# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/f10b23f7-67d7-4b9d-b8f4-d60f6228fe26/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 NaI3O8 / P-4 (81) / materials id 559065](https://mdr.nims.go.jp/datasets/40cf9e11-6fc8-4d91-b887-b97627c06411)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  nac_unit_conversion_factor: 14.399652  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "P-4"  number: 81  Hall_symbol: "P -4"supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   2 ]primitive_cell:  lattice:  - [     8.007312490000000,    -0.000000160000000,     0.000000000000000 ] # a  - [     0.000000160000000,     8.007312490000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     5.706850490000000 ] # c  points:  - symbol: Na # 1    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 22.989769  - symbol: Na # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 22.989769  - symbol: I  # 3    coordinates: [  0.000000000000000,  0.500000000000000,  0.098671380000000 ]    mass: 126.904470  - symbol: I  # 4    coordinates: [  0.749810940000000,  0.728995580000000,  0.605281710000000 ]    mass: 126.904470  - symbol: I  # 5    coordinates: [  0.500000000000000,  0.000000000000000,  0.901328620000000 ]    mass: 126.904470  - symbol: I  # 6    coordinates: [  0.728995580000000,  0.250189060000000,  0.394718290000000 ]    mass: 126.904470  - symbol: I  # 7    coordinates: [  0.250189060000000,  0.271004420000000,  0.605281710000000 ]    mass: 126.904470  - symbol: I  # 8    coordinates: [  0.271004420000000,  0.749810940000000,  0.394718290000000 ]    mass: 126.904470  - symbol: O  # 9    coordinates: [  0.274923130000000,  0.493877670000000,  0.651282290000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.067078620000000,  0.239618220000000,  0.788927760000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.948825960000000,  0.672234960000000,  0.303537790000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.760381780000000,  0.067078620000000,  0.211072240000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.672234960000000,  0.051174040000000,  0.696462210000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.506122330000000,  0.274923130000000,  0.348717710000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.762680480000000,  0.411197840000000,  0.138854060000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.493877670000000,  0.725076870000000,  0.348717710000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.588802160000000,  0.762680480000000,  0.861145940000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.411197840000000,  0.237319520000000,  0.861145940000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.932921380000000,  0.760381780000000,  0.788927760000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.327765040000000,  0.948825960000000,  0.696462210000000 ]    mass: 15.999400  - symbol: O  # 21    coordinates: [  0.237319520000000,  0.588802160000000,  0.138854060000000 ]    mass: 15.999400  - symbol: O  # 22    coordinates: [  0.051174040000000,  0.327765040000000,  0.303537790000000 ]    mass: 15.999400  - symbol: O  # 23    coordinates: [  0.239618220000000,  0.932921380000000,  0.211072240000000 ]    mass: 15.999400  - symbol: O  # 24    coordinates: [  0.725076870000000,  0.506122330000000,  0.651282290000000 ]    mass: 15.999400  reciprocal_lattice: # without 2pi  - [     0.124885846686870,    -0.000000002495436,     0.000000000000000 ] # a*  - [     0.000000002495436,     0.124885846686870,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.175228000409732 ] # c*unit_cell:  lattice:  - [     8.007312490000000,    -0.000000160000000,     0.000000000000000 ] # a  - [     0.000000160000000,     8.007312490000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     5.706850490000000 ] # c  points:  - symbol: Na # 1    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 1  - symbol: Na # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 2  - symbol: I  # 3    coordinates: [  0.000000000000000,  0.500000000000000,  0.098671380000000 ]    mass: 126.904470    reduced_to: 3  - symbol: I  # 4    coordinates: [  0.749810940000000,  0.728995580000000,  0.605281710000000 ]    mass: 126.904470    reduced_to: 4  - symbol: I  # 5    coordinates: [  0.500000000000000,  0.000000000000000,  0.901328620000000 ]    mass: 126.904470    reduced_to: 5  - symbol: I  # 6    coordinates: [  0.728995580000000,  0.250189060000000,  0.394718290000000 ]    mass: 126.904470    reduced_to: 6  - symbol: I  # 7    coordinates: [  0.250189060000000,  0.271004420000000,  0.605281710000000 ]    mass: 126.904470    reduced_to: 7  - symbol: I  # 8    coordinates: [  0.271004420000000,  0.749810940000000,  0.394718290000000 ]    mass: 126.904470    reduced_to: 8  - symbol: O  # 9    coordinates: [  0.274923130000000,  0.493877670000000,  0.651282290000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.067078620000000,  0.239618220000000,  0.788927760000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.948825960000000,  0.672234960000000,  0.303537790000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.760381780000000,  0.067078620000000,  0.211072240000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.672234960000000,  0.051174040000000,  0.696462210000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.506122330000000,  0.274923130000000,  0.348717710000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.762680480000000,  0.411197840000000,  0.138854060000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.493877670000000,  0.725076870000000,  0.348717710000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.588802160000000,  0.762680480000000,  0.861145940000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.411197840000000,  0.237319520000000,  0.861145940000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.932921380000000,  0.760381780000000,  0.788927760000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.327765040000000,  0.948825960000000,  0.696462210000000 ]    mass: 15.999400    reduced_to: 20  - symbol: O  # 21    coordinates: [  0.237319520000000,  0.588802160000000,  0.138854060000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.051174040000000,  0.327765040000000,  0.303537790000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 23    coordinates: [  0.239618220000000,  0.932921380000000,  0.211072240000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.725076870000000,  0.506122330000000,  0.651282290000000 ]    mass: 15.999400    reduced_to: 24supercell:  lattice:  - [     8.007312490000000,    -0.000000160000000,     0.000000000000000 ] # a  - [     0.000000160000000,     8.007312490000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.413700980000000 ] # c  points:  - symbol: Na # 1    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 1  - symbol: Na # 2    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 22.989769    reduced_to: 1  - symbol: