# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/8bd95ace-c3a7-4264-9f23-316bbd24f5fa/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 Mg3BeAl8O16 / P6_3mc (186) / materials id 17313](https://mdr.nims.go.jp/datasets/20253c10-1b63-4b80-8d56-25615839c3bf)

## 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: "P6_3mc"  number: 186  Hall_symbol: "P 6c -2c"supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     5.696257930000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -2.848128960000000,     4.933104070000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    18.373718109999999 ] # c  points:  - symbol: Be # 1    coordinates: [  0.333333330000000,  0.666666670000000,  0.996450070000000 ]    mass: 9.012182  - symbol: Be # 2    coordinates: [  0.666666670000000,  0.333333330000000,  0.496450070000000 ]    mass: 9.012182  - symbol: O  # 3    coordinates: [  0.814306700000000,  0.185693300000000,  0.834509690000000 ]    mass: 15.999400  - symbol: O  # 4    coordinates: [  0.185693300000000,  0.814306700000000,  0.334509690000000 ]    mass: 15.999400  - symbol: O  # 5    coordinates: [  0.628613400000000,  0.814306700000000,  0.334509690000000 ]    mass: 15.999400  - symbol: O  # 6    coordinates: [  0.814306700000000,  0.628613400000000,  0.834509690000000 ]    mass: 15.999400  - symbol: O  # 7    coordinates: [  0.185693300000000,  0.371386600000000,  0.334509690000000 ]    mass: 15.999400  - symbol: O  # 8    coordinates: [  0.371386600000000,  0.185693300000000,  0.834509690000000 ]    mass: 15.999400  - symbol: O  # 9    coordinates: [  0.666666670000000,  0.333333330000000,  0.338657160000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.333333330000000,  0.666666670000000,  0.838657160000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.814863720000000,  0.185136280000000,  0.452673400000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.185136280000000,  0.370272560000000,  0.952673400000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.629727440000000,  0.814863720000000,  0.952673400000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.370272560000000,  0.185136280000000,  0.452673400000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.814863720000000,  0.629727440000000,  0.452673400000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.185136280000000,  0.814863720000000,  0.952673400000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.333333330000000,  0.666666670000000,  0.451772720000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.666666670000000,  0.333333330000000,  0.951772720000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.161609430000000,  0.323218850000000,  0.582654170000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.323218850000000,  0.161609430000000,  0.082654170000000 ]    mass: 15.999400  - symbol: O  # 21    coordinates: [  0.838390570000000,  0.161609430000000,  0.082654170000000 ]    mass: 15.999400  - symbol: O  # 22    coordinates: [  0.161609430000000,  0.838390570000000,  0.582654170000000 ]    mass: 15.999400  - symbol: O  # 23    coordinates: [  0.676781150000000,  0.838390570000000,  0.582654170000000 ]    mass: 15.999400  - symbol: O  # 24    coordinates: [  0.838390570000000,  0.676781150000000,  0.082654170000000 ]    mass: 15.999400  - symbol: O  # 25    coordinates: [  0.000000000000000,  0.000000000000000,  0.191348760000000 ]    mass: 15.999400  - symbol: O  # 26    coordinates: [  0.000000000000000,  0.000000000000000,  0.691348760000000 ]    mass: 15.999400  - symbol: O  # 27    coordinates: [  0.480624580000000,  0.961249170000000,  0.199796550000000 ]    mass: 15.999400  - symbol: O  # 28    coordinates: [  0.961249170000000,  0.480624580000000,  0.699796550000000 ]    mass: 15.999400  - symbol: O  # 29    coordinates: [  0.519375420000000,  0.480624580000000,  0.699796550000000 ]    mass: 15.999400  - symbol: O  # 30    coordinates: [  0.480624580000000,  0.519375420000000,  0.199796550000000 ]    mass: 15.999400  - symbol: O  # 31    coordinates: [  0.038750830000000,  0.519375420000000,  0.199796550000000 ]    mass: 15.999400  - symbol: O  # 32    coordinates: [  0.519375420000000,  0.038750830000000,  0.699796550000000 ]    mass: 15.999400  - symbol: O  # 33    coordinates: [  0.333333330000000,  0.666666670000000,  0.083655130000000 ]    mass: 15.999400  - symbol: O  # 34    coordinates: [  0.666666670000000,  0.333333330000000,  0.583655130000000 ]    mass: 15.999400  - symbol: Mg # 35    coordinates: [  0.000000000000000,  0.000000000000000,  0.000090170000000 ]    mass: 24.305000  - symbol: Mg # 36    coordinates: [  0.000000000000000,  0.000000000000000,  0.500090170000000 ]    mass: 24.305000  - symbol: Mg # 37    coordinates: [  0.000000000000000,  0.000000000000000,  0.799348290000000 ]    mass: 24.305000  - symbol: Mg # 38    coordinates: [  0.000000000000000,  0.000000000000000,  0.299348290000000 ]    mass: 24.305000  - symbol: Mg # 39    coordinates: [  0.333333330000000,  0.666666670000000,  0.733575640000000 ]    mass: 24.305000  - symbol: Mg # 40    coordinates: [  0.666666670000000,  0.333333330000000,  0.233575640000000 ]    mass: 24.305000  - symbol: Al # 41    coordinates: [  0.501562450000000,  0.003124900000000,  0.393619440000000 ]    mass: 26.981539  - symbol: Al # 42    coordinates: [  0.498437550000000,  0.501562450000000,  0.893619440000000 ]    mass: 26.981539  - symbol: Al # 43    coordinates: [  0.833016420000000,  0.166983580000000,  0.639218240000000 ]    mass: 26.981539  - symbol: Al # 44    coordinates: [  0.166983580000000,  0.333967160000000,  0.139218240000000 ]    mass: 26.981539  - symbol: Al # 45    coordinates: [  0.666032840000000,  0.833016420000000,  0.139218240000000 ]    mass: 26.981539  - symbol: Al # 46    coordinates: [  0.333967160000000,  0.166983580000000,  0.639218240000000 ]    mass: 26.981539  - symbol: Al # 47    coordinates: [  0.833016420000000,  0.666032840000000,  0.639218240000000 ]    mass: 26.981539  - symbol: Al # 48    coordinates: [  0.166983580000000,  0.833016420000000,  0.139218240000000 ]    mass: 26.981539  - symbol: Al # 49    coordinates: [  0.333333330000000,  0.666666670000000,  0.549637630000000 ]    mass: 26.981539  - symbol: Al # 50    coordinates: [  0.666666670000000,  0.333333330000000,  0.049637630000000 ]    mass: 26.981539  - symbol: Al # 51    coordinates: [  0.996875100000000,  0.498437550000000,  0.393619440000000 ]    mass: 26.981539  - symbol: Al # 52    coordinates: [  0.003124900000000,  0.501562450000000,  0.893619440000000 ]    mass: 26.981539  - symbol: Al # 53    coordinates: [  0.498437550000000,  0.996875100000000,  0.893619440000000 ]    mass: 26.981539  - symbol: Al # 54    coordinates: [  0.501562450000000,  0.498437550000000,  0.393619440000000 ]    mass: 26.981539  - symbol: Al # 55    coordinates: [  0.666666670000000,  0.333333330000000,  0.767149990000000 ]    mass: 26.981539  - symbol: Al # 56    coordinates: [  0.333333330000000,  0.666666670000000,  0.267149990000000 ]    mass: 26.981539  reciprocal_lattice: # without 2pi  - [     0.175553848208555,     0.101356061422444,     0.000000000000000 ] # a*  - [     0.000000000000000,     0.202712123200758,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.054425565583035 ] # c*unit_cell:  lattice:  - [     5.696257930000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -2.848128960000000,     4.933104070000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    18.373718109999999 ] # c  points:  - symbol: Be # 1    coordinates: [  0.333333330000000,  0.666666670000000,  0.996450070000000 ]    mass: 9.012182    reduced_to: 1  - symbol: Be # 2    coordinates: [  0.666666670000000,  0.333333330000000,  0.496450070000000 ]    mass: 9.012182    reduced_to: 2  - symbol: O  # 3    coordinates: [  0.814306700000000,  0.185693300000000,  0.834509690000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.185693300000000,  0.814306700000000,  0.334509690000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 5    coordinates: [  0.628613400000000,  0.814306700000000,  0.334509690000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.814306700000000,  0.628613400000000,  0.834509690000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 7    coordinates: [  0.185693300000000,  0.371386600000000,  0.334509690000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.371386600000000,  0.185693300000000,  0.834509690000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 9    coordinates: [  0.666666670000000,  0.333333330000000,  0.338657160000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.333333330000000,  0.666666670000000,  0.838657160000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.814863720000000,  0.185136280000000,  0.452673400000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.185136280000000,  0.370272560000000,  0.952673400000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.629727440000000,  0.814863720000000,  0.952673400000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.370272560000000,  0.185136280000000,  0.452673400000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.814863720000000,  0.629727440000000,  0.452673400000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.185136280000000,  0.814863720000000,  0.952673400000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.333333330000000,  0.666666670000000,  0.451772720000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.666666670000000,  0.333333330000000,  0.951772720000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.161609430000000,  0.323218850000000,  0.582654170000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.323218850000000,  0.161609430000000,  0.082654170000000 ]    mass: 15.999400    reduced_to: 20  - symbol: O  # 21    coordinates: [  0.838390570000000,  0.161609430000000,  0.082654170000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.161609430000000,  0.838390570000000,  0.582654170000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 23    coordinates: [  0.676781150000000,  0.838390570000000,  0.582654170000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.838390570000000,  0.676781150000000,  0.082654170000000 ]    mass: 15.999400    reduced_to: 24  - symbol: O  # 25    coordinates: [  0.000000000000000,  0.000000000000000,  0.191348760000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.000000000000000,  0.000000000000000,  0.691348760000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 27    coordinates: [  0.480624580000000,  0.961249170000000,  0.199796550000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.961249170000000,  0.480624580000000,  0.699796550000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 29    coordinates: [  0.519375420000000,  0.480624580000000,  0.699796550000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.480624580000000,  0.519375420000000,  0.199796550000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 31    coordinates: [  0.038750830000000,  0.519375420000000,  0.199796550000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.519375420000000,  0.038750830000000,  0.699796550000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 33    coordinates: [  0.333333330000000,  0.666666670000000,  0.083655130000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.666666670000000,  0.333333330000000,  0.583655130000000 ]    mass: 15.999400    reduced_to: 34  - symbol: Mg # 35    coordinates: [  0.000000000000000,  0.000000000000000,  0.000090170000000 ]    mass: 24.305000    reduced_to: 35  - symbol: Mg # 36    coordinates: [  0.000000000000000,  0.000000000000000,  0.500090170000000 ]    mass: 24.305000    reduced_to: 36  - symbol: Mg # 37    coordinates: [  0.000000000000000,  0.000000000000000,  0.799348290000000 ]    mass: 24.305000    reduced_to: 37  - symbol: Mg # 38    coordinates: [  0.000000000000000,  0.000000000000000,  0.299348290000000 ]    mass: 24.305000    reduced_to: 38  - symbol: Mg # 39    coordinates: [  0.333333330000000,  0.666666670000000,  0.733575640000000 ]    mass: 24.305000    reduced_to: 39  - symbol: Mg # 40    coordinates: [  0.666666670000000,  0.333333330000000,  0.233575640000000 ]    mass: 24.305000    reduced_to: 40  - symbol: Al # 41    coordinates: [  0.501562450000000,  0.003124900000000,  0.393619440000000 ]    mass: 26.981539    reduced_to: 41  - symbol: Al # 42    coordinates: [  0.498437550000000,  0.501562450000000,  0.893619440000000 ]    mass: 26.981539    reduced_to: 42  - symbol: Al # 43    coordinates: [  0.833016420000000,  0.166983580000000,  0.639218240000000 ]    mass: 26.981539    reduced_to: 43  - symbol: Al # 44    coordinates: [  0.166983580000000,  0.333967160000000,  0.139218240000000 ]    mass: 26.981539    reduced_to: 44  - symbol: Al # 45    coordinates: [  0.666032840000000,  0.833016420000000,  0.139218240000000 ]    mass: 26.981539    reduced_to: 45  - symbol: Al # 46    coordinates: [  0.333967160000000,  0.166983580000000,  0.639218240000000 ]    mass: 26.981539    reduced_to: 46  - symbol: Al # 47    coordinates: [  0.833016420000000,  0.666032840000000,  0.639218240000000 ]    mass: 26.981539    reduced_to: 47  - symbol: Al # 48    coordinates: [  0.166983580000000,  0.833016420000000,  0.139218240000000 ]    mass: 26.981539    reduced_to: 48  - symbol: Al # 49    coordinates: [  0.333333330000000,  0.666666670000000,  0.549637630000000 ]    mass: 26.981539    reduced_to: 49  - symbol: Al # 50    coordinates: [  0.666666670000000,  0.333333330000000,  0.049637630000000 ]    mass: 26.981539    reduced_to: 50  - symbol: Al # 51    coordinates: [  0.996875100000000,  0.498437550000000,  0.393619440000000 ]    mass: 26.981539    reduced_to: 51  - symbol: Al # 52    coordinates: [  0.003124900000000,  0.501562450000000,  0.893619440000000 ]    mass: 26.981539    reduced_to: 52  - symbol: Al # 53    coordinates: [  0.498437550000000,  0.996875100000000,  0.893619440000000 ]    mass: 26.981539    reduced_to: 53  - symbol: Al # 54    coordinates: [  0.501562450000000,  0.498437550000000,  0.393619440000000 ]    mass: 26.981539    reduced_to: 54  - symbol: Al # 55    coordinates: [  0.666666670000000,  0.333333330000000,  0.767149990000000 ]    mass: 26.981539    reduced_to: 55  - symbol: Al # 56    coordinates: [  0.333333330000000,  0.666666670000000,  0.267149990000000 ]    mass: 26.981539    reduced_to: 56supercell:  lattice:  - [     5.696257930000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -2.848128960000000,     4.933104070000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    18.373718109999999 ] # c  points:  - symbol: Be # 1    coordinates: [  0.333333330000000,  0.666666670000000,  0.996450070000000 ]    mass: 9.012182    reduced_to: 1  - symbol: Be # 2    coordinates: [  0.666666670000000,  0.333333330000000,  0.496450070000000 ]    mass: 9.012182    reduced_to: 2  - symbol: O  # 3    coordinates: [  0.814306700000000,  0.185693300000000,  0.834509690000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.185693300000000,  0.814306700000000,  0.334509690000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 5    coordinates: [  0.628613400000000,  0.814306700000000,  0.334509690000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.814306700000000,  0.628613400000000,  0.834509690000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 7    coordinates: [  0.185693300000000,  0.371386600000000,  0.334509690000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.371386600000000,  0.185693300000000,  0.834509690000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 9    coordinates: [  0.666666670000000,  0.333333330000000,  0.338657160000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.333333330000000,  0.666666670000000,  0.838657160000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.814863720000000,  0.185136280000000,  0.452673400000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.185136280000000,  0.370272560000000,  0.952673400000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.629727440000000,  0.814863720000000,  0.952673400000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.370272560000000,  0.185136280000000,  0.452673400000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.814863720000000,  0.629727440000000,  0.452673400000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.185136280000000,  0.814863720000000,  0.952673400000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.333333330000000,  0.666666670000000,  0.451772720000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.666666670000000,  0.333333330000000,  0.951772720000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.161609430000000,  0.323218850000000,  0.582654170000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.323218850000000,  0.161609430000000,  0.082654170000000 ]    mass: 15.999400    reduced_to: 20  - symbol: O  # 21    coordinates: [  0.838390570000000,  0.161609430000000,  0.082654170000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.161609430000000,  0.838390570000000,  0.582654170000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 23    coordinates: [  0.676781150000000,  0.838390570000000,  0.582654170000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.838390570000000,  0.676781150000000,  0.082654170000000 ]    mass: 15.999400    reduced_to: 24  - symbol: O  # 25    coordinates: [  0.000000000000000,  0.000000000000000,  0.191348760000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.000000000000000,  0.000000000000000,  0.691348760000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 27    coordinates: [  0.480624580000000,  0.961249170000000,  0.199796550000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.961249170000000,  0.480624580000000,  0.699796550000000 ]    mass: 15.999400    reduced_to: 28  - symbol: O  # 29    coordinates: [  0.519375420000000,  0.480624580000000,  0.699796550000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.480624580000000,  0.519375420000000,  0.199796550000000 ]    mass: 15.999400    reduced_to: 30  - symbol: O  # 31    coordinates: [  0.038750830000000,  0.519375420000000,  0.199796550000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.519375420000000,  0.038750830000000,  0.699796550000000 ]    mass: 15.999400    reduced_to: 32  - symbol: O  # 33    coordinates: [  0.333333330000000,  0.666666670000000,  0.083655130000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.666666670000000,  0.333333330000000,  0.583655130000000 ]    mass: 15.999400    reduced_to: 34  - symbol: Mg # 35    coordinates: [  0.000000000000000,  0.000000000000000,  0.000090170000000 ]    mass: 24.305000    reduced_to: 35  - symbol: Mg # 36    coordinates: [  0.000000000000000,  0.000000000000000,  0.500090170000000 ]    mass: 24.305000    reduced_to: 36  - symbol: Mg # 37    coordinates: [  0.000000000000000,  0.000000000000000,  0.799348290000000 ]    mass: 24.305000    reduced_to: 37  - symbol: Mg # 38    coordinates: [  0.000000000000000,  0.000000000000000,  0.299348290000000 ]    mass: 24.305000    reduced_to: 38  - symbol: Mg # 39    coordinates: [  0.333333330000000,  0.666666670000000,  0.733575640000000 ]    mass: 24.305000    reduced_to: 39  - symbol: Mg # 40    coordinates: [  0.666666670000000,  0.333333330000000,  0.233575640000000 ]    mass: 24.305000    reduced_to: 40  - symbol: Al # 41    coordinates: [  0.501562450000000,  0.003124900000000,  0.393619440000000 ]    mass: 26.981539    reduced_to: 41  - symbol: Al # 42    coordinates: [  0.498437550000000,  0.501562450000000,  0.893619440000000 ]    mass: 26.981539    reduced_to: 42  - symbol: Al # 43    coordinates: [  0.833016420000000,  0.166983580000000,  0.639218240000000 ]    mass: 26.981539    reduced_to: 43  - symbol: Al # 44    coordinates: [  0.166983580000000,  0.333967160000000,  0.139218240000000 ]    mass: 26.981539    reduced_to: 44  - symbol: Al # 45    coordinates: [  0.666032840000000,  0.833016420000000,  0.139218240000000 ]    mass: 26.981539    reduced_to: 45  - symbol: Al # 46    coordinates: [  0.333967160000000,  0.166983580000000,  0.639218240000000 ]    mass: 26.981539    reduced_to: 46  - symbol: Al # 47    coordinates: [  0.833016420000000,  0.666032840000000,  0.639218240000000 ]    mass: 26.981539    reduced_to: 47  - symbol: Al # 48    coordinates: [  0.166983580000000,  0.833016420000000,  0.139218240000000 ]    mass: 26.981539    reduced_to: 48  - symbol: Al # 49    coordinates: [  0.333333330000000,  0.666666670000000,  0.549637630000000 ]    mass: 26.981539    reduced_to: 49  - symbol: Al # 50    coordinates: [  0.666666670000000,  0.333333330000000,  0.049637630000000 ]    mass: 26.981539    reduced_to: 50  - symbol: Al # 51    coordinates: [  0.996875100000000,  0.498437550000000,  0.393619440000000 ]    mass: 26.981539    reduced_to: 51  - symbol: Al # 52    coordinates: [  0.003124900000000,  0.501562450000000,  0.893619440000000 ]    mass: 26.981539    reduced_to: 52  - symbol: Al # 53    coordinates: [  0.498437550000000,  0.996875100000000,  0.893619440000000 ]    mass: 26.981539    reduced_to: 53  - symbol: Al # 54    coordinates: [  0.501562450000000,  0.498437550000000,  0.393619440000000 ]    mass: 26.981539    reduced_to: 54  - symbol: Al # 55    coordinates: [  0.666666670000000,  0.333333330000000,  0.767149990000000 ]    mass: 26.981539    reduced_to: 55  - symbol: Al # 56    coordinates: [  0.333333330000000,  0.666666670000000,  0.267149990000000 ]    mass: 26.981539    reduced_to: 56displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.1318090500000000, -0.0013506500000000,  0.0017572700000000 ]  - [   0.0000142800000000,  0.0000002900000000,  0.0000118700000000 ]  - [   0.0013390200000000, -0.0027892500000000,  0.0042011100000000 ]  - [   0.0000020800000000, -0.0000727500000000, -0.0000434400000000 ]  - [  -0.0000410500000000,  0.0000445100000000,  0.0000893700000000 ]  - [  -0.0034832400000000, -0.0000334700000000,  0.0000193900000000 ]  - [  -0.0001209100000000,  0.0000205600000000,  0.0000196800000000 ]  - [   0.0014114900000000,  0.0028208400000000, -0.0041502800000000 ]  - [   0.0000774900000000,  0.0000005700000000,  0.0000521600000000 ]  - [   0.0072579300000000,  0.0000186200000000,  0.0000657500000000 ]  - [  -0.0000305600000000,  0.0000206200000000, -0.0000262600000000 ]  - [   0.0242925300000000,  0.0001893400000000,  0.0000353900000000 ]  - [   0.0384512500000000,  0.0081879600000000, -0.0043518300000000 ]  - [   0.0000180200000000,  0.0000077500000000, -0.0000380900000000 ]  - [   0.0000050900000000, -0.0000251200000000, -0.0000302200000000 ]  - [   0.0363494200000000, -0.0069587600000000,  0.0029111100000000 ]  - [  -0.0000110800000000, -0.0000005400000000, -0.0000307600000000 ]  - [  -0.0011215500000000,  0.0000145200000000,  0.0000004600000000 ]  - [  -0.0000476300000000, -0.0000048600000000, -0.0000065800000000 ]  - [  -0.0006245500000000,  0.0031358400000000,  0.0014659600000000 ]  - [  -0.0006192100000000, -0.0031403800000000, -0.0014855300000000 ]  - [  -0.0000077000000000, -0.0000234800000000,  0.0000499000000000 ]  - [   0.0000029200000000,  0.0000289600000000, -0.0000615800000000 ]  - [  -0.0060575000000000, -0.0000083700000000, -0.0000506800000000 ]  - [  -0.0000367500000000, -0.0000080800000000, -0.0000370400000000 ]  - [  -0.0001202300000000,  0.0000001300000000, -0.0000260800000000 ]  - [  -0.0004141700000000, -0.0000046200000000,  0.0000258800000000 ]  - [   0.0000976700000000, -0.0001493100000000,  0.0005912300000000 ]  - [   0.0001353600000000,  0.0001253000000000, -0.0005789200000000 ]  - [   0.0003970700000000, -0.0004625800000000,  0.0018188200000000 ]  - [   0.0004067400000000,  0.0004796900000000, -0.0017989400000000 ]  - [   0.0003543500000000,  0.0000169700000000,  0.0000072200000000 ]  - [   0.0213514800000000,  0.0000167000000000, -0.0002913600000000 ]  - [   0.0000743900000000, -0.0000002400000000, -0.0000213400000000 ]  - [   0.0180528100000000,  0.0000812400000000, -0.0000657400000000 ]  - [  -0.0000145900000000, -0.0000051600000000, -0.0000150600000000 ]  - [   0.0027439700000000, -0.0000086000000000,  0.0000274400000000 ]  - [  -0.0000109400000000,  0.0000090000000000,  0.0000163400000000 ]  - [   0.0003165900000000,  0.0000107800000000,  0.0000129600000000 ]  - [  -0.0004584600000000, -0.0000131800000000,  0.0000181800000000 ]  - [   0.0000464400000000,  0.0000018500000000, -0.0000109300000000 ]  - [   0.0062623800000000, -0.0195710700000000, -0.0234553200000000 ]  - [   0.0000116500000000, -0.0001707500000000, -0.0001439500000000 ]  - [   0.0008714500000000,  0.0000262100000000, -0.0000064900000000 ]  - [   0.0004407200000000, -0.0002053000000000,  0.0057345400000000 ]  - [  -0.0000059500000000,  0.0001601600000000,  0.0001845300000000 ]  - [  -0.0002837300000000,  0.0000102200000000,  0.0000202000000000 ]  - [   0.0005419600000000,  0.0002335900000000, -0.0056411000000000 ]  - [   0.0000528800000000, -0.0000007900000000,  0.0000684700000000 ]  - [   0.0071441600000000, -0.0000909000000000,  0.0000909800000000 ]  - [  -0.0000024400000000, -0.0000275900000000,  0.0000321200000000 ]  - [   0.0063475200000000,  0.0195074800000000,  0.0232021300000000 ]  - [  -0.0275371200000000, -0.0000737700000000,  0.0000286300000000 ]  - [   0.0000019600000000,  0.0000262100000000, -0.0000529400000000 ]  - [  -0.0026274600000000, -0.0000005200000000, -0.0000682500000000 ]  - [   0.0006128300000000,  0.0000041900000000, -0.0000704100000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.2433331200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0047857300000000 ]  - [  -0.0008424600000000,  0.0004863900000000, -0.0028471900000000 ]  - [   0.0000976200000000, -0.0000563600000000, -0.0043091700000000 ]  - [  -0.0000976200000000, -0.0000563600000000, -0.0043091700000000 ]  - [   0.0000000000000000, -0.0009727900000000, -0.0028471900000000 ]  - [   0.0000000000000000,  0.0001127300000000, -0.0043091700000000 ]  - [   0.0008424600000000,  0.0004863900000000, -0.0028471900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0046807800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057145800000000 ]  - [  -0.0001596900000000,  0.0000922000000000, -0.0041172000000000 ]  - [   0.0000000000000000,  0.0072890200000000,  0.0328575100000000 ]  - [  -0.0063124800000000, -0.0036445100000000,  0.0328575100000000 ]  - [   0.0001596900000000,  0.0000922000000000, -0.0041172000000000 ]  - [   0.0000000000000000, -0.0001844000000000, -0.0041172000000000 ]  - [   0.0063124800000000, -0.0036445100000000,  0.0328575100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0051580200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0098899400000000 ]  - [   0.0000000000000000,  0.0005358100000000, -0.0040390000000000 ]  - [   0.0000983900000000,  0.0000568100000000,  0.0088393500000000 ]  - [  -0.0000983900000000,  0.0000568100000000,  0.0088393500000000 ]  - [   0.0004640200000000, -0.0002679000000000, -0.0040390000000000 ]  - [  -0.0004640200000000, -0.0002679000000000, -0.0040390000000000 ]  - [   0.0000000000000000, -0.0001136200000000,  0.0088393500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001372200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041319000000000 ]  - [   0.0000000000000000, -0.0037323400000000, -0.0070075500000000 ]  - [  -0.0001421600000000, -0.0000820700000000, -0.0044659800000000 ]  - [   0.0001421600000000, -0.0000820700000000, -0.0044659800000000 ]  - [  -0.0032323000000000,  0.0018661700000000, -0.0070075500000000 ]  - [   0.0032323000000000,  0.0018661700000000, -0.0070075500000000 ]  - [   0.0000000000000000,  0.0001641500000000, -0.0044659800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0934783300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0052293100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0251065000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0048744500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0052818700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0039987500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0055920800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0030833400000000 ]  - [   0.0000000000000000,  0.0002540900000000,  0.0060820000000000 ]  - [  -0.0192724100000000,  0.0111269300000000,  0.0172525900000000 ]  - [  -0.0003938800000000,  0.0002274100000000,  0.0060097700000000 ]  - [   0.0000000000000000, -0.0177383300000000,  0.0105804300000000 ]  - [   0.0153618500000000,  0.0088691700000000,  0.0105804300000000 ]  - [   0.0003938800000000,  0.0002274100000000,  0.0060097700000000 ]  - [   0.0000000000000000, -0.0004548200000000,  0.0060097700000000 ]  - [  -0.0153618500000000,  0.0088691700000000,  0.0105804300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0067007100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0243019500000000 ]  - [  -0.0002200500000000, -0.0001270400000000,  0.0060820000000000 ]  - [   0.0192724100000000,  0.0111269300000000,  0.0172525900000000 ]  - [   0.0000000000000000, -0.0222538700000000,  