0001406400000000 ]  - [  -0.0250526800000000,  0.0068900300000000, -0.0286689200000000 ]  - [   0.0004307800000000, -0.0001605900000000,  0.0017460700000000 ]  - [   0.0002997200000000,  0.0012567400000000, -0.0000665700000000 ]  - [  -0.0043198100000000, -0.0072285200000000, -0.0002301900000000 ]  - [   0.0122743200000000, -0.0031958200000000, -0.0275957600000000 ]  - [   0.0073140000000000, -0.0000215800000000, -0.0011621500000000 ]  - [  -0.0036013600000000,  0.0073772300000000,  0.0003319200000000 ]  - [   0.0017812900000000,  0.0035690300000000, -0.0019302000000000 ]  - [   0.0022476900000000, -0.0035540700000000, -0.0013964600000000 ]  - [   0.0009788900000000, -0.0001332900000000,  0.0018458200000000 ]  - [   0.0014037500000000, -0.0002343800000000,  0.0016651500000000 ]  - [  -0.0002507300000000, -0.0004335300000000,  0.0025734100000000 ]  - [  -0.0008691600000000,  0.0006029400000000,  0.0015192100000000 ]  - [  -0.0009788300000000, -0.0013202600000000,  0.0015074700000000 ]  - [  -0.0005187200000000,  0.0009559000000000,  0.0024628000000000 ]  - [  -0.0012256000000000, -0.0059365600000000, -0.0015149300000000 ]  - [   0.0005782700000000, -0.0004626400000000,  0.0011150200000000 ]  - [  -0.0013396400000000,  0.0015210300000000, -0.0020806500000000 ]  - [   0.0027605300000000,  0.0008848000000000,  0.0005773600000000 ]  - [   0.0011916300000000, -0.0004494900000000,  0.0068726300000000 ]  - [  -0.0002815800000000,  0.0004516000000000,  0.0012335100000000 ]  - [   0.0148470300000000,  0.0010333600000000,  0.0038721500000000 ]  - [  -0.0000028400000000,  0.0004724100000000, -0.0001436000000000 ]  - [   0.0017215800000000, -0.0000614000000000,  0.0028587100000000 ]  - [   0.0004181100000000,  0.0008053300000000,  0.0005698700000000 ]  - [   0.0371304000000000, -0.0111148700000000,  0.0732981400000000 ]  - [  -0.0017428100000000,  0.0005471700000000,  0.0007856500000000 ]  - [  -0.0005215800000000, -0.0002916700000000, -0.0001979200000000 ]  - [   0.0013300300000000,  0.0000739200000000, -0.0007467100000000 ]  - [  -0.0130768600000000,  0.0024042800000000, -0.0080123900000000 ]  - [  -0.0012473000000000,  0.0052726800000000,  0.0047074800000000 ]  - [  -0.0009092900000000,  0.0006144100000000,  0.0023932000000000 ]  - [  -0.0019859100000000, -0.0083364800000000, -0.0079567200000000 ]  - [  -0.0000516600000000, -0.0010279400000000,  0.0025917500000000 ]  - [  -0.0125139500000000,  0.0058801100000000, -0.0013484000000000 ]  - [  -0.0010777800000000,  0.0010744600000000, -0.0005165700000000 ]  - [  -0.0044940100000000, -0.0049944900000000,  0.0047009200000000 ]  - [  -0.0000415300000000, -0.0010247400000000, -0.0003078300000000 ]  - [   0.0020116000000000,  0.0103655100000000, -0.0079527800000000 ]  - [  -0.0001537500000000, -0.0005150600000000, -0.0013705100000000 ]  - [   0.0002351500000000,  0.0001916900000000, -0.0021527300000000 ]  - [  -0.0004338200000000, -0.0002811400000000, -0.0010391800000000 ]  - [  -0.0012701500000000, -0.0000730900000000, -0.0006198900000000 ]  - [  -0.0011984500000000, -0.0002147700000000, -0.0005826800000000 ]  - [   0.0005938400000000, -0.0007453000000000, -0.0004479500000000 ]  - [  -0.0003667800000000,  0.0005109300000000, -0.0013131300000000 ]  - [   0.0006011000000000,  0.0000479800000000, -0.0005199500000000 ]  - [  -0.0001404800000000,  0.0005037200000000, -0.0006583400000000 ]  - [   0.0007581600000000, -0.0006249300000000, -0.0008740200000000 ]  - [   0.0004907200000000, -0.0001118200000000, -0.0013277700000000 ]  - [  -0.0002820900000000,  0.0000595000000000, -0.0003780100000000 ]  - [  -0.0000323200000000,  0.0004224400000000, -0.0010242700000000 ]  - [   0.0004846900000000,  0.0010386800000000, -0.0005686200000000 ]  - [  -0.0000003900000000,  0.0014341000000000, -0.0014947500000000 ]  - [   0.0003229500000000,  0.0011304600000000, -0.0005415400000000 ]  - [  -0.0001314700000000, -0.0006446000000000, -0.0004627700000000 ]  - [  -0.0000557700000000, -0.0004474000000000, -0.0003765100000000 ]  - [  -0.0002544000000000, -0.0007867900000000, -0.0002263100000000 ]  - [   0.0011588600000000,  0.0003473900000000, -0.0004118000000000 ]  - [   0.0002384200000000,  0.0001429500000000,  0.0001122400000000 ]  - [   0.0000204300000000,  0.0000965700000000, -0.0005087500000000 ]  - [  -0.0010768600000000, -0.0001805300000000, -0.0005821700000000 ]  - [   0.0011683600000000, -0.0010403200000000, -0.0017397300000000 ]  - [  -0.0055774000000000, -0.0014529600000000, -0.0075455900000000 ]  - [  -0.0007860100000000,  0.0020088400000000,  0.0009777600000000 ]  - [   0.0013286000000000, -0.0001102800000000,  0.0007818000000000 ]  - [   0.0006673700000000, -0.0008187700000000, -0.0005399400000000 ]  - [   0.0002581000000000,  0.0004627400000000,  0.0007249100000000 ]  - [  -0.0008567600000000, -0.0003167900000000,  0.0001348400000000 ]  - [  -0.0009536800000000,  0.0001303300000000, -0.0002315200000000 ]  - [   0.0001928900000000,  0.0001949700000000, -0.0005362200000000 ]  - [  -0.0003817600000000, -0.0008978600000000,  0.0006828200000000 ]  - [  -0.0017289700000000, -0.0012387500000000, -0.0008695900000000 ]  - [  -0.0062192500000000, -0.0005666100000000, -0.0011941000000000 ]  - [   0.0004186300000000,  0.0009612100000000,  0.0001314700000000 ]