Na # 3    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 22.989769    reduced_to: 3  - symbol: Na # 4    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 22.989769    reduced_to: 3  - symbol: I  # 5    coordinates: [  0.000000000000000,  0.500000000000000,  0.049335690000000 ]    mass: 126.904470    reduced_to: 5  - symbol: I  # 6    coordinates: [  0.000000000000000,  0.500000000000000,  0.549335690000000 ]    mass: 126.904470    reduced_to: 5  - symbol: I  # 7    coordinates: [  0.749810940000000,  0.728995580000000,  0.302640855000000 ]    mass: 126.904470    reduced_to: 7  - symbol: I  # 8    coordinates: [  0.749810940000000,  0.728995580000000,  0.802640855000000 ]    mass: 126.904470    reduced_to: 7  - symbol: I  # 9    coordinates: [  0.500000000000000,  0.000000000000000,  0.450664310000000 ]    mass: 126.904470    reduced_to: 9  - symbol: I  # 10    coordinates: [  0.500000000000000,  0.000000000000000,  0.950664310000000 ]    mass: 126.904470    reduced_to: 9  - symbol: I  # 11    coordinates: [  0.728995580000000,  0.250189060000000,  0.197359145000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 12    coordinates: [  0.728995580000000,  0.250189060000000,  0.697359145000000 ]    mass: 126.904470    reduced_to: 11  - symbol: I  # 13    coordinates: [  0.250189060000000,  0.271004420000000,  0.302640855000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 14    coordinates: [  0.250189060000000,  0.271004420000000,  0.802640855000000 ]    mass: 126.904470    reduced_to: 13  - symbol: I  # 15    coordinates: [  0.271004420000000,  0.749810940000000,  0.197359145000000 ]    mass: 126.904470    reduced_to: 15  - symbol: I  # 16    coordinates: [  0.271004420000000,  0.749810940000000,  0.697359145000000 ]    mass: 126.904470    reduced_to: 15  - symbol: O  # 17    coordinates: [  0.274923130000000,  0.493877670000000,  0.325641145000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.274923130000000,  0.493877670000000,  0.825641145000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 19    coordinates: [  0.067078620000000,  0.239618220000000,  0.394463880000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.067078620000000,  0.239618220000000,  0.894463880000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 21    coordinates: [  0.948825960000000,  0.672234960000000,  0.151768895000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.948825960000000,  0.672234960000000,  0.651768895000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 23    coordinates: [  0.760381780000000,  0.067078620000000,  0.105536120000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.760381780000000,  0.067078620000000,  0.605536120000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 25    coordinates: [  0.672234960000000,  0.051174040000000,  0.348231105000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.672234960000000,  0.051174040000000,  0.848231105000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 27    coordinates: [  0.506122330000000,  0.274923130000000,  0.174358855000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.506122330000000,  0.274923130000000,  0.674358855000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 29    coordinates: [  0.762680480000000,  0.411197840000000,  0.069427030000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.762680480000000,  0.411197840000000,  0.569427030000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 31    coordinates: [  0.493877670000000,  0.725076870000000,  0.174358855000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.493877670000000,  0.725076870000000,  0.674358855000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 33    coordinates: [  0.588802160000000,  0.762680480000000,  0.430572970000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.588802160000000,  0.762680480000000,  0.930572970000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 35    coordinates: [  0.411197840000000,  0.237319520000000,  0.430572970000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.411197840000000,  0.237319520000000,  0.930572970000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 37    coordinates: [  0.932921380000000,  0.760381780000000,  0.394463880000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.932921380000000,  0.760381780000000,  0.894463880000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 39    coordinates: [  0.327765040000000,  0.948825960000000,  0.348231105000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.327765040000000,  0.948825960000000,  0.848231105000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 41    coordinates: [  0.237319520000000,  0.588802160000000,  0.069427030000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.237319520000000,  0.588802160000000,  0.569427030000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 43    coordinates: [  0.051174040000000,  0.327765040000000,  0.151768895000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.051174040000000,  0.327765040000000,  0.651768895000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 45    coordinates: [  0.239618220000000,  0.932921380000000,  0.105536120000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.239618220000000,  0.932921380000000,  0.605536120000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 47    coordinates: [  0.725076870000000,  0.506122330000000,  0.325641145000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.725076870000000,  0.506122330000000,  0.825641145000000 ]    mass: 15.999400    reduced_to: 47born_effective_charge:- # 1 (Na)  - [  1.162898120000000, -0.104987570000000,  0.000000000000000 ]  - [  0.104987570000000,  1.162898120000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  1.261940690000000 ]- # 2 (Na)  - [  1.338850450000000,  0.195252550000000,  0.000000000000000 ]  - [ -0.195252550000000,  1.338850450000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  1.140851890000000 ]- # 3 (I)  - [  5.694280230000000, -0.206030360000000,  0.000000000000000 ]  - [  1.796953710000000,  4.933545090000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  4.244821650000000 ]- # 4 (I)  - [  5.874820140000000, -0.787611900000000, -0.792113790000000 ]  - [ -2.031584420000000,  4.064585280000000,  1.679104900000000 ]  - [  0.030734920000000,  0.756162220000000,  3.646513580000000 ]- # 5 (I)  - [  4.933545090000000, -1.796953709999999,  0.000000000000000 ]  - [  0.206030360000000,  5.694280230000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  4.244821650000000 ]- # 6 (I)  - [  4.064585280000000,  2.031584419999999, -1.679104900000000 ]  - [  0.787611900000000,  5.874820140000000, -0.792113790000000 ]  - [ -0.756162220000000,  0.030734920000000,  3.646513580000000 ]- # 7 (I)  - [  5.874820140000000, -0.787611900000000,  0.792113790000000 ]  - [ -2.031584419999999,  4.064585280000000, -1.679104900000000 ]  - [ -0.030734920000000, -0.756162220000000,  3.646513580000000 ]- # 