0.0172525900000000 ]  - [   0.0002200500000000, -0.0001270400000000,  0.0060820000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0069819300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0086195700000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.2375642200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0047610300000000 ]  - [   0.0007917300000000, -0.0004571000000000,  0.0028564500000000 ]  - [  -0.0000537800000000,  0.0000310500000000,  0.0043497900000000 ]  - [   0.0000537800000000,  0.0000310500000000,  0.0043497900000000 ]  - [   0.0000000000000000,  0.0009142100000000,  0.0028564500000000 ]  - [   0.0000000000000000, -0.0000621000000000,  0.0043497900000000 ]  - [  -0.0007917300000000, -0.0004571000000000,  0.0028564500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0047781200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0058139200000000 ]  - [   0.0001113200000000, -0.0000642700000000,  0.0040505600000000 ]  - [   0.0000000000000000, -0.0079214100000000, -0.0332502100000000 ]  - [   0.0068601400000000,  0.0039607000000000, -0.0332502100000000 ]  - [  -0.0001113200000000, -0.0000642700000000,  0.0040505600000000 ]  - [   0.0000000000000000,  0.0001285400000000,  0.0040505600000000 ]  - [  -0.0068601400000000,  0.0039607000000000, -0.0332502100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0050891800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0099593500000000 ]  - [   0.0000000000000000, -0.0005461400000000,  0.0040215700000000 ]  - [  -0.0001182200000000, -0.0000682500000000, -0.0088042000000000 ]  - [   0.0001182200000000, -0.0000682500000000, -0.0088042000000000 ]  - [  -0.0004729800000000,  0.0002730700000000,  0.0040215700000000 ]  - [   0.0004729800000000,  0.0002730700000000,  0.0040215700000000 ]  - [   0.0000000000000000,  0.0001365100000000, -0.0088042000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000948200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040761700000000 ]  - [   0.0000000000000000,  0.0036985800000000,  0.0070156700000000 ]  - [   0.0001120600000000,  0.0000647000000000,  0.0044761000000000 ]  - [  -0.0001120600000000,  0.0000647000000000,  0.0044761000000000 ]  - [   0.0032030700000000, -0.0018492900000000,  0.0070156700000000 ]  - [  -0.0032030700000000, -0.0018492900000000,  0.0070156700000000 ]  - [   0.0000000000000000, -0.0001294000000000,  0.0044761000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0865512600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0051810900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0249766900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0049008000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0052176700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0039634400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055769100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0030527600000000 ]  - [   0.0000000000000000, -0.0002508400000000, -0.0060973500000000 ]  - [   0.0195942800000000, -0.0113127700000000, -0.0173767000000000 ]  - [   0.0004130600000000, -0.0002384800000000, -0.0059649600000000 ]  - [   0.0000000000000000,  0.0176231600000000, -0.0104370700000000 ]  - [  -0.0152621000000000, -0.0088115800000000, -0.0104370700000000 ]  - [  -0.0004130600000000, -0.0002384800000000, -0.0059649600000000 ]  - [   0.0000000000000000,  0.0004769600000000, -0.0059649600000000 ]  - [   0.0152621000000000, -0.0088115800000000, -0.0104370700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0065592600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0242881800000000 ]  - [   0.0002172400000000,  0.0001254200000000, -0.0060973500000000 ]  - [  -0.0195942800000000, -0.0113127700000000, -0.0173767000000000 ]  - [   0.0000000000000000,  0.0226255300000000, -0.0173767000000000 ]  - [  -0.0002172400000000,  0.0001254200000000, -0.0060973500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0070945700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0087442700000000 ]- atom:    3  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0013662600000000, -0.0028139100000000, -0.0008046000000000 ]  - [  -0.0000252500000000, -0.0000560700000000, -0.0000636200000000 ]  - [  -0.1978491300000000,  0.0366032500000000,  0.0221440500000000 ]  - [   0.0000140800000000, -0.0000161700000000, -0.0000089200000000 ]  - [  -0.0000012900000000, -0.0000107100000000, -0.0000155900000000 ]  - [   0.0079940200000000, -0.0247354600000000,  0.0006331300000000 ]  - [   0.0000013300000000,  0.0000108200000000, -0.0000275000000000 ]  - [   0.0533623200000000, -0.0016799100000000, -0.0004353300000000 ]  - [   0.0000025500000000,  0.0000097300000000,  0.0000289200000000 ]  - [   0.0075471100000000,  0.0180229100000000,  0.0005242500000000 ]  - [  -0.0000432500000000,  0.0000175900000000, -0.0000437400000000 ]  - [   0.0060784200000000,  0.0057754100000000,  0.0086293700000000 ]  - [  -0.0014967700000000, -0.0008586500000000,  0.0018433300000000 ]  - [   0.0000411400000000,  0.0000280500000000, -0.0000792900000000 ]  - [  -0.0000053300000000, -0.0000309900000000,  0.0000051500000000 ]  - [  -0.0005154800000000,  0.0016635500000000, -0.0009291800000000 ]  - [   0.0000173600000000,  0.0000057400000000, -0.0001437900000000 ]  - [   0.0040975500000000, -0.0046869800000000, -0.0150698100000000 ]  - [   0.0001113800000000,  0.0003457400000000, -0.0003363100000000 ]  - [   0.0006485800000000,  0.0000641100000000, -0.0002477300000000 ]  - [  -0.0005100800000000,  0.0001288100000000, -0.0000825100000000 ]  - [   0.0008443500000000,  0.0001166700000000, -0.0003031700000000 ]  - [  -0.0006012600000000, -0.0000861800000000,  0.0000473500000000 ]  - [   0.0000297500000000, -0.0006134600000000, -0.0007402300000000 ]  - [   0.0000189700000000, -0.0000619200000000, -0.0002493300000000 ]  - [   0.0015624900000000, -0.0013782100000000, -0.0036017600000000 ]  - [  -0.0000014400000000,  0.0000399300000000,  0.0001177100000000 ]  - [  -0.0029000300000000,  0.0012966100000000, -0.0024551800000000 ]  - [   0.0005602100000000, -0.0009171800000000,  0.0013653800000000 ]  - [   0.0000523700000000, -0.0000121700000000, -0.0000094800000000 ]  - [  -0.0000634200000000, -0.0000115300000000,  0.0000300700000000 ]  - [   0.0011975300000000,  0.0011620400000000,  0.0064180600000000 ]  - [  -0.0002363000000000,  0.0004601700000000,  0.0008591600000000 ]  - [  -0.0002709700000000, -0.0005812600000000,  0.0002553300000000 ]  - [  -0.0009746000000000,  0.0018337300000000, -0.0021813500000000 ]  - [   0.0000584800000000,  0.0000669800000000,  0.0000656900000000 ]  - [   0.0477782400000000, -0.0270633400000000, -0.0212639100000000 ]  - [  -0.0000154000000000,  0.0000081500000000,  0.0000802300000000 ]  - [  -0.0011806900000000, -0.0036306100000000,  0.0014114800000000 ]  - [   0.0000242400000000, -0.0000389800000000,  0.0000730500000000 ]  - [  -0.0000108600000000, -0.0000106900000000,  0.0000458400000000 ]  - [  -0.0077268700000000,  0.0049331900000000,  0.0039035600000000 ]  - [   0.0026348300000000,  0.0006793200000000,  0.0009488800000000 ]  - [  -0.0000504100000000,  0.0003463800000000, -0.0003106400000000 ]  - [  -0.0004825400000000, -0.0000309000000000, -0.0000298300000000 ]  - [  -0.0027013300000000, -0.0001907800000000, -0.0005358700000000 ]  - [   0.0009351400000000,  0.0012057600000000,  0.0008237800000000 ]  - [   0.0004939700000000, -0.0000913800000000,  0.0000831300000000 ]  - [  -0.0001423200000000, -0.0002022800000000, -0.0000924900000000 ]  - [   0.0003352800000000, -0.0005217700000000,  0.0030502900000000 ]  - [   0.0000226000000000,  0.0000044000000000,  0.0000373700000000 ]  - [   0.0176419800000000, -0.0038468800000000, -0.0021486000000000 ]  - [   0.0311620200000000,  0.0053932300000000, -0.0115642700000000 ]  - [  -0.0000243700000000, -0.0000083500000000,  0.0000421600000000 ]  - [   0.0312024900000000, -0.0060639600000000,  0.0103404000000000 ]  - [  -0.0000076400000000,  0.0000284100000000, -0.0000330700000000 ]- atom:    3  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0013950100000000,  0.0028007000000000,  0.0008280500000000 ]  - [   0.0000247100000000,  0.0000564500000000,  0.0000871500000000 ]  - [   0.1985739300000000, -0.0346427000000000, -0.0207136000000000 ]  - [   0.0000411800000000, -0.0000162300000000,  0.0000591100000000 ]  - [  -0.0000325400000000, -0.0000132100000000,  0.0000568300000000 ]  - [  -0.0079024200000000,  0.0247548100000000, -0.0005952700000000 ]  - [   0.0000021900000000,  0.0000315800000000,  0.0000697800000000 ]  - [  -0.0541918300000000,  0.0017401700000000,  0.0005063200000000 ]  - [  -0.0000037400000000, -0.0000094800000000,  0.0000738600000000 ]  - [  -0.0075224200000000, -0.0179350000000000, -0.0003870700000000 ]  - [  -0.0000113800000000,  0.0000136600000000, -0.0000231200000000 ]  - [  -0.0060678900000000, -0.0056612900000000, -0.0085607600000000 ]  - [   0.0014577000000000,  0.0008954200000000, -0.0019566700000000 ]  - [   0.0000022200000000, -0.0000028600000000,  0.0000184800000000 ]  - [   0.0000052200000000, -0.0000202600000000, -0.0000657300000000 ]  - [   0.0005764400000000, -0.0017130900000000,  0.0008865500000000 ]  - [  -0.0000172000000000, -0.0000069400000000,  0.0000830500000000 ]  - [  -0.0040233100000000,  0.0047021200000000,  0.0150738400000000 ]  - [  -0.0001134400000000, -0.0003519700000000,  0.0003222600000000 ]  - [  -0.0006557700000000, -0.0000677500000000,  0.0002345300000000 ]  - [   0.0005192000000000, -0.0001377600000000,  0.0000724900000000 ]  - [  -0.0008525800000000, -0.0001160700000000,  0.0002956000000000 ]  - [   0.0006073800000000,  0.0000891900000000, -0.0000664800000000 ]  - [  -0.0000341000000000,  0.0006225900000000,  0.0007248600000000 ]  - [  -0.0000207600000000,  0.0000622100000000,  0.0001968500000000 ]  - [  -0.0015671200000000,  0.0013584000000000,  0.0035123800000000 ]  - [  -0.0000018700000000, -0.0000762300000000, -0.0001021700000000 ]  - [   0.0028629400000000, -0.0013515000000000,  0.0025436900000000 ]  - [  -0.0004973600000000,  0.0009002500000000, -0.0013709200000000 ]  - [  -0.0001007400000000,  0.0000401300000000,  0.0000194400000000 ]  - [   0.0000921700000000,  0.0000318800000000, -0.0000154900000000 ]  - [  -0.0011724300000000, -0.0011273200000000, -0.0064354900000000 ]  - [   0.0002395100000000, -0.0004559500000000, -0.0008966500000000 ]  - [   0.0002760700000000,  0.0005825700000000, -0.0002959200000000 ]  - [   0.0009725700000000, -0.0018126900000000,  0.0021183500000000 ]  - [  -0.0000420700000000, -0.0000774700000000, -0.0000979500000000 ]  - [  -0.0454558000000000,  0.0254193400000000,  0.0200926800000000 ]  - [  -0.0000172200000000,  0.0000106100000000, -0.0000557100000000 ]  - [   0.0011610800000000,  0.0036221300000000, -0.0013572600000000 ]  - [   0.0000083300000000,  0.0000196200000000, -0.0000480700000000 ]  - [   0.0000105600000000,  0.0000133500000000, -0.0000674500000000 ]  - [   0.0076475600000000, -0.0050451300000000, -0.0040200400000000 ]  - [  -0.0026048700000000, -0.0007133700000000, -0.0009127900000000 ]  - [   0.0000511000000000, -0.0003649000000000,  0.0003474200000000 ]  - [   0.0004981200000000,  0.0000401000000000,  0.0000706700000000 ]  - [   0.0026737100000000,  0.0001863200000000,  0.0005917500000000 ]  - [  -0.0009615800000000, -0.0011705500000000, -0.0007845100000000 ]  - [  -0.0005105600000000,  0.0001019600000000, -0.0000445800000000 ]  - [   0.0001499100000000,  0.0002011400000000,  0.0002262100000000 ]  - [  -0.0003310000000000,  0.0005230700000000, -0.0028926700000000 ]  - [  -0.0000253800000000, -0.0000056800000000, -0.0000589500000000 ]  - [  -0.0176201100000000,  0.0037383800000000,  0.0020311900000000 ]  - [  -0.0323586200000000, -0.0064542700000000,  0.0126899800000000 ]  - [   0.0000274500000000,  0.0000063400000000, -0.0000636200000000 ]  - [  -0.0323786300000000,  0.0068139900000000, -0.0118410300000000 ]  - [   0.0000085100000000, -0.0000288400000000, -0.0001033800000000 ]- atom:    3  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0041859200000000, -0.0024167400000000, -0.0028311600000000 ]  - [   0.0000681000000000, -0.0000393200000000, -0.0043157300000000 ]  - [   0.0224369900000000, -0.0129540000000000, -0.1505423900000000 ]  - [   0.0000621700000000, -0.0000359000000000,  0.0040592400000000 ]  - [  -0.0000537200000000, -0.0000475100000000,  0.0040531900000000 ]  - [   0.0011323300000000, -0.0000125200000000, -0.0172662600000000 ]  - [   0.0000142800000000,  0.0000702700000000,  0.0040531900000000 ]  - [   0.0005770100000000, -0.0009743700000000, -0.0172662600000000 ]  - [  -0.0000212100000000,  0.0000122500000000,  0.0041528000000000 ]  - [  -0.0000326800000000,  0.0000188700000000, -0.0147041800000000 ]  - [   0.0000535400000000, -0.0000309100000000,  0.0035896500000000 ]  - [   0.0074671800000000,  0.0068769900000000,  0.0049836400000000 ]  - [  -0.0022220600000000, -0.0099052600000000,  0.0049836400000000 ]  - [  -0.0000833300000000, -0.0001105700000000,  0.0037511700000000 ]  - [   0.0000540900000000,  0.0001274500000000,  0.0037511700000000 ]  - [  -0.0010680900000000,  0.0006166600000000, -0.0041984300000000 ]  - [  -0.0000817900000000,  0.0000472200000000,  0.0047461000000000 ]  - [  -0.0165879300000000,  0.0095770400000000,  0.0189780300000000 ]  - [  -0.0004492700000000, -0.0005095800000000,  0.0031475700000000 ]  - [  -0.0007374800000000, -0.0010775900000000,  0.0039549000000000 ]  - [   0.0006248300000000, -0.0003607500000000,  0.0036436600000000 ]  - [  -0.0002422700000000,  0.0001398800000000,  0.0050608600000000 ]  - [   0.0002166700000000,  0.0006438700000000,  0.0031475700000000 ]  - [   0.0005644800000000,  0.0011774700000000,  0.0039549000000000 ]  - [  -0.0000549600000000,  0.0000317300000000,  0.0040226400000000 ]  - [  -0.0026963300000000,  0.0015567300000000,  0.0036262200000000 ]  - [   0.0000252900000000, -0.0000495000000000,  0.0041016500000000 ]  - [   0.0024339600000000, -0.0089512400000000,  0.0104631200000000 ]  - [   0.0014278100000000, -0.0008243500000000, -0.0026452900000000 ]  - [  -0.0000634400000000,  0.0000366300000000,  0.0040022900000000 ]  - [   0.0000555200000000,  0.0000028500000000,  0.0041016500000000 ]  - [   0.0089689800000000,  0.0023677500000000,  0.0104631200000000 ]  - [  -0.0006471600000000,  0.0003736400000000,  0.0043207800000000 ]  - [   0.0006676500000000, -0.0003854700000000,  0.0043497800000000 ]  - [  -0.0021697100000000,  0.0012526800000000, -0.0032283100000000 ]  - [  -0.0002752700000000,  0.0001589300000000, -0.0045823100000000 ]  - [  -0.0182876200000000,  0.0105583600000000,  0.0231692900000000 ]  - [  -0.0000204600000000,  0.0000118100000000, -0.0044425100000000 ]  - [   0.0015116500000000, -0.0008727500000000,  0.0059191900000000 ]  - [   0.0000249200000000, -0.0000143900000000, -0.0044531100000000 ]  - [   0.0000427500000000, -0.0003442400000000, -0.0055720400000000 ]  - [   0.0004627400000000, -0.0002671700000000,  0.0210501900000000 ]  - [   0.0014825600000000, -0.0008559600000000, -0.0080440700000000 ]  - [   0.0000425700000000, -0.0005503100000000, -0.0054920000000000 ]  - [   0.0004978700000000,  0.0002382900000000, -0.0054920000000000 ]  - [  -0.0016543400000000,  0.0034265100000000, -0.0037928500000000 ]  - [  -0.0037946100000000, -0.0002805500000000, -0.0037928500000000 ]  - [  -0.0005231500000000,  0.0003020400000000, -0.0052293700000000 ]  - [   0.0008051700000000, -0.0004648700000000, -0.0060678600000000 ]  - [  -0.0014411800000000,  0.0008320600000000, -0.0087948000000000 ]  - [   0.0003194900000000,  0.0001351000000000, -0.0055720400000000 ]  - [   0.0009316100000000,  0.0097859900000000,  0.0398058600000000 ]  - [  -0.0080091100000000, -0.0056997900000000,  0.0398058600000000 ]  - [  -0.0003203600000000,  0.0001849600000000, -0.0055822300000000 ]  - [   0.0043908200000000, -0.0025350400000000,  0.0378904100000000 ]  - [  -0.0000114300000000,  0.0000066000000000, -0.0071953200000000 ]- atom:    3  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0041613300000000,  0.0024025400000000,  0.0028700300000000 ]  - [  -0.0000693800000000,  0.0000400600000000,  0.0043399500000000 ]  - [  -0.0203918700000000,  0.0117732500000000,  0.1499841400000000 ]  - [  -0.0000060400000000,  0.0000034900000000, -0.0040123600000000 ]  - [   0.0000187400000000,  0.0000232400000000, -0.0040150800000000 ]  - [  -0.0010374200000000, -0.0001776800000000,  0.0173162500000000 ]  - [  -0.0000107600000000, -0.0000278500000000, -0.0040150800000000 ]  - [  -0.0003648400000000,  0.0009872700000000,  0.0173162500000000 ]  - [   0.0000196600000000, -0.0000113500000000, -0.0040537000000000 ]  - [   0.0000415800000000, -0.0000240100000000,  0.0147946800000000 ]  - [  -0.0001117300000000,  0.0000645100000000, -0.0036584800000000 ]  - [  -0.0073458500000000, -0.0067391200000000, -0.0049777000000000 ]  - [   0.0021633200000000,  0.0097312500000000, -0.0049777000000000 ]  - [   0.0001307000000000,  0.0001391800000000, -0.0038169300000000 ]  - [  -0.0000551800000000, -0.0001827800000000, -0.0038169300000000 ]  - [   0.0011213700000000, -0.0006474200000000,  0.0040838600000000 ]  - [   0.0000834700000000, -0.0000481900000000, -0.0048129400000000 ]  - [   0.0162612300000000, -0.0093884300000000, -0.0186943600000000 ]  - [   0.0004541800000000,  0.0005006500000000, -0.0031603000000000 ]  - [   0.0007236900000000,  0.0010662600000000, -0.0039673800000000 ]  - [  -0.0006107000000000,  0.0003525900000000, -0.0036588600000000 ]  - [   0.0002284900000000, -0.0001319200000000, -0.0050913100000000 ]  - [  -0.0002064800000000, -0.0006436500000000, -0.0031603000000000 ]  - [  -0.0005615700000000, -0.0011598600000000, -0.0039673800000000 ]  - [   0.0000526100000000, -0.0000303800000000, -0.0040736400000000 ]  - [   0.0027389600000000, -0.0015813400000000, -0.0036964600000000 ]  - [  -0.0000283000000000,  0.0000158300000000, -0.0040891200000000 ]  - [  -0.0024824200000000,  0.0090802300000000, -0.0106075900000000 ]  - [  -0.0013918300000000,  0.0008035700000000,  0.0027049700000000 ]  - [   0.0000153600000000, -0.0000088700000000, -0.0039973000000000 ]  - [  -0.0000278600000000,  0.0000166000000000, -0.0040891200000000 ]  - [  -0.0091049200000000, -0.0023902800000000, -0.0106075900000000 ]  - [   0.0006432800000000, -0.0003714000000000, -0.0043749500000000 ]  - [  -0.0006726300000000,  0.0003883400000000, -0.0043947200000000 ]  - [   0.0021411900000000, -0.0012362200000000,  0.0032473600000000 ]  - [   0.0002952400000000, -0.0001704500000000,  0.0045576400000000 ]  - [   0.0184945400000000, -0.0106778300000000, -0.0230693000000000 ]  - [  -0.0000107600000000,  0.0000062100000000,  0.0044659800000000 ]  - [  -0.0015530000000000,  0.0008966300000000, -0.0059687300000000 ]  - [   0.0000064800000000, -0.0000037400000000,  0.0044893400000000 ]  - [  -0.0000441300000000,  0.0003472700000000,  0.0055534600000000 ]  - [  -0.0004506700000000,  0.0002602000000000, -0.0208896600000000 ]  - [  -0.0014726100000000,  0.0008502100000000,  0.0081091300000000 ]  - [  -0.0000410000000000,  0.0005284900000000,  0.0055340300000000 ]  - [  -0.0004781800000000, -0.0002287300000000,  0.0055340300000000 ]  - [   0.0016446400000000, -0.0034637100000000,  0.0038181600000000 ]  - [   0.0038219800000000,  0.0003075500000000,  0.0038181600000000 ]  - [   0.0005022900000000, -0.0002900000000000,  0.0052723000000000 ]  - [  -0.0008090000000000,  0.0004670800000000,  0.0062071400000000 ]  - [   0.0014248600000000, -0.0008226500000000,  0.0089145400000000 ]  - [  -0.0003228100000000, -0.0001354200000000,  0.0055534600000000 ]  - [  -0.0008230400000000, -0.0085336000000000, -0.0390935900000000 ]  - [   0.0069787900000000,  0.0049795800000000, -0.0390935900000000 ]  - [   0.0003238800000000, -0.0001869900000000,  0.0055641500000000 ]  - [  -0.0056961000000000,  0.0032886400000000, -0.0392117600000000 ]  - [   0.0000118700000000, -0.0000068600000000,  0.0070649200000000 ]- atom:    9  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000784600000000,  0.0000003200000000,  0.0000125700000000 ]  - [   0.0072572300000000, -0.0000173500000000,  0.0000210900000000 ]  - [  -0.0000248700000000,  0.0000254000000000,  0.0000028200000000 ]  - [   0.0075785500000000,  0.0179933200000000,  0.0000674100000000 ]  - [   0.0075023200000000, -0.0179598200000000, -0.0000115000000000 ]  - [   0.0000184200000000, -0.0000203100000000,  0.0000194300000000 ]  - [   0.0386806800000000,  0.0000598000000000,  0.0000274700000000 ]  - [   0.0000210400000000,  0.0000019900000000,  0.0000394600000000 ]  - [  -0.1245029700000000, -0.0011499400000000, -0.0015650800000000 ]  - [  -0.0000148300000000, -0.0000003800000000,  0.0000493900000000 ]  - [   0.0053856800000000, -0.0064367800000000,  0.0211461700000000 ]  - [   0.0000027600000000,  0.0000258600000000, -0.0000312800000000 ]  - [  -0.0000260800000000, -0.0000169000000000, -0.0000771500000000 ]  - [   0.0054989900000000,  0.0064254500000000, -0.0210373000000000 ]  - [  -0.0056960500000000, -0.0000793600000000, -0.0001065900000000 ]  - [   0.0000245200000000, -0.0000126500000000,  0.0000108600000000 ]  - [   0.0004927700000000,  0.0000097400000000, -0.0000098600000000 ]  - [  -0.0000108200000000,  0.0000000900000000, -0.0000312800000000 ]  - [   0.0010729500000000, -0.0000062300000000, -0.0000068900000000 ]  - [  -0.0000081500000000,  0.0001966800000000,  0.0001519300000000 ]  - [  -0.0000004100000000, -0.0002031800000000, -0.0001659300000000 ]  - [   0.0000737700000000,  0.0005727200000000, -0.0009969600000000 ]  - [   0.0000920900000000, -0.0005702500000000,  0.0009819200000000 ]  - [  -0.0003505600000000,  0.0000044400000000, -0.0000103200000000 ]  - [   0.0004237100000000, -0.0000034600000000, -0.0000334800000000 ]  - [   0.0001454100000000,  0.0000000400000000, -0.0000284800000000 ]  - [  -0.0010462900000000, -0.0000047000000000,  0.0000256600000000 ]  - [   0.0000188000000000,  0.0000455000000000, -0.0001904100000000 ]  - [   0.0000588500000000, -0.0000706700000000,  0.0001991300000000 ]  - [   0.0018451400000000, -0.0016552600000000,  0.0033873400000000 ]  - [   0.0018807000000000,  0.0017039500000000, -0.0034168400000000 ]  - [  -0.0000617800000000,  0.0000180200000000,  0.0000050900000000 ]  - [   0.0007615800000000,  0.0000030700000000, -0.0000211200000000 ]  - [  -0.0011148200000000,  0.0000041300000000, -0.0000209400000000 ]  - [  -0.0000836200000000,  0.0000040000000000, -0.0000131000000000 ]  - [  -0.0051696500000000,  0.0000046900000000, -0.0000160900000000 ]  - [   0.0000209200000000, -0.0000086300000000,  0.0000128800000000 ]  - [  -0.0063643600000000,  0.0000615200000000,  0.0000167000000000 ]  - [   0.0000808300000000,  0.0000100400000000,  0.0000134600000000 ]  - [   0.0062283200000000,  0.0000052800000000,  0.0002600300000000 ]  - [   0.0189479200000000,  0.0000577600000000, -0.0000463000000000 ]  - [  -0.0000010700000000,  0.0000072300000000, -0.0000097200000000 ]  - [  -0.0000083100000000, -0.0003900100000000, -0.0006478400000000 ]  - [  -0.0019724400000000, -0.0000105000000000,  0.0000274100000000 ]  - [   0.0002086100000000,  0.0012505100000000, -0.0006100400000000 ]  - [  -0.0000264600000000,  0.0003810100000000,  0.0006894000000000 ]  - [  -0.0006851100000000,  0.0000096100000000,  0.0000236300000000 ]  - [   0.0001739000000000, -0.0012479000000000,  0.0006495900000000 ]  - [   0.0006148600000000,  0.0000007700000000,  0.0000602600000000 ]  - [   0.0002148400000000,  0.0000023400000000,  0.0000685500000000 ]  - [   0.0233429400000000,  0.0025843000000000,  0.0112374300000000 ]  - [   0.0000017200000000, -0.0000056700000000, -0.0000087900000000 ]  - [   0.0000115500000000, -0.0000015500000000, -0.0000091900000000 ]  - [   0.0216796100000000, -0.0015388400000000, -0.0099673400000000 ]  - [  -0.0000965600000000,  0.0000000600000000, -0.0000660900000000 ]  - [  -0.0031751900000000, -0.0000593300000000, -0.0000511400000000 ]- atom:    9  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0047165900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057369800000000 ]  - [  -0.0000425800000000,  0.0000245800000000,  0.0041185600000000 ]  - [  -0.0004370400000000,  0.0002523200000000, -0.0147012400000000 ]  - [   0.0004370400000000,  0.0002523200000000, -0.0147012400000000 ]  - [   0.0000000000000000, -0.0000491700000000,  0.0041185600000000 ]  - [   0.0000000000000000, -0.0005046500000000, -0.0147012400000000 ]  - [   0.0000425800000000,  0.0000245800000000,  0.0041185600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2466089900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042327400000000 ]  - [   0.0175552600000000, -0.0101355400000000,  0.0191770000000000 ]  - [   0.0000000000000000, -0.0000533200000000,  0.0038079500000000 ]  - [   0.0000461800000000,  0.0000266600000000,  0.0038079500000000 ]  - [  -0.0175552600000000, -0.0101355400000000,  0.0191770000000000 ]  - [   0.0000000000000000,  0.0202710700000000,  0.0191770000000000 ]  - [  -0.0000461800000000,  0.0000266600000000,  0.0038079500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0080281700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0047218700000000 ]  - [   0.0000000000000000,  0.0005957000000000,  0.0037484500000000 ]  - [  -0.0001264300000000, -0.0000729900000000,  0.0034022500000000 ]  - [   0.0001264300000000, -0.0000729900000000,  0.0034022500000000 ]  - [   0.0005158900000000, -0.0002978500000000,  0.0037484500000000 ]  - [  -0.0005158900000000, -0.0002978500000000,  0.0037484500000000 ]  - [   0.0000000000000000,  0.0001459900000000,  0.0034022500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0004013700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0037546700000000 ]  - [   0.0000000000000000,  0.0043665900000000,  0.0040055500000000 ]  - [  -0.0000398800000000, -0.0000230200000000,  0.0042323200000000 ]  - [   0.0000398800000000, -0.0000230200000000,  0.0042323200000000 ]  - [   0.0037815700000000, -0.0021832900000000,  0.0040055500000000 ]  - [  -0.0037815700000000, -0.0021832900000000,  0.0040055500000000 ]  - [   0.0000000000000000,  0.0000460500000000,  0.0042323200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0060026400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049017000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045280500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0018754000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044809200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0095647200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045665700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0802566700000000 ]  - [   0.0000000000000000, -0.0100777300000000,  0.0451469300000000 ]  - [   0.0003418600000000, -0.0001973700000000, -0.0056683300000000 ]  - [   0.0001783700000000, -0.0001029800000000, -0.0058232000000000 ]  - [   0.0000000000000000, -0.0026072900000000, -0.0051168800000000 ]  - [   0.0022579800000000,  0.0013036400000000, -0.0051168800000000 ]  - [  -0.0001783700000000, -0.0001029800000000, -0.0058232000000000 ]  - [   0.0000000000000000,  0.0002059600000000, -0.0058232000000000 ]  - [  -0.0022579800000000,  0.0013036400000000, -0.0051168800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011761000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063190200000000 ]  - [   0.0087275700000000,  0.0050388700000000,  0.0451469300000000 ]  - [  -0.0003418600000000, -0.0001973700000000, -0.0056683300000000 ]  - [   0.0000000000000000,  0.0003947500000000, -0.0056683300000000 ]  - [  -0.0087275700000000,  0.0050388700000000,  0.0451469300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0073595600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0125718900000000 ]- atom:    9  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0047462300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057991500000000 ]  - [   0.0000010900000000, -0.0000006300000000, -0.0040820500000000 ]  - [   0.0004754800000000, -0.0002745200000000,  0.0148084800000000 ]  - [  -0.0004754800000000, -0.0002745200000000,  0.0148084800000000 ]  - [   0.0000000000000000,  0.0000012600000000, -0.0040820500000000 ]  - [   0.0000000000000000,  0.0005490400000000,  0.0148084800000000 ]  - [  -0.0000010900000000, -0.0000006300000000, -0.0040820500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2496004000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041362700000000 ]  - [  -0.0172892600000000,  0.0099819600000000, -0.0189287900000000 ]  - [   0.0000000000000000,  0.0001092000000000, -0.0038774400000000 ]  - [  -0.0000945700000000, -0.0000546000000000, -0.0038774400000000 ]  - [   0.0172892600000000,  0.0099819600000000, -0.0189287900000000 ]  - [   0.0000000000000000, -0.0199639200000000, -0.0189287900000000 ]  - [   0.0000945700000000, -0.0000546000000000, -0.0038774400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0079308300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0047948500000000 ]  - [   0.0000000000000000, -0.0005997700000000, -0.0037637200000000 ]  - [   0.0001143500000000,  0.0000660200000000, -0.0034193300000000 ]  - [  -0.0001143500000000,  