8 (I)  - [  4.064585280000000,  2.031584419999999,  1.679104900000000 ]  - [  0.787611900000000,  5.874820140000000,  0.792113790000000 ]  - [  0.756162220000000, -0.030734920000000,  3.646513580000000 ]- # 9 (O)  - [ -1.010968230000000, -0.060432870000000, -0.071142680000000 ]  - [  0.084399290000000, -2.977964750000000,  0.279762210000000 ]  - [  0.087136340000000,  0.723927690000000, -1.065661780000000 ]- # 10 (O)  - [ -2.137108420000000,  0.269321130000000,  1.185293640000000 ]  - [  0.166611700000000, -1.237702320000000, -0.043510640000000 ]  - [  0.834222690000000, -0.334426300000000, -1.878493440000000 ]- # 11 (O)  - [ -2.275534990000000,  0.549437670000000,  0.980727800000000 ]  - [  0.162661010000000, -1.883012440000000, -1.273260750000000 ]  - [  0.550220940000000, -0.678314410000000, -1.969365900000000 ]- # 12 (O)  - [ -1.237702320000000, -0.166611700000000, -0.043510640000000 ]  - [ -0.269321130000000, -2.137108420000000, -1.185293640000000 ]  - [ -0.334426300000000, -0.834222690000000, -1.878493440000000 ]- # 13 (O)  - [ -1.883012440000000, -0.162661010000000,  1.273260749999999 ]  - [ -0.549437670000000, -2.275534990000000,  0.980727800000000 ]  - [  0.678314410000000,  0.550220940000000, -1.969365900000000 ]- # 14 (O)  - [ -2.977964750000000, -0.084399290000000,  0.279762210000000 ]  - [  0.060432870000000, -1.010968230000000,  0.071142680000000 ]  - [  0.723927690000000, -0.087136340000000, -1.065661780000000 ]- # 15 (O)  - [ -2.810622790000000, -1.649307730000001,  1.484197720000000 ]  - [ -1.017040810000000, -2.171278430000000,  1.447355760000000 ]  - [  0.096738830000000,  0.584180880000000, -1.456101410000000 ]- # 16 (O)  - [ -2.977964750000000, -0.084399290000000, -0.279762210000000 ]  - [  0.060432870000000, -1.010968230000000, -0.071142680000000 ]  - [ -0.723927690000000,  0.087136340000000, -1.065661780000000 ]- # 17 (O)  - [ -2.171278430000000,  1.017040809999999,  1.447355760000000 ]  - [  1.649307730000001, -2.810622790000000, -1.484197720000000 ]  - [  0.584180880000000, -0.096738830000000, -1.456101410000000 ]- # 18 (O)  - [ -2.171278430000000,  1.017040809999999, -1.447355760000000 ]  - [  1.649307730000001, -2.810622790000000,  1.484197720000000 ]  - [ -0.584180880000000,  0.096738830000000, -1.456101410000000 ]- # 19 (O)  - [ -2.137108420000000,  0.269321130000000, -1.185293640000000 ]  - [  0.166611700000000, -1.237702320000000,  0.043510640000000 ]  - [ -0.834222690000000,  0.334426300000000, -1.878493440000000 ]- # 20 (O)  - [ -1.883012440000000, -0.162661010000000, -1.273260749999999 ]  - [ -0.549437670000000, -2.275534990000000, -0.980727800000000 ]  - [ -0.678314410000000, -0.550220940000000, -1.969365900000000 ]- # 21 (O)  - [ -2.810622790000000, -1.649307730000001, -1.484197720000000 ]  - [ -1.017040809999999, -2.171278430000000, -1.447355760000000 ]  - [ -0.096738830000000, -0.584180880000000, -1.456101410000000 ]- # 22 (O)  - [ -2.275534990000000,  0.549437670000000, -0.980727800000000 ]  - [  0.162661010000000, -1.883012440000000,  1.273260749999999 ]  - [ -0.550220940000000,  0.678314410000000, -1.969365900000000 ]- # 23 (O)  - [ -1.237702320000000, -0.166611700000000,  0.043510640000000 ]  - [ -0.269321130000000, -2.137108420000000,  1.185293640000000 ]  - [  0.334426300000000,  0.834222690000000, -1.878493440000000 ]- # 24 (O)  - [ -1.010968230000000, -0.060432870000000,  0.071142680000000 ]  - [  0.084399290000000, -2.977964750000000, -0.279762210000000 ]  - [ -0.087136340000000, -0.723927690000000, -1.065661780000000 ]dielectric_constant:  - [  4.743442640000000,  0.000000230000000,  0.000000000000000 ]  - [ -0.000000230000000,  4.743442640000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  4.031647530000000 ]displacements:- atom:    1  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [  -0.0337343100000000,  0.0000042500000000, -0.0001990800000000 ]  - [  -0.0001857000000000,  0.0000006900000000,  0.0000000900000000 ]  - [   0.0006011100000000,  0.0001065500000000, -0.0000000900000000 ]  - [   0.0001394500000000,  0.0000239200000000,  0.0000002200000000 ]  - [   0.0159047200000000,  0.0028617600000000, -0.0006740100000000 ]  - [   0.0010744400000000, -0.0007537000000000, -0.0006841300000000 ]  - [   0.0003146400000000,  0.0007729000000000,  0.0003987900000000 ]  - [   0.0021924500000000,  0.0050960600000000, -0.0032469800000000 ]  - [  -0.0014779000000000,  0.0000325100000000,  0.0006855700000000 ]  - [  -0.0048914300000000,  0.0038084700000000,  0.0006853700000000 ]  - [  -0.0006080600000000, -0.0052613700000000,  0.0053937800000000 ]  - [  -0.0003987900000000, -0.0017517600000000, -0.0018017900000000 ]  - [  -0.0002565700000000,  0.0012130300000000, -0.0006137900000000 ]  - [   0.0016354700000000,  0.0055127100000000,  0.0030078000000000 ]  - [  -0.0001315200000000, -0.0046561000000000, -0.0051506900000000 ]  - [   0.0000503300000000, -0.0011659200000000,  0.0020202900000000 ]  - [   0.0000423500000000, -0.0005346400000000,  0.0004720900000000 ]  - [  -0.0002139600000000, -0.0013010400000000, -0.0020391500000000 ]  - [  -0.0001312200000000, -0.0003019100000000, -0.0003727700000000 ]  - [  -0.0011607300000000, -0.0006417100000000,  0.0000291900000000 ]  - [  -0.0030869600000000,  0.0000924600000000,  0.0007077500000000 ]  - [  -0.0012508300000000,  0.0004412400000000,  0.0011440000000000 ]  - [   0.0004231800000000,  0.0009403700000000,  0.0003405200000000 ]  - [   0.0004472700000000,  0.0001643100000000,  0.0007567400000000 ]  - [   0.0010182100000000,  0.0009972000000000, -0.0012595400000000 ]  - [   0.0010642100000000, -0.0004562300000000, -0.0005194000000000 ]  - [   0.0019965600000000,  0.0002826800000000, -0.0003587100000000 ]  - [   0.0007635400000000,  0.0001575300000000, -0.0000575700000000 ]  - [   0.0076107300000000, -0.0029303900000000,  0.0031957900000000 ]  - [  -0.0000704400000000,  0.0002692000000000,  0.0001884500000000 ]  - [   0.0020935600000000,  0.0000574500000000,  0.0003566500000000 ]  - [   0.0008761700000000, -0.0000739300000000,  0.0000451900000000 ]  - [   0.0000243600000000,  0.0002553800000000,  0.0001388500000000 ]  - [   0.0030705600000000,  0.0012850100000000, -0.0021584500000000 ]  - [   0.0003969100000000, -0.0001969800000000,  0.0002150600000000 ]  - [   0.0034551100000000,  0.0008068500000000,  0.0024976700000000 ]  - [  -0.0001681700000000,  0.0002106500000000, -0.0003829200000000 ]  - [  -0.0011936200000000, -0.0001326300000000, -0.0007752900000000 ]  - [   0.0006689000000000,  0.0003119200000000,  0.0006428800000000 ]  - [   0.0007129500000000, -0.0011475000000000, -0.0001014600000000 ]  - [   0.0065983300000000, -0.0031133600000000, -0.0033229800000000 ]  - [  -0.0005208800000000, -0.0001057800000000, -0.0005424000000000 ]  - [  -0.0023853000000000, -0.0002511900000000, -0.0000934100000000 ]  - [  -0.0005688500000000,  0.0000978900000000, -0.0005320100000000 ]  - [  -0.0000938500000000,  0.0008994200000000,  0.0004135100000000 ]  - [  -0.0000658800000000,  0.0001271900000000, -0.0000021400000000 ]  - [  -0.0001873100000000, -0.0006466900000000, -0.0004641200000000 ]  - [  -0.0003932800000000, -0.0014068000000000,  0.0020166300000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0154540600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011901600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011155700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0008111100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0049528100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029072500000000 ]  - [   0.0025563800000000,  0.0014327700000000,  0.0029430500000000 ]  - [  -0.0047452300000000, -0.0066435700000000,  0.0023271900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042727100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035884400000000 ]  - [   0.0062533600000000, -0.0053521700000000,  0.0025360700000000 ]  - [  -0.0018556800000000,  0.0019603300000000,  0.0031615500000000 ]  - [  -0.0025563800000000, -0.0014327700000000,  0.0029430500000000 ]  - [   0.0047452300000000,  0.0066435700000000,  0.0023271900000000 ]  - [  -0.0062533600000000,  0.0053521700000000,  0.0025360700000000 ]  - [   0.0018556800000000, -0.0019603300000000,  0.0031615500000000 ]  - [   0.0007490500000000,  0.0006440700000000, -0.0010280200000000 ]  - [  -0.0020828400000000, -0.0016202000000000, -0.0009260700000000 ]  - [   0.0008896000000000, -0.0004571700000000, -0.0017851400000000 ]  - [  -0.0016846000000000, -0.0004032500000000,  0.0013904100000000 ]  - [   0.0000644300000000, -0.0000244100000000,  0.0007086700000000 ]  - [   0.0001864800000000, -0.0000666600000000, -0.0013251500000000 ]  - [   0.0000999000000000,  0.0017415900000000,  0.0021630300000000 ]  - [   0.0000483600000000, -0.0008326000000000, -0.0010186600000000 ]  - [   0.0004011000000000,  0.0008651800000000, -0.0019323200000000 ]  - [   0.0003685600000000,  0.0007541300000000,  0.0000876000000000 ]  - [  -0.0017285600000000,  0.0022804700000000, -0.0008742100000000 ]  - [   0.0005325500000000, -0.0005046200000000, -0.0010356800000000 ]  - [   0.0024561000000000, -0.0011767100000000,  0.0022198900000000 ]  - [   0.0003694200000000,  0.0004753200000000, -0.0012866700000000 ]  - [   0.0017285600000000, -0.0022804700000000, -0.0008742100000000 ]  - [  -0.0005325500000000,  0.0005046200000000, -0.0010356800000000 ]  - [   0.0000976300000000,  0.0000808100000000, -0.0009353600000000 ]  - [  -0.0015334900000000, -0.0019553900000000,  0.0025746400000000 ]  - [  -0.0000976300000000, -0.0000808100000000, -0.0009353600000000 ]  - [   0.0015334900000000,  0.0019553900000000,  0.0025746400000000 ]  - [  -0.0008896000000000,  0.0004571700000000, -0.0017851400000000 ]  - [   0.0016846000000000,  0.0004032500000000,  0.0013904100000000 ]  - [  -0.0004011000000000, -0.0008651800000000, -0.0019323200000000 ]  - [  -0.0003685600000000, -0.0007541300000000,  0.0000876000000000 ]  - [  -0.0024561000000000,  0.0011767100000000,  0.0022198900000000 ]  - [  -0.0003694200000000, -0.0004753200000000, -0.0012866700000000 ]  - [  -0.0000644300000000,  0.0000244100000000,  0.0007086700000000 ]  - [  -0.0001864800000000,  0.0000666600000000, -0.0013251500000000 ]  - [  -0.0000999000000000, -0.0017415900000000,  0.0021630300000000 ]  - [  -0.0000483600000000,  0.0008326000000000, -0.0010186600000000 ]  - [  -0.0007490500000000, -0.0006440700000000, -0.0010280200000000 ]  - [   0.0020828400000000,  0.0016202000000000, -0.0009260700000000 ]- atom:    3  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [   0.0006010500000000, -0.0001068400000000,  0.0000006800000000 ]  - [   0.0001385500000000, -0.0000227600000000, -0.0000002800000000 ]  - [  -0.0281332000000000,  0.0000032200000000, -0.0003792200000000 ]  - [  -0.0001609200000000,  0.0000003800000000, -0.0000004300000000 ]  - [  -0.0052096900000000, -0.0002823300000000, -0.0006823900000000 ]  - [  -0.0006682800000000,  0.0003485400000000, -0.0006823100000000 ]  - [   0.0009502700000000, -0.0001643800000000, -0.0003220300000000 ]  - [   0.0027523600000000,  0.0028060600000000,  0.0032252100000000 ]  - [   0.0017911500000000,  0.0000425500000000,  0.0006791200000000 ]  - [   0.0139081300000000,  0.0000854400000000,  0.0006862800000000 ]  - [   0.0022292500000000, -0.0057210900000000, -0.0034506500000000 ]  - [  -0.0002185700000000, -0.0012243400000000,  0.0018305100000000 ]  - [   0.0003628600000000,  0.0002796800000000,  0.0001004500000000 ]  - [   0.0021219800000000,  0.0032746700000000, -0.0034642800000000 ]  - [   0.0026833600000000, -0.0051289900000000,  0.0036696600000000 ]  - [   0.0002160700000000, -0.0006631500000000, -0.0016284500000000 ]  - [   0.0000600100000000,  0.0012709700000000, -0.0002901800000000 ]  - [  -0.0000852900000000, -0.0003319900000000,  0.0000144500000000 ]  - [   0.0002585900000000, -0.0001655500000000, -0.0003699500000000 ]  - [   0.0013909100000000,  0.0011767400000000, -0.0013631700000000 ]  - [   0.0012767700000000, -0.0004034500000000,  0.0002491100000000 ]  - [   0.0001201300000000, -0.0001471000000000, -0.0002289500000000 ]  - [   0.0089595700000000, -0.0011359400000000, -0.0040750600000000 ]  - [   0.0001110900000000,  0.0000385100000000,  0.0001355000000000 ]  - [  -0.0007135100000000, -0.0001782900000000,  0.0008514400000000 ]  - [  -0.0041402700000000,  0.0002180000000000, -0.0006721600000000 ]  - [  -0.0025781900000000,  0.0008540100000000,  0.0001494500000000 ]  - [  -0.0006498100000000,  0.0002740000000000, -0.0000991100000000 ]  - [   0.0014933600000000,  0.0023498300000000, -0.0009455400000000 ]  - [   0.0003956400000000,  0.0003458100000000, -0.0004194300000000 ]  - [  -0.0024630200000000,  0.0006113600000000, -0.0001569700000000 ]  - [  -0.0005474900000000,  0.0000441300000000,  0.0000916200000000 ]  - [  -0.0006086900000000,  0.0003815500000000,  0.0003839700000000 ]  - [  -0.0017979800000000,  0.0005358300000000,  0.0001506400000000 ]  - [  -0.0002300300000000, -0.0000762600000000, -0.0000373400000000 ]  - [  -0.0014118100000000,  0.0000640000000000,  0.0002120500000000 ]  - [   0.0001984800000000,  0.0003331900000000, -0.0003980200000000 ]  - [   0.0013351900000000,  0.0016692400000000,  0.0005826900000000 ]  - [  -0.0010407700000000, -0.0008577200000000, -0.0014601400000000 ]  - [  -0.0044773500000000, -0.0004572000000000,  0.0000848600000000 ]  - [   0.0010430600000000,  0.0019826300000000,  0.0006006100000000 ]  - [  -0.0000621700000000, -0.0000289900000000,  0.0000777000000000 ]  - [   0.0019609000000000, -0.0007254400000000,  0.0003670400000000 ]  - [   0.0007989500000000, -0.0004759500000000,  0.0008392800000000 ]  - [   0.0089294600000000, -0.0013857600000000,  0.0052157800000000 ]  - [  -0.0003870800000000, -0.0000187200000000,  0.0006347300000000 ]  - [  -0.0001748900000000,  0.0011605000000000,  0.0002999600000000 ]  - [  -0.0003281400000000, -0.0004485800000000, -0.0000067500000000 ]- atom:    3  