0.0000660200000000, -0.0034193300000000 ]  - [  -0.0005194200000000,  0.0002998800000000, -0.0037637200000000 ]  - [   0.0005194200000000,  0.0002998800000000, -0.0037637200000000 ]  - [   0.0000000000000000, -0.0001320400000000, -0.0034193300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0004317900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0038118800000000 ]  - [   0.0000000000000000, -0.0044570800000000, -0.0040154100000000 ]  - [   0.0000053400000000,  0.0000030800000000, -0.0042250700000000 ]  - [  -0.0000053400000000,  0.0000030800000000, -0.0042250700000000 ]  - [  -0.0038599400000000,  0.0022285400000000, -0.0040154100000000 ]  - [   0.0038599400000000,  0.0022285400000000, -0.0040154100000000 ]  - [   0.0000000000000000, -0.0000061600000000, -0.0042250700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0060598700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0049662900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045033500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018646700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045164100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0096333400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0046029700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0853264100000000 ]  - [   0.0000000000000000,  0.0090137400000000, -0.0446960800000000 ]  - [  -0.0003453200000000,  0.0001993700000000,  0.0056563400000000 ]  - [  -0.0001579300000000,  0.0000911800000000,  0.0058692700000000 ]  - [   0.0000000000000000,  0.0025988400000000,  0.0051612400000000 ]  - [  -0.0022506700000000, -0.0012994200000000,  0.0051612400000000 ]  - [   0.0001579300000000,  0.0000911800000000,  0.0058692700000000 ]  - [   0.0000000000000000, -0.0001823600000000,  0.0058692700000000 ]  - [   0.0022506700000000, -0.0012994200000000,  0.0051612400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0013348300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0064683000000000 ]  - [  -0.0078061300000000, -0.0045068700000000, -0.0446960800000000 ]  - [   0.0003453200000000,  0.0001993700000000,  0.0056563400000000 ]  - [   0.0000000000000000, -0.0003987400000000,  0.0056563400000000 ]  - [   0.0078061300000000, -0.0045068700000000, -0.0446960800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0072360200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0129048000000000 ]- atom:   11  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000027700000000,  0.0000044700000000, -0.0001296200000000 ]  - [   0.0363763200000000, -0.0069576300000000, -0.0059066800000000 ]  - [  -0.0000436500000000,  0.0000171800000000,  0.0001112500000000 ]  - [  -0.0005159700000000,  0.0016631500000000,  0.0011136000000000 ]  - [  -0.0014915700000000, -0.0013388300000000, -0.0021354800000000 ]  - [   0.0000143500000000, -0.0000380600000000,  0.0001866600000000 ]  - [   0.0064989400000000,  0.0055306200000000, -0.0096400600000000 ]  - [   0.0000372000000000,  0.0000023200000000,  0.0001310500000000 ]  - [   0.0054993500000000, -0.0064213300000000,  0.0174285100000000 ]  - [  -0.0000031000000000,  0.0000029000000000,  0.0001231900000000 ]  - [  -0.1851812200000000,  0.0270593100000000, -0.0299114800000000 ]  - [  -0.0000009100000000,  0.0000263200000000,  0.0000734000000000 ]  - [  -0.0000290200000000, -0.0000114500000000,  0.0000724500000000 ]  - [   0.0522564600000000, -0.0021525300000000,  0.0012661400000000 ]  - [   0.0069311600000000, -0.0242487400000000, -0.0005130500000000 ]  - [   0.0000381900000000, -0.0000168500000000,  0.0000681300000000 ]  - [   0.0076451900000000,  0.0169875000000000, -0.0005932900000000 ]  - [   0.0000032200000000, -0.0000086900000000,  0.0001020700000000 ]  - [   0.0042548500000000,  0.0015047100000000,  0.0064248700000000 ]  - [   0.0000164900000000, -0.0000230400000000,  0.0000698700000000 ]  - [  -0.0000152800000000, -0.0000019600000000,  0.0001127100000000 ]  - [   0.0004109800000000,  0.0002617300000000, -0.0005327200000000 ]  - [  -0.0010489500000000, -0.0010325800000000,  0.0009151400000000 ]  - [   0.0000272500000000,  0.0000012800000000,  0.0000025100000000 ]  - [   0.0000425700000000, -0.0001657800000000, -0.0002051200000000 ]  - [   0.0000505200000000, -0.0005536500000000,  0.0005663700000000 ]  - [  -0.0001501500000000,  0.0003870300000000,  0.0004031800000000 ]  - [  -0.0006475100000000, -0.0001033100000000, -0.0002728200000000 ]  - [   0.0009977800000000, -0.0001809900000000,  0.0000108800000000 ]  - [   0.0007463500000000,  0.0000805300000000, -0.0003867600000000 ]  - [  -0.0006063500000000,  0.0001411700000000,  0.0001244900000000 ]  - [  -0.0000334200000000,  0.0003785200000000, -0.0003968300000000 ]  - [  -0.0000254300000000,  0.0000259800000000,  0.0002234700000000 ]  - [   0.0004256900000000, -0.0022330600000000, -0.0071003500000000 ]  - [  -0.0000011400000000, -0.0000119100000000, -0.0001496000000000 ]  - [   0.0234551600000000, -0.0119559600000000,  0.0140275900000000 ]  - [   0.0000181400000000, -0.0000344100000000, -0.0002253200000000 ]  - [  -0.0016958500000000,  0.0024082200000000,  0.0028574400000000 ]  - [   0.0000681600000000, -0.0001717300000000, -0.0004415800000000 ]  - [   0.0001622100000000, -0.0001981000000000, -0.0020063900000000 ]  - [   0.0350730600000000,  0.0057273900000000,  0.0139268000000000 ]  - [   0.0000392100000000, -0.0000072400000000, -0.0001661500000000 ]  - [   0.0032957300000000, -0.0003485500000000, -0.0009646900000000 ]  - [   0.0001035400000000, -0.0001394700000000,  0.0000688900000000 ]  - [   0.0002655200000000, -0.0000859400000000, -0.0001181800000000 ]  - [  -0.0033331800000000,  0.0002469400000000,  0.0004598400000000 ]  - [  -0.0003648600000000,  0.0020722400000000,  0.0009836600000000 ]  - [  -0.0002578700000000,  0.0000395700000000, -0.0002352700000000 ]  - [  -0.0009507000000000, -0.0047619500000000,  0.0003490000000000 ]  - [  -0.0000202600000000,  0.0000413600000000, -0.0001120800000000 ]  - [   0.0187698800000000, -0.0042283600000000,  0.0023850200000000 ]  - [  -0.0000405100000000,  0.0000013100000000, -0.0001573600000000 ]  - [  -0.0000067600000000,  0.0000251300000000, -0.0001460100000000 ]  - [  -0.0082145400000000,  0.0053945100000000, -0.0035707500000000 ]  - [  -0.0000776300000000,  0.0001512300000000, -0.0001461500000000 ]  - [   0.0012351400000000, -0.0027505200000000,  0.0015756400000000 ]- atom:   11  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000035500000000, -0.0000046800000000,  0.0001434900000000 ]  - [  -0.0384197700000000,  0.0081866800000000,  0.0072835200000000 ]  - [  -0.0000119900000000,  0.0000138000000000, -0.0000518600000000 ]  - [   0.0005748400000000, -0.0017122600000000, -0.0010800500000000 ]  - [   0.0014631200000000,  0.0013799400000000,  0.0022463600000000 ]  - [  -0.0000173100000000, -0.0000021900000000, -0.0001347700000000 ]  - [  -0.0064820600000000, -0.0054249700000000,  0.0095536800000000 ]  - [  -0.0000022900000000,  0.0000202600000000, -0.0000810200000000 ]  - [  -0.0053907000000000,  0.0064441500000000, -0.0174144100000000 ]  - [   0.0000044100000000, -0.0000036800000000, -0.0000123800000000 ]  - [   0.1875980100000000, -0.0262738000000000,  0.0287551100000000 ]  - [   0.0000023700000000,  0.0000237500000000, -0.0001246400000000 ]  - [  -0.0000142000000000, -0.0000151400000000, -0.0001240400000000 ]  - [  -0.0530285100000000,  0.0022337000000000, -0.0013342700000000 ]  - [  -0.0068036400000000,  0.0242145200000000,  0.0004739400000000 ]  - [   0.0000171000000000, -0.0000146900000000, -0.0001249200000000 ]  - [  -0.0076149300000000, -0.0169129500000000,  0.0004980400000000 ]  - [  -0.0000039400000000,  0.0000091700000000, -0.0001488700000000 ]  - [  -0.0042430500000000, -0.0014966900000000, -0.0063463400000000 ]  - [  -0.0000269200000000,  0.0000183100000000, -0.0000744900000000 ]  - [   0.0000276900000000, -0.0000053300000000, -0.0001140900000000 ]  - [  -0.0004215200000000, -0.0002657100000000,  0.0005371300000000 ]  - [   0.0010610200000000,  0.0010484900000000, -0.0009462100000000 ]  - [  -0.0000282200000000,  0.0000092600000000, -0.0000081100000000 ]  - [  -0.0000444000000000,  0.0001643600000000,  0.0001609700000000 ]  - [  -0.0000528500000000,  0.0005484100000000, -0.0006063500000000 ]  - [   0.0001503100000000, -0.0004214100000000, -0.0003763700000000 ]  - [   0.0006151900000000,  0.0000823100000000,  0.0003027600000000 ]  - [  -0.0009442300000000,  0.0001536100000000,  0.0000027300000000 ]  - [  -0.0007886700000000, -0.0000485200000000,  0.0004084500000000 ]  - [   0.0006317700000000, -0.0001209600000000, -0.0001073000000000 ]  - [   0.0000374900000000, -0.0003436900000000,  0.0004187500000000 ]  - [   0.0000251700000000, -0.0000259400000000, -0.0002542400000000 ]  - [  -0.0003700500000000,  0.0022449900000000,  0.0070411000000000 ]  - [  -0.0000158200000000,  0.0000206100000000,  0.0001070300000000 ]  - [  -0.0220542800000000,  0.0110228700000000, -0.0131415300000000 ]  - [   0.0000128300000000,  0.0000167500000000,  0.0002396700000000 ]  - [   0.0016816600000000, -0.0023732600000000, -0.0027970100000000 ]  - [  -0.0001009800000000,  0.0001894900000000,  0.0004560200000000 ]  - [  -0.0001234800000000,  0.0001790700000000,  0.0020045000000000 ]  - [  -0.0363988200000000, -0.0068445500000000, -0.0152065000000000 ]  - [  -0.0000411400000000,  0.0000084900000000,  0.0001322700000000 ]  - [  -0.0032590200000000,  0.0003459800000000,  0.0010018200000000 ]  - [  -0.0001061300000000,  0.0001182400000000, -0.0000394900000000 ]  - [  -0.0002454200000000,  0.0000973200000000,  0.0001435300000000 ]  - [   0.0032977000000000, -0.0002628900000000, -0.0004419000000000 ]  - [   0.0003779300000000, -0.0020441000000000, -0.0009472100000000 ]  - [   0.0002376100000000, -0.0000313700000000,  0.0002642500000000 ]  - [   0.0009451100000000,  0.0047414600000000, -0.0002308200000000 ]  - [   0.0000201500000000, -0.0000394100000000,  0.0002318300000000 ]  - [  -0.0187269300000000,  0.0041023400000000, -0.0022854300000000 ]  - [   0.0000423900000000, -0.0000011500000000,  0.0001228100000000 ]  - [   0.0000078100000000, -0.0000272700000000,  0.0001118900000000 ]  - [   0.0081302700000000, -0.0055069600000000,  0.0036428200000000 ]  - [   0.0000797000000000, -0.0001505400000000, -0.0000046800000000 ]  - [  -0.0012639100000000,  0.0027357800000000, -0.0017251600000000 ]- atom:   11  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000076500000000, -0.0000044100000000, -0.0040728500000000 ]  - [  -0.0040119600000000,  0.0023163100000000,  0.0332761900000000 ]  - [  -0.0000386600000000,  0.0000223200000000,  0.0036515500000000 ]  - [   0.0009341500000000, -0.0005393300000000, -0.0040877200000000 ]  - [   0.0018728100000000,  0.0087449000000000,  0.0049691000000000 ]  - [   0.0000828400000000, -0.0000299000000000,  0.0038086100000000 ]  - [  -0.0066369000000000, -0.0059943600000000,  0.0049691000000000 ]  - [   0.0000673200000000, -0.0000567900000000,  0.0038086100000000 ]  - [   0.0208938300000000, -0.0120630600000000,  0.0189250500000000 ]  - [  -0.0000449200000000,  0.0000259300000000,  0.0039014600000000 ]  - [  -0.0286198600000000,  0.0165236800000000, -0.1521179300000000 ]  - [  -0.0000001700000000, -0.0000854300000000,  0.0034279500000000 ]  - [   0.0000739000000000,  0.0000428600000000,  0.0034279500000000 ]  - [  -0.0011887500000000,  0.0013272500000000, -0.0169527700000000 ]  - [  -0.0017438100000000,  0.0003658700000000, -0.0169527700000000 ]  - [  -0.0000660100000000,  0.0000381100000000,  0.0034667200000000 ]  - [   0.0001329700000000, -0.0000767700000000, -0.0153573800000000 ]  - [   0.0000018900000000, -0.0000010900000000,  0.0043733900000000 ]  - [   0.0059025400000000,  0.0022223700000000,  0.0056077800000000 ]  - [  -0.0004086000000000, -0.0001353900000000,  0.0034625400000000 ]  - [   0.0004034300000000, -0.0002329200000000,  0.0033137100000000 ]  - [   0.0003716900000000, -0.0002145900000000, -0.0021515800000000 ]  - [   0.0010266400000000, -0.0062229300000000,  0.0056077800000000 ]  - [  -0.0000870500000000,  0.0004215500000000,  0.0034625400000000 ]  - [  -0.0001119900000000,  0.0000646600000000,  0.0031812500000000 ]  - [   0.0004646600000000, -0.0002682700000000,  0.0027108000000000 ]  - [   0.0003328000000000,  0.0001970400000000,  0.0032348000000000 ]  - [   0.0003497900000000,  0.0003531200000000,  0.0035014000000000 ]  - [  -0.0001730900000000,  0.0000999300000000,  0.0055883000000000 ]  - [   0.0003916200000000, -0.0002261000000000,  0.0051107000000000 ]  - [  -0.0000042400000000, -0.0003867300000000,  0.0032348000000000 ]  - [  -0.0001309200000000, -0.0004794800000000,  0.0035014000000000 ]  - [   0.0001383200000000, -0.0000798600000000,  0.0044896300000000 ]  - [  -0.0089972600000000,  0.0051945700000000,  0.0115757500000000 ]  - [  -0.0000308400000000,  0.0000178000000000, -0.0042157500000000 ]  - [   0.0110075400000000, -0.0063552100000000,  0.0215150000000000 ]  - [   0.0000414300000000, -0.0000239200000000, -0.0039477800000000 ]  - [   0.0027329600000000, -0.0015778700000000, -0.0027536900000000 ]  - [   0.0004291600000000, -0.0002477800000000, -0.0039561600000000 ]  - [   0.0009247900000000, -0.0005339300000000, -0.0058475000000000 ]  - [   0.0109669700000000,  0.0054953600000000,  0.0426134300000000 ]  - [   0.0002818600000000, -0.0001627300000000, -0.0052175300000000 ]  - [  -0.0008206800000000,  0.0004738200000000, -0.0083877200000000 ]  - [  -0.0004611500000000, -0.0006635900000000, -0.0052079100000000 ]  - [   0.0003441100000000,  0.0007311700000000, -0.0052079100000000 ]  - [   0.0007211300000000,  0.0037157400000000, -0.0037511600000000 ]  - [  -0.0028573600000000, -0.0024823900000000, -0.0037511600000000 ]  - [  -0.0003252300000000,  0.0001877700000000, -0.0047536100000000 ]  - [   0.0014984200000000, -0.0008651200000000,  0.0088253600000000 ]  - [   0.0000742100000000, -0.0000428500000000, -0.0056153000000000 ]  - [   0.0007243700000000, -0.0122453600000000,  0.0426134300000000 ]  - [  -0.0002811200000000, -0.0001173000000000, -0.0051547800000000 ]  - [  -0.0000389700000000,  0.0003021100000000, -0.0051547800000000 ]  - [  -0.0018287900000000,  0.0010558500000000,  0.0215674300000000 ]  - [  -0.0004981900000000,  0.0002876300000000, -0.0068461400000000 ]  - [  -0.0037892800000000,  0.0021877400000000, -0.0052616700000000 ]- atom:   11  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0000068900000000,  0.0000039800000000,  0.0040904700000000 ]  - [   0.0032360900000000, -0.0018683600000000, -0.0328351800000000 ]  - [  -0.0000173000000000,  0.0000099900000000, -0.0035977400000000 ]  - [  -0.0008828300000000,  0.0005097000000000,  0.0041926300000000 ]  - [  -0.0019263200000000, -0.0089105200000000, -0.0049943100000000 ]  - [  -0.0000857800000000, -0.0000133900000000, -0.0037608900000000 ]  - [   0.0067535700000000,  0.0061235000000000, -0.0049943100000000 ]  - [  -0.0000313000000000,  0.0000809800000000, -0.0037608900000000 ]  - [  -0.0212954200000000,  0.0122949100000000, -0.0191898200000000 ]  - [   0.0000457100000000, -0.0000263900000000, -0.0037902700000000 ]  - [   0.0300463200000000, -0.0173472500000000,  0.1533846300000000 ]  - [   0.0000017500000000,  0.0001427900000000, -0.0034839300000000 ]  - [  -0.0001227800000000, -0.0000729100000000, -0.0034839300000000 ]  - [   0.0014102100000000, -0.0013143400000000,  0.0169007700000000 ]  - [   0.0018433600000000, -0.0005641100000000,  0.0169007700000000 ]  - [   0.0001274500000000, -0.0000735800000000, -0.0035281400000000 ]  - [  -0.0001256800000000,  0.0000725600000000,  0.0152790700000000 ]  - [  -0.0000032600000000,  0.0000018800000000, -0.0044290900000000 ]  - [  -0.0058059800000000, -0.0021997100000000, -0.0055420900000000 ]  - [   0.0003981400000000,  0.0001301100000000, -0.0034706800000000 ]  - [  -0.0003901300000000,  0.0002252400000000, -0.0033180100000000 ]  - [  -0.0003845600000000,  0.0002220300000000,  0.0021057100000000 ]  - [  -0.0009979900000000,  0.0061279800000000, -0.0055420900000000 ]  - [   0.0000863900000000, -0.0004098500000000, -0.0034706800000000 ]  - [   0.0001120300000000, -0.0000646800000000, -0.0032240400000000 ]  - [  -0.0004613900000000,  0.0002663800000000, -0.0027632500000000 ]  - [  -0.0003375600000000, -0.0002348600000000, -0.0032099900000000 ]  - [  -0.0003745900000000, -0.0003706400000000, -0.0034834500000000 ]  - [   0.0002184900000000, -0.0001261500000000, -0.0055553800000000 ]  - [  -0.0004448800000000,  0.0002568500000000, -0.0051094400000000 ]  - [   0.0000346200000000,  0.0004097600000000, -0.0032099900000000 ]  - [   0.0001336900000000,  0.0005097200000000, -0.0034834500000000 ]  - [  -0.0001397400000000,  0.0000806800000000, -0.0045282800000000 ]  - [   0.0088417000000000, -0.0051047600000000, -0.0114505900000000 ]  - [   0.0000136100000000, -0.0000078600000000,  0.0041783900000000 ]  - [  -0.0106047900000000,  0.0061226800000000, -0.0214461800000000 ]  - [  -0.0000075500000000,  0.0000043600000000,  0.0039721600000000 ]  - [  -0.0027836500000000,  0.0016071400000000,  0.0027688400000000 ]  - [  -0.0004567100000000,  0.0002636800000000,  0.0039809800000000 ]  - [  -0.0008990900000000,  0.0005190900000000,  0.0058729200000000 ]  - [  -0.0120892400000000, -0.0062585800000000, -0.0434266100000000 ]  - [  -0.0002848600000000,  0.0001644700000000,  0.0051893900000000 ]  - [   0.0008298200000000, -0.0004791000000000,  0.0083976100000000 ]  - [   0.0004649900000000,  0.0006456300000000,  0.0052417500000000 ]  - [  -0.0003266300000000, -0.0007255100000000,  0.0052417500000000 ]  - [  -0.0007289700000000, -0.0036962500000000,  0.0037968400000000 ]  - [   0.0028365600000000,  0.0024794400000000,  0.0037968400000000 ]  - [   0.0003068900000000, -0.0001771800000000,  0.0047837500000000 ]  - [  -0.0014935900000000,  0.0008623200000000, -0.0085820600000000 ]  - [  -0.0000773100000000,  0.0000446400000000,  0.0057425800000000 ]  - [  -0.0006245300000000,  0.0135988800000000, -0.0434266100000000 ]  - [   0.0002840500000000,  0.0001189600000000,  0.0051272900000000 ]  - [   0.0000390000000000, -0.0003054800000000,  0.0051272900000000 ]  - [   0.0018377300000000, -0.0010610100000000, -0.0217893300000000 ]  - [   0.0004936600000000, -0.0002850100000000,  0.0067018900000000 ]  - [   0.0038154700000000, -0.0022028600000000,  0.0051063800000000 ]- atom:   17  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000109600000000, -0.0000000400000000,  0.0000111200000000 ]  - [  -0.0011220200000000,  0.0000460100000000, -0.0000028300000000 ]  - [  -0.0000102200000000,  0.0000218800000000, -0.0000562000000000 ]  - [   0.0041063000000000, -0.0046936600000000,  0.0163843000000000 ]  - [   0.0040259600000000,  0.0047003900000000, -0.0164669400000000 ]  - [   0.0000267700000000, -0.0000196700000000,  0.0000224900000000 ]  - [  -0.0040691100000000,  0.0000437200000000,  0.0000637400000000 ]  - [   0.0000343600000000,  0.0000049500000000,  0.0001049400000000 ]  - [   0.0004918400000000, -0.0000111500000000,  0.0000422600000000 ]  - [  -0.0000103700000000, -0.0000003600000000,  0.0000520100000000 ]  - [   0.0075902400000000,  0.0169292700000000,  0.0001072800000000 ]  - [  -0.0000117800000000,  0.0000235300000000, -0.0000291900000000 ]  - [  -0.0000167700000000, -0.0000035600000000, -0.0000265300000000 ]  - [   0.0076645700000000, -0.0169745100000000, -0.0001488700000000 ]  - [   0.0369928100000000, -0.0000534300000000, -0.0000252000000000 ]  - [   0.0000297200000000, -0.0000237100000000, -0.0000346700000000 ]  - [  -0.1118330100000000,  0.0007851700000000,  0.0013358400000000 ]  - [   0.0000232500000000,  0.0000003200000000, -0.0000278500000000 ]  - [  -0.0021833700000000,  0.0000030200000000, -0.0000118300000000 ]  - [   0.0000046300000000, -0.0000194600000000, -0.0001347400000000 ]  - [   0.0000160500000000,  0.0000143100000000,  0.0001250400000000 ]  - [   0.0034019000000000, -0.0032006400000000, -0.0079334800000000 ]  - [   0.0033917800000000,  0.0032431700000000,  0.0079807700000000 ]  - [   0.0000396900000000,  0.0000052300000000, -0.0000054500000000 ]  - [   0.0005955300000000,  0.0000009700000000, -0.0000234700000000 ]  - [   0.0018343800000000,  0.0000012700000000, -0.0000276000000000 ]  - [  -0.0012301700000000, -0.0000172600000000,  0.0000047100000000 ]  - [   0.0000817000000000,  0.0003893400000000, -0.0003254200000000 ]  - [   0.0001182400000000, -0.0004128400000000,  0.0003420200000000 ]  - [  -0.0002846300000000, -0.0005471700000000, -0.0006306500000000 ]  - [  -0.0002449600000000,  0.0005674900000000,  0.0006476400000000 ]  - [  -0.0005947500000000,  0.0000167300000000,  0.0000123000000000 ]  - [  -0.0000645500000000, -0.0000003200000000, -0.0000201000000000 ]  - [   0.0000969900000000, -0.0000056600000000, -0.0000107700000000 ]  - [   0.0000290900000000,  0.0000046000000000, -0.0000161300000000 ]  - [  -0.0050674100000000, -0.0000399100000000, -0.0000394600000000 ]  - [   0.0000933900000000, -0.0000086200000000,  0.0000110500000000 ]  - [  -0.0042696500000000,  0.0000024800000000,  0.0000165600000000 ]  - [   0.0003346200000000,  0.0000108700000000,  0.0000121800000000 ]  - [   0.0000242500000000, -0.0000107700000000,  0.0000145800000000 ]  - [   0.0157881100000000, -0.0000340400000000, -0.0000244500000000 ]  - [   0.0000005000000000, -0.0000273500000000, -0.0000331300000000 ]  - [   0.0002657100000000, -0.0024361500000000, -0.0012086900000000 ]  - [   0.0004115000000000, -0.0000096700000000,  0.0000172800000000 ]  - [   0.0000174900000000, -0.0002264300000000,  0.0004032800000000 ]  - [   0.0002638000000000,  0.0024277500000000,  0.0012453700000000 ]  - [  -0.0039475000000000,  0.0000034300000000,  0.0000132400000000 ]  - [   0.0000024600000000,  0.0002376700000000, -0.0003651300000000 ]  - [   0.0173845000000000, -0.0000409200000000, -0.0002942000000000 ]  - [  -0.0000996100000000,  0.0000005100000000,  0.0000652500000000 ]  - [   0.0115305100000000, -0.0024722900000000,  0.0015952400000000 ]  - [   0.0000026300000000,  0.0000281100000000,  0.0000075200000000 ]  - [  -0.0000461500000000, -0.0000009400000000, -0.0000129100000000 ]  - [   0.0126920500000000,  0.0017673900000000, -0.0025573800000000 ]  - [  -0.0003155400000000, -0.0000008600000000, -0.0000710300000000 ]  - [   0.0060252400000000,  0.0000118100000000, -0.0000737100000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0051221200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0100225900000000 ]  - [  -0.0001327000000000,  0.0000766100000000,  0.0048128800000000 ]  - [   0.0149635700000000, -0.0086392200000000,  0.0187192100000000 ]  - [  -0.0149635700000000, -0.0086392200000000,  0.0187192100000000 ]  - [   0.0000000000000000, -0.0001532300000000,  0.0048128800000000 ]  - [   0.0000000000000000,  0.0172784500000000,  0.0187192100000000 ]  - [   0.0001327000000000,  0.0000766100000000,  0.0048128800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0079052100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0048221600000000 ]  - [  -0.0005605500000000,  0.0003236400000000, -0.0153747400000000 ]  - [   0.0000000000000000, -0.0001183000000000,  0.0043806200000000 ]  - [   0.0001024500000000,  0.0000591500000000,  0.0043806200000000 ]  - [   0.0005605500000000,  0.0003236400000000, -0.0153747400000000 ]  - [   0.0000000000000000, -0.0006472700000000, -0.0153747400000000 ]  - [  -0.0001024500000000,  0.0000591500000000,  0.0043806200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2706704100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056792700000000 ]  - [   0.0000000000000000, -0.0080533800000000,  0.0080885000000000 ]  - [  -0.0006555100000000, -0.0003784600000000,  0.0044911200000000 ]  - [   0.0006555100000000, -0.0003784600000000,  0.0044911200000000 ]  - [  -0.0069744300000000,  0.0040266900000000,  0.0080885000000000 ]  - [   0.0069744300000000,  0.0040266900000000,  0.0080885000000000 ]  - [   0.0000000000000000,  0.0007569100000000,  0.0044911200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057321400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0071030500000000 ]  - [   0.0000000000000000, -0.0004434300000000,  0.0045225000000000 ]  - [  -0.0006574300000000, -0.0003795700000000,  0.0039519600000000 ]  - [   0.0006574300000000, -0.0003795700000000,  0.0039519600000000 ]  - [  -0.0003840200000000,  0.0002217100000000,  0.0045225000000000 ]  - [   0.0003840200000000,  0.0002217100000000,  0.0045225000000000 ]  - [   0.0000000000000000,  0.0007591300000000,  0.0039519600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053837200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037429600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054282300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0144439100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056695700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0003637800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054348700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025054800000000 ]  - [   0.0000000000000000,  0.0016156600000000,  0.0354853800000000 ]  - [   0.0004007700000000, -0.0002313900000000, -0.0065994100000000 ]  - [   0.0047901600000000, -0.0027656000000000, -0.0044575000000000 ]  - [   0.0000000000000000,  0.0001680400000000, -0.0067034400000000 ]  - [  -0.0001455300000000, -0.0000840200000000, -0.0067034400000000 ]  - [  -0.0047901600000000, -0.0027656000000000, -0.0044575000000000 ]  - [   0.0000000000000000,  0.0055312000000000, -0.0044575000000000 ]  - [   0.0001455300000000, -0.0000840200000000, -0.0067034400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1243156200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0071327400000000 ]  - [  -0.0013992000000000, -0.0008078300000000,  0.0354853800000000 ]  - [  -0.0004007700000000, -0.0002313900000000, -0.0065994100000000 ]  - [   0.0000000000000000,  0.0004627700000000, -0.0065994100000000 ]  - [   0.0013992000000000, -0.0008078300000000,  0.0354853800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0081801900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0100256800000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0051198000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0098289300000000 ]  - [   0.0000904600000000, -0.0000522300000000, -0.0047457000000000 ]  - [  -0.0151802800000000,  0.0087643400000000, -0.0189498300000000 ]  - [   0.0151802800000000,  0.0087643400000000, -0.0189498300000000 ]  - [   0.0000000000000000,  0.0001044500000000, -0.0047457000000000 ]  - [   0.0000000000000000, -0.0175286800000000, -0.0189498300000000 ]  - [  -0.0000904600000000, -0.0000522300000000, -0.0047457000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0080544700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0046952500000000 ]  - [   0.0005287600000000, -0.0003052800000000,  0.0152609000000000 ]  - [   0.0000000000000000,  0.0001746900000000, -0.0044228900000000 ]  - [  -0.0001512900000000, -0.0000873500000000, -0.0044228900000000 ]  - [  -0.0005287600000000, -0.0003052800000000,  0.0152609000000000 ]  - [   0.0000000000000000,  0.0006105600000000,  0.0152609000000000 ]  - [   0.0001512900000000, -0.0000873500000000, -0.0044228900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2643142400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057172500000000 ]  - [   0.0000000000000000,  0.0079057800000000, -0.0079820300000000 ]  - [   0.0006439400000000,  0.0003717800000000, -0.0044842200000000 ]  - [  -0.0006439400000000,  0.0003717800000000, -0.0044842200000000 ]  - [   0.0068466100000000, -0.0039528900000000, -0.0079820300000000 ]  - [  -0.0068466100000000, -0.0039528900000000, -0.0079820300000000 ]  - [   0.0000000000000000, -0.0007435600000000, -0.0044842200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057707000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0071059200000000 ]  - [   0.0000000000000000,  0.0004041300000000, -0.0044805800000000 ]  - [   0.0006178600000000,  0.0003567200000000, -0.0039210400000000 ]  - [  -0.0006178600000000,  0.0003567200000000, -0.0039210400000000 ]  - [   0.0003499900000000, -0.0002020700000000, -0.0044805800000000 ]  - [  -0.0003499900000000, -0.0002020700000000, -0.0044805800000000 ]  - [   0.0000000000000000, -0.0007134400000000, -0.0039210400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054002800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0036338000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053702900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0142789900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056715700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0003848400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054404000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0025095000000000 ]  - [   0.0000000000000000, -0.0007201700000000, -0.0360587800000000 ]  - [  -0.0004010300000000,  0.0002315300000000,  0.0065471600000000 ]  - [  -0.0047347000000000,  0.0027335800000000,  0.0044789100000000 ]  - [   0.0000000000000000, -0.0001957200000000,  0.0067141500000000 ]  - [   0.0001694900000000,  0.0000978600000000,  0.0067141500000000 ]  - [   0.0047347000000000,  0.0027335800000000,  0.0044789100000000 ]  - [   0.0000000000000000, -0.0054671600000000,  0.0044789100000000 ]  - [  -0.0001694900000000,  0.0000978600000000,  0.0067141500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1158708300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0072338000000000 ]  - [   0.0006236800000000,  0.0003600800000000, -0.0360587800000000 ]  - [   0.0004010300000000,  0.0002315300000000,  0.0065471600000000 ]  - [   0.0000000000000000, -0.0004630700000000,  0.0065471600000000 ]  - [  -0.0006236800000000,  0.0003600800000000, -0.0360587800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0080072600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0098296800000000 ]- atom:   19  displacement:    [  -0.0049999999963727,  0.0086602540399386,  0.0000000000000000 ]  forces:  - [   0.0000245500000000,  0.0000118000000000,  0.0004822500000000 ]  - [   0.0030261100000000,  0.0010420800000000,  0.0001173500000000 ]  - [   0.0002178300000000, -0.0005392200000000, -0.0001835100000000 ]  - [  -0.0005240600000000,  0.0004194600000000, -0.0007078800000000 ]  - [   0.0005032400000000,  0.0001333600000000, -0.0012757800000000 ]  - [  -0.0005281600000000,  0.0006555200000000, -0.0002180000000000 ]  - [   0.0001425200000000, -0.0004930000000000, -0.0005985700000000 ]  - [  -0.0003412500000000, -0.0002161700000000, -0.0006431300000000 ]  - [  -0.0005329600000000, -0.0002157400000000,  0.0005697700000000 ]  - [   0.0001762500000000,  0.0000944000000000, -0.0000704500000000 ]  - [  -0.0008295300000000, -0.0016774800000000, -0.0010170500000000 ]  - [   0.0000099300000000,  0.0000057400000000, -0.0004276100000000 ]  - [  -0.0000320600000000, -0.0000151200000000, -0.0003478800000000 ]  - [  -0.0033990700000000,  0.0003476200000000,  0.0047971500000000 ]  - [  -0.0004407000000000,  0.0001983500000000,  0.0003422000000000 ]  - [   0.0000099500000000, -0.0000003700000000, -0.0004376800000000 ]  - [   0.0011086200000000,  0.0045542000000000, -0.0069769000000000 ]  - [  -0.0000203200000000,  0.0000003500000000, -0.0006809500000000 ]  - [   0.0609302200000000, -0.1804170900000000,  0.0556400800000000 ]  - [   0.0000541700000000,  0.0000308700000000, -0.0004352400000000 ]  - [  -0.0000521700000000,  0.0000371100000000, -0.0004218800000000 ]  - [  -0.0218598000000000,  0.0372485200000000,  0.0025024700000000 ]  - [   0.0141432900000000,  0.0171207800000000,  0.0019455500000000 ]  - [   0.0000060300000000, -0.0000641500000000, -0.0004233000000000 ]  - [   0.0000102100000000,  0.0000103700000000, -0.0005113700000000 ]  - [   0.0019121700000000,  0.0141703500000000, -0.0191430000000000 ]  - [  -0.0000263300000000,  0.0000142900000000, -0.0004578800000000 ]  - [  -0.0075999800000000,  0.0008336100000000,  0.0099669900000000 ]  - [  -0.0001812000000000, -0.0020828200000000, -0.0000073000000000 ]  - [  -0.0000138000000000, -0.0000284800000000, -0.0004694500000000 ]  - [  -0.0000153700000000, -0.0000116800000000, -0.0003891600000000 ]  - [  -0.0008086800000000, -0.0004037100000000,  0.0002160400000000 ]  - [  -0.0000101600000000, -0.0000040800000000, -0.0005319000000000 ]  - [  -0.0187186400000000, -0.0029200400000000,  0.0014235600000000 ]  - [  -0.0000243800000000, -0.0000030800000000,  0.0005102800000000 ]  - [  -0.0035596300000000,  0.0027927900000000, -0.0022001300000000 ]  - [   0.0000647000000000,  0.0004188600000000,  0.0027910400000000 ]  - [  -0.0001850800000000, -0.0000849100000000,  0.0002618600000000 ]  - [  -0.0016900500000000, -0.0016971300000000, -0.0031759200000000 ]  - [  -0.0000070500000000, -0.0000175300000000,  0.0003490900000000 ]  - [   0.0016347100000000, -0.0033294700000000,  0.0006371400000000 ]  - [  -0.0001654400000000,  0.0002423200000000,  0.0006575600000000 ]  - [  -0.0088923500000000,  0.0148688900000000, -0.0030346600000000 ]  - [   0.0000172200000000,  0.0000041100000000,  0.0006320400000000 ]  - [  -0.0000119400000000, -0.0000064800000000,  0.0006535500000000 ]  - [  -0.0118916500000000,  0.0167568000000000, -0.0110942800000000 ]  - [   0.0028895800000000, -0.0063695900000000, -0.0030246300000000 ]  - [   0.0000095900000000,  0.0000132900000000,  0.0006334800000000 ]  - [  -0.0072578500000000,  0.0838016400000000, -0.0300757600000000 ]  - [  -0.0000048100000000,  0.0000012600000000,  0.0007692500000000 ]  - [   0.0020540700000000,  0.0007994100000000,  0.0019713600000000 ]  - [   0.0001713400000000,  0.0000644700000000,  0.0004048500000000 ]  - [   0.0001464900000000, -0.0002402900000000,  0.0006291200000000 ]  - [  -0.0020900900000000,  0.0026239800000000,  0.0004491200000000 ]  - [   0.0022667200000000,  0.0014074200000000, -0.0012737900000000 ]  - [   0.0001850200000000,  0.0001136300000000,  0.0009018700000000 ]- atom:   19  displacement:    [   0.0049999999963727, -0.0086602540399386,  0.0000000000000000 ]  forces:  - [  -0.0000237400000000, -0.0000122700000000, -0.0004548700000000 ]  - [  -0.0030306200000000, -0.0010181200000000, -0.0000999700000000 ]  - [  -0.0002742200000000,  0.0005725700000000,  0.0002397600000000 ]  - [   0.0005792400000000, -0.0004508900000000,  0.0007538900000000 ]  - [  -0.0005355300000000, -0.0001522700000000,  0.0013116300000000 ]  - [   0.0005217400000000, -0.0006983500000000,  0.0002531500000000 ]  - [  -0.0001412700000000,  0.0005317600000000,  0.0006375800000000 ]  - [   0.0003755500000000,  0.0002435900000000,  0.0006834100000000 ]  - [   0.0005391200000000,  0.0002105200000000, -0.0004633700000000 ]  - [  -0.0001740400000000, -0.0000965700000000,  0.0001719100000000 ]  - [   0.0008176300000000,  0.0017122300000000,  0.0010079200000000 ]  - [  -0.0000084500000000,  0.0000460800000000,  0.0003666600000000 ]  - [  -0.0000120900000000, -0.0000121700000000,  0.0002859900000000 ]  - [   0.0034510600000000, -0.0003065200000000, -0.0048857200000000 ]  - [   0.0004325700000000, -0.0002608100000000, -0.0004136100000000 ]  - [   0.0000455700000000, -0.0000314700000000,  0.0003698200000000 ]  - [  -0.0010754100000000, -0.0045533300000000,  0.0068452600000000 ]  - [   0.0000195500000000,  0.0000007200000000,  0.0006198700000000 ]  - [  -0.0632063700000000,  0.1769300200000000, -0.0545764500000000 ]  - [  -0.0000634600000000, -0.0000349700000000,  0.0004191600000000 ]  - [   0.0000635000000000, -0.0000433500000000,  0.0004102700000000 ]  - [   0.0218948300000000, -0.0373504600000000, -0.0024755600000000 ]  - [  -0.0141236100000000, -0.0170784700000000, -0.0019461800000000 ]  - [  -0.0000066800000000,  0.0000735800000000,  0.0004075500000000 ]  - [  -0.0000107200000000, -0.0000103900000000,  0.0004575300000000 ]  - [  -0.0019894800000000, -0.0141744800000000,  0.0193236500000000 ]  - [   0.0000229900000000, -0.0000504600000000,  0.0004702900000000 ]  - [   0.0075504500000000, -0.0009014200000000, -0.0098813200000000 ]  - [   0.0001511000000000,  0.0020264300000000, -0.0000698500000000 ]  - [  -0.0000346900000000,  0.0000566700000000,  0.0004772700000000 ]  - [   0.0000442000000000,  0.0000322300000000,  0.0004020500000000 ]  - [   0.0008267900000000,  0.0004601800000000, -0.0001728900000000 ]  - [   0.0000089800000000,  0.0000042000000000,  0.0004868100000000 ]  - [   0.0187213800000000,  0.0029051100000000, -0.0014364900000000 ]  - [   0.0000072700000000,  0.0000124300000000, -0.0005372500000000 ]  - [   0.0036166100000000, -0.0032044900000000,  0.0018218000000000 ]  - [  -0.0000361100000000, -0.0004337200000000, -0.0027592200000000 ]  - [   0.0001531400000000,  0.0001031600000000, -0.0002364600000000 ]  - [   0.0016433300000000,  0.0017433300000000,  0.0031696500000000 ]  - [   0.0000403900000000, -0.0000015700000000, -0.0003179300000000 ]  - [  -0.0016468900000000,  0.0033127800000000, -0.0006605700000000 ]  - [   0.0001603700000000, -0.0002415600000000, -0.0006751000000000 ]  - [   0.0090043600000000, -0.0148821500000000,  0.0029949300000000 ]  - [  -0.0000173300000000, -0.0000235600000000, -0.0005896200000000 ]  - [   0.0000291100000000,  0.0000163700000000, -0.0006108900000000 ]  - [   0.0135288400000000, -0.0176183800000000,  0.0123611900000000 ]  - [  -0.0027867800000000,  0.0064431900000000,  0.0029468300000000 ]  - [  -0.0000273000000000, -0.0000032000000000, -0.0005906500000000 ]  - [   0.0076787700000000, -0.0790164000000000,  0.0281926400000000 ]  - [   0.0000037200000000,  0.0000005400000000, -0.0006331700000000 ]  - [  -0.0020510600000000, -0.0007756500000000, -0.0019813700000000 ]  - [  -0.0001666700000000, -0.0000669600000000, -0.0004254100000000 ]  - [  -0.0001438000000000,  0.0002384500000000, -0.0006512800000000 ]  - [   0.0020890300000000, -0.0026158900000000, -0.0004591000000000 ]  - [  -0.0022499100000000, -0.0014425400000000,  0.0011492900000000 ]  - [  -0.0001849200000000, -0.0001133000000000, -0.0010334500000000 ]- atom:   19  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000640200000000, -0.0040159500000000 ]  - [   0.0000000000000000,  0.0017035400000000,  0.0087855600000000 ]  - [  -0.0003512400000000, -0.0002434100000000,  0.0031752000000000 ]  - [   0.0007511200000000,  0.0001301900000000,  0.0039822100000000 ]  - [  -0.0007511200000000,  0.0001301900000000,  0.0039822100000000 ]  - [   0.0000000000000000, -0.0003648900000000,  0.0051023800000000 ]  - [   0.0000000000000000,  0.0001098900000000,  0.0036727700000000 ]  - [   0.0003512400000000, -0.0002434100000000,  0.0031752000000000 ]  - [   0.0000000000000000, -0.0011393000000000,  0.0038099800000000 ]  - [   0.0000000000000000,  0.0001846300000000,  0.0034641000000000 ]  - [   0.0063227000000000,  0.0026043900000000,  0.0055132000000000 ]  - [   0.0000000000000000, -0.0001083200000000,  0.0032871500000000 ]  - [  -0.0000176600000000,  0.0000668500000000,  0.0034364900000000 ]  - [  -0.0063227000000000,  0.0026043900000000,  0.0055132000000000 ]  - [   0.0000000000000000, -0.0006365200000000, -0.0021397600000000 ]  - [   0.0000176600000000,  0.0000668500000000,  0.0034364900000000 ]  - [   0.0000000000000000, -0.0091235900000000,  0.0079496900000000 ]  - [   0.0000000000000000, -0.0001490000000000,  0.0044585100000000 ]  - [   0.0000000000000000,  0.0641919400000000, -0.1400573900000000 ]  - [  -0.0004315700000000, -0.0002358200000000,  0.0034380100000000 ]  - [   0.0004315700000000, -0.0002358200000000,  0.0034380100000000 ]  - [   0.0019330300000000, -0.0017355200000000, -0.0142322500000000 ]  - [  -0.0019330300000000, -0.0017355200000000, -0.0142322500000000 ]  - [   0.0000000000000000,  0.0004838700000000,  0.0034386300000000 ]  - [   0.0000000000000000, -0.0000115100000000,  0.0036153100000000 ]  - [   0.0000000000000000, -0.0231761200000000,  0.0152230700000000 ]  - [   0.0000000000000000, -0.0000422900000000,  0.0037486700000000 ]  - [  -0.0101776300000000,  0.0026756000000000,  0.0068565900000000 ]  - [   0.0101776300000000,  0.0026756000000000,  0.0068565900000000 ]  - [  -0.0000172600000000,  0.0000296900000000,  0.0038139000000000 ]  - [   0.0000172600000000,  0.0000296900000000,  0.0038139000000000 ]  - [   0.0000000000000000, -0.0013728900000000, -0.0041966700000000 ]  - [   0.0000000000000000, -0.0000171100000000,  0.0043605400000000 ]  - [   0.0000000000000000,  0.0001011800000000, -0.0146387300000000 ]  - [   0.0000000000000000, -0.0000407500000000, -0.0042077400000000 ]  - [   0.0000000000000000, -0.0051043100000000,  0.0125357500000000 ]  - [   0.0000000000000000, -0.0009947300000000, -0.0053670200000000 ]  - [   0.0000000000000000, -0.0000522900000000, -0.0038866500000000 ]  - [   0.0000000000000000, -0.0037487700000000, -0.0030640800000000 ]  - [   0.0000000000000000, -0.0000613000000000, -0.0040795600000000 ]  - [   0.0000000000000000,  0.0002067900000000, -0.0056263500000000 ]  - [   0.0007919000000000,  0.0001122000000000, -0.0052692300000000 ]  - [  -0.0064674200000000, -0.0049856900000000,  0.0371195700000000 ]  - [   0.0000000000000000, -0.0003295500000000, -0.0050883500000000 ]  - [   0.0002725700000000,  0.0001708200000000, -0.0050906900000000 ]  - [   0.0064674200000000, -0.0049856900000000,  0.0371195700000000 ]  - [   0.0000000000000000,  0.0015223600000000,  0.0214196300000000 ]  - [  -0.0002725700000000,  0.0001708200000000, -0.0050906900000000 ]  - [   0.0000000000000000, -0.0267618500000000,  0.0387641900000000 ]  - [   0.0000000000000000, -0.0000126700000000, -0.0055992600000000 ]  - [  -0.0022082600000000,  0.0011259400000000, -0.0049404800000000 ]  - [  -0.0007919000000000,  0.0001122000000000, -0.0052692300000000 ]  - [   0.0000000000000000,  0.0003197000000000, -0.0047811200000000 ]  - [   0.0022082600000000,  0.0011259400000000, -0.0049404800000000 ]  - [   0.0000000000000000,  0.0049069000000000, -0.0057772700000000 ]  - [   0.0000000000000000,  0.0000225000000000, -0.0067151100000000 ]- atom:   19  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000, -0.0000638500000000,  0.0040438800000000 ]  - [   0.0000000000000000, -0.0017071400000000, -0.0088551500000000 ]  - [   0.0003071500000000,  0.0002682700000000, -0.0031331800000000 ]  - [  -0.0007140300000000, -0.0001588000000000, -0.0039408700000000 ]  - [   0.0007140300000000, -0.0001588000000000, -0.0039408700000000 ]  - [   0.0000000000000000,  0.0003260900000000, -0.0050502200000000 ]  - [   0.0000000000000000, -0.0000691200000000, -0.0036307500000000 ]  - [  -0.0003071500000000,  0.0002682700000000, -0.0031331800000000 ]  - [   0.0000000000000000,  0.0011471000000000, -0.0037086000000000 ]  - [   0.0000000000000000, -0.0001848300000000, -0.0033663000000000 ]  - [  -0.0064524400000000, -0.0026182000000000, -0.0056409600000000 ]  - [   0.0000000000000000,  0.0001548400000000, -0.0033470800000000 ]  - [  -0.0000289500000000, -0.0000942900000000, -0.0034992500000000 ]  - [   0.0064524400000000, -0.0026182000000000, -0.0056409600000000 ]  - [   0.0000000000000000,  0.0005945200000000,  0.0021134700000000 ]  - [   0.0000289500000000, -0.0000942900000000, -0.0034992500000000 ]  - [   0.0000000000000000,  0.0092551600000000, -0.0081242100000000 ]  - [   0.0000000000000000,  0.0001485900000000, -0.0045197700000000 ]  - [   0.0000000000000000, -0.0630233700000000,  0.1389931000000000 ]  - [   0.0004218600000000,  0.0002308000000000, -0.0034516100000000 ]  - [  -0.0004218600000000,  0.0002308000000000, -0.0034516100000000 ]  - [  -0.0019593400000000,  0.0017655900000000,  0.0142291200000000 ]  - [   0.0019593400000000,  0.0017655900000000,  0.0142291200000000 ]  - [   0.0000000000000000, -0.0004745700000000, -0.0034544700000000 ]  - [   0.0000000000000000,  0.0000119700000000, -0.0036664300000000 ]  - [   0.0000000000000000,  0.0227780700000000, -0.0150055700000000 ]  - [   0.0000000000000000,  0.0000079000000000, -0.0037343800000000 ]  - [   0.0099852000000000, -0.0026371900000000, -0.0067398300000000 ]  - [  -0.0099852000000000, -0.0026371900000000, -0.0067398300000000 ]  - [  -0.0000205300000000, -0.0000063000000000, -0.0038022700000000 ]  - [   0.0000205300000000, -0.0000063000000000, -0.0038022700000000 ]  - [   0.0000000000000000,  0.0014005600000000,  0.0041746900000000 ]  - [   0.0000000000000000,  0.0000171100000000, -0.0044041700000000 ]  - [   0.0000000000000000, -0.0001019200000000,  0.0146016100000000 ]  - [   0.0000000000000000,  0.0000496700000000,  0.0041973600000000 ]  - [   0.0000000000000000,  0.0046431200000000, -0.0130348300000000 ]  - [   0.0000000000000000,  0.0009699500000000,  0.0053875000000000 ]  - [   0.0000000000000000,  0.0000739100000000,  0.0039113300000000 ]  - [   0.0000000000000000,  0.0037529600000000,  0.0031269600000000 ]  - [   0.0000000000000000,  0.0000423100000000,  0.0041067200000000 ]  - [   0.0000000000000000, -0.0002143600000000,  0.0056049700000000 ]  - [  -0.0007920100000000, -0.0001095500000000,  0.0052469100000000 ]  - [   0.0055739800000000,  0.0044397900000000, -0.0365237000000000 ]  - [   0.0000000000000000,  0.0003107100000000,  0.0051289400000000 ]  - [  -0.0002556300000000, -0.0001613200000000,  0.0051316200000000 ]  - [  -0.0055739800000000,  0.0044397900000000, -0.0365237000000000 ]  - [   0.0000000000000000, -0.0014910200000000, -0.0212447400000000 ]  - [   0.0002556300000000, -0.0001613200000000,  0.0051316200000000 ]  - [   0.0000000000000000,  0.0272800100000000, -0.0385640700000000 ]  - [   0.0000000000000000,  0.0000137700000000,  0.0057335100000000 ]  - [   0.0022253500000000, -0.0011292900000000,  0.0049218900000000 ]  - [   0.0007920100000000, -0.0001095500000000,  0.0052469100000000 ]  - [   0.0000000000000000, -0.0003226800000000,  0.0047614600000000 ]  - [  -0.0022253500000000, -0.0011292900000000,  0.0049218900000000 ]  - [   0.0000000000000000, -0.0048812700000000,  0.0056477300000000 ]  - [   0.0000000000000000, -0.0000232600000000,  0.0065817800000000 ]- atom:   25  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000363100000000, -0.0000018600000000,  0.0000132400000000 ]  - [  -0.0001209100000000,  0.0000011500000000,  0.0000073500000000 ]  - [  -0.0000074300000000, -0.0000470800000000, -0.0000252100000000 ]  - [   0.0015897100000000, -0.0013938700000000,  0.0027614100000000 ]  - [   0.0015502100000000,  0.0013471500000000, -0.0026783400000000 ]  - [  -0.0000891600000000, -0.0000196100000000,  0.0000247500000000 ]  - [  -0.0008036600000000,  0.0000089000000000,  0.0000069800000000 ]  - [   0.0000365700000000,  0.0000727800000000,  0.0000787500000000 ]  - [   0.0004231700000000,  0.0000038900000000,  0.0000589200000000 ]  - [   0.0001454300000000,  0.0000002500000000,  0.0000538400000000 ]  - [   0.0000185300000000, -0.0001496500000000, -0.0001415100000000 ]  - [  -0.0009022200000000,  0.0000247100000000, -0.0000300400000000 ]  - [   0.0000327700000000,  0.0005375900000000,  0.0004366600000000 ]  - [   0.0000621800000000,  0.0001771300000000,  0.0000851000000000 ]  - [  -0.0002424900000000, -0.0000240400000000, -0.0000243600000000 ]  - [   0.0000760200000000, -0.0005668600000000, -0.0004918800000000 ]  - [   0.0005958700000000, -0.0000030400000000, -0.0000263900000000 ]  - [   0.0018341200000000,  0.0000047600000000, -0.0000225500000000 ]  - [  -0.0000204200000000, -0.0000053600000000, -0.0000025500000000 ]  - [   0.0112796200000000,  0.0088066900000000, -0.0200027100000000 ]  - [   0.0113175400000000, -0.0087455900000000,  0.0197957900000000 ]  - [  -0.0000029800000000, -0.0000102400000000, -0.0000114400000000 ]  - [   0.0000083400000000,  0.0000165500000000,  0.0000080400000000 ]  - [  -0.0039016100000000,  0.0000727200000000,  0.0000612500000000 ]  - [  -0.1390635900000000,  0.0012896700000000,  0.0016413400000000 ]  - [   0.0000061400000000,  0.0000000000000000, -0.0000223600000000 ]  - [   0.0379815100000000, -0.0000522200000000,  0.0000137600000000 ]  - [  -0.0000145800000000, -0.0000065300000000,  0.0000172100000000 ]  - [   0.0000244600000000, -0.0000178800000000,  0.0000028700000000 ]  - [   0.0073900100000000,  0.0176192500000000,  0.0000514200000000 ]  - [   0.0074606000000000, -0.0176598800000000, -0.0000388200000000 ]  - [  -0.0000048800000000,  0.0000174400000000,  0.0000115200000000 ]  - [   0.0007133400000000, -0.0000120200000000, -0.0000325600000000 ]  - [   0.0000218000000000, -0.0000006000000000, -0.0000158600000000 ]  - [   0.0034441000000000,  0.0000131400000000, -0.0000247700000000 ]  - [   0.0000947400000000, -0.0000057100000000, -0.0000191700000000 ]  - [   0.0000166600000000, -0.0000085000000000,  0.0000078800000000 ]  - [   0.0070961800000000, -0.0000059000000000, -0.0001558700000000 ]  - [  -0.0000092800000000,  0.0000102100000000,  0.0000088800000000 ]  - [  -0.0057538900000000, -0.0000577000000000,  0.0000085800000000 ]  - [  -0.0016969800000000,  0.0000017800000000, -0.0000206700000000 ]  - [  -0.0000179700000000, -0.0001826800000000,  0.0000428400000000 ]  - [   0.0000101100000000, -0.0000093100000000,  0.0000191100000000 ]  - [   0.0186076500000000, -0.0000809700000000,  0.0000501800000000 ]  - [   0.0258195300000000,  0.0041015200000000,  0.0122542300000000 ]  - [  -0.0000081800000000, -0.0000014900000000,  0.0000105600000000 ]  - [  -0.0000058000000000,  0.0000104900000000,  0.0000147000000000 ]  - [   0.0276479300000000, -0.0052911300000000, -0.0136105900000000 ]  - [   0.0000561900000000, -0.0000009200000000,  0.0000629200000000 ]  - [  -0.0100842000000000, -0.0000179900000000,  0.0000663600000000 ]  - [   0.0001555800000000,  0.0010776600000000, -0.0005298000000000 ]  - [  -0.0000117700000000,  0.0001830400000000, -0.0000746500000000 ]  - [  -0.0003315400000000, -0.0000019600000000, -0.0000161100000000 ]  - [   0.0001737400000000, -0.0010720900000000,  0.0005024100000000 ]  - [   0.0000064200000000, -0.0000002100000000, -0.0000741900000000 ]  - [  -0.0025668900000000,  0.0000544300000000, -0.0000864200000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0001185500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041014200000000 ]  - [  -0.0002401500000000,  0.0001386500000000,  0.0040723300000000 ]  - [   0.0035960700000000, -0.0020761900000000,  0.0036940700000000 ]  - [  -0.0035960700000000, -0.0020761900000000,  0.0036940700000000 ]  - [   0.0000000000000000, -0.0002773100000000,  0.0040723300000000 ]  - [   0.0000000000000000,  0.0041523800000000,  0.0036940700000000 ]  - [   0.0002401500000000,  0.0001386500000000,  0.0040723300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0004584500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038375500000000 ]  - [  -0.0002052000000000,  0.0001184700000000,  0.0031746800000000 ]  - [   0.0000000000000000, -0.0006541200000000,  0.0027111700000000 ]  - [   0.0005664800000000,  0.0003270600000000,  0.0027111700000000 ]  - [   0.0002052000000000,  0.0001184700000000,  0.0031746800000000 ]  - [   0.0000000000000000, -0.0002369400000000,  0.0031746800000000 ]  - [  -0.0005664800000000,  0.0003270600000000,  0.0027111700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057282200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0070667800000000 ]  - [   0.0000000000000000, -0.0005659600000000,  0.0036368200000000 ]  - [  -0.0190944400000000, -0.0110241800000000,  0.0149956600000000 ]  - [   0.0190944400000000, -0.0110241800000000,  0.0149956600000000 ]  - [  -0.0004901300000000,  0.0002829800000000,  0.0036368200000000 ]  - [   0.0004901300000000,  0.0002829800000000,  0.0036368200000000 ]  - [   0.0000000000000000,  0.0220483600000000,  0.0149956600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2153716800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038224600000000 ]  - [   0.0000000000000000, -0.0002993400000000, -0.0146186100000000 ]  - [  -0.0000350000000000, -0.0000202100000000,  0.0039931100000000 ]  - [   0.0000350000000000, -0.0000202100000000,  0.0039931100000000 ]  - [  -0.0002592300000000,  0.0001496700000000, -0.0146186100000000 ]  - [   0.0002592300000000,  0.0001496700000000, -0.0146186100000000 ]  - [   0.0000000000000000,  0.0000404200000000,  0.0039931100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0078241900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045431200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056588000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044420600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042160500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0606534100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042912800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0096117400000000 ]  - [   0.0000000000000000, -0.0025242100000000, -0.0049096700000000 ]  - [  -0.0005244900000000,  0.0003028100000000, -0.0056123000000000 ]  - [   0.0003200400000000, -0.0001847800000000, -0.0053563800000000 ]  - [   0.0000000000000000, -0.0102614900000000,  0.0446591500000000 ]  - [   0.0088867100000000,  0.0051307500000000,  0.0446591500000000 ]  - [  -0.0003200400000000, -0.0001847800000000, -0.0053563800000000 ]  - [   0.0000000000000000,  0.0003695500000000, -0.0053563800000000 ]  - [  -0.0088867100000000,  0.0051307500000000,  0.0446591500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0061513900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0004893000000000 ]  - [   0.0021860300000000,  0.0012621000000000, -0.0049096700000000 ]  - [   0.0005244900000000,  0.0003028100000000, -0.0056123000000000 ]  - [   0.0000000000000000, -0.0006056300000000, -0.0056123000000000 ]  - [  -0.0021860300000000,  0.0012621000000000, -0.0049096700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0070750500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0117193500000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0001178400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0041106900000000 ]  - [   0.0002034700000000, -0.0001174700000000, -0.0040179400000000 ]  - [  -0.0035167700000000,  0.0020304100000000, -0.0036251500000000 ]  - [   0.0035167700000000,  0.0020304100000000, -0.0036251500000000 ]  - [   0.0000000000000000,  0.0002349400000000, -0.0040179400000000 ]  - [   0.0000000000000000, -0.0040608200000000, -0.0036251500000000 ]  - [  -0.0002034700000000, -0.0001174700000000, -0.0040179400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0003771900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037235900000000 ]  - [   0.0001595200000000, -0.0000921000000000, -0.0032289100000000 ]  - [   0.0000000000000000,  0.0007084900000000, -0.0027593500000000 ]  - [  -0.0006135700000000, -0.0003542500000000, -0.0027593500000000 ]  - [  -0.0001595200000000, -0.0000921000000000, -0.0032289100000000 ]  - [   0.0000000000000000,  0.0001842000000000, -0.0032289100000000 ]  - [   0.0006135700000000, -0.0003542500000000, -0.0027593500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057680700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0071315700000000 ]  - [   0.0000000000000000,  0.0005538600000000, -0.0036410200000000 ]  - [   0.0193736000000000,  0.0111853600000000, -0.0152259900000000 ]  - [  -0.0193736000000000,  0.0111853600000000, -0.0152259900000000 ]  - [   0.0004796600000000, -0.0002769300000000, -0.0036410200000000 ]  - [  -0.0004796600000000, -0.0002769300000000, -0.0036410200000000 ]  - [   0.0000000000000000, -0.0223707100000000, -0.0152259900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2130874900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0038573900000000 ]  - [   0.0000000000000000,  0.0002654900000000,  0.0145775400000000 ]  - [   0.0000043100000000,  0.0000024900000000, -0.0039650400000000 ]  - [  -0.0000043100000000,  0.0000024900000000, -0.0039650400000000 ]  - [   0.0002299200000000, -0.0001327500000000,  0.0145775400000000 ]  - [  -0.0002299200000000, -0.0001327500000000,  0.0145775400000000 ]  - [   0.0000000000000000, -0.0000049800000000, -0.0039650400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0078193500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045729300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056141300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044105500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042306100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0566512200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043146000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0095073000000000 ]  - [   0.0000000000000000,  0.0025139800000000,  0.0048747200000000 ]  - [   0.0005263500000000, -0.0003038900000000,  0.0055754800000000 ]  - [  -0.0003012100000000,  0.0001739000000000,  0.0053785800000000 ]  - [   0.0000000000000000,  0.0112696900000000, -0.0450155600000000 ]  - [  -0.0097598400000000, -0.0056348500000000, -0.0450155600000000 ]  - [   0.0003012100000000,  0.0001739000000000,  0.0053785800000000 ]  - [   0.0000000000000000, -0.0003478100000000,  0.0053785800000000 ]  - [   0.0097598400000000, -0.0056348500000000, -0.0450155600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0062667200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0004012700000000 ]  - [  -0.0021771700000000, -0.0012569900000000,  0.0048747200000000 ]  - [  -0.0005263500000000, -0.0003038900000000,  0.0055754800000000 ]  - [   0.0000000000000000,  0.0006077800000000,  0.0055754800000000 ]  - [   0.0021771700000000, -0.0012569900000000,  0.0048747200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0069193500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0116829000000000 ]- atom:   27  displacement:    [  -0.0049999999963727,  0.0086602540399386,  0.0000000000000000 ]  forces:  - [   0.0002041200000000,  0.0005923700000000, -0.0032198500000000 ]  - [  -0.0001760300000000,  0.0000256200000000, -0.0001188900000000 ]  - [   0.0000232400000000, -0.0000457100000000, -0.0000132500000000 ]  - [   0.0004420100000000, -0.0031073700000000,  0.0024493500000000 ]  - [  -0.0016049900000000,  0.0005720500000000, -0.0065376200000000 ]  - [  -0.0000171500000000,  0.0000603100000000, -0.0000150400000000 ]  - [   0.0005158100000000,  0.0009354000000000, -0.0013791800000000 ]  - [  -0.0000338800000000, -0.0000265200000000,  0.0000092800000000 ]  - [   0.0005335300000000,  0.0024613700000000,  0.0038919900000000 ]  - [   0.0000325500000000,  0.0000564200000000,  0.0000300600000000 ]  - [   