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0011171600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0008100200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0242019300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011455300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0086992000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022289500000000 ]  - [  -0.0005000500000000, -0.0005289200000000,  0.0023739800000000 ]  - [   0.0045765500000000,  0.0031022700000000,  0.0028754900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035926200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0073115000000000 ]  - [  -0.0035744100000000,  0.0039986100000000,  0.0030825400000000 ]  - [   0.0000759300000000, -0.0010652000000000,  0.0025908800000000 ]  - [   0.0005000500000000,  0.0005289200000000,  0.0023739800000000 ]  - [  -0.0045765500000000, -0.0031022700000000,  0.0028754900000000 ]  - [   0.0035744100000000, -0.0039986100000000,  0.0030825400000000 ]  - [  -0.0000759300000000,  0.0010652000000000,  0.0025908800000000 ]  - [   0.0000866500000000,  0.0004352800000000, -0.0006565200000000 ]  - [   0.0006862800000000,  0.0014866700000000,  0.0000072800000000 ]  - [   0.0003891200000000, -0.0007575500000000, -0.0016334400000000 ]  - [  -0.0007999800000000, -0.0041675700000000,  0.0041873500000000 ]  - [  -0.0003047600000000,  0.0022559300000000,  0.0014440400000000 ]  - [  -0.0000695200000000, -0.0003251800000000, -0.0009629900000000 ]  - [  -0.0038554600000000,  0.0009345300000000,  0.0050450400000000 ]  - [  -0.0002515800000000, -0.0003299200000000, -0.0008623500000000 ]  - [   0.0006585300000000,  0.0006093400000000, -0.0015678400000000 ]  - [  -0.0019148300000000,  0.0003792100000000,  0.0008199200000000 ]  - [   0.0013762100000000, -0.0004450900000000,  0.0000007700000000 ]  - [   0.0003402400000000,  0.0001461300000000, -0.0006681300000000 ]  - [   0.0001652200000000, -0.0007172500000000,  0.0011148500000000 ]  - [   0.0003059900000000,  0.0006119800000000, -0.0011094900000000 ]  - [  -0.0013762100000000,  0.0004450900000000,  0.0000007700000000 ]  - [  -0.0003402400000000, -0.0001461300000000, -0.0006681300000000 ]  - [   0.0002389600000000,  0.0001513200000000, -0.0007633100000000 ]  - [  -0.0010939500000000,  0.0002928200000000,  0.0014582300000000 ]  - [  -0.0002389600000000, -0.0001513200000000, -0.0007633100000000 ]  - [   0.0010939500000000, -0.0002928200000000,  0.0014582300000000 ]  - [  -0.0003891200000000,  0.0007575500000000, -0.0016334400000000 ]  - [   0.0007999800000000,  0.0041675700000000,  0.0041873500000000 ]  - [  -0.0006585300000000, -0.0006093400000000, -0.0015678400000000 ]  - [   0.0019148300000000, -0.0003792100000000,  0.0008199200000000 ]  - [  -0.0001652200000000,  0.0007172500000000,  0.0011148500000000 ]  - [  -0.0003059900000000, -0.0006119800000000, -0.0011094900000000 ]  - [   0.0003047600000000, -0.0022559300000000,  0.0014440400000000 ]  - [   0.0000695200000000,  0.0003251800000000, -0.0009629900000000 ]  - [   0.0038554600000000, -0.0009345300000000,  0.0050450400000000 ]  - [   0.0002515800000000,  0.0003299200000000, -0.0008623500000000 ]  - [  -0.0000866500000000, -0.0004352800000000, -0.0006565200000000 ]  - [  -0.0006862800000000, -0.0014866700000000,  0.0000072800000000 ]- atom:    5  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [   0.0159056400000000, -0.0038077000000000, -0.0000062300000000 ]  - [   0.0010759200000000, -0.0000322200000000, -0.0000018800000000 ]  - [  -0.0052098800000000, -0.0000818600000000,  0.0000055600000000 ]  - [  -0.0006708800000000, -0.0000407400000000, -0.0000020100000000 ]  - [  -0.2314389800000000,  0.0118309800000000, -0.0015417800000000 ]  - [  -0.0032886900000000,  0.0011692800000000, -0.0006988100000000 ]  - [   0.0091746200000000, -0.0111949100000000, -0.0055568500000000 ]  - [   0.0053094300000000, -0.0079115600000000,  0.0066091700000000 ]  - [   0.0121963700000000, -0.0000000300000000,  0.0007098400000000 ]  - [   0.0152836500000000, -0.0000000600000000,  0.0007081200000000 ]  - [   0.0152810500000000,  0.0540387200000000, -0.0590358900000000 ]  - [   0.0005170300000000,  0.0023801300000000,  0.0038031200000000 ]  - [   0.0085152700000000, -0.0107792800000000,  0.0052575300000000 ]  - [   0.0046378100000000, -0.0075393300000000, -0.0068539900000000 ]  - [   0.0158909900000000,  0.0549633700000000,  0.0596824300000000 ]  - [   0.0009517600000000,  0.0029697800000000, -0.0036077100000000 ]  - [  -0.0012749700000000,  0.0058306800000000, -0.0050471600000000 ]  - [  -0.0008454900000000,  0.0025617700000000,  0.0052451700000000 ]  - [   0.0008936200000000,  0.0010378300000000, -0.0009698900000000 ]  - [   0.0032737800000000, -0.0000117400000000,  0.0019042000000000 ]  - [   0.0451200400000000, -0.0263373500000000, -0.0300768700000000 ]  - [   0.0011386500000000, -0.0005029800000000, -0.0011797300000000 ]  - [  -0.0004805500000000, -0.0119334700000000, -0.0002336200000000 ]  - [  -0.0004718800000000, -0.0003962500000000, -0.0004011500000000 ]  - [  -0.0073713300000000, -0.0056315200000000,  0.0086336100000000 ]  - [  -0.0030076200000000,  0.0002480700000000,  0.0003345700000000 ]  - [  -0.0143028200000000, -0.0024905800000000,  0.0059089700000000 ]  - [  -0.0020156200000000,  0.0001270300000000,  0.0000923500000000 ]  - [   0.0527736000000000, -0.0082638000000000,  0.0161385700000000 ]  - [   0.0007991100000000, -0.0000204500000000, -0.0005086600000000 ]  - [  -0.0140322800000000, -0.0027001100000000, -0.0058857100000000 ]  - [  -0.0019077700000000, -0.0001065400000000, -0.0000982100000000 ]  - [  -0.0024230900000000,  0.0000071800000000,  0.0007964800000000 ]  - [  -0.0052131100000000,  0.0037219600000000,  0.0017653300000000 ]  - [  -0.0020300100000000, -0.0004555400000000, -0.0004144300000000 ]  - [  -0.0048349100000000,  0.0033057700000000, -0.0013843400000000 ]  - [   0.0008756700000000,  0.0015576400000000,  0.0002567100000000 ]  - [   0.0031939300000000,  0.0005447400000000, -0.0027250900000000 ]  - [  -0.0077551600000000, -0.0063378000000000, -0.0092740300000000 ]  - [  -0.0033507300000000, -0.0004379000000000, -0.0009502200000000 ]  - [   0.0561268700000000, -0.0072223200000000, -0.0159105700000000 ]  - [   0.0003504000000000, -0.0003932000000000,  0.0001623200000000 ]  - [   0.0454181600000000, -0.0265527500000000,  0.0305900700000000 ]  - [   0.0018258100000000, -0.0008494900000000,  0.0018045600000000 ]  - [  -0.0009879000000000, -0.0119243700000000,  0.0009359300000000 ]  - [  -0.0009844200000000, -0.0004344100000000,  0.0011605500000000 ]  - [  -0.0015244000000000,  0.0056937000000000,  0.0050487500000000 ]  - [  -0.0011066800000000,  0.0024016100000000, -0.0051890300000000 ]- atom:    5  displacement:    [   0.0000000001998174,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0028611000000000, -0.0048910200000000,  0.0000130200000000 ]  - [  -0.0007542400000000, -0.0014780500000000, -0.0000100000000000 ]  - [  -0.0002851900000000,  0.0139108900000000, -0.0000031300000000 ]  - [   0.0003450400000000,  