0.0004007400000000, -0.0004560800000000, -0.0000060400000000 ]  - [  -0.0003424300000000,  0.0009480800000000,  0.0001722300000000 ]  - [  -0.0003158300000000, -0.0002987000000000,  0.0004696900000000 ]  - [  -0.0002563800000000, -0.0000580800000000,  0.0003287200000000 ]  - [  -0.0004384900000000,  0.0006124800000000,  0.0003909000000000 ]  - [   0.0003578000000000, -0.0005547000000000,  0.0003311000000000 ]  - [   0.0006122100000000,  0.0000554900000000, -0.0003945300000000 ]  - [   0.0003005700000000,  0.0002817800000000, -0.0006653000000000 ]  - [  -0.0000238300000000,  0.0000267700000000, -0.0000250000000000 ]  - [  -0.0076145600000000,  0.0045517800000000, -0.0101682200000000 ]  - [   0.0030259800000000, -0.0002357400000000, -0.0027140300000000 ]  - [   0.0000272900000000, -0.0000254400000000, -0.0000168900000000 ]  - [  -0.0000249100000000,  0.0000070100000000, -0.0000014700000000 ]  - [  -0.0008096800000000, -0.0004222300000000,  0.0011848500000000 ]  - [  -0.0190350400000000, -0.0023957400000000, -0.0002858800000000 ]  - [   0.0000030600000000,  0.0000017800000000, -0.0000413600000000 ]  - [   0.0639176100000000, -0.1941291000000000, -0.0215270300000000 ]  - [  -0.0000123800000000, -0.0000089200000000,  0.0000079400000000 ]  - [   0.0000219800000000, -0.0000155900000000, -0.0000012700000000 ]  - [  -0.0252150700000000,  0.0475352600000000,  0.0008036000000000 ]  - [   0.0174857700000000,  0.0192424000000000, -0.0003869500000000 ]  - [  -0.0000015200000000,  0.0000178000000000,  0.0000042500000000 ]  - [   0.0022451700000000,  0.0063881600000000,  0.0162210800000000 ]  - [   0.0000305200000000, -0.0000051800000000, -0.0000190900000000 ]  - [   0.0009008800000000,  0.0013452000000000,  0.0013030100000000 ]  - [   0.0001332100000000, -0.0000270600000000,  0.0000819900000000 ]  - [   0.0000139000000000, -0.0000065700000000, -0.0000181000000000 ]  - [   0.0040032800000000,  0.0008382900000000, -0.0013725800000000 ]  - [  -0.0000144500000000,  0.0000130200000000,  0.0000137500000000 ]  - [  -0.0004378300000000,  0.0574538400000000,  0.0217264600000000 ]  - [  -0.0019940500000000,  0.0020052200000000, -0.0009042100000000 ]  - [   0.0001630500000000, -0.0002363000000000,  0.0000863700000000 ]  - [   0.0000015700000000, -0.0000093500000000,  0.0000331400000000 ]  - [  -0.0002911500000000, -0.0094087400000000, -0.0045399800000000 ]  - [  -0.0181338300000000,  0.0235595200000000,  0.0102595300000000 ]  - [  -0.0000008400000000, -0.0000052200000000,  0.0000206400000000 ]  - [  -0.0000017600000000,  0.0000059000000000,  0.0000191800000000 ]  - [  -0.0056261600000000,  0.0172229600000000,  0.0023233200000000 ]  - [   0.0000541200000000,  0.0000080900000000,  0.0002232700000000 ]  - [  -0.0024547100000000, -0.0036758100000000,  0.0031393000000000 ]  - [  -0.0015971600000000,  0.0002090300000000, -0.0007953700000000 ]  - [  -0.0001609400000000, -0.0001665500000000,  0.0000409800000000 ]  - [  -0.0000611200000000,  0.0003003300000000,  0.0000592600000000 ]  - [   0.0016044200000000, -0.0023513500000000,  0.0005560900000000 ]  - [   0.0000041600000000, -0.0000015700000000, -0.0000495500000000 ]  - [  -0.0103623800000000,  0.0303398800000000, -0.0109646300000000 ]- atom:   27  displacement:    [   0.0049999999963727, -0.0086602540399386,  0.0000000000000000 ]  forces:  - [  -0.0002083700000000, -0.0005857100000000,  0.0032134200000000 ]  - [   0.0001768200000000, -0.0000281700000000,  0.0001357800000000 ]  - [  -0.0000775400000000,  0.0000762500000000,  0.0000693600000000 ]  - [  -0.0003539500000000,  0.0030861300000000, -0.0024651100000000 ]  - [   0.0015613800000000, -0.0005778300000000,  0.0066200400000000 ]  - [   0.0000138700000000, -0.0000991900000000,  0.0000631200000000 ]  - [  -0.0005292400000000, -0.0008878000000000,  0.0014414600000000 ]  - [   0.0000672000000000,  0.0000489400000000,  0.0000383800000000 ]  - [  -0.0005114900000000, -0.0024548500000000, -0.0037456200000000 ]  - [  -0.0000308100000000, -0.0000579600000000,  0.0000775500000000 ]  - [  -0.0004518900000000,  0.0004839900000000, -0.0000470600000000 ]  - [   0.0003391300000000, -0.0008976500000000, -0.0002201500000000 ]  - [   0.0002718900000000,  0.0002739600000000, -0.0005202700000000 ]  - [   0.0002954000000000,  0.0000782700000000, -0.0003822100000000 ]  - [   0.0004411200000000, -0.0006540700000000, -0.0004471000000000 ]  - [  -0.0003008400000000,  0.0005207600000000, -0.0003942300000000 ]  - [  -0.0006163000000000, -0.0000533500000000,  0.0003412300000000 ]  - [  -0.0002958600000000, -0.0002818500000000,  0.0006125200000000 ]  - [   0.0000254400000000, -0.0000370700000000,  0.0000177900000000 ]  - [   0.0075373000000000, -0.0045775800000000,  0.0099956400000000 ]  - [  -0.0030474100000000,  0.0001772700000000,  0.0027678800000000 ]  - [  -0.0000400700000000,  0.0000324400000000,  0.0000119300000000 ]  - [   0.0000344700000000, -0.0000033500000000, -0.0000053600000000 ]  - [   0.0008257800000000,  0.0004409900000000, -0.0012152000000000 ]  - [   0.0189447000000000,  0.0023724900000000,  0.0002049600000000 ]  - [  -0.0000033300000000, -0.0000018500000000, -0.0000034400000000 ]  - [  -0.0658821800000000,  0.1937249300000000,  0.0201619800000000 ]  - [  -0.0000163900000000, -0.0000114000000000,  0.0000153300000000 ]  - [   0.0000263500000000, -0.0000125000000000,  0.0000167400000000 ]  - [   0.0255731500000000, -0.0482868400000000, -0.0008191000000000 ]  - [  -0.0175565400000000, -0.0191642200000000,  0.0004131100000000 ]  - [   0.0000046200000000,  0.0000163200000000,  0.0000181500000000 ]  - [  -0.0023013000000000, -0.0063228800000000, -0.0163256900000000 ]  - [  -0.0000311100000000,  0.0000047000000000, -0.0000147400000000 ]  - [  -0.0009010000000000, -0.0013440000000000, -0.0013384400000000 ]  - [  -0.0001168500000000,  0.0000187200000000, -0.0001210500000000 ]  - [   0.0000170800000000, -0.0000111000000000,  0.0000344700000000 ]  - [  -0.0040169500000000, -0.0007949800000000,  0.0013623700000000 ]  - [  -0.0000168500000000,  0.0000069800000000,  0.0000049000000000 ]  - [   0.0007478800000000, -0.0545679100000000, -0.0205103400000000 ]  - [   0.0020079900000000, -0.0019813700000000,  0.0008776700000000 ]  - [  -0.0001631000000000,  0.0002369800000000, -0.0001164100000000 ]  - [   0.0000169800000000, -0.0000019300000000, -0.0000019800000000 ]  - [   0.0004252400000000,  0.0093690100000000,  0.0046608400000000 ]  - [   0.0195945400000000, -0.0240447100000000, -0.0113603200000000 ]  - [  -0.0000168400000000, -0.0000046300000000,  0.0000113500000000 ]  - [   0.0000009600000000,  0.0000145500000000,  0.0000126600000000 ]  - [   0.0056737100000000, -0.0171351900000000, -0.0022040400000000 ]  - [  -0.0000517300000000, -0.0000094800000000, -0.0000958700000000 ]  - [   0.0024109900000000,  0.0036869100000000, -0.0029571100000000 ]  - [   0.0015946200000000, -0.0002404700000000,  0.0007654600000000 ]  - [   0.0001603600000000,  0.0001691200000000, -0.0000711900000000 ]  - [   0.0000593400000000, -0.0003019500000000, -0.0000883200000000 ]  - [  -0.0016021400000000,  0.0023383700000000, -0.0006021500000000 ]  - [  -0.0000048500000000,  0.0000013900000000, -0.0000972400000000 ]  - [   0.0102966100000000, -0.0317456400000000,  0.0122036400000000 ]- atom:   27  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0020828900000000, -0.0070003800000000 ]  - [   0.0000000000000000,  0.0006757300000000, -0.0044662500000000 ]  - [   0.0000877100000000,  0.0000502500000000,  0.0041218600000000 ]  - [  -0.0064636100000000, -0.0066566000000000,  0.0106401400000000 ]  - [   0.0064636100000000, -0.0066566000000000,  0.0106401400000000 ]  - [   0.0000000000000000, -0.0000359800000000,  0.0040252200000000 ]  - [   0.0000000000000000, -0.0015645600000000, -0.0026768400000000 ]  - [  -0.0000877100000000,  0.0000502500000000,  0.0041218600000000 ]  - [   0.0000000000000000,  0.0039601800000000,  0.0040792100000000 ]  - [   0.0000000000000000, -0.0002268400000000,  0.0042859100000000 ]  - [   0.0003656300000000,  0.0001065100000000,  0.0031923800000000 ]  - [   0.0000000000000000,  0.0000165200000000,  0.0055391700000000 ]  - [  -0.0004289600000000, -0.0001097500000000,  0.0034665000000000 ]  - [  -0.0003656300000000,  0.0001065100000000,  0.0031923800000000 ]  - [   0.0000000000000000, -0.0004869500000000,  0.0050914700000000 ]  - [   0.0004289600000000, -0.0001097500000000,  0.0034665000000000 ]  - [   0.0000000000000000, -0.0007399500000000,  0.0044755100000000 ]  - [   0.0000000000000000, -0.0003865000000000,  0.0039163700000000 ]  - [   0.0000000000000000, -0.0005422800000000,  0.0037390900000000 ]  - [   0.0098388600000000, -0.0056505700000000,  0.0067459200000000 ]  - [  -0.0098388600000000, -0.0056505700000000,  0.0067459200000000 ]  - [  -0.0004014600000000,  0.0003218900000000,  0.0038067700000000 ]  - [   0.0004014600000000,  0.0003218900000000,  0.0038067700000000 ]  - [   0.0000000000000000, -0.0002166700000000, -0.0041654100000000 ]  - [   0.0000000000000000,  0.0000585400000000, -0.0146049600000000 ]  - [   0.0000000000000000,  0.0000061100000000,  0.0039620700000000 ]  - [   0.0000000000000000, -0.0228245600000000, -0.1539278500000000 ]  - [  -0.0000238000000000, -0.0000207400000000,  0.0041793000000000 ]  - [   0.0000238000000000, -0.0000207400000000,  0.0041793000000000 ]  - [  -0.0004582100000000, -0.0010749600000000, -0.0177225900000000 ]  - [   0.0004582100000000, -0.0010749600000000, -0.0177225900000000 ]  - [   0.0000000000000000,  0.0000260900000000,  0.0042268300000000 ]  - [   0.0000000000000000,  0.0201159300000000,  0.0189763600000000 ]  - [   0.0000000000000000, -0.0001157600000000,  0.0048427600000000 ]  - [   0.0000000000000000, -0.0024700200000000, -0.0036169000000000 ]  - [   0.0000000000000000, -0.0004755400000000, -0.0046400100000000 ]  - [   0.0000000000000000, -0.0000629300000000, -0.0045537000000000 ]  - [   0.0000000000000000, -0.0017964500000000,  0.0064613800000000 ]  - [   0.0000000000000000,  0.0000063200000000, -0.0045536600000000 ]  - [   0.0000000000000000,  0.0209276500000000,  0.0228103700000000 ]  - [   0.0000000000000000, -0.0018203300000000, -0.0082252600000000 ]  - [   0.0009825900000000,  0.0000439700000000, -0.0057055400000000 ]  - [   0.0002970000000000, -0.0001974200000000, -0.0055977400000000 ]  - [   0.0000000000000000, -0.0009473900000000,  0.0211928500000000 ]  - [  -0.0068677600000000,  0.0038764000000000,  0.0387485600000000 ]  - [  -0.0002970000000000, -0.0001974200000000, -0.0055977400000000 ]  - [   0.0000000000000000,  0.0003656200000000, -0.0056665400000000 ]  - [   0.0068677600000000,  0.0038764000000000,  0.0387485600000000 ]  - [   0.0000000000000000, -0.0000433700000000, -0.0061167300000000 ]  - [   0.0000000000000000,  0.0050687600000000, -0.0041170000000000 ]  - [  -0.0022947000000000,  0.0032429800000000, -0.0038978900000000 ]  - [  -0.0009825900000000,  0.0000439700000000, -0.0057055400000000 ]  - [   0.0000000000000000,  0.0005044700000000, -0.0054188900000000 ]  - [   0.0022947000000000,  0.0032429800000000, -0.0038978900000000 ]  - [   0.0000000000000000,  0.0000446400000000, -0.0073365100000000 ]  - [   0.0000000000000000, -0.0069672900000000,  0.0395070100000000 ]- atom:   27  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000, -0.0020978200000000,  0.0070266600000000 ]  - [   0.0000000000000000, -0.0006703600000000,  0.0044786500000000 ]  - [  -0.0001322100000000, -0.0000240100000000, -0.0040685000000000 ]  - [   0.0063915500000000,  0.0065378800000000, -0.0104278900000000 ]  - [  -0.0063915500000000,  0.0065378800000000, -0.0104278900000000 ]  - [   0.0000000000000000, -0.0000022900000000, -0.0039743500000000 ]  - [   0.0000000000000000,  0.0015955700000000,  0.0026759400000000 ]  - [   0.0001322100000000, -0.0000240100000000, -0.0040685000000000 ]  - [   0.0000000000000000, -0.0038999500000000, -0.0039492500000000 ]  - [   0.0000000000000000,  0.0002276500000000, -0.0041760900000000 ]  - [  -0.0004109200000000, -0.0000776300000000, -0.0032524300000000 ]  - [   0.0000000000000000,  0.0000292400000000, -0.0056056300000000 ]  - [   0.0003840600000000,  0.0000831800000000, -0.0035191900000000 ]  - [   0.0004109200000000, -0.0000776300000000, -0.0032524300000000 ]  - [   0.0000000000000000,  0.0004346300000000, -0.0051287600000000 ]  - [  -0.0003840600000000,  0.0000831800000000, -0.0035191900000000 ]  - [   0.0000000000000000,  0.0007332700000000, -0.0045284100000000 ]  - [   0.0000000000000000,  0.0003890600000000, -0.0039555100000000 ]  - [   0.0000000000000000,  0.0005305100000000, -0.0037449500000000 ]  - [  -0.0100102900000000,  0.0057381100000000, -0.0068504700000000 ]  - [   0.0100102900000000,  0.0057381100000000, -0.0068504700000000 ]  - [   0.0003901900000000, -0.0003147700000000, -0.0038103800000000 ]  - [  -0.0003901900000000, -0.0003147700000000, -0.0038103800000000 ]  - [   0.0000000000000000,  0.0002319900000000,  0.0042065000000000 ]  - [   0.0000000000000000, -0.0000484600000000,  0.0145876600000000 ]  - [   0.0000000000000000, -0.0000057800000000, -0.0040033400000000 ]  - [   0.0000000000000000,  0.0252800300000000,  0.1547509400000000 ]  - [  -0.0000144200000000, -0.0000029300000000, -0.0041568200000000 ]  - [   0.0000144200000000, -0.0000029300000000, -0.0041568200000000 ]  - [   0.0003406100000000,  0.0012609200000000,  0.0177350100000000 ]  - [  -0.0003406100000000,  0.0012609200000000,  0.0177350100000000 ]  - [   0.0000000000000000,  0.0000082900000000, -0.0042023800000000 ]  - [   0.0000000000000000, -0.0205204200000000, -0.0193668600000000 ]  - [   0.0000000000000000,  0.0001142400000000, -0.0048723400000000 ]  - [   0.0000000000000000,  0.0024941600000000,  0.0035634700000000 ]  - [   0.0000000000000000,  0.0004617200000000,  0.0045949200000000 ]  - [   0.0000000000000000,  0.0000448100000000,  0.0045670400000000 ]  - [   0.0000000000000000,  0.0018047700000000, -0.0063496400000000 ]  - [   0.0000000000000000,  0.0000150600000000,  0.0045712100000000 ]  - [   0.0000000000000000, -0.0207933200000000, -0.0228872900000000 ]  - [   0.0000000000000000,  0.0018109700000000,  0.0081700600000000 ]  - [  -0.0009892900000000, -0.0000437600000000,  0.0056721700000000 ]  - [  -0.0002789100000000,  0.0001866300000000,  0.0056244300000000 ]  - [   0.0000000000000000,  0.0009484200000000, -0.0213524300000000 ]  - [   0.0080201100000000, -0.0044209100000000, -0.0395050900000000 ]  - [   0.0002789100000000,  0.0001866300000000,  0.0056244300000000 ]  - [   0.0000000000000000, -0.0003446800000000,  0.0056924600000000 ]  - [  -0.0080201100000000, -0.0044209100000000, -0.0395050900000000 ]  - [   0.0000000000000000,  0.0000408700000000,  0.0062393700000000 ]  - [   0.0000000000000000, -0.0050906100000000,  0.0042168900000000 ]  - [   0.0022728100000000, -0.0032222100000000,  0.0038811500000000 ]  - [   0.0009892900000000, -0.0000437600000000,  0.0056721700000000 ]  - [   0.0000000000000000, -0.0005083200000000,  0.0053838500000000 ]  - [  -0.0022728100000000, -0.0032222100000000,  0.0038811500000000 ]  - [   0.0000000000000000, -0.0000451500000000,  0.0071842100000000 ]  - [   0.0000000000000000,  0.0054308800000000, -0.0384565500000000 ]- atom:   33  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0213526400000000,  0.0000331500000000,  0.0002973200000000 ]  - [   0.0000739500000000,  0.0000001100000000,  0.0000083200000000 ]  - [  -0.0002628300000000,  0.0004747200000000, -0.0006191400000000 ]  - [  -0.0002444200000000, -0.0005959500000000, -0.0006440200000000 ]  - [  -0.0002918400000000,  0.0005722600000000,  0.0006915300000000 ]  - [   0.0005537300000000, -0.0000194400000000,  0.0000214100000000 ]  - [  -0.0012797600000000,  0.0000212100000000,  0.0000278400000000 ]  - [  -0.0002237000000000, -0.0004455400000000,  0.0006670400000000 ]  - [   0.0007613500000000, -0.0000011300000000,  0.0000513600000000 ]  - [  -0.0011143600000000, -0.0000054100000000,  0.0000539800000000 ]  - [  -0.0000533500000000,  0.0000419200000000,  0.0001077600000000 ]  - [  -0.0034791200000000,  0.0000428400000000,  0.0000130400000000 ]  - [   0.0003660200000000,  0.0022382800000000, -0.0089831700000000 ]  - [  -0.0000033100000000, -0.0000132200000000, -0.0001677200000000 ]  - [   0.0000195600000000, -0.0000257100000000, -0.0000288800000000 ]  - [   0.0004353700000000, -0.0022417400000000,  0.0088519400000000 ]  - [  -0.0000635600000000, -0.0000000700000000, -0.0000272100000000 ]  - [   0.0000966800000000, -0.0000049300000000, -0.0000404200000000 ]  - [   0.0000199500000000, -0.0000053400000000, -0.0000040700000000 ]  - [   0.0068222500000000, -0.0176673800000000,  0.0000806800000000 ]  - [   0.0068532600000000,  0.0176673400000000, -0.0000926200000000 ]  - [  -0.0000052600000000,  0.0000141700000000, -0.0000174600000000 ]  - [   0.0000060900000000, -0.0000081700000000,  0.0000111200000000 ]  - [   0.0374432700000000,  0.0000162200000000,  0.0000004300000000 ]  - [   0.0007137100000000,  0.0000132700000000, -0.0000092600000000 ]  - [   0.0000220600000000,  0.0000000500000000, -0.0000241700000000 ]  - [  -0.0045481100000000, -0.0000472500000000, -0.0000435700000000 ]  - [  -0.0000340800000000,  0.0000139600000000, -0.0000892100000000 ]  - [   0.0000051000000000, -0.0000386800000000,  0.0001056300000000 ]  - [   0.0043245600000000, -0.0051495100000000,  0.0176737800000000 ]  - [   0.0044010100000000,  0.0051400900000000, -0.0175133500000000 ]  - [  -0.0000600700000000,  0.0000175100000000,  0.0000103100000000 ]  - [  -0.1274238600000000, -0.0010865200000000, -0.0015867200000000 ]  - [  -0.0000258400000000, -0.0000004400000000, -0.0000183100000000 ]  - [  -0.0029400900000000, -0.0000253600000000,  0.0000084500000000 ]  - [  -0.0000420200000000, -0.0000049000000000, -0.0000188800000000 ]  - [  -0.0004573200000000, -0.0000096900000000,  0.0000072900000000 ]  - [  -0.0000003900000000,  0.0000109300000000,  0.0000078900000000 ]  - [  -0.0000660700000000,  0.0000099900000000,  0.0000103000000000 ]  - [  -0.0045580400000000,  0.0000020100000000,  0.0000065200000000 ]  - [   0.0004492900000000,  0.0000010400000000, -0.0000121000000000 ]  - [  -0.0000328300000000,  0.0023833000000000,  0.0015122400000000 ]  - [   0.0000107600000000,  0.0000186400000000,  0.0000389900000000 ]  - [   0.0163667600000000,  0.0000568200000000,  0.0000030500000000 ]  - [   0.0206861400000000,  0.0025350300000000,  0.0085099400000000 ]  - [  -0.0000078200000000, -0.0000293000000000, -0.0000060100000000 ]  - [   0.0000429900000000,  0.0000104900000000,  0.0000165700000000 ]  - [   0.0191788700000000, -0.0015900900000000, -0.0072827200000000 ]  - [  -0.0000093500000000, -0.0000006700000000,  0.0000642800000000 ]  - [  -0.0046995800000000,  0.0000717200000000,  0.0000864300000000 ]  - [   0.0000028300000000, -0.0002593300000000,  0.0003998100000000 ]  - [  -0.0000585800000000, -0.0023762100000000, -0.0015390200000000 ]  - [   0.0040762100000000,  0.0000035900000000, -0.0000104100000000 ]  - [   0.0000019600000000,  0.0002566000000000, -0.0004282800000000 ]  - [   0.0004695700000000,  0.0000006100000000, -0.0000715300000000 ]  - [   0.0064296200000000, -0.0000159000000000, -0.0000670100000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0866056000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0051864900000000 ]  - [   0.0008533200000000, -0.0004926600000000,  0.0043632700000000 ]  - [  -0.0002533400000000,  0.0001462700000000,  0.0043846900000000 ]  - [   0.0002533400000000,  0.0001462700000000,  0.0043846900000000 ]  - [   0.0000000000000000,  0.0009853300000000,  0.0043632700000000 ]  - [   0.0000000000000000, -0.0002925400000000,  0.0043846900000000 ]  - [  -0.0008533200000000, -0.0004926600000000,  0.0043632700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0060823300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049817000000000 ]  - [   0.0002137800000000, -0.0001234300000000,  0.0044712900000000 ]  - [   0.0000000000000000,  0.0081246200000000,  0.0114040600000000 ]  - [  -0.0070361300000000, -0.0040623100000000,  0.0114040600000000 ]  - [  -0.0002137800000000, -0.0001234300000000,  0.0044712900000000 ]  - [   0.0000000000000000,  0.0002468600000000,  0.0044712900000000 ]  - [   0.0070361300000000, -0.0040623100000000,  0.0114040600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053502900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0036858300000000 ]  - [   0.0000000000000000, -0.0005923000000000,  0.0043685300000000 ]  - [   0.0014208600000000,  0.0008203400000000, -0.0145959300000000 ]  - [  -0.0014208600000000,  0.0008203400000000, -0.0145959300000000 ]  - [  -0.0005129400000000,  0.0002961500000000,  0.0043685300000000 ]  - [   0.0005129400000000,  0.0002961500000000,  0.0043685300000000 ]  - [   0.0000000000000000, -0.0016406700000000, -0.0145959300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0078643700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045260300000000 ]  - [   0.0000000000000000,  0.0189314600000000,  0.0193207200000000 ]  - [  -0.0000203700000000, -0.0000117600000000,  0.0048555000000000 ]  - [   0.0000203700000000, -0.0000117600000000,  0.0048555000000000 ]  - [   0.0163951200000000, -0.0094657300000000,  0.0193207200000000 ]  - [  -0.0163951200000000, -0.0094657300000000,  0.0193207200000000 ]  - [   0.0000000000000000,  0.0000235300000000,  0.0048555000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2657505800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0055822700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0113011500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0052936300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057569500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022304900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0053626100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0012996100000000 ]  - [   0.0000000000000000,  0.0002105900000000, -0.0067385100000000 ]  - [   0.0040310200000000, -0.0023273100000000, -0.0052970300000000 ]  - [   0.0003837200000000, -0.0002215400000000, -0.0064787800000000 ]  - [   0.0000000000000000, -0.0070809200000000,  0.0414836800000000 ]  - [   0.0061322500000000,  0.0035404600000000,  0.0414836800000000 ]  - [  -0.0003837200000000, -0.0002215400000000, -0.0064787800000000 ]  - [   0.0000000000000000,  0.0004430800000000, -0.0064787800000000 ]  - [  -0.0061322500000000,  0.0035404600000000,  0.0414836800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0070580400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0160756400000000 ]  - [  -0.0001823800000000, -0.0001053000000000, -0.0067385100000000 ]  - [  -0.0040310200000000, -0.0023273100000000, -0.0052970300000000 ]  - [   0.0000000000000000,  0.0046546200000000, -0.0052970300000000 ]  - [   0.0001823800000000, -0.0001053000000000, -0.0067385100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0083575800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0098824800000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0934230600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0052246600000000 ]  - [  -0.0009030300000000,  0.0005213700000000, -0.0043321600000000 ]  - [   0.0002968900000000, -0.0001714100000000, -0.0043593200000000 ]  - [  -0.0002968900000000, -0.0001714100000000, -0.0043593200000000 ]  - [   0.0000000000000000, -0.0010427300000000, -0.0043321600000000 ]  - [   0.0000000000000000,  0.0003428200000000, -0.0043593200000000 ]  - [   0.0009030300000000,  0.0005213700000000, -0.0043321600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059895700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048905900000000 ]  - [  -0.0002595800000000,  0.0001498700000000, -0.0045472200000000 ]  - [   0.0000000000000000, -0.0082013900000000, -0.0116251300000000 ]  - [   0.0071026100000000,  0.0041007000000000, -0.0116251300000000 ]  - [   0.0002595800000000,  0.0001498700000000, -0.0045472200000000 ]  - [   0.0000000000000000, -0.0002997400000000, -0.0045472200000000 ]  - [  -0.0071026100000000,  0.0041007000000000, -0.0116251300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054337200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0036913800000000 ]  - [   0.0000000000000000,  0.0005835600000000, -0.0043964500000000 ]  - [  -0.0014396700000000, -0.0008311900000000,  0.0146440300000000 ]  - [   0.0014396700000000, -0.0008311900000000,  0.0146440300000000 ]  - [   0.0005053800000000, -0.0002917800000000, -0.0043964500000000 ]  - [  -0.0005053800000000, -0.0002917800000000, -0.0043964500000000 ]  - [   0.0000000000000000,  0.0016623800000000,  0.0146440300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0077789200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045901200000000 ]  - [   0.0000000000000000, -0.0186535200000000, -0.0190196200000000 ]  - [  -0.0000126900000000, -0.0000073300000000, -0.0048563500000000 ]  - [   0.0000126900000000, -0.0000073300000000, -0.0048563500000000 ]  - [  -0.0161544200000000,  0.0093267600000000, -0.0190196200000000 ]  - [   0.0161544200000000,  0.0093267600000000, -0.0190196200000000 ]  - [   0.0000000000000000,  0.0000146500000000, -0.0048563500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2708203300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056441500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0114956600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0052797000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0058071600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022819100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054099400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012325000000000 ]  - [   0.0000000000000000, -0.0002023900000000,  0.0067346100000000 ]  - [  -0.0040675500000000,  0.0023484000000000,  0.0052885100000000 ]  - [  -0.0003670800000000,  0.0002119300000000,  0.0065379500000000 ]  - [   0.0000000000000000,  0.0060287800000000, -0.0409771000000000 ]  - [  -0.0052210800000000, -0.0030143900000000, -0.0409771000000000 ]  - [   0.0003670800000000,  0.0002119300000000,  0.0065379500000000 ]  - [   0.0000000000000000, -0.0004238700000000,  0.0065379500000000 ]  - [   0.0052210800000000, -0.0030143900000000, -0.0409771000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0072167100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0161309000000000 ]  - [   0.0001752800000000,  0.0001012000000000,  0.0067346100000000 ]  - [   0.0040675500000000,  0.0023484000000000,  0.0052885100000000 ]  - [   0.0000000000000000, -0.0046968000000000,  0.0052885100000000 ]  - [  -0.0001752800000000,  0.0001012000000000,  0.0067346100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0082473400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0097969300000000 ]- atom:   35  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0180618200000000, -0.0000702900000000, -0.0000382000000000 ]  - [  -0.0000231100000000, -0.0000000500000000,  0.0000084600000000 ]  - [  -0.0010081300000000,  0.0018370400000000, -0.0021222000000000 ]  - [   0.0000787100000000,  0.0000558100000000,  0.0003118400000000 ]  - [   0.0000337700000000, -0.0000844900000000, -0.0002633400000000 ]  - [   0.0021827600000000, -0.0000265500000000,  0.0000324300000000 ]  - [   0.0001776900000000,  0.0000209300000000,  0.0000224900000000 ]  - [  -0.0009477900000000, -0.0018129500000000,  0.0021842900000000 ]  - [  -0.0000758500000000,  0.0000002300000000,  0.0000529500000000 ]  - [  -0.0051775900000000,  0.0000044900000000,  0.0000309800000000 ]  - [  -0.0000184900000000, -0.0000006700000000, -0.0000535000000000 ]  - [   0.0028622700000000, -0.0000790800000000,  0.0000262800000000 ]  - [   0.0220442300000000,  0.0110135100000000,  0.0103444600000000 ]  - [   0.0000294900000000,  0.0000284400000000, -0.0000064400000000 ]  - [  -0.0000197000000000, -0.0000251400000000, -0.0000282600000000 ]  - [   0.0234724000000000, -0.0119673700000000, -0.0112836400000000 ]  - [   0.0000390400000000, -0.0000002800000000, -0.0000277700000000 ]  - [  -0.0050765200000000, -0.0000400300000000, -0.0000038300000000 ]  - [   0.0000336000000000, -0.0000061400000000, -0.0000044800000000 ]  - [   0.0045696400000000, -0.0015313700000000, -0.0040849700000000 ]  - [   0.0042164600000000,  0.0016830900000000,  0.0043592000000000 ]  - [  -0.0000046700000000,  0.0000214200000000, -0.0000419600000000 ]  - [   0.0000066900000000, -0.0000159500000000,  0.0000345200000000 ]  - [   0.0071777800000000,  0.0000186200000000, -0.0000237500000000 ]  - [   0.0034524500000000,  0.0000081100000000, -0.0000261900000000 ]  - [   0.0000866900000000, -0.0000003600000000, -0.0000243100000000 ]  - [  -0.0018021400000000, -0.0000231100000000,  0.0000100300000000 ]  - [  -0.0000969500000000,  0.0000857200000000, -0.0003958700000000 ]  - [  -0.0000567200000000, -0.0001119500000000,  0.0004119700000000 ]  - [   0.0006842600000000, -0.0014380600000000, -0.0021449300000000 ]  - [   0.0007350000000000,  0.0014624200000000,  0.0021568400000000 ]  - [  -0.0002480800000000,  0.0000177400000000,  0.0000091800000000 ]  - [  -0.0029318800000000,  0.0000170100000000, -0.0000309200000000 ]  - [  -0.0000497900000000, -0.0000003900000000, -0.0000187500000000 ]  - [  -0.1052116900000000,  0.0009336400000000,  0.0005502600000000 ]  - [   0.0000339300000000, -0.0000053900000000, -0.0000172800000000 ]  - [  -0.0020814700000000, -0.0000078400000000,  0.0000196700000000 ]  - [   0.0001400900000000,  0.0000091800000000,  0.0000123300000000 ]  - [  -0.0002479900000000,  0.0000094300000000,  0.0000105600000000 ]  - [   0.0015345200000000, -0.0000086200000000,  0.0000069200000000 ]  - [  -0.0001462800000000,  0.0000008600000000, -0.0000133200000000 ]  - [   0.0005037600000000,  0.0118088900000000,  0.0045361800000000 ]  - [   0.0000081200000000,  0.0001114400000000,  0.0001324300000000 ]  - [  -0.0135989700000000, -0.0000346000000000, -0.0000037400000000 ]  - [   0.0016793200000000,  0.0087951200000000, -0.0118106400000000 ]  - [  -0.0000096600000000, -0.0001224200000000, -0.0000992800000000 ]  - [   0.0002017600000000,  0.0000098400000000,  0.0000166000000000 ]  - [   0.0016023600000000, -0.0088024900000000,  0.0119032100000000 ]  - [  -0.0000312500000000, -0.0000005800000000,  0.0000649500000000 ]  - [   0.0210235600000000,  0.0000932400000000,  0.0001491200000000 ]  - [   0.0000030200000000,  0.0000860200000000, -0.0000963000000000 ]  - [   0.0005954400000000, -0.0117823100000000, -0.0045789900000000 ]  - [   0.0209805800000000, -0.0000442800000000, -0.0000800500000000 ]  - [   0.0000053700000000, -0.0000878300000000,  0.0000697400000000 ]  - [   0.0019481700000000, -0.0000007500000000, -0.0000739200000000 ]  - [  -0.0013400200000000, -0.0000008800000000, -0.0000710300000000 ]- atom:   35  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0250850000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049083600000000 ]  - [  -0.0021788800000000,  0.0012579800000000, -0.0032167200000000 ]  - [  -0.0000780600000000,  0.0000450700000000, -0.0045233100000000 ]  - [   0.0000780600000000,  0.0000450700000000, -0.0045233100000000 ]  - [   0.0000000000000000, -0.0025159600000000, -0.0032167200000000 ]  - [   0.0000000000000000, -0.0000901400000000, -0.0045233100000000 ]  - [   0.0021788800000000,  0.0012579800000000, -0.0032167200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044402700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0018662800000000 ]  - [  -0.0001350300000000,  0.0000779600000000, -0.0042109000000000 ]  - [   0.0000000000000000, -0.0154130600000000,  0.0213897000000000 ]  - [   0.0133481000000000,  0.0077065300000000,  0.0213897000000000 ]  - [   0.0001350300000000,  0.0000779600000000, -0.0042109000000000 ]  - [   0.0000000000000000, -0.0001559200000000, -0.0042109000000000 ]  - [  -0.0133481000000000,  0.0077065300000000,  0.0213897000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054126800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0142890900000000 ]  - [   0.0000000000000000,  0.0005751100000000, -0.0041916400000000 ]  - [  -0.0018447900000000, -0.0010650900000000,  0.0130255600000000 ]  - [   0.0018447900000000, -0.0010650900000000,  0.0130255600000000 ]  - [   0.0004980600000000, -0.0002875500000000, -0.0041916400000000 ]  - [  -0.0004980600000000, -0.0002875500000000, -0.0041916400000000 ]  - [   0.0000000000000000,  0.0021301800000000,  0.0130255600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056526200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044579900000000 ]  - [   0.0000000000000000,  0.0014795400000000, -0.0035573700000000 ]  - [   0.0001013400000000,  0.0000585100000000, -0.0046284600000000 ]  - [  -0.0001013400000000,  0.0000585100000000, -0.0046284600000000 ]  - [   0.0012813200000000, -0.0007397700000000, -0.0035573700000000 ]  - [  -0.0012813200000000, -0.0007397700000000, -0.0035573700000000 ]  - [   0.0000000000000000, -0.0001170200000000, -0.0046284600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0114124900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0053248600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1125129200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0050500000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0104388800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054335300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0046465600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0060099200000000 ]  - [   0.0000000000000000,  0.0004612000000000,  0.0062114400000000 ]  - [  -0.0026632700000000,  0.0015376400000000,  0.0021259500000000 ]  - [  -0.0003158300000000,  0.0001823400000000,  0.0062180000000000 ]  - [   0.0000000000000000,  0.0131922600000000,  0.0124450500000000 ]  - [  -0.0114248300000000, -0.0065961300000000,  0.0124450500000000 ]  - [   0.0003158300000000,  0.0001823400000000,  0.0062180000000000 ]  - [   0.0000000000000000, -0.0003646800000000,  0.0062180000000000 ]  - [   0.0114248300000000, -0.0065961300000000,  0.0124450500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0069239700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0316562800000000 ]  - [  -0.0003994100000000, -0.0002306000000000,  0.0062114400000000 ]  - [   0.0026632700000000,  0.0015376400000000,  0.0021259500000000 ]  - [   0.0000000000000000, -0.0030752700000000,  0.0021259500000000 ]  - [   0.0003994100000000, -0.0002306000000000,  0.0062114400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0085086900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0075255400000000 ]- atom:   35  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0250186800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0049170700000000 ]  - [   0.0021760100000000, -0.0012563200000000,  0.0032499600000000 ]  - [   0.0001059100000000, -0.0000611500000000,  0.0045664000000000 ]  - [  -0.0001059100000000, -0.0000611500000000,  0.0045664000000000 ]  - [   0.0000000000000000,  0.0025126500000000,  0.0032499600000000 ]  - [   0.0000000000000000,  0.0001223000000000,  0.0045664000000000 ]  - [  -0.0021760100000000, -0.0012563200000000,  0.0032499600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045208200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018690700000000 ]  - [   0.0001027400000000, -0.0000593200000000,  0.0041622900000000 ]  - [   0.0000000000000000,  0.0158758600000000, -0.0215175300000000 ]  - [  -0.0137489000000000, -0.0079379300000000, -0.0215175300000000 ]  - [  -0.0001027400000000, -0.0000593200000000,  0.0041622900000000 ]  - [   0.0000000000000000,  0.0001186400000000,  0.0041622900000000 ]  - [   0.0137489000000000, -0.0079379300000000, -0.0215175300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053655400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0143977800000000 ]  - [   0.0000000000000000, -0.0005848500000000,  0.0041798600000000 ]  - [   0.0021542400000000,  0.0012437500000000, -0.0125907800000000 ]  - [  -0.0021542400000000,  0.0012437500000000, -0.0125907800000000 ]  - [  -0.0005064900000000,  0.0002924200000000,  0.0041798600000000 ]  - [   0.0005064900000000,  0.0002924200000000,  0.0041798600000000 ]  - [   0.0000000000000000, -0.0024875000000000, -0.0125907800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056106300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044425400000000 ]  - [   0.0000000000000000, -0.0015058400000000,  0.0035945600000000 ]  - [  -0.0001228800000000, -0.0000709500000000,  0.0046531600000000 ]  - [   0.0001228800000000, -0.0000709500000000,  0.0046531600000000 ]  - [  -0.0013041000000000,  0.0007529200000000,  0.0035945600000000 ]  - [   0.0013041000000000,  0.0007529200000000,  0.0035945600000000 ]  - [   0.0000000000000000,  0.0001419000000000,  0.0046531600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0114164200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0052829800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1110714500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0051047300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0105051900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054035000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045934700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0060048000000000 ]  - [   0.0000000000000000, -0.0004598500000000, -0.0062367000000000 ]  - [   0.0026118200000000, -0.0015079400000000, -0.0020254200000000 ]  - [   0.0003307700000000, -0.0001909700000000, -0.0062023900000000 ]  - [   0.0000000000000000, -0.0130433300000000, -0.0123031600000000 ]  - [   0.0112958600000000,  0.0065216700000000, -0.0123031600000000 ]  - [  -0.0003307700000000, -0.0001909700000000, -0.0062023900000000 ]  - [   0.0000000000000000,  0.0003819400000000, -0.0062023900000000 ]  - [  -0.0112958600000000,  0.0065216700000000, -0.0123031600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0068397000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0316733000000000 ]  - [   0.0003982400000000,  0.0002299300000000, -0.0062367000000000 ]  - [  -0.0026118200000000, -0.0015079400000000, -0.0020254200000000 ]  - [   0.0000000000000000,  0.0030158700000000, -0.0020254200000000 ]  - [  -0.0003982400000000,  0.0002299300000000, -0.0062367000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0086283400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0076347300000000 ]- atom:   37  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0027277900000000, -0.0000008400000000,  0.0000112800000000 ]  - [   0.0000034800000000, -0.0000005600000000,  0.0000052800000000 ]  - [   0.0454261000000000, -0.0253825900000000, -0.0177743500000000 ]  - [   0.0000271000000000, -0.0000170200000000,  0.0000332100000000 ]  - [  -0.0000164600000000, -0.0000104700000000,  0.0000185100000000 ]  - [   0.0011739200000000,  0.0001774500000000, -0.0000383800000000 ]  - [  -0.0000002100000000,  0.0000209400000000,  0.0000241000000000 ]  - [   0.0477944900000000,  0.0270955500000000,  0.0190225400000000 ]  - [   0.0000036200000000,  0.0000004000000000,  0.0000544900000000 ]  - [  -0.0063497000000000,  0.0000571300000000,  0.0000086000000000 ]  - [  -0.0000264800000000, -0.0000097400000000, -0.0000054200000000 ]  - [   0.0024512700000000,  0.0000382300000000, -0.0000388500000000 ]  - [  -0.0017228700000000, -0.0024022900000000,  0.0027192500000000 ]  - [   0.0000230500000000,  0.0000381700000000, -0.0000520200000000 ]  - [  -0.0000430300000000, -0.0000255900000000, -0.0000261000000000 ]  - [  -0.0016519000000000,  0.0023768300000000, -0.0027997300000000 ]  - [   0.0000761500000000, -0.0000000200000000, -0.0000277400000000 ]  - [  -0.0042537600000000, -0.0000055300000000,  0.0000013600000000 ]  - [  -0.0001015800000000,  0.0000047200000000, -0.0000144800000000 ]  - [  -0.0000048700000000, -0.0001966500000000, -0.0000581000000000 ]  - [   0.0000086400000000,  0.0001896200000000,  0.0000534600000000 ]  - [   0.0003481200000000, -0.0002546000000000, -0.0008552000000000 ]  - [   0.0003353400000000,  0.0002574100000000,  0.0008449800000000 ]  - [   0.0003363900000000,  0.0000065500000000, -0.0000037400000000 ]  - [  -0.0000010600000000,  0.0000000300000000, -0.0000219600000000 ]  - [   0.0071109900000000,  0.0000060100000000,  0.0001004700000000 ]  - [  -0.0000004000000000, -0.0000178300000000,  0.0000106200000000 ]  - [  -0.0013122800000000,  0.0038626300000000, -0.0015460300000000 ]  - [  -0.0012769500000000, -0.0039040400000000,  0.0015684600000000 ]  - [  -0.0000231300000000,  0.0000142900000000, -0.0000386500000000 ]  - [   0.0000150000000000,  0.0000099500000000,  0.0000571600000000 ]  - [  -0.0080212300000000, -0.0000071400000000,  0.0000673400000000 ]  - [  -0.0004752300000000,  0.0000003100000000, -0.0000185200000000 ]  - [   0.0000145600000000, -0.0000079900000000, -0.0000056000000000 ]  - [  -0.0021073100000000,  0.0000045300000000, -0.0000299900000000 ]  - [   0.0001636900000000, -0.0000034600000000, -0.0000162900000000 ]  - [  -0.1417205300000000, -0.0020097000000000, -0.0013624700000000 ]  - [  -0.0000180400000000,  0.0000096200000000,  0.0000093600000000 ]  - [   0.0095982400000000, -0.0000768300000000, -0.0000200800000000 ]  - [   0.0000315200000000, -0.0000094300000000,  0.0000098100000000 ]  - [  -0.0000202200000000,  0.0000007500000000, -0.0000146900000000 ]  - [   0.0011482800000000,  0.0141280400000000,  0.0050167100000000 ]  - [   0.0007675100000000, -0.0002372300000000,  0.0042257500000000 ]  - [  -0.0000792300000000, -0.0000111200000000,  0.0000161100000000 ]  - [   0.0000018400000000,  0.0000468600000000, -0.0001263500000000 ]  - [   0.0006377500000000,  0.0002342700000000, -0.0042237800000000 ]  - [   0.0002943300000000,  0.0000426400000000,  0.0000426500000000 ]  - [  -0.0000178600000000, -0.0000353700000000,  0.0001591600000000 ]  - [  -0.0004372000000000, -0.0000053700000000,  0.0000600300000000 ]  - [  -0.0003102200000000,  0.0000004000000000,  0.0000578700000000 ]  - [  -0.0000019000000000,  0.0000104000000000, -0.0000134900000000 ]  - [   0.0010293700000000, -0.0141805400000000, -0.0050296300000000 ]  - [   0.0256054600000000,  0.0000620100000000,  0.0000688400000000 ]  - [  -0.0000007900000000, -0.0000114900000000, -0.0000161200000000 ]  - [   0.0228597800000000,  0.0001278400000000, -0.0000166000000000 ]  - [  -0.0000193600000000, -0.0000001800000000, -0.0000730600000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0052618700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0039889900000000 ]  - [  -0.0207883300000000,  0.0120021500000000,  0.0230592500000000 ]  - [  -0.0000444500000000,  0.0000256600000000, -0.0044401500000000 ]  - [   0.0000444500000000,  0.0000256600000000, -0.0044401500000000 ]  - [   0.0000000000000000, -0.0240043000000000,  0.0230592500000000 ]  - [   0.0000000000000000, -0.0000513200000000, -0.0044401500000000 ]  - [   0.0207883300000000,  0.0120021500000000,  0.0230592500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044481500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0096920000000000 ]  - [  -0.0002588700000000,  0.0001494600000000, -0.0039960900000000 ]  - [   0.0000000000000000, -0.0032644200000000, -0.0027871200000000 ]  - [   0.0028270700000000,  0.0016322100000000, -0.0027871200000000 ]  - [   0.0002588700000000,  0.0001494600000000, -0.0039960900000000 ]  - [   0.0000000000000000, -0.0002989200000000, -0.0039960900000000 ]  - [  -0.0028270700000000,  0.0016322100000000, -0.0027871200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057117000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0003785800000000 ]  - [   0.0000000000000000,  0.0032055900000000, -0.0053914300000000 ]  - [   0.0002419800000000,  0.0001397100000000, -0.0039093500000000 ]  - [  -0.0002419800000000,  0.0001397100000000, -0.0039093500000000 ]  - [   0.0027761200000000, -0.0016027900000000, -0.0053914300000000 ]  - [  -0.0027761200000000, -0.0016027900000000, -0.0053914300000000 ]  - [   0.0000000000000000, -0.0002794200000000, -0.0039093500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042529200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0565809100000000 ]  - [   0.0000000000000000, -0.0000512300000000, -0.0045597400000000 ]  - [  -0.0013832600000000, -0.0007986300000000,  0.0063861600000000 ]  - [   0.0013832600000000, -0.0007986300000000,  0.0063861600000000 ]  - [  -0.0000443700000000,  0.0000256100000000, -0.0045597400000000 ]  - [   0.0000443700000000,  0.0000256100000000, -0.0045597400000000 ]  - [   0.0000000000000000,  0.0015972500000000,  0.0063861600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0058120700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022843500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0104880100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054243100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1274582800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0048725300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0135572200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049030000000000 ]  - [   0.0000000000000000,  0.0002379800000000,  0.0061453800000000 ]  - [   0.0011615200000000, -0.0006706000000000, -0.0015884500000000 ]  - [   0.0100289800000000, -0.0057902300000000,  0.0107620400000000 ]  - [   0.0000000000000000,  0.0001324400000000,  0.0061862000000000 ]  - [  -0.0001146900000000, -0.0000662200000000,  0.0061862000000000 ]  - [  -0.0100289800000000, -0.0057902300000000,  0.0107620400000000 ]  - [   0.0000000000000000,  0.0115804700000000,  0.0107620400000000 ]  - [   0.0001146900000000, -0.0000662200000000,  0.0061862000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057664200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053229900000000 ]  - [  -0.0002061000000000, -0.0001189900000000,  0.0061453800000000 ]  - [  -0.0011615200000000, -0.0006706000000000, -0.0015884500000000 ]  - [   0.0000000000000000,  0.0013412000000000, -0.0015884500000000 ]  - [   0.0002061000000000, -0.0001189900000000,  0.0061453800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0345741100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0078191400000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0052115400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0039519300000000 ]  - [   0.0205498800000000, -0.0118644800000000, -0.0231498500000000 ]  - [   0.0000893800000000, -0.0000516000000000,  0.0044962500000000 ]  - [  -0.0000893800000000, -0.0000516000000000,  0.0044962500000000 ]  - [   0.0000000000000000,  0.0237289600000000, -0.0231498500000000 ]  - [   0.0000000000000000,  0.0001032100000000,  0.0044962500000000 ]  - [  -0.0205498800000000, -0.0118644800000000, -0.0231498500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045611200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0094849400000000 ]  - [   0.0002090000000000, -0.0001206700000000,  0.0039435300000000 ]  - [   0.0000000000000000,  0.0032717100000000,  0.0027518600000000 ]  - [  -0.0028333800000000, -0.0016358600000000,  0.0027518600000000 ]  - [  -0.0002090000000000, -0.0001206700000000,  0.0039435300000000 ]  - [   0.0000000000000000,  0.0002413300000000,  0.0039435300000000 ]  - [   0.0028333800000000, -0.0016358600000000,  0.0027518600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056536000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0003485600000000 ]  - [   0.0000000000000000, -0.0032057400000000,  0.0053884300000000 ]  - [  -0.0002561800000000, -0.0001479000000000,  0.0039097500000000 ]  - [   0.0002561800000000, -0.0001479000000000,  0.0039097500000000 ]  - [  -0.0027762500000000,  0.0016028700000000,  0.0053884300000000 ]  - [   0.0027762500000000,  0.0016028700000000,  0.0053884300000000 ]  - [   0.0000000000000000,  0.0002958100000000,  0.0039097500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042139300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0606856300000000 ]  - [   0.0000000000000000,  0.0000090200000000,  0.0045811600000000 ]  - [   0.0013540800000000,  0.0007817800000000, -0.0063984200000000 ]  - [  -0.0013540800000000,  0.0007817800000000, -0.0063984200000000 ]  - [   0.0000078100000000, -0.0000045100000000,  0.0045811600000000 ]  - [  -0.0000078100000000, -0.0000045100000000,  0.0045811600000000 ]  - [   0.0000000000000000, -0.0015635600000000, -0.0063984200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057675300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022483500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0104039400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054338000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1316742200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048216900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0136985900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048612000000000 ]  - [   0.0000000000000000, -0.0002354400000000, -0.0061506800000000 ]  - [  -0.0011160200000000,  0.0006443300000000,  0.0013910300000000 ]  - [  -0.0100373500000000,  0.0057950700000000, -0.0107993800000000 ]  - [   0.0000000000000000, -0.0001568500000000, -0.0061289000000000 ]  - [   0.0001358300000000,  0.0000784200000000, -0.0061289000000000 ]  - [   0.0100373500000000,  0.0057950700000000, -0.0107993800000000 ]  - [   0.0000000000000000, -0.0115901300000000, -0.0107993800000000 ]  - [  -0.0001358300000000,  0.0000784200000000, -0.0061289000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056182500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0051946500000000 ]  - [   0.0002038900000000,  0.0001177200000000, -0.0061506800000000 ]  - [   0.0011160200000000,  0.0006443300000000,  0.0013910300000000 ]  - [   0.0000000000000000, -0.0012886700000000,  0.0013910300000000 ]  - [  -0.0002038900000000,  0.0001177200000000, -0.0061506800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0346295200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0079350200000000 ]- atom:   39  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0003293800000000, -0.0000030400000000,  0.0000079100000000 ]  - [  -0.0004774100000000,  0.0000006800000000,  0.0000160200000000 ]  - [  -0.0011985000000000, -0.0036005100000000,  0.0015549400000000 ]  - [   0.0000342400000000, -0.0000454300000000,  0.0000160200000000 ]  - [  -0.0000103500000000,  0.0000179100000000,  0.0000299500000000 ]  - [  -0.0074513300000000,  0.0000045100000000, -0.0000329700000000 ]  - [  -0.0000429200000000,  0.0000215100000000,  0.0000212900000000 ]  - [  -0.0011563200000000,  0.0036435600000000, -0.0015120900000000 ]  - [   0.0000949200000000,  0.0000004100000000,  0.0000509500000000 ]  - [   0.0062099500000000, -0.0000081700000000, -0.0001451000000000 ]  - [   0.0000571700000000, -0.0001662400000000,  0.0004093300000000 ]  - [  -0.0001849000000000,  0.0000172600000000, -0.0000172300000000 ]  - [   0.0001303400000000,  0.0001778300000000,  0.0008867200000000 ]  - [   0.0001030000000000,  0.0001922900000000, -0.0004743400000000 ]  - [  -0.0002302300000000, -0.0000232200000000, -0.0000311600000000 ]  - [   0.0001560900000000, -0.0002009200000000, -0.0009398500000000 ]  - [   0.0003503400000000,  0.0000002300000000, -0.0000280300000000 ]  - [   0.0000054500000000,  0.0000071800000000, -0.0000401300000000 ]  - [   0.0033326600000000, -0.0000199900000000,  0.0000034000000000 ]  - [  -0.0000005900000000, -0.0000263600000000, -0.0000511100000000 ]  - [   0.0000085500000000,  0.0000214300000000,  0.0000404000000000 ]  - [  -0.0006795400000000,  0.0023066100000000, -0.0032410600000000 ]  - [  -0.0006387500000000, -0.0023025900000000,  0.0032526000000000 ]  - [   0.0000454400000000,  0.0000047200000000, -0.0000063000000000 ]  - [   0.0000048600000000,  0.0000001900000000, -0.0000258000000000 ]  - [  -0.0057750800000000, -0.0000522300000000,  0.0000184300000000 ]  - [  -0.0000051700000000, -0.0000177500000000,  0.0000079500000000 ]  - [   0.0475777700000000,  0.0266076000000000,  0.0174896500000000 ]  - [   0.0500335900000000, -0.0283827100000000, -0.0186654600000000 ]  - [  -0.0000233400000000,  0.0000116500000000,  0.0000013600000000 ]  - [   0.0000152500000000,  0.0000129200000000,  0.0000116300000000 ]  - [   0.0011940800000000, -0.0001876000000000,  0.0000694300000000 ]  - [  -0.0000531300000000,  0.0000006700000000, -0.0000200000000000 ]  - [  -0.0045784100000000,  0.0000060700000000, -0.0000474600000000 ]  - [  -0.0002414200000000,  0.0000069500000000, -0.0000140500000000 ]  - [   0.0015284000000000, -0.0000040600000000, -0.0000170000000000 ]  - [   0.0096284900000000,  0.0000786400000000,  0.0000488600000000 ]  - [  -0.0000014500000000,  0.0000095500000000,  0.0000134300000000 ]  - [  -0.1447309500000000,  0.0020734700000000,  0.0014226000000000 ]  - [   0.0000243600000000, -0.0000091100000000,  0.0000130800000000 ]  - [  -0.0002487100000000,  0.0000023700000000, -0.0000110700000000 ]  - [   0.0005706500000000, -0.0001837100000000,  0.0041863500000000 ]  - [   0.0010325300000000,  0.0139971800000000,  0.0052560700000000 ]  - [  -0.0000344200000000, -0.0000097100000000,  0.0000192700000000 ]  - [   0.0000069200000000,  0.0000239100000000, -0.0000100100000000 ]  - [   0.0011318800000000, -0.0139562300000000, -0.0052321700000000 ]  - [   0.0252912000000000, -0.0000519400000000, -0.0000641400000000 ]  - [  -0.0000108200000000, -0.0000135700000000,  0.0000492000000000 ]  - [  -0.0046877600000000, -0.0000014200000000,  0.0000943300000000 ]  - [   0.0000263400000000,  0.0000014800000000,  0.0000705200000000 ]  - [  -0.0000002200000000,  0.0001438400000000, -0.0000525600000000 ]  - [   0.0006816700000000,  0.0001757600000000, -0.0041827300000000 ]  - [   0.0003149200000000, -0.0000311300000000, -0.0000388300000000 ]  - [   0.0000034500000000, -0.0001452800000000,  0.0000314800000000 ]  - [   0.0225582700000000, -0.0001254700000000, -0.0001244000000000 ]  - [  -0.0000204300000000, -0.0000000200000000, -0.0000680600000000 ]- atom:   39  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0055720700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0030710400000000 ]  - [   0.0013684300000000, -0.0007900600000000,  0.0059656500000000 ]  - [  -0.0000390500000000,  0.0000225500000000, -0.0044553500000000 ]  - [   0.0000390500000000,  0.0000225500000000, -0.0044553500000000 ]  - [   0.0000000000000000,  0.0015801300000000,  0.0059656500000000 ]  - [   0.0000000000000000, -0.0000450900000000, -0.0044553500000000 ]  - [  -0.0013684300000000, -0.0007900600000000,  0.0059656500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045392100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0853935800000000 ]  - [  -0.0004706500000000,  0.0002717300000000, -0.0040118700000000 ]  - [   0.0000000000000000,  0.0023335400000000, -0.0059003200000000 ]  - [  -0.0020209000000000, -0.0011667700000000, -0.0059003200000000 ]  - [   0.0004706500000000,  0.0002717300000000, -0.0040118700000000 ]  - [   0.0000000000000000, -0.0005434600000000, -0.0040118700000000 ]  - [   0.0020209000000000, -0.0011667700000000, -0.0059003200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054744200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025446800000000 ]  - [   0.0000000000000000, -0.0036371900000000, -0.0031340100000000 ]  - [   0.0003265300000000,  0.0001885200000000, -0.0041105000000000 ]  - [  -0.0003265300000000,  0.0001885200000000, -0.0041105000000000 ]  - [  -0.0031499000000000,  0.0018185900000000, -0.0031340100000000 ]  - [   0.0031499000000000,  0.0018185900000000, -0.0031340100000000 ]  - [   0.0000000000000000, -0.0003770400000000, -0.0041105000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043318900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0094781500000000 ]  - [   0.0000000000000000, -0.0000138800000000, -0.0045630000000000 ]  - [   0.0210108600000000,  0.0121306200000000,  0.0229334000000000 ]  - [  -0.0210108600000000,  0.0121306200000000,  0.0229334000000000 ]  - [  -0.0000120200000000,  0.0000069400000000, -0.0045630000000000 ]  - [   0.0000120200000000,  0.0000069400000000, -0.0045630000000000 ]  - [   0.0000000000000000, -0.0242612500000000,  0.0229334000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054175000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011869200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045501200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0059759100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0136699700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0048856900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1582386500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049343200000000 ]  - [   0.0000000000000000,  0.0003185200000000,  0.0061556500000000 ]  - [   0.0095740400000000, -0.0055275800000000,  0.0113728100000000 ]  - [   0.0019189300000000, -0.0011078900000000, -0.0024475600000000 ]  - [   0.0000000000000000,  0.0003047100000000,  0.0061637800000000 ]  - [  -0.0002638900000000, -0.0001523600000000,  0.0061637800000000 ]  - [  -0.0019189300000000, -0.0011078900000000, -0.0024475600000000 ]  - [   0.0000000000000000,  0.0022157800000000, -0.0024475600000000 ]  - [   0.0002638900000000, -0.0001523600000000,  0.0061637800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0171176000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0059653700000000 ]  - [  -0.0002758400000000, -0.0001592600000000,  0.0061556500000000 ]  - [  -0.0095740400000000, -0.0055275800000000,  0.0113728100000000 ]  - [   0.0000000000000000,  0.0110551500000000,  0.0113728100000000 ]  - [   0.0002758400000000, -0.0001592600000000,  0.0061556500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0336415100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0078209300000000 ]- atom:   39  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0055657800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0030337000000000 ]  - [  -0.0014020500000000,  0.0008094700000000, -0.0058788700000000 ]  - [   0.0000817200000000, -0.0000471800000000,  0.0045129300000000 ]  - [  -0.0000817200000000, -0.0000471800000000,  0.0045129300000000 ]  - [   0.0000000000000000, -0.0016189500000000, -0.0058788700000000 ]  - [   0.0000000000000000,  0.0000943700000000,  0.0045129300000000 ]  - [   0.0014020500000000,  0.0008094700000000, -0.0058788700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0046517100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0801271500000000 ]  - [   0.0004309800000000, -0.0002488300000000,  0.0039579800000000 ]  - [   0.0000000000000000, -0.0022935300000000,  0.0058540400000000 ]  - [   0.0019862600000000,  0.0011467700000000,  0.0058540400000000 ]  - [  -0.0004309800000000, -0.0002488300000000,  0.0039579800000000 ]  - [   0.0000000000000000,  0.0004976500000000,  0.0039579800000000 ]  - [  -0.0019862600000000,  0.0011467700000000,  0.0058540400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054285600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0024955800000000 ]  - [   0.0000000000000000,  0.0036963700000000,  0.0031177400000000 ]  - [  -0.0003375200000000, -0.0001948700000000,  0.0041083800000000 ]  - [   0.0003375200000000, -0.0001948700000000,  0.0041083800000000 ]  - [   0.0032011500000000, -0.0018481800000000,  0.0031177400000000 ]  - [  -0.0032011500000000, -0.0018481800000000,  0.0031177400000000 ]  - [   0.0000000000000000,  0.0003897300000000,  0.0041083800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042958900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0096140700000000 ]  - [   0.0000000000000000, -0.0000246700000000,  0.0045902500000000 ]  - [  -0.0212073200000000, -0.0122440500000000, -0.0227386800000000 ]  - [   0.0212073200000000, -0.0122440500000000, -0.0227386800000000 ]  - [  -0.0000213700000000,  0.0000123400000000,  0.0045902500000000 ]  - [   0.0000213700000000,  0.0000123400000000,  0.0045902500000000 ]  - [   0.0000000000000000,  0.0244881100000000, -0.0227386800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053863800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0013132700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045928600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0060281600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0135911500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048707800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1522467400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0049217100000000 ]  - [   0.0000000000000000, -0.0003167200000000, -0.0061931800000000 ]  - [  -0.0095557900000000,  0.0055170400000000, -0.0113159400000000 ]  - [  -0.0019553100000000,  0.0011289000000000,  0.0026808600000000 ]  - [   0.0000000000000000, -0.0003269400000000, -0.0061407000000000 ]  - [   0.0002831300000000,  0.0001634700000000, -0.0061407000000000 ]  - [   0.0019553100000000,  0.0011289000000000,  0.0026808600000000 ]  - [   0.0000000000000000, -0.0022577900000000,  0.0026808600000000 ]  - [  -0.0002831300000000,  0.0001634700000000, -0.0061407000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0171834200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0058449100000000 ]  - [   0.0002742900000000,  0.0001583600000000, -0.0061931800000000 ]  - [   0.0095557900000000,  0.0055170400000000, -0.0113159400000000 ]  - [   0.0000000000000000, -0.0110340700000000, -0.0113159400000000 ]  - [  -0.0002742900000000,  0.0001583600000000, -0.0061931800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0333117600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0079763800000000 ]- atom:   41  displacement:    [  -0.0049999999963727,  0.0086602540399386,  0.0000000000000000 ]  forces:  - [  -0.0000231200000000, -0.0000137400000000,  0.0002312300000000 ]  - [   0.0138207200000000,  0.0152167300000000,  0.0195362900000000 ]  - [  -0.0000320500000000,  0.0000402900000000, -0.0002959600000000 ]  - [  -0.0106167900000000,  0.0141995100000000,  0.0009913900000000 ]  - [  -0.0202051500000000,  0.0179068600000000,  0.0076849100000000 ]  - [   0.0000175100000000, -0.0000365500000000, -0.0003001800000000 ]  - [  -0.0004448600000000, -0.0091265100000000, -0.0004185200000000 ]  - [   0.0000327300000000,  0.0000205300000000, -0.0002565700000000 ]  - [  -0.0094826700000000,  0.0214619600000000, -0.0087934300000000 ]  - [  -0.0000053000000000, -0.0000039000000000, -0.0002931800000000 ]  - [  -0.0125861800000000,  0.0144252000000000, -0.0008111300000000 ]  - [  -0.0000132000000000,  0.0000635300000000, -0.0003119300000000 ]  - [  -0.0000395200000000, -0.0000241000000000, -0.0002724900000000 ]  - [  -0.0241516300000000,  0.0207376400000000,  0.0115786600000000 ]  - [  -0.0006679100000000, -0.0098274200000000, -0.0018723200000000 ]  - [   0.0000530200000000, -0.0000471800000000, -0.0003140700000000 ]  - [  -0.0078607000000000,  0.0087614000000000,  0.0013886200000000 ]  - [   0.0000229400000000,  0.0000151800000000, -0.0004278600000000 ]  - [   0.0016406400000000, -0.0033303600000000,  0.0001952100000000 ]  - [   0.0001641500000000,  0.0000888300000000, -0.0007981600000000 ]  - [  -0.0001360400000000,  0.0002518400000000, -0.0003051700000000 ]  - [  -0.0017133800000000,  0.0028424900000000,  0.0001158300000000 ]  - [   0.0020580300000000,  0.0012248700000000,  0.0022072200000000 ]  - [   0.0001449200000000, -0.0002343900000000, -0.0002839000000000 ]  - [   0.0008461100000000,  0.0006845400000000, -0.0022038000000000 ]  - [   0.0001673600000000,  0.0000753600000000,  0.0005023600000000 ]  - [  -0.0019971200000000,  0.0019796700000000, -0.0015631200000000 ]  - [  -0.0001746600000000, -0.0001058500000000, -0.0009767200000000 ]  - [   0.0002506500000000, -0.0002150100000000, -0.0004483500000000 ]  - [   0.0005740400000000, -0.0029142600000000, -0.0016536700000000 ]  - [  -0.0015775900000000, -0.0009283200000000,  0.0022902300000000 ]  - [  -0.0000581200000000,  0.0003159700000000, -0.0004316200000000 ]  - [  -0.0002259400000000, -0.0001261800000000,  0.0001584300000000 ]  - [  -0.0020425700000000, -0.0012292300000000, -0.0040719000000000 ]  - [   0.0000647000000000,  0.0000496400000000,  0.0003980400000000 ]  - [  -0.0104887900000000, -0.0054004800000000,  0.0026104000000000 ]  - [   0.0000240800000000, -0.0000040400000000,  0.0002167400000000 ]  - [  -0.0128159000000000, -0.0061592900000000, -0.0011428000000000 ]  - [   0.0001077600000000,  0.0000851900000000,  0.0002900600000000 ]  - [  -0.0001406400000000,  0.0006317300000000, -0.0095523900000000 ]  - [   0.0918217800000000, -0.2020068700000000, -0.0369178700000000 ]  - [  -0.0000027300000000, -0.0000264000000000,  0.0004136500000000 ]  - [   0.0011560700000000, -0.0015980800000000,  0.0005718600000000 ]  - [   0.0009962000000000, -0.0011686900000000,  0.0001490800000000 ]  - [   0.0005254300000000,  0.0003138200000000,  0.0017166600000000 ]  - [  -0.0012068900000000, -0.0006993900000000,  0.0023595100000000 ]  - [  -0.0008119800000000,  0.0018021200000000,  0.0005162000000000 ]  - [  -0.0005089700000000,  0.0014520600000000,  0.0002306100000000 ]  - [   0.0003253600000000,  0.0008348600000000, -0.0161273900000000 ]  - [  -0.0002067000000000, -0.0001257000000000,  0.0004586800000000 ]  - [   0.0356087800000000,  0.0293033900000000,  0.0153154200000000 ]  - [   0.0000017700000000,  0.0000018000000000,  0.0004334100000000 ]  - [  -0.0000234800000000,  0.0000111500000000,  0.0004134800000000 ]  - [  -0.0431924800000000,  0.0786510700000000, -0.0001276900000000 ]  - [  -0.0001297600000000, -0.0000774600000000,  0.0005971100000000 ]  - [   0.0131581300000000,  0.0119802100000000,  0.0174009200000000 ]- atom:   41  displacement:    [   0.0049999999963727, -0.0086602540399386,  0.0000000000000000 ]  forces:  - [   0.0000236200000000,  0.0000138300000000, -0.0002085600000000 ]  - [  -0.0137176200000000, -0.0152438000000000, -0.0193283400000000 ]  - [  -0.0000241800000000, -0.0000088400000000,  0.0003480100000000 ]  - [   0.0108950700000000, -0.0141006900000000, -0.0007602800000000 ]  - [   0.0218199400000000, -0.0191312200000000, -0.0090687700000000 ]  - [  -0.0000202900000000, -0.0000038700000000,  0.0003452400000000 ]  - [   0.0005108300000000,  0.0091767800000000,  0.0004949500000000 ]  - [   0.0000025800000000,  0.0000022300000000,  0.0003002800000000 ]  - [   0.0094594200000000, -0.0195893800000000,  0.0077526200000000 ]  - [   0.0000061400000000,  0.0000033900000000,  0.0003977900000000 ]  - [   0.0122694800000000, -0.0145203900000000,  0.0005387600000000 ]  - [   0.0000143000000000, -0.0000117300000000,  0.0002539200000000 ]  - [  -0.0000049800000000, -0.0000029100000000,  0.0002143000000000 ]  - [   0.0224812400000000, -0.0194981200000000, -0.0101410500000000 ]  - [   0.0006019300000000,  0.0097746400000000,  0.0017927900000000 ]  - [   0.0000032500000000,  0.0000150500000000,  0.0002507200000000 ]  - [   0.0079238400000000, -0.0100955100000000, -0.0006290400000000 ]  - [  -0.0000234100000000, -0.0000141400000000,  0.0003710200000000 ]  - [  -0.0016427000000000,  0.0033140400000000, -0.0001680300000000 ]  - [  -0.0001740100000000, -0.0000938400000000,  0.0007871000000000 ]  - [   0.0001479200000000, -0.0002585900000000,  0.0002968300000000 ]  - [   0.0017023300000000, -0.0028370900000000, -0.0001467100000000 ]  - [  -0.0020474100000000, -0.0012295500000000, -0.0022253400000000 ]  - [  -0.0001457700000000,  0.0002450700000000,  0.0002741500000000 ]  - [  -0.0008506700000000, -0.0006755600000000,  0.0021550100000000 ]  - [  -0.0001662800000000, -0.0000800800000000, -0.0005518700000000 ]  - [   0.0020087000000000, -0.0020151600000000,  0.0015816700000000 ]  - [   0.0001438900000000,  0.0000870000000000,  0.0009953200000000 ]  - [  -0.0002005100000000,  0.0001874300000000,  0.0004612700000000 ]  - [  -0.0006341100000000,  0.0029314200000000,  0.0016613400000000 ]  - [   0.0016157100000000,  0.0009323200000000, -0.0022770900000000 ]  - [   0.0000608100000000, -0.0002826400000000,  0.0004466200000000 ]  - [   0.0002244700000000,  0.0001267200000000, -0.0001987000000000 ]  - [   0.0020331000000000,  0.0012310000000000,  0.0040257300000000 ]  - [  -0.0000818800000000, -0.0000403500000000, -0.0004321700000000 ]  - [   0.0104908500000000,  0.0054465800000000, -0.0026214700000000 ]  - [   0.0000069300000000, -0.0000133500000000, -0.0001941500000000 ]  - [   0.0127904100000000,  0.0061080800000000,  0.0011331300000000 ]  - [  -0.0001383600000000, -0.0000655900000000, -0.0002627900000000 ]  - [   0.0001764900000000, -0.0006347000000000,  0.0095761200000000 ]  - [  -0.0917542700000000,  0.2013944300000000,  0.0371276400000000 ]  - [   0.0000000700000000,  0.0000280100000000, -0.0004387300000000 ]  - [  -0.0011298100000000,  0.0015936500000000, -0.0005434300000000 ]  - [  -0.0009980800000000,  0.0011494300000000, -0.0001157100000000 ]  - [  -0.0005085000000000, -0.0003024000000000, -0.0016799300000000 ]  - [   0.0011816700000000,  0.0007013400000000, -0.0023229400000000 ]  - [   0.0008067400000000, -0.0017859000000000, -0.0004709900000000 ]  - [   0.0004911500000000, -0.0014426400000000, -0.0001891500000000 ]  - [  -0.0003167500000000, -0.0008659800000000,  0.0162684200000000 ]  - [   0.0002062600000000,  0.0001268800000000, -0.0003286400000000 ]  - [  -0.0356085900000000, -0.0292998100000000, -0.0153520000000000 ]  - [   0.0000004200000000, -0.0000009600000000, -0.0004587300000000 ]  - [   0.0000240100000000, -0.0000136400000000, -0.0004385600000000 ]  - [   0.0431740700000000, -0.0785930700000000,  0.0000929800000000 ]  - [   0.0001286800000000,  0.0000786400000000, -0.0007369800000000 ]  - [  -0.0132381500000000, -0.0119164700000000, -0.0176535800000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000, -0.0000486100000000,  0.0060969400000000 ]  - [   0.0000000000000000,  0.0271286500000000,  0.0173967400000000 ]  - [   0.0000341400000000, -0.0000094400000000, -0.0055387600000000 ]  - [   0.0117137400000000,  0.0042534700000000,  0.0391152200000000 ]  - [  -0.0117137400000000,  0.0042534700000000,  0.0391152200000000 ]  - [   0.0000000000000000,  0.0000413100000000, -0.0055489800000000 ]  - [   0.0000000000000000, -0.0045531000000000,  0.0209920100000000 ]  - [  -0.0000341400000000, -0.0000094400000000, -0.0055387600000000 ]  - [   0.0000000000000000, -0.0117569400000000,  0.0446978700000000 ]  - [   0.0000000000000000,  0.0000001800000000, -0.0056054300000000 ]  - [   0.0150114400000000,  0.0060719700000000,  0.0433768800000000 ]  - [   0.0000000000000000,  0.0001987400000000, -0.0052289800000000 ]  - [  -0.0001549400000000, -0.0001026500000000, -0.0051705400000000 ]  - [  -0.0150114400000000,  0.0060719700000000,  0.0433768800000000 ]  - [   0.0000000000000000, -0.0041871700000000,  0.0216548600000000 ]  - [   0.0001549400000000, -0.0001026500000000, -0.0051705400000000 ]  - [   0.0000000000000000, -0.0027400000000000,  0.0360378200000000 ]  - [   0.0000000000000000,  0.0000238500000000, -0.0066019900000000 ]  - [   0.0000000000000000,  0.0007369300000000, -0.0055957800000000 ]  - [   0.0004124100000000,  0.0005257200000000, -0.0052625000000000 ]  - [  -0.0004124100000000,  0.0005257200000000, -0.0052625000000000 ]  - [   0.0019770100000000,  0.0006253300000000, -0.0049374600000000 ]  - [  -0.0019770100000000,  0.0006253300000000, -0.0049374600000000 ]  - [   0.0000000000000000, -0.0007344200000000, -0.0047792800000000 ]  - [   0.0000000000000000,  0.0005989100000000, -0.0049204900000000 ]  - [   0.0000000000000000, -0.0000716000000000, -0.0056172500000000 ]  - [   0.0000000000000000, -0.0010344600000000, -0.0081663100000000 ]  - [   0.0000351800000000,  0.0000737000000000, -0.0056817000000000 ]  - [  -0.0000351800000000,  0.0000737000000000, -0.0056817000000000 ]  - [  -0.0008045900000000, -0.0011069200000000, -0.0038970600000000 ]  - [   0.0008045900000000, -0.0011069200000000, -0.0038970600000000 ]  - [   0.0000000000000000, -0.0000689600000000, -0.0053929300000000 ]  - [   0.0000000000000000, -0.0004733700000000, -0.0067538600000000 ]  - [   0.0000000000000000, -0.0017684600000000, -0.0053093200000000 ]  - [   0.0000000000000000,  0.0000997600000000,  0.0062291000000000 ]  - [   0.0000000000000000, -0.0052518400000000,  0.0020219000000000 ]  - [   0.0000000000000000, -0.0000111000000000,  0.0061705900000000 ]  - [   0.0000000000000000, -0.0058085600000000, -0.0014333300000000 ]  - [   0.0000000000000000,  0.0000589400000000,  0.0062050500000000 ]  - [   0.0000000000000000, -0.0047781500000000,  0.0113484700000000 ]  - [   0.0000000000000000, -0.0429326900000000, -0.2116423800000000 ]  - [  -0.0004470500000000,  0.0002354500000000,  0.0076692200000000 ]  - [  -0.0007414200000000,  0.0004307200000000,  0.0078424800000000 ]  - [   0.0000000000000000,  0.0001891800000000,  0.0065647700000000 ]  - [  -0.0016704100000000,  0.0007119000000000,  0.0081351400000000 ]  - [   0.0007414200000000,  0.0004307200000000,  0.0078424800000000 ]  - [   0.0000000000000000, -0.0009214100000000,  0.0068976600000000 ]  - [   0.0016704100000000,  0.0007119000000000,  0.0081351400000000 ]  - [   0.0000000000000000, -0.0060144600000000,  0.0161276800000000 ]  - [   0.0000000000000000, -0.0002691300000000,  0.0085157100000000 ]  - [  -0.0153419700000000,  0.0089745900000000, -0.0616258900000000 ]  - [   0.0004470500000000,  0.0002354500000000,  0.0076692200000000 ]  - [   0.0000000000000000, -0.0004933800000000,  0.0076543700000000 ]  - [   0.0153419700000000,  0.0089745900000000, -0.0616258900000000 ]  - [   0.0000000000000000, -0.0000608800000000,  0.0097678000000000 ]  - [   0.0000000000000000,  0.0235345100000000,  0.0201669100000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000496000000000, -0.0060805600000000 ]  - [   0.0000000000000000, -0.0267492600000000, -0.0172295400000000 ]  - [  -0.0000786600000000,  0.0000362600000000,  0.0055883300000000 ]  - [  -0.0125327200000000, -0.0049222400000000, -0.0397870800000000 ]  - [   0.0125327200000000, -0.0049222400000000, -0.0397870800000000 ]  - [   0.0000000000000000, -0.0000808500000000,  0.0055958500000000 ]  - [   0.0000000000000000,  0.0045966100000000, -0.0209482300000000 ]  - [   0.0000786600000000,  0.0000362600000000,  0.0055883300000000 ]  - [   0.0000000000000000,  0.0127109900000000, -0.0451524600000000 ]  - [   0.0000000000000000, -0.0000010200000000,  0.0057116700000000 ]  - [  -0.0141184100000000, -0.0053502300000000, -0.0426686400000000 ]  - [   0.0000000000000000, -0.0001484300000000,  0.0051748600000000 ]  - [   0.0001053700000000,  0.0000732400000000,  0.0051118200000000 ]  - [   0.0141184100000000, -0.0053502300000000, -0.0426686400000000 ]  - [   0.0000000000000000,  0.0041386000000000, -0.0217048500000000 ]  - [  -0.0001053700000000,  0.0000732400000000,  0.0051118200000000 ]  - [   0.0000000000000000,  0.0020423900000000, -0.0355098300000000 ]  - [   0.0000000000000000, -0.0000230400000000,  0.0065450900000000 ]  - [   0.0000000000000000, -0.0007613200000000,  0.0056348600000000 ]  - [  -0.0004185800000000, -0.0005345900000000,  0.0052561800000000 ]  - [   0.0004185800000000, -0.0005345900000000,  0.0052561800000000 ]  - [  -0.0019761000000000, -0.0006082400000000,  0.0049252000000000 ]  - [   0.0019761000000000, -0.0006082400000000,  0.0049252000000000 ]  - [   0.0000000000000000,  0.0007451100000000,  0.0047655700000000 ]  - [   0.0000000000000000, -0.0005927500000000,  0.0048579100000000 ]  - [   0.0000000000000000,  0.0000640300000000,  0.0055712100000000 ]  - [   0.0000000000000000,  0.0010231800000000,  0.0082285000000000 ]  - [  -0.0000763400000000, -0.0000954200000000,  0.0057001200000000 ]  - [   0.0000763400000000, -0.0000954200000000,  0.0057001200000000 ]  - [   0.0007558600000000,  0.0011322300000000,  0.0038848700000000 ]  - [  -0.0007558600000000,  0.0011322300000000,  0.0038848700000000 ]  - [   0.0000000000000000,  0.0001017100000000,  0.0054108800000000 ]  - [   0.0000000000000000,  0.0004836500000000,  0.0067202100000000 ]  - [   0.0000000000000000,  0.0017548000000000,  0.0052749500000000 ]  - [   0.0000000000000000, -0.0000920500000000, -0.0062649500000000 ]  - [   0.0000000000000000,  0.0052742100000000, -0.0021024700000000 ]  - [   0.0000000000000000, -0.0000078800000000, -0.0061500400000000 ]  - [   0.0000000000000000,  0.0057927400000000,  0.0015233900000000 ]  - [   0.0000000000000000, -0.0000387800000000, -0.0061831900000000 ]  - [   0.0000000000000000,  0.0048864500000000, -0.0113734900000000 ]  - [   0.0000000000000000,  0.0425681400000000,  0.2114881100000000 ]  - [   0.0004449000000000, -0.0002338500000000, -0.0076961000000000 ]  - [   0.0007739100000000, -0.0004286600000000, -0.0078119600000000 ]  - [   0.0000000000000000, -0.0002056900000000, -0.0065178400000000 ]  - [   0.0017154300000000, -0.0007179100000000, -0.0081058900000000 ]  - [  -0.0007739100000000, -0.0004286600000000, -0.0078119600000000 ]  - [   0.0000000000000000,  0.0009364700000000, -0.0068581800000000 ]  - [  -0.0017154300000000, -0.0007179100000000, -0.0081058900000000 ]  - [   0.0000000000000000,  0.0058402100000000, -0.0159464700000000 ]  - [   0.0000000000000000,  0.0002742600000000, -0.0083879700000000 ]  - [   0.0153260500000000, -0.0089863400000000,  0.0615907700000000 ]  - [  -0.0004449000000000, -0.0002338500000000, -0.0076961000000000 ]  - [   0.0000000000000000,  0.0004904600000000, -0.0076807300000000 ]  - [  -0.0153260500000000, -0.0089863400000000,  0.0615907700000000 ]  - [   0.0000000000000000,  0.0000620400000000, -0.0099108800000000 ]  - [   0.0000000000000000, -0.0238630300000000, -0.0204766000000000 ]- atom:   43  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000026900000000, -0.0001650000000000, -0.0003916500000000 ]  - [   0.0004786800000000,  0.0002272500000000,  0.0153123400000000 ]  - [   0.0025916300000000,  0.0007058600000000,  0.0015044700000000 ]  - [   0.0005296500000000, -0.0001130200000000,  0.0005400900000000 ]  - [  -0.0005068300000000, -0.0001141600000000,  0.0005119400000000 ]  - [  -0.0000144100000000,  0.0017178000000000, -0.0021328600000000 ]  - [   0.0000092700000000,  0.0003438300000000,  0.0004705200000000 ]  - [  -0.0026719100000000,  0.0009296400000000,  0.0016748500000000 ]  - [  -0.0000191800000000, -0.0003845500000000,  0.0002223000000000 ]  - [   0.0001970500000000, -0.0012500900000000,  0.0023074800000000 ]  - [   0.0032530700000000, -0.0003255700000000, -0.0008577100000000 ]  - [  -0.0000100600000000, -0.0000358800000000,  0.0007699200000000 ]  - [   0.0002328200000000,  0.0000278600000000,  0.0003077400000000 ]  - [  -0.0032923900000000, -0.0003522800000000, -0.0007539400000000 ]  - [   0.0001679700000000,  0.0017242500000000, -0.0035988100000000 ]  - [  -0.0002193100000000,  0.0000190700000000,  0.0002846300000000 ]  - [   0.0002548400000000, -0.0024341200000000,  0.0047341000000000 ]  - [   0.0000106100000000,  0.0002321400000000, -0.0001844900000000 ]  - [   0.0224398900000000,  0.0025951800000000, -0.0065948400000000 ]  - [  -0.0000068000000000, -0.0000244200000000,  0.0002702800000000 ]  - [   0.0000072400000000, -0.0000252400000000,  0.0002740500000000 ]  - [  -0.0069711500000000,  0.0007824700000000,  0.0013075300000000 ]  - [   0.0173595600000000, -0.0000483000000000,  0.0011478300000000 ]  - [  -0.0000002200000000,  0.0000263900000000,  0.0002586700000000 ]  - [  -0.0000000800000000, -0.0000030200000000,  0.0002875700000000 ]  - [   0.0276474300000000, -0.0052287700000000,  0.0099220300000000 ]  - [  -0.0000028300000000, -0.0000273700000000,  0.0002980200000000 ]  - [   0.0176873000000000,  0.0025616000000000, -0.0002087700000000 ]  - [  -0.0079377700000000,  0.0049614300000000,  0.0008129800000000 ]  - [  -0.0000264200000000,  0.0000173400000000,  0.0003146300000000 ]  - [   0.0000153900000000,  0.0000142100000000,  0.0003203400000000 ]  - [   0.0236516200000000,  0.0072640100000000, -0.0067654400000000 ]  - [  -0.0000013100000000,  0.0000255100000000,  0.0003560400000000 ]  - [   0.0191853300000000, -0.0016420200000000,  0.0051300900000000 ]  - [  -0.0000102000000000,  0.0001218400000000, -0.0003237300000000 ]  - [   0.0016184100000000, -0.0088136400000000, -0.0114266300000000 ]  - [   0.0007249500000000, -0.0002490500000000,  0.0100466200000000 ]  - [  -0.0000223100000000, -0.0000319100000000, -0.0001147200000000 ]  - [   0.0010367100000000,  0.0140024600000000,  0.0019652800000000 ]  - [   0.0000151500000000, -0.0000277800000000, -0.0002605800000000 ]  - [   0.0000525400000000,  0.0013512100000000, -0.0007722900000000 ]  - [  -0.0015035800000000, -0.0002822900000000, -0.0001831500000000 ]  - [  -0.2197806500000000,  0.0250377100000000,  0.0123215000000000 ]  - [   0.0000001500000000, -0.0000151600000000, -0.0004198600000000 ]  - [   0.0000019500000000,  0.0000141800000000, -0.0003992600000000 ]  - [   0.0904645300000000, -0.0008745700000000,  0.0003802300000000 ]  - [   0.0070149500000000, -0.0473061400000000, -0.0155697200000000 ]  - [  -0.0000024500000000,  0.0000146300000000, -0.0003994800000000 ]  - [   0.0014565800000000,  0.0230638600000000, -0.0014047200000000 ]  - [   0.0000004600000000,  0.0000143100000000, -0.0002738900000000 ]  - [  -0.0019553400000000, -0.0002636100000000, -0.0007660000000000 ]  - [   0.0015041300000000, -0.0002609100000000, -0.0002436100000000 ]  - [  -0.0000159800000000, -0.0005889600000000, -0.0017065100000000 ]  - [   0.0019596900000000, -0.0001962200000000, -0.0008169900000000 ]  - [   0.0033914000000000, -0.0167410100000000, -0.0168114700000000 ]  - [   0.0000075700000000,  0.0000289900000000, -0.0006729500000000 ]- atom:   43  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000016900000000,  0.0001652000000000,  0.0004103100000000 ]  - [  -0.0005038900000000, -0.0002113300000000, -0.0153143500000000 ]  - [  -0.0026569200000000, -0.0006857200000000, -0.0014515300000000 ]  - [  -0.0004730400000000,  0.0000801500000000, -0.0004873100000000 ]  - [   0.0004708400000000,  0.0000884100000000, -0.0004655500000000 ]  - [  -0.0000060600000000, -0.0017602900000000,  0.0021843200000000 ]  - [  -0.0000047700000000, -0.0002989800000000, -0.0004239900000000 ]  - [   0.0027054300000000, -0.0008913800000000, -0.0016247100000000 ]  - [   0.0000157700000000,  0.0003857400000000, -0.0001128100000000 ]  - [  -0.0001850900000000,  0.0012485700000000, -0.0021995900000000 ]  - [  -0.0033114600000000,  0.0003700600000000,  0.0007912400000000 ]  - [   0.0000105400000000,  0.0000913300000000, -0.0008272400000000 ]  - [  -0.0002813300000000, -0.0000567800000000, -0.0003634000000000 ]  - [   0.0033419900000000,  0.0003663700000000,  0.0006947800000000 ]  - [  -0.0001515200000000, -0.0017816700000000,  0.0035438000000000 ]  - [   0.0002792700000000, -0.0000531600000000, -0.0003482100000000 ]  - [  -0.0002736400000000,  0.0024296600000000, -0.0047914800000000 ]  - [  -0.0000107100000000, -0.0002318100000000,  0.0001297500000000 ]  - [  -0.0208733700000000, -0.0017537800000000,  0.0054584900000000 ]  - [  -0.0000041600000000,  0.0000195200000000, -0.0002791400000000 ]  - [   0.0000053400000000,  0.0000183100000000, -0.0002782500000000 ]  - [   0.0069601400000000, -0.0007076200000000, -0.0012992700000000 ]  - [  -0.0173533300000000,  0.0002868800000000, -0.0009919000000000 ]  - [  -0.0000005500000000, -0.0000151900000000, -0.0002670000000000 ]  - [  -0.0000006800000000,  0.0000028700000000, -0.0003367700000000 ]  - [  -0.0258209500000000,  0.0041622400000000, -0.0087392300000000 ]  - [  -0.0000004300000000, -0.0000101000000000, -0.0002799100000000 ]  - [  -0.0177208600000000, -0.0028309000000000,  0.0000465300000000 ]  - [   0.0079665400000000, -0.0050495400000000, -0.0008289500000000 ]  - [  -0.0000235200000000,  0.0000118000000000, -0.0003020900000000 ]  - [   0.0000145900000000,  0.0000070300000000, -0.0003021500000000 ]  - [  -0.0253815700000000, -0.0079953000000000,  0.0081307800000000 ]  - [   0.0000000200000000, -0.0000255000000000, -0.0003936700000000 ]  - [  -0.0206796300000000,  0.0024817100000000, -0.0062326000000000 ]  - [  -0.0000072000000000, -0.0001128100000000,  0.0002861300000000 ]  - [  -0.0016618100000000,  0.0087837600000000,  0.0113335800000000 ]  - [  -0.0006815600000000,  0.0002204900000000, -0.0100193300000000 ]  - [  -0.0000101900000000,  0.0000508600000000,  0.0001367000000000 ]  - [  -0.0011284300000000, -0.0139532600000000, -0.0019050400000000 ]  - [   0.0000175000000000,  0.0000089100000000,  0.0002840200000000 ]  - [  -0.0000501100000000, -0.0013477700000000,  0.0007451700000000 ]  - [   0.0015018200000000,  0.0002855100000000,  0.0001593600000000 ]  - [   0.2196059700000000, -0.0249279500000000, -0.0127075900000000 ]  - [  -0.0000002500000000, -0.0000047400000000,  0.0004538200000000 ]  - [   0.0000156900000000, -0.0000041900000000,  0.0004332600000000 ]  - [  -0.0905020900000000,  0.0008658000000000, -0.0003230500000000 ]  - [  -0.0070182100000000,  0.0473254800000000,  0.0156166100000000 ]  - [  -0.0000159000000000, -0.0000043000000000,  0.0004337000000000 ]  - [  -0.0013208400000000, -0.0230827100000000,  0.0014968600000000 ]  - [  -0.0000014600000000, -0.0000124800000000,  0.0004012600000000 ]  - [   0.0019523300000000,  0.0002605400000000,  0.0007380000000000 ]  - [  -0.0015027200000000,  0.0002620500000000,  0.0002117000000000 ]  - [   0.0000180200000000,  0.0005858300000000,  0.0016796900000000 ]  - [  -0.0019570200000000,  0.0001959000000000,  0.0007940100000000 ]  - [  -0.0032974900000000,  0.0167775500000000,  0.0167719800000000 ]  - [  -0.0000073700000000, -0.0000292900000000,  0.0005302900000000 ]- atom:   43  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0001648600000000,  0.0000951800000000,  0.0059981700000000 ]  - [   0.0056173600000000, -0.0032431800000000,  0.0105175200000000 ]  - [   0.0009144100000000, -0.0005279300000000, -0.0080690500000000 ]  - [  -0.0000358200000000,  0.0000206800000000, -0.0052277400000000 ]  - [  -0.0000667400000000, -0.0003594500000000, -0.0054893000000000 ]  - [   0.0013644600000000,  0.0001138400000000, -0.0037676300000000 ]  - [   0.0002779300000000,  0.0002375200000000, -0.0054893000000000 ]  - [   0.0005836400000000, -0.0012385800000000, -0.0037676300000000 ]  - [  -0.0006625700000000,  0.0003825300000000, -0.0057832300000000 ]  - [  -0.0006262900000000,  0.0003615900000000, -0.0050748100000000 ]  - [  -0.0010041500000000,  0.0005797500000000, -0.0083893300000000 ]  - [  -0.0001864800000000,  0.0000695300000000, -0.0052546000000000 ]  - [  -0.0001534500000000,  0.0001267300000000, -0.0052546000000000 ]  - [  -0.0004162600000000, -0.0008437200000000, -0.0038210100000000 ]  - [   0.0005225600000000,  0.0007823500000000, -0.0038210100000000 ]  - [   0.0002793000000000, -0.0001612600000000, -0.0047985100000000 ]  - [  -0.0012308500000000,  0.0007106300000000, -0.0045158500000000 ]  - [   0.0003880800000000, -0.0002240600000000, -0.0067376700000000 ]  - [  -0.0083086800000000, -0.0082799400000000,  0.0365317200000000 ]  - [   0.0006074200000000,  0.0003751000000000, -0.0051183800000000 ]  - [  -0.0006047200000000,  0.0003491400000000, -0.0051146600000000 ]  - [  -0.0029955600000000,  0.0017294900000000,  0.0213228200000000 ]  - [   0.0030163000000000,  0.0113355000000000,  0.0365317200000000 ]  - [  -0.0000211300000000, -0.0007135900000000, -0.0051183800000000 ]  - [   0.0000039900000000, -0.0000023000000000, -0.0053872200000000 ]  - [   0.0133185800000000, -0.0076894800000000,  0.0450530700000000 ]  - [  -0.0000143500000000, -0.0000020600000000, -0.0055997700000000 ]  - [   0.0021928800000000,  0.0117046900000000,  0.0395282500000000 ]  - [   