0.0017923000000000, -0.0000099000000000 ]  - [   0.0119005000000000, -0.3362428800000000, -0.0061425700000000 ]  - [   0.0011695100000000, -0.0086646400000000, -0.0007314500000000 ]  - [  -0.0260275100000000,  0.0045128900000000,  0.0361240600000000 ]  - [  -0.0171276900000000, -0.0059617200000000, -0.0107890800000000 ]  - [   0.0000003700000000,  0.0121953900000000,  0.0006676300000000 ]  - [   0.0000001200000000,  0.0152830600000000,  0.0007220500000000 ]  - [   0.0312227900000000,  0.0241733800000000, -0.0279609100000000 ]  - [  -0.0010360200000000, -0.0009651000000000,  0.0001610800000000 ]  - [  -0.0267074000000000,  0.0049099900000000, -0.0364993300000000 ]  - [  -0.0175004800000000, -0.0054684200000000,  0.0104187600000000 ]  - [   0.0318369900000000,  0.0246190700000000,  0.0283339400000000 ]  - [  -0.0006057400000000, -0.0003787100000000,  0.0000118400000000 ]  - [   0.0039390100000000,  0.0092155100000000,  0.0018259400000000 ]  - [   0.0009281000000000,  0.0071240700000000,  0.0008660600000000 ]  - [  -0.0005119600000000, -0.0000896600000000,  0.0057563500000000 ]  - [   0.0098272100000000,  0.0033468700000000, -0.0130453300000000 ]  - [  -0.0252138600000000,  0.1204138600000000,  0.0809355500000000 ]  - [  -0.0019986700000000,  0.0032032200000000,  0.0034243900000000 ]  - [  -0.0028195600000000, -0.0079049000000000, -0.0009001400000000 ]  - [   0.0003779700000000, -0.0010106500000000,  0.0002875300000000 ]  - [  -0.0024728000000000, -0.0079891400000000,  0.0044995200000000 ]  - [   0.0000373700000000, -0.0031174200000000, -0.0001274900000000 ]  - [  -0.0056317100000000, -0.0007333200000000, -0.0005527900000000 ]  - [   0.0041042400000000,  0.0001853200000000, -0.0004799500000000 ]  - [   0.0117907200000000,  0.0188812500000000,  0.0016684300000000 ]  - [   0.0008561400000000,  0.0016119300000000, -0.0008402500000000 ]  - [  -0.0054724800000000, -0.0009428800000000,  0.0005389300000000 ]  - [   0.0042582300000000, -0.0000480400000000,  0.0004920900000000 ]  - [   0.0066421500000000, -0.0040199300000000, -0.0087899700000000 ]  - [   0.0047436900000000, -0.0038470400000000, -0.0015917100000000 ]  - [   0.0070933500000000, -0.0044856000000000,  0.0092486500000000 ]  - [   0.0050761700000000, -0.0042892600000000,  0.0019317700000000 ]  - [  -0.0005146800000000,  0.0004273700000000, -0.0064350700000000 ]  - [   0.0098898700000000,  0.0040969500000000,  0.0123525200000000 ]  - [  -0.0028307800000000, -0.0086934600000000, -0.0051113000000000 ]  - [  -0.0003153000000000, -0.0037975200000000, -0.0004908800000000 ]  - [   0.0117116800000000,  0.0186758400000000, -0.0018881100000000 ]  - [   0.0004096800000000,  0.0012484600000000,  0.0005088900000000 ]  - [  -0.0227776500000000,  0.1152117600000000, -0.0750384700000000 ]  - [  -0.0013014800000000,  0.0028349400000000, -0.0027575000000000 ]  - [  -0.0033804400000000, -0.0078534000000000,  0.0015602000000000 ]  - [  -0.0001394300000000, -0.0010606100000000,  0.0004949700000000 ]  - [   0.0036901100000000,  0.0090205500000000, -0.0017913500000000 ]  - [   0.0007129600000000,  0.0070384900000000, -0.0008575100000000 ]- atom:    5  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0042501700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035836900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0079798600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029046600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.3114010000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0122468100000000 ]  - [  -0.0146174500000000,  0.0122633500000000,  0.0235547700000000 ]  - [   0.0179648600000000, -0.0051749800000000,  0.0104455100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0094484300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0101494800000000 ]  - [  -0.0278403200000000, -0.0099584200000000, -0.0012766200000000 ]  - [  -0.0005672500000000,  0.0044097200000000,  0.0069945600000000 ]  - [   0.0146174500000000, -0.0122633500000000,  0.0235547700000000 ]  - [  -0.0179648600000000,  0.0051749800000000,  0.0104455100000000 ]  - [   0.0278403200000000,  0.0099584200000000, -0.0012766200000000 ]  - [   0.0005672500000000, -0.0044097200000000,  0.0069945600000000 ]  - [  -0.0036678200000000,  0.0009541400000000, -0.0041135800000000 ]  - [   0.0039248100000000,  0.0009649000000000, -0.0034851300000000 ]  - [   0.0026316900000000, -0.0004877100000000, -0.0045059800000000 ]  - [   0.0094903500000000, -0.0042081900000000, -0.0065300900000000 ]  - [  -0.0294994200000000,  0.0827610200000000,  0.1060530700000000 ]  - [   0.0011108800000000, -0.0012312900000000, -0.0050579400000000 ]  - [   0.0039444600000000,  0.0021543700000000,  0.0041667400000000 ]  - [  -0.0006602800000000, -0.0023404400000000, -0.0038311700000000 ]  - [   0.0014420300000000,  0.0001293900000000, -0.0036368900000000 ]  - [  -0.0012870800000000,  0.0012466700000000,  0.0019715800000000 ]  - [  -0.0005307800000000, -0.0018841200000000,  0.0053416300000000 ]  - [   0.0032344800000000, -0.0009051300000000, -0.0026409200000000 ]  - [  -0.0078422600000000, -0.0106773300000000,  0.0343989100000000 ]  - [   0.0005470100000000,  0.0012434300000000, -0.0036455100000000 ]  - [   0.0005307800000000,  0.0018841200000000,  0.0053416300000000 ]  - [  -0.0032344800000000,  0.0009051300000000, -0.0026409200000000 ]  - [   0.0038570400000000, -0.0011253000000000, -0.0060500400000000 ]  - [  -0.0043616100000000,  0.0026580200000000,  0.0046455700000000 ]  - [  -0.0038570400000000,  0.0011253000000000, -0.0060500400000000 ]  - [   0.0043616100000000, -0.0026580200000000,  0.0046455700000000 ]  - [  -0.0026316900000000,  0.0004877100000000, -0.0045059800000000 ]  - [  -0.0094903500000000,  0.0042081900000000, -0.0065300900000000 ]  - [  -0.0014420300000000, -0.0001293900000000, -0.0036368900000000 ]  - [   0.0012870800000000, -0.0012466700000000,  0.0019715800000000 ]  - [   0.0078422600000000,  0.0106773300000000,  0.0343989100000000 ]  - [  -0.0005470100000000, -0.0012434300000000, -0.0036455100000000 ]  - [   0.0294994200000000, -0.0827610200000000,  0.1060530700000000 ]  - [  -0.0011108800000000,  0.0012312900000000, -0.0050579400000000 ]  - [  -0.0039444600000000, -0.0021543700000000,  0.0041667400000000 ]  - [   0.0006602800000000,  0.0023404400000000, -0.0038311700000000 ]  - [   0.0036678200000000, -0.0009541400000000, -0.0041135800000000 ]  - [  -0.0039248100000000, -0.0009649000000000, -0.0034851300000000 ]- atom:    5  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0042962700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035987100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0080316700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029222700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.3034387200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0136873700000000 ]  - [   0.0151550600000000, -0.0125722100000000, -0.0239333400000000 ]  - [  -0.0175567800000000,  