0.0046253000000000, -0.0026704200000000,  0.0212854700000000 ]  - [  -0.0000190500000000,  0.0000110000000000, -0.0056694900000000 ]  - [  -0.0000053800000000,  0.0000134600000000, -0.0055997700000000 ]  - [  -0.0090401200000000, -0.0077514300000000,  0.0395282500000000 ]  - [   0.0000226000000000, -0.0000130500000000, -0.0065291900000000 ]  - [   0.0075029200000000, -0.0043318100000000,  0.0409347900000000 ]  - [   0.0001088400000000, -0.0000628400000000,  0.0061707800000000 ]  - [  -0.0117605800000000,  0.0067899700000000,  0.0123118400000000 ]  - [   0.0042968500000000, -0.0024807900000000,  0.0108240200000000 ]  - [  -0.0001562600000000,  0.0000902100000000,  0.0061793600000000 ]  - [   0.0052141100000000, -0.0030103700000000, -0.0025610500000000 ]  - [  -0.0000139000000000,  0.0000080200000000,  0.0061787500000000 ]  - [   0.0017635200000000,  0.0016621900000000,  0.0078096500000000 ]  - [  -0.0001323100000000,  0.0000763900000000,  0.0065191300000000 ]  - [   0.0127164900000000, -0.0073418700000000, -0.1949710100000000 ]  - [   0.0000203800000000,  0.0004828100000000,  0.0076082500000000 ]  - [  -0.0004079300000000, -0.0002590600000000,  0.0076082500000000 ]  - [  -0.0003598100000000,  0.0182065200000000, -0.0593860300000000 ]  - [  -0.0159472100000000, -0.0087916600000000, -0.0593860300000000 ]  - [   0.0004076600000000, -0.0002353600000000,  0.0075761000000000 ]  - [   0.0100732600000000, -0.0058158000000000,  0.0003097000000000 ]  - [   0.0000269300000000, -0.0000155500000000,  0.0084924200000000 ]  - [  -0.0005577400000000, -0.0023583500000000,  0.0078096500000000 ]  - [   0.0002108200000000,  0.0018564000000000,  0.0081070600000000 ]  - [  -0.0015022800000000, -0.0011107800000000,  0.0081070600000000 ]  - [   0.0004946200000000, -0.0002855700000000,  0.0068763800000000 ]  - [  -0.0203108400000000,  0.0117264700000000,  0.0202921600000000 ]  - [   0.0001340800000000, -0.0000774100000000,  0.0096899200000000 ]- atom:   43  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0001633800000000, -0.0000943300000000, -0.0059811900000000 ]  - [  -0.0057593500000000,  0.0033251600000000, -0.0105032700000000 ]  - [  -0.0009481400000000,  0.0005474100000000,  0.0080820400000000 ]  - [   0.0000925000000000, -0.0000534000000000,  0.0052745900000000 ]  - [   0.0000337900000000,  0.0003421200000000,  0.0055375700000000 ]  - [  -0.0013716100000000, -0.0001640300000000,  0.0038444200000000 ]  - [  -0.0002793900000000, -0.0002003200000000,  0.0055375700000000 ]  - [  -0.0005437500000000,  0.0012698600000000,  0.0038444200000000 ]  - [   0.0006744600000000, -0.0003894000000000,  0.0058998500000000 ]  - [   0.0006333700000000, -0.0003656800000000,  0.0052020400000000 ]  - [   0.0009703600000000, -0.0005602400000000,  0.0083951700000000 ]  - [   0.0001840400000000, -0.0000171000000000,  0.0051987000000000 ]  - [   0.0001068300000000, -0.0001508300000000,  0.0051987000000000 ]  - [   0.0004787300000000,  0.0008620500000000,  0.0037300900000000 ]  - [  -0.0005071900000000, -0.0008456200000000,  0.0037300900000000 ]  - [  -0.0002191500000000,  0.0001265300000000,  0.0047417700000000 ]  - [   0.0012231400000000, -0.0007061800000000,  0.0044178900000000 ]  - [  -0.0003809300000000,  0.0002199300000000,  0.0066800400000000 ]  - [   0.0091059200000000,  0.0087368200000000, -0.0371113600000000 ]  - [  -0.0006182300000000, -0.0003792200000000,  0.0051090600000000 ]  - [   0.0006184300000000, -0.0003570500000000,  0.0051081300000000 ]  - [   0.0029753100000000, -0.0017178000000000, -0.0213410100000000 ]  - [  -0.0030133500000000, -0.0122543700000000, -0.0371113600000000 ]  - [   0.0000193000000000,  0.0007250100000000,  0.0051090600000000 ]  - [  -0.0000044300000000,  0.0000025600000000,  0.0053422900000000 ]  - [  -0.0125293000000000,  0.0072338000000000, -0.0446314500000000 ]  - [   0.0000113900000000, -0.0000331100000000,  0.0056202000000000 ]  - [  -0.0023317600000000, -0.0106401200000000, -0.0387285700000000 ]  - [  -0.0045757800000000,  0.0026418300000000, -0.0212615700000000 ]  - [  -0.0000296800000000,  0.0000171300000000,  0.0056845200000000 ]  - [   0.0000343700000000,  0.0000067000000000,  0.0056202000000000 ]  - [   0.0080487300000000,  0.0073394200000000, -0.0387285700000000 ]  - [  -0.0000225900000000,  0.0000130400000000,  0.0064914300000000 ]  - [  -0.0082759400000000,  0.0047781200000000, -0.0415284900000000 ]  - [  -0.0001248400000000,  0.0000720800000000, -0.0062066500000000 ]  - [   0.0119544200000000, -0.0069018900000000, -0.0124605200000000 ]  - [  -0.0041541500000000,  0.0023984000000000, -0.0107569100000000 ]  - [   0.0001286500000000, -0.0000742800000000, -0.0061600800000000 ]  - [  -0.0052757000000000,  0.0030459300000000,  0.0025229000000000 ]  - [   0.0000460900000000, -0.0000266100000000, -0.0061633400000000 ]  - [  -0.0018042000000000, -0.0016860000000000, -0.0078439800000000 ]  - [   0.0001322300000000, -0.0000763400000000, -0.0065619600000000 ]  - [  -0.0123201400000000,  0.0071130400000000,  0.1945441100000000 ]  - [  -0.0000205000000000, -0.0005034300000000, -0.0075760800000000 ]  - [   0.0004257300000000,  0.0002694700000000, -0.0075760800000000 ]  - [   0.0003424800000000, -0.0182116300000000,  0.0594181800000000 ]  - [   0.0159429800000000,  0.0088092200000000,  0.0594181800000000 ]  - [  -0.0004264700000000,  0.0002462200000000, -0.0075439800000000 ]  - [  -0.0100092800000000,  0.0057788600000000, -0.0000736900000000 ]  - [  -0.0000288500000000,  0.0000166600000000, -0.0083633400000000 ]  - [   0.0005580100000000,  0.0024054800000000, -0.0078439800000000 ]  - [  -0.0002084900000000, -0.0018235700000000, -0.0081326500000000 ]  - [   0.0014750100000000,  0.0010923500000000, -0.0081326500000000 ]  - [  -0.0004928100000000,  0.0002845200000000, -0.0068780400000000 ]  - [   0.0200338500000000, -0.0115665500000000, -0.0202687400000000 ]  - [  -0.0001375100000000,  0.0000793900000000, -0.0098336800000000 ]- atom:   49  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000517200000000,  0.0000000500000000,  0.0000063700000000 ]  - [   0.0071439800000000, -0.0000897400000000, -0.0000167300000000 ]  - [  -0.0001760900000000, -0.0001855200000000,  0.0008363700000000 ]  - [   0.0003426400000000, -0.0005342000000000,  0.0014553500000000 ]  - [   0.0003315000000000,  0.0005130700000000, -0.0014143800000000 ]  - [  -0.0004985300000000, -0.0000216100000000,  0.0000262200000000 ]  - [  -0.0005698100000000,  0.0000113200000000,  0.0000083900000000 ]  - [  -0.0001284700000000,  0.0002143600000000, -0.0007823700000000 ]  - [   0.0006113200000000,  0.0000123100000000,  0.0000701300000000 ]  - [   0.0002158200000000, -0.0000003600000000,  0.0000547800000000 ]  - [  -0.0009842400000000, -0.0047188900000000,  0.0014731700000000 ]  - [   0.0000509300000000,  0.0000263500000000, -0.0000261000000000 ]  - [  -0.0000427700000000, -0.0000542800000000,  0.0000495500000000 ]  - [  -0.0009182900000000,  0.0047812900000000, -0.0015160200000000 ]  - [  -0.0091792100000000, -0.0000053100000000,  0.0000495100000000 ]  - [   0.0000083000000000,  0.0000245500000000, -0.0001045600000000 ]  - [   0.0173813000000000,  0.0000326200000000,  0.0002597900000000 ]  - [  -0.0000981700000000,  0.0000000900000000, -0.0000231700000000 ]  - [   0.0149565500000000,  0.0002982800000000, -0.0000989100000000 ]  - [  -0.0000044800000000, -0.0000071000000000, -0.0000138700000000 ]  - [   0.0000070800000000,  0.0000011200000000,  0.0000111900000000 ]  - [   0.0721853300000000, -0.0327941700000000, -0.0223970200000000 ]  - [   0.0762864600000000,  0.0356790700000000,  0.0244442300000000 ]  - [   0.0000084900000000,  0.0000055000000000, -0.0000024100000000 ]  - [   0.0000547100000000, -0.0000000500000000, -0.0000221000000000 ]  - [  -0.0100861300000000, -0.0000075500000000,  0.0000386500000000 ]  - [  -0.0001072700000000, -0.0000167500000000,  0.0000136900000000 ]  - [  -0.0019991900000000, -0.0039527300000000,  0.0043971200000000 ]  - [  -0.0019329000000000,  0.0039382200000000, -0.0044061300000000 ]  - [  -0.0000409900000000, -0.0000366600000000, -0.0000272000000000 ]  - [  -0.0000048000000000,  0.0000606600000000,  0.0000487000000000 ]  - [   0.0048676900000000,  0.0000251900000000, -0.0000107300000000 ]  - [  -0.0000118500000000,  0.0000001500000000, -0.0000158300000000 ]  - [  -0.0046984600000000,  0.0000576100000000, -0.0000707600000000 ]  - [  -0.0000425200000000,  0.0000045000000000, -0.0000215600000000 ]  - [   0.0210371700000000,  0.0001095700000000,  0.0000059200000000 ]  - [  -0.0004244200000000, -0.0000088300000000,  0.0000016600000000 ]  - [  -0.0003273000000000,  0.0000136000000000,  0.0000039800000000 ]  - [  -0.0046945600000000,  0.0000068400000000, -0.0000119600000000 ]  - [   0.0000454400000000, -0.0000088700000000,  0.0000060800000000 ]  - [  -0.0006422300000000, -0.0000489600000000,  0.0000213400000000 ]  - [  -0.0000065700000000,  0.0002425300000000,  0.0002176800000000 ]  - [   0.0014931000000000,  0.0230427800000000,  0.0100788200000000 ]  - [   0.0000245400000000, -0.0000106400000000,  0.0000136500000000 ]  - [   0.0000110900000000, -0.0000083700000000,  0.0000410300000000 ]  - [   0.0012855700000000, -0.0231033000000000, -0.0100031900000000 ]  - [   0.0413539400000000,  0.0000966500000000,  0.0001459300000000 ]  - [  -0.0000089500000000,  0.0000187500000000, -0.0000145100000000 ]  - [  -0.2281163800000000, -0.0033428300000000, -0.0023572000000000 ]  - [  -0.0000153500000000,  0.0000009600000000,  0.0000596900000000 ]  - [   0.0006537000000000,  0.0006960000000000,  0.0050981200000000 ]  - [  -0.0000056600000000, -0.0002418700000000, -0.0002529400000000 ]  - [   0.0004134400000000, -0.0000005200000000, -0.0000175500000000 ]  - [   0.0004983300000000, -0.0007108000000000, -0.0051666700000000 ]  - [   0.0039828000000000,  0.0000004700000000, -0.0000705000000000 ]  - [   0.0004626200000000, -0.0000045300000000, -0.0000727300000000 ]- atom:   49  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0066425300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0242278700000000 ]  - [  -0.0001811300000000,  0.0001045700000000, -0.0061201400000000 ]  - [  -0.0029562100000000,  0.0017067700000000, -0.0088365300000000 ]  - [   0.0029562100000000,  0.0017067700000000, -0.0088365300000000 ]  - [   0.0000000000000000, -0.0002091500000000, -0.0061201400000000 ]  - [   0.0000000000000000, -0.0034135400000000, -0.0088365300000000 ]  - [   0.0001811300000000,  0.0001045700000000, -0.0061201400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012031500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063421900000000 ]  - [   0.0002639800000000, -0.0001524100000000,  0.0086506800000000 ]  - [   0.0000000000000000,  0.0002268100000000, -0.0057132700000000 ]  - [  -0.0001964300000000, -0.0001134100000000, -0.0057132700000000 ]  - [  -0.0002639800000000, -0.0001524100000000,  0.0086506800000000 ]  - [   0.0000000000000000,  0.0003048200000000,  0.0086506800000000 ]  - [   0.0001964300000000, -0.0001134100000000, -0.0057132700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1157929100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0072177000000000 ]  - [   0.0000000000000000, -0.0338744500000000,  0.0385711400000000 ]  - [   0.0006963400000000,  0.0004020300000000, -0.0056759700000000 ]  - [  -0.0006963400000000,  0.0004020300000000, -0.0056759700000000 ]  - [  -0.0293361300000000,  0.0169372200000000,  0.0385711400000000 ]  - [   0.0293361300000000,  0.0169372200000000,  0.0385711400000000 ]  - [   0.0000000000000000, -0.0008040600000000, -0.0056759700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0062341500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0004840200000000 ]  - [   0.0000000000000000,  0.0001652200000000, -0.0061741100000000 ]  - [   0.0030551500000000,  0.0017638900000000, -0.0041478100000000 ]  - [  -0.0030551500000000,  0.0017638900000000, -0.0041478100000000 ]  - [   0.0001430800000000, -0.0000826100000000, -0.0061741100000000 ]  - [  -0.0001430800000000, -0.0000826100000000, -0.0061741100000000 ]  - [   0.0000000000000000, -0.0035277900000000, -0.0041478100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0071620100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0161242300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0068310000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0316093800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057069200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0052853300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0172879000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0059391600000000 ]  - [   0.0000000000000000, -0.0186678800000000,  0.0159631900000000 ]  - [  -0.0003958800000000,  0.0002285600000000,  0.0084458200000000 ]  - [  -0.0014106400000000,  0.0008144300000000,  0.0000848200000000 ]  - [   0.0000000000000000,  0.0003787600000000,  0.0084504300000000 ]  - [  -0.0003280200000000, -0.0001893800000000,  0.0084504300000000 ]  - [   0.0014106400000000,  0.0008144300000000,  0.0000848200000000 ]  - [   0.0000000000000000, -0.0016288600000000,  0.0000848200000000 ]  - [   0.0003280200000000, -0.0001893800000000,  0.0084504300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2598425100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0093124600000000 ]  - [   0.0161668600000000,  0.0093339400000000,  0.0159631900000000 ]  - [   0.0003958800000000,  0.0002285600000000,  0.0084458200000000 ]  - [   0.0000000000000000, -0.0004571200000000,  0.0084458200000000 ]  - [  -0.0161668600000000,  0.0093339400000000,  0.0159631900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0121584300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0117792700000000 ]- atom:   49  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0066157600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0243664700000000 ]  - [   0.0001333800000000, -0.0000770100000000,  0.0061616600000000 ]  - [   0.0029899100000000, -0.0017262300000000,  0.0088738000000000 ]  - [  -0.0029899100000000, -0.0017262300000000,  0.0088738000000000 ]  - [   0.0000000000000000,  0.0001540100000000,  0.0061616600000000 ]  - [   0.0000000000000000,  0.0034524600000000,  0.0088738000000000 ]  - [  -0.0001333800000000, -0.0000770100000000,  0.0061616600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0012991400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0064414700000000 ]  - [  -0.0003163200000000,  0.0001826200000000, -0.0087583900000000 ]  - [   0.0000000000000000, -0.0001640300000000,  0.0056467800000000 ]  - [   0.0001420600000000,  0.0000820200000000,  0.0056467800000000 ]  - [   0.0003163200000000,  0.0001826200000000, -0.0087583900000000 ]  - [   0.0000000000000000, -0.0003652500000000, -0.0087583900000000 ]  - [  -0.0001420600000000,  0.0000820200000000,  0.0056467800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1243990900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0071478700000000 ]  - [   0.0000000000000000,  0.0333666200000000, -0.0387586900000000 ]  - [  -0.0007067200000000, -0.0004080300000000,  0.0056605200000000 ]  - [   0.0007067200000000, -0.0004080300000000,  0.0056605200000000 ]  - [   0.0288963400000000, -0.0166833100000000, -0.0387586900000000 ]  - [  -0.0288963400000000, -0.0166833100000000, -0.0387586900000000 ]  - [   0.0000000000000000,  0.0008160600000000,  0.0056605200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0061774200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0004101400000000 ]  - [   0.0000000000000000, -0.0002066200000000,  0.0061831300000000 ]  - [  -0.0030434800000000, -0.0017571600000000,  0.0041878800000000 ]  - [   0.0030434800000000, -0.0017571600000000,  0.0041878800000000 ]  - [  -0.0001789400000000,  0.0001033100000000,  0.0061831300000000 ]  - [   0.0001789400000000,  0.0001033100000000,  0.0061831300000000 ]  - [   0.0000000000000000,  0.0035143100000000,  0.0041878800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0071124700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0160851200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0068586500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0317264100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056945100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0052521600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0170600200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059076800000000 ]  - [   0.0000000000000000,  0.0187347400000000, -0.0161106900000000 ]  - [   0.0003942400000000, -0.0002276200000000, -0.0084602400000000 ]  - [   0.0014900900000000, -0.0008603000000000, -0.0002994800000000 ]  - [   0.0000000000000000, -0.0004001600000000, -0.0084049000000000 ]  - [   0.0003465500000000,  0.0002000800000000, -0.0084049000000000 ]  - [  -0.0014900900000000, -0.0008603000000000, -0.0002994800000000 ]  - [   0.0000000000000000,  0.0017206100000000, -0.0002994800000000 ]  - [  -0.0003465500000000,  0.0002000800000000, -0.0084049000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2695707500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0091697000000000 ]  - [  -0.0162247600000000, -0.0093673700000000, -0.0161106900000000 ]  - [  -0.0003942400000000, -0.0002276200000000, -0.0084602400000000 ]  - [   0.0000000000000000,  0.0004552300000000, -0.0084602400000000 ]  - [   0.0162247600000000, -0.0093673700000000, -0.0161106900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0122493500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0119039500000000 ]- atom:   55  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0026273200000000, -0.0000004500000000,  0.0000132600000000 ]  - [   0.0006117600000000,  0.0000014400000000,  0.0000103100000000 ]  - [   0.0323869100000000, -0.0067922100000000,  0.0056870500000000 ]  - [   0.0000172700000000,  0.0000142000000000,  0.0000380700000000 ]  - [  -0.0000259300000000, -0.0000412200000000,  0.0000099700000000 ]  - [   0.0206423300000000, -0.0001435500000000, -0.0000750200000000 ]  - [   0.0000437100000000,  0.0000203500000000,  0.0000222400000000 ]  - [   0.0311855700000000,  0.0060822400000000, -0.0044032500000000 ]  - [  -0.0000997600000000,  0.0000000800000000,  0.0000512200000000 ]  - [  -0.0031740600000000, -0.0000314900000000,  0.0000161100000000 ]  - [  -0.0001048000000000,  0.0001660100000000, -0.0005276800000000 ]  - [  -0.0035014400000000,  0.0000359800000000, -0.0000272400000000 ]  - [   0.0012162300000000,  0.0027268200000000, -0.0038339200000000 ]  - [  -0.0000576400000000, -0.0001389400000000,  0.0004658000000000 ]  - [   0.0001834200000000, -0.0000243400000000, -0.0000298200000000 ]  - [   0.0012884500000000, -0.0027621400000000,  0.0037680500000000 ]  - [  -0.0003152100000000, -0.0000004000000000, -0.0000279800000000 ]  - [   0.0060286100000000, -0.0000123900000000, -0.0000374500000000 ]  - [  -0.0045164600000000, -0.0000200000000000, -0.0000116100000000 ]  - [   0.0000012700000000,  0.0002147700000000,  0.0000135800000000 ]  - [   0.0000121500000000, -0.0002200300000000, -0.0000245200000000 ]  - [   0.0000837700000000, -0.0026592600000000,  0.0042328000000000 ]  - [   0.0001237000000000,  0.0026757400000000, -0.0042451000000000 ]  - [  -0.0003697600000000,  0.0000047900000000, -0.0000070800000000 ]  - [   0.0000075300000000, -0.0000001200000000, -0.0000232800000000 ]  - [  -0.0025662700000000,  0.0000257500000000,  0.0000107600000000 ]  - [  -0.0000099000000000, -0.0000161800000000,  0.0000096000000000 ]  - [   0.0326639000000000,  0.0069380400000000, -0.0059850000000000 ]  - [   0.0314456900000000, -0.0062182700000000,  0.0047476900000000 ]  - [  -0.0000270700000000,  0.0000109500000000,  0.0000458600000000 ]  - [   0.0000085400000000,  0.0000115900000000, -0.0000293300000000 ]  - [   0.0206667500000000,  0.0001423900000000,  0.0001126100000000 ]  - [   0.0004687400000000, -0.0000000500000000, -0.0000195900000000 ]  - [   0.0064329000000000,  0.0000130200000000, -0.0000089100000000 ]  - [   0.0019354200000000,  0.0000048500000000, -0.0000250100000000 ]  - [  -0.0013345400000000, -0.0000050500000000, -0.0000170800000000 ]  - [   0.0228803800000000, -0.0001190800000000,  0.0000762900000000 ]  - [  -0.0000356800000000,  0.0000094500000000,  0.0000121900000000 ]  - [   0.0225499000000000,  0.0001202200000000, -0.0000485500000000 ]  - [  -0.0000044200000000, -0.0000095000000000,  0.0000127100000000 ]  - [   0.0002580700000000,  0.0000013800000000, -0.0000129300000000 ]  - [   0.0037934200000000, -0.0173885000000000, -0.0204641100000000 ]  - [   0.0033087700000000, -0.0167789400000000, -0.0202212400000000 ]  - [   0.0000579100000000, -0.0000097100000000,  0.0000178700000000 ]  - [   0.0000158600000000, -0.0000242400000000,  0.0001539200000000 ]  - [   0.0033806200000000,  0.0167402700000000,  0.0201210900000000 ]  - [  -0.0256833600000000, -0.0000303700000000,  0.0000380200000000 ]  - [  -0.0000012600000000,  0.0000342100000000, -0.0001177200000000 ]  - [   0.0039840800000000, -0.0000013700000000,  0.0000803100000000 ]  - [   0.0004614900000000, -0.0000003100000000,  0.0000654800000000 ]  - [  -0.0000046700000000, -0.0001514100000000,  0.0000403500000000 ]  - [   0.0037029400000000,  0.0174193800000000,  0.0205806900000000 ]  - [  -0.0263958200000000,  0.0000431600000000, -0.0000360500000000 ]  - [  -0.0000015600000000,  0.0001501000000000, -0.0000659500000000 ]  - [  -0.1810264600000000, -0.0000074100000000, -0.0000578300000000 ]  - [   0.0000353800000000, -0.0000002100000000, -0.0000706700000000 ]- atom:   55  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0070441700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0086805500000000 ]  - [   0.0116134200000000, -0.0067050100000000,  0.0391177100000000 ]  - [  -0.0000119200000000,  0.0000068800000000, -0.0071060500000000 ]  - [   0.0000119200000000,  0.0000068800000000, -0.0071060500000000 ]  - [   0.0000000000000000,  0.0134100200000000,  0.0391177100000000 ]  - [   0.0000000000000000, -0.0000137600000000, -0.0071060500000000 ]  - [  -0.0116134200000000, -0.0067050100000000,  0.0391177100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0072405500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0128148600000000 ]  - [  -0.0000996700000000,  0.0000575400000000, -0.0068024500000000 ]  - [   0.0000000000000000, -0.0018774400000000, -0.0052009800000000 ]  - [   0.0016259100000000,  0.0009387200000000, -0.0052009800000000 ]  - [   0.0000996700000000,  0.0000575400000000, -0.0068024500000000 ]  - [   0.0000000000000000, -0.0001150900000000, -0.0068024500000000 ]  - [  -0.0016259100000000,  0.0009387200000000, -0.0052009800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0081274100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0099671800000000 ]  - [   0.0000000000000000, -0.0014090300000000, -0.0057309500000000 ]  - [   0.0009636500000000,  0.0005563600000000, -0.0066556500000000 ]  - [  -0.0009636500000000,  0.0005563600000000, -0.0066556500000000 ]  - [  -0.0012202500000000,  0.0007045100000000, -0.0057309500000000 ]  - [   0.0012202500000000,  0.0007045100000000, -0.0057309500000000 ]  - [   0.0000000000000000, -0.0011127200000000, -0.0066556500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0070205100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0116605600000000 ]  - [   0.0000000000000000,  0.0000062400000000, -0.0072540900000000 ]  - [  -0.0110439700000000, -0.0063762400000000,  0.0384456600000000 ]  - [   0.0110439700000000, -0.0063762400000000,  0.0384456600000000 ]  - [   0.0000054000000000, -0.0000031200000000, -0.0072540900000000 ]  - [  -0.0000054000000000, -0.0000031200000000, -0.0072540900000000 ]  - [   0.0000000000000000,  0.0127524800000000,  0.0384456600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0083200500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0098464100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0085528900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0076095000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0346119400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0079000000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0334279300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0079285800000000 ]  - [   0.0000000000000000,  0.0007700300000000,  0.0098268100000000 ]  - [  -0.0176530400000000,  0.0101919900000000,  0.0203956200000000 ]  - [  -0.0166621200000000,  0.0096198800000000,  0.0202088200000000 ]  - [   0.0000000000000000,  0.0006840200000000,  0.0097811000000000 ]  - [  -0.0005923800000000, -0.0003420100000000,  0.0097811000000000 ]  - [   0.0166621200000000,  0.0096198800000000,  0.0202088200000000 ]  - [   0.0000000000000000, -0.0192397500000000,  0.0202088200000000 ]  - [   0.0005923800000000, -0.0003420100000000,  0.0097811000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0122801700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0119182900000000 ]  - [  -0.0006668600000000, -0.0003850100000000,  0.0098268100000000 ]  - [   0.0176530400000000,  0.0101919900000000,  0.0203956200000000 ]  - [   0.0000000000000000, -0.0203839700000000,  0.0203956200000000 ]  - [   0.0006668600000000, -0.0003850100000000,  0.0098268100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2874869100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0125827100000000 ]- atom:   55  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0070314000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0086847900000000 ]  - [  -0.0105645300000000,  0.0060994300000000, -0.0379908000000000 ]  - [   0.0000555400000000, -0.0000320600000000,  0.0071556100000000 ]  - [  -0.0000555400000000, -0.0000320600000000,  0.0071556100000000 ]  - [   0.0000000000000000, -0.0121988700000000, -0.0379908000000000 ]  - [   0.0000000000000000,  0.0000641300000000,  0.0071556100000000 ]  - [   0.0105645300000000,  0.0060994300000000, -0.0379908000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0073472200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0126657000000000 ]  - [   0.0000474500000000, -0.0000273900000000,  0.0067453600000000 ]  - [   0.0000000000000000,  0.0019440500000000,  0.0051626400000000 ]  - [  -0.0016836000000000, -0.0009720300000000,  0.0051626400000000 ]  - [  -0.0000474500000000, -0.0000273900000000,  0.0067453600000000 ]  - [   0.0000000000000000,  0.0000547900000000,  0.0067453600000000 ]  - [   0.0016836000000000, -0.0009720300000000,  0.0051626400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0080626500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0098849300000000 ]  - [   0.0000000000000000,  0.0013878200000000,  0.0056974400000000 ]  - [  -0.0009721000000000, -0.0005612400000000,  0.0066446000000000 ]  - [   0.0009721000000000, -0.0005612400000000,  0.0066446000000000 ]  - [   0.0012018900000000, -0.0006939100000000,  0.0056974400000000 ]  - [  -0.0012018900000000, -0.0006939100000000,  0.0056974400000000 ]  - [   0.0000000000000000,  0.0011224800000000,  0.0066446000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0069732400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0117470200000000 ]  - [   0.0000000000000000, -0.0000467900000000,  0.0072705700000000 ]  - [   0.0121250300000000,  0.0070003900000000, -0.0395175600000000 ]  - [  -0.0121250300000000,  0.0070003900000000, -0.0395175600000000 ]  - [  -0.0000405200000000,  0.0000233900000000,  0.0072705700000000 ]  - [   0.0000405200000000,  0.0000233900000000,  0.0072705700000000 ]  - [   0.0000000000000000, -0.0140007700000000, -0.0395175600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0082853500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0098285000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0086026200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0076366700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0345852700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0078746600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0335027800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0079069000000000 ]  - [   0.0000000000000000, -0.0007693000000000, -0.0098525300000000 ]  - [   0.0174018800000000, -0.0100469800000000, -0.0202436100000000 ]  - [   0.0169238900000000, -0.0097710100000000, -0.0203551700000000 ]  - [   0.0000000000000000, -0.0007030900000000, -0.0097470400000000 ]  - [   0.0006088900000000,  0.0003515500000000, -0.0097470400000000 ]  - [  -0.0169238900000000, -0.0097710100000000, -0.0203551700000000 ]  - [   0.0000000000000000,  0.0195420300000000, -0.0203551700000000 ]  - [  -0.0006088900000000,  0.0003515500000000, -0.0097470400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0121237300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0117645900000000 ]  - [   0.0006662300000000,  0.0003846500000000, -0.0098525300000000 ]  - [  -0.0174018800000000, -0.0100469800000000, -0.0202436100000000 ]  - [   0.0000000000000000,  0.0200939600000000, -0.0202436100000000 ]  - [  -0.0006662300000000,  0.0003846500000000, -0.0098525300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2873823600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0127227500000000 ]