0.0048352300000000, -0.0107547800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0081452500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0116215000000000 ]  - [   0.0273805800000000,  0.0093920800000000,  0.0012760500000000 ]  - [   0.0001230300000000, -0.0050318900000000, -0.0067990500000000 ]  - [  -0.0151550600000000,  0.0125722100000000, -0.0239333400000000 ]  - [   0.0175567800000000, -0.0048352300000000, -0.0107547800000000 ]  - [  -0.0273805800000000, -0.0093920800000000,  0.0012760500000000 ]  - [  -0.0001230300000000,  0.0050318900000000, -0.0067990500000000 ]  - [   0.0038620400000000, -0.0008126500000000,  0.0041406900000000 ]  - [  -0.0037296000000000, -0.0008221300000000,  0.0035196200000000 ]  - [  -0.0026237900000000,  0.0000100600000000,  0.0037771000000000 ]  - [  -0.0094903600000000,  0.0036415700000000,  0.0057124300000000 ]  - [   0.0274357200000000, -0.0778087200000000, -0.1019523100000000 ]  - [  -0.0018015000000000,  0.0015746300000000,  0.0057110400000000 ]  - [  -0.0034578900000000, -0.0021762100000000, -0.0034159800000000 ]  - [   0.0011686200000000,  0.0024108500000000,  0.0046238300000000 ]  - [  -0.0011154300000000,  0.0005424000000000,  0.0030625700000000 ]  - [   0.0016413400000000, -0.0005706800000000, -0.0026167500000000 ]  - [   0.0003253500000000,  0.0021103900000000, -0.0053308700000000 ]  - [  -0.0033668200000000,  0.0011491100000000,  0.0026440600000000 ]  - [   0.0081334200000000,  0.0109194000000000, -0.0346310700000000 ]  - [  -0.0000886600000000, -0.0008676300000000,  0.0033115900000000 ]  - [  -0.0003253500000000, -0.0021103900000000, -0.0053308700000000 ]  - [   0.0033668200000000, -0.0011491100000000,  0.0026440600000000 ]  - [  -0.0042743900000000,  0.0015758100000000,  0.0064746800000000 ]  - [   0.0040214700000000, -0.0022161600000000, -0.0043367900000000 ]  - [   0.0042743900000000, -0.0015758100000000,  0.0064746800000000 ]  - [  -0.0040214700000000,  0.0022161600000000, -0.0043367900000000 ]  - [   0.0026237900000000, -0.0000100600000000,  0.0037771000000000 ]  - [   0.0094903600000000, -0.0036415700000000,  0.0057124300000000 ]  - [   0.0011154300000000, -0.0005424000000000,  0.0030625700000000 ]  - [  -0.0016413400000000,  0.0005706800000000, -0.0026167500000000 ]  - [  -0.0081334200000000, -0.0109194000000000, -0.0346310700000000 ]  - [   0.0000886600000000,  0.0008676300000000,  0.0033115900000000 ]  - [  -0.0274357200000000,  0.0778087200000000, -0.1019523100000000 ]  - [   0.0018015000000000, -0.0015746300000000,  0.0057110400000000 ]  - [   0.0034578900000000,  0.0021762100000000, -0.0034159800000000 ]  - [  -0.0011686200000000, -0.0024108500000000,  0.0046238300000000 ]  - [  -0.0038620400000000,  0.0008126500000000,  0.0041406900000000 ]  - [   0.0037296000000000,  0.0008221300000000,  0.0035196200000000 ]- atom:    7  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [   0.0000337400000000,  0.0014450000000000,  0.0022417200000000 ]  - [   0.0019228500000000,  0.0049472000000000, -0.0050264900000000 ]  - [   0.0006458000000000,  0.0009488000000000, -0.0007909100000000 ]  - [   0.0024377400000000,  0.0054314400000000,  0.0043075200000000 ]  - [   0.0088664500000000, -0.0265276600000000, -0.0157073800000000 ]  - [   0.0049279300000000, -0.0172518100000000,  0.0169953500000000 ]  - [  -0.3226010600000000, -0.0392964400000000, -0.0761658500000000 ]  - [  -0.0059225600000000,  0.0006578700000000,  0.0007971900000000 ]  - [   0.0244528200000000, -0.0544205000000000, -0.0088390700000000 ]  - [  -0.0006499700000000, -0.0026512500000000,  0.0053738300000000 ]  - [  -0.0065842300000000, -0.0049224700000000,  0.0113911700000000 ]  - [  -0.0024083500000000, -0.0034616400000000,  0.0002785100000000 ]  - [   0.0145671200000000, -0.0021945200000000,  0.0073846200000000 ]  - [   0.0056723700000000,  0.0001148100000000,  0.0012516500000000 ]  - [   0.0579580700000000,  0.0049771200000000,  0.0049821700000000 ]  - [   0.0044091600000000,  0.0034663400000000,  0.0011760900000000 ]  - [  -0.0054529100000000,  0.0002063300000000, -0.0008369400000000 ]  - [  -0.0008828000000000, -0.0010900800000000,  0.0000057500000000 ]  - [  -0.0048754900000000, -0.0001017700000000,  0.0022381000000000 ]  - [  -0.0022524300000000,  0.0019794600000000,  0.0017317000000000 ]  - [  -0.0019919300000000,  0.0118696800000000,  0.0125438100000000 ]  - [  -0.0009501400000000,  0.0009609700000000, -0.0042772200000000 ]  - [   0.0025425500000000, -0.0013118500000000, -0.0014471800000000 ]  - [   0.0028730700000000,  0.0009560900000000,  0.0021126100000000 ]  - [   0.0088389300000000,  0.0105013000000000, -0.0048888900000000 ]  - [   0.0009593100000000,  0.0005457500000000, -0.0013883400000000 ]  - [   0.0010937900000000,  0.0005448300000000, -0.0008414100000000 ]  - [   0.0001007600000000,  0.0006920400000000,  0.0011049600000000 ]  - [   0.0043044000000000,  0.0048080100000000, -0.0034079400000000 ]  - [   0.0037797500000000,  0.0012357000000000, -0.0008986200000000 ]  - [  -0.0154968000000000,  0.0034034900000000,  0.0006688600000000 ]  - [  -0.0015683300000000, -0.0004880900000000,  0.0024394500000000 ]  - [   0.0479723900000000,  0.0198542700000000, -0.0405616500000000 ]  - [   0.0016420900000000, -0.0002181500000000, -0.0017312300000000 ]  - [  -0.0085210700000000,  0.0092562700000000, -0.0093515600000000 ]  - [  -0.0014689800000000,  0.0007564700000000, -0.0015904600000000 ]  - [   0.1859571800000000,  0.0246434200000000,  0.1216119800000000 ]  - [   0.0018224900000000, -0.0003143900000000,  0.0021052000000000 ]  - [  -0.0099126300000000,  0.0040037900000000, -0.0030727200000000 ]  - [  -0.0007491600000000,  0.0000655900000000, -0.0010923400000000 ]  - [  -0.0126056900000000, -0.0045180600000000, -0.0035790700000000 ]  - [  -0.0039600400000000, -0.0025879500000000, -0.0021636200000000 ]  - [  -0.0019841800000000,  0.0063714000000000, -0.0051803600000000 ]  - [  -0.0008218800000000,  0.0035749200000000, -0.0054449500000000 ]  - [  -0.0066828600000000,  0.0042926500000000, -0.0032257800000000 ]  - [  -0.0031990100000000, -0.0015228200000000,  0.0017826100000000 ]  - [   0.0330752200000000,  0.0297916800000000, -0.0028730700000000 ]  - [   0.0006865500000000,  0.0005767300000000, -0.0001418100000000 ]- atom:    7  displacement:    [  -0.0100000000000000,  0.0000000001998174,  0.0000000000000000 ]  forces:  - [  -0.0000260500000000, -0.0014727900000000, -0.0022750100000000 ]  - [  -0.0019077900000000, -0.0049699000000000,  0.0050700900000000 ]  - [  -0.0006631600000000, -0.0009348600000000,  0.0007745300000000 ]  - [  -0.0024350500000000, -0.0054205500000000, -0.0042656600000000 ]  - [  -0.0088235900000000,  0.0262076200000000,  0.0140710600000000 ]  - [  -0.0050188000000000,  0.0173750900000000, -0.0185277500000000 ]  - [   0.3168219300000000,  0.0359798800000000,  0.0664784100000000 ]  - [   0.0065136900000000, -0.0011238600000000, -0.0010879500000000 ]  - [  -0.0243404800000000,  0.0545810700000000,  0.0105071900000000 ]  - [   0.0006929700000000,  0.0026987100000000, -0.0040683700000000 ]  - [   0.0061621800000000,  0.0044077600000000, -0.0109626900000000 ]  - [   0.0019919700000000,  0.0029093500000000, -0.0001023400000000 ]  - [  -0.0151163600000000,  0.0025525200000000, -0.0075529000000000 ]  - [  -0.0062683300000000,  0.0003390700000000, -0.0015437400000000 ]  - [  -0.0580363600000000, -0.0043529500000000, -0.0047832800000000 ]  - [  -0.0039750600000000, -0.0029048100000000, -0.0009975400000000 ]  - [   0.0056908600000000,  0.0000260700000000,  0.0008249100000000 ]  - [   0.0011151900000000,  0.0011994500000000,  0.0000216600000000 ]  - [   0.0049311400000000, -0.0004139300000000, -0.0030275800000000 ]  - [   0.0022720700000000, -0.0024814300000000, -0.0024469100000000 ]  - [   0.0014956500000000, -0.0114320100000000, -0.0118998500000000 ]  - [   0.0002607900000000, -0.0005987100000000,  0.0049647500000000 ]  - [  -0.0020435700000000,  0.0013187500000000,  0.0021339200000000 ]  - [  -0.0023634900000000, -0.0009264100000000, -0.0013527500000000 ]  - [  -0.0085670700000000, -0.0098108000000000,  0.0042974300000000 ]  - [  -0.0006342300000000,  0.0001250400000000,  0.0008030400000000 ]  - [  -0.0012441300000000, -0.0003038900000000,  0.0008084800000000 ]  - [  -0.0002278400000000, -0.0004588400000000, -0.0011090900000000 ]  - [  -0.0038081700000000, -0.0043747000000000,  0.0029942100000000 ]  - [  -0.0033446900000000, -0.0008806800000000,  0.0005741100000000 ]  - [   0.0154095000000000, -0.0037411400000000, -0.0008571000000000 ]  - [   0.0016919000000000,  0.0002545000000000, -0.0024306600000000 ]  - [  -0.0501190600000000, -0.0189670500000000,  0.0432958500000000 ]  - [  -0.0020377000000000,  0.0006661600000000,  0.0021237400000000 ]  - [   0.0088123500000000, -0.0096460000000000,  0.0096460400000000 ]  - [   0.0018567200000000, -0.0012122000000000,  0.0019714800000000 ]  - [  -0.1778347200000000, -0.0226673000000000, -0.1150135400000000 ]  - [  -0.0018422800000000,  0.0008266000000000, -0.0028182500000000 ]  - [   0.0095084100000000, -0.0047582200000000,  0.0023333800000000 ]  - [   0.0004060600000000, -0.0007483200000000,  0.0004978400000000 ]  - [   0.0122374600000000,  0.0041562400000000,  0.0032458000000000 ]  - [   0.0035331400000000,  0.0022308200000000,  0.0018242600000000 ]  - [   0.0026869600000000, -0.0066850100000000,  0.0057929000000000 ]  - [   0.0015426300000000, -0.0040022600000000,  0.0061761400000000 ]  - [   0.0061787700000000, -0.0043564400000000,  0.0040212000000000 ]  - [   0.0026947300000000,  0.0014987000000000, -0.0010308900000000 ]  - [  -0.0329090400000000, -0.0290301900000000,  0.0027361900000000 ]  - [  -0.0009200900000000, -0.0006781800000000,  0.0001652300000000 ]- atom:    7  displacement:    [   0.0000000001998174,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0009875500000000, -0.0001667700000000,  0.0016397700000000 ]  - [   0.0052746200000000, -0.0003634600000000, -0.0064147800000000 ]  - [   0.0000616900000000, -0.0000037000000000, -0.0003047700000000 ]  - [   0.0030556900000000,  0.0024535000000000,  0.0033564200000000 ]  - [  -0.0109287400000000,  0.0048178100000000,  0.0117082000000000 ]  - [  -0.0077110200000000, -0.0056504200000000, -0.0057175200000000 ]  - [  -0.0361367000000000, -0.3557214400000000,  0.0097154400000000 ]  - [   0.0011859100000000, -0.0001339400000000,  0.0019082200000000 ]  - [  -0.0317459400000000,  0.0154000300000000,  0.0285597700000000 ]  - [   0.0008085100000000,  0.0007218300000000,  0.0010253100000000 ]  - [   0.0030519500000000,  0.0578092000000000,  0.0088542700000000 ]  - [  -0.0000418800000000,  0.0039034500000000,  0.0008995700000000 ]  - [  -0.0026741200000000,  0.0076463900000000, -0.0057469900000000 ]  - [  -0.0004138300000000, -0.0001885700000000,  0.0012744100000000 ]  - [  -0.0030351100000000, -0.0060883800000000, -0.0051366500000000 ]  - [   0.0000402700000000, -0.0019252100000000,  0.0018873300000000 ]  - [  -0.0012906600000000, -0.0014724900000000,  0.0003384600000000 ]  - [   0.0002301000000000,  0.0007977900000000, -0.0004427300000000 ]  - [   0.0007019600000000, -0.0024379900000000,  0.0011958700000000 ]  - [   0.0006621300000000, -0.0006156100000000, -0.0015148100000000 ]  - [   0.0015008000000000,  0.0089459800000000, -0.0021119100000000 ]  - [  -0.0001862300000000,  0.0012794700000000, -0.0004957400000000 ]  - [   0.0000200700000000, -0.0107901900000000, -0.0045381300000000 ]  - [   0.0001785700000000, -0.0026703700000000, -0.0028932400000000 ]  - [   0.0073422100000000, -0.0096157300000000, -0.0007742400000000 ]  - [  -0.0001157500000000,  0.0001284000000000, -0.0004423300000000 ]  - [  -0.0014225100000000, -0.0064822300000000, -0.0010013100000000 ]  - [   0.0003379900000000, -0.0002615500000000, -0.0001255400000000 ]  - [   0.0026236400000000, -0.0067032000000000, -0.0025762900000000 ]  - [   0.0012525600000000, -0.0019841000000000,  0.0025754000000000 ]  - [   0.0045743700000000,  0.0052991100000000,  0.0012483200000000 ]  - [   0.0000849000000000,  0.0005075000000000, -0.0016344000000000 ]  - [  -0.0012367000000000,  0.0185148500000000,  0.0014673600000000 ]  - [  -0.0003470200000000,  0.0003180600000000, -0.0001204000000000 ]  - [   0.0044245300000000, -0.0050506700000000,  0.0011179600000000 ]  - [  -0.0000641400000000, -0.0003761800000000, -0.0003943800000000 ]  - [   0.0239459700000000,  0.0375203900000000,  0.0155533500000000 ]  - [  -0.0007170100000000,  0.0005680100000000, -0.0019317500000000 ]  - [   0.0059925800000000, -0.0009172600000000,  0.0028128000000000 ]  - [  -0.0005834600000000, -0.0007646500000000, -0.0011098300000000 ]  - [   0.0031649200000000,  0.0022605800000000,  0.0021318700000000 ]  - [   0.0010063600000000,  0.0013976300000000,  0.0007629900000000 ]  - [   0.0027394200000000, -0.0024234300000000,  0.0002686300000000 ]  - [   0.0003037600000000,  0.0007144400000000, -0.0010061700000000 ]  - [  -0.0006790100000000,  0.0007535400000000,  0.0008975800000000 ]  - [   0.0007030900000000,  0.0009968100000000, -0.0017933500000000 ]  - [   0.0232178600000000,  0.2503882500000000, -0.0525051600000000 ]  - [  -0.0001441500000000, -0.0003354600000000, -0.0004668600000000 ]- atom:    7  displacement:    [  -0.0000000001998174, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0009979900000000,  0.0001796400000000, -0.0016485000000000 ]  - [  -0.0053341400000000,  0.0003725200000000,  0.0064821000000000 ]  - [  -0.0000518800000000, -0.0000043500000000,  0.0002998900000000 ]  - [  -0.0030242500000000, -0.0024682600000000, -0.0033180900000000 ]  - [   0.0110428100000000, -0.0046073000000000, -0.0131242800000000 ]  - [   0.0077403000000000,  0.0057797300000000,  0.0042939900000000 ]  - [   0.0391641500000000,  0.3730357300000000, -0.0127795400000000 ]  - [  -0.0005938500000000, -0.0003049000000000, -0.0021388500000000 ]  - [   0.0313117500000000, -0.0157705500000000, -0.0266668000000000 ]  - [  -0.0008343200000000, -0.0007463800000000,  0.0003321000000000 ]  - [  -0.0034209900000000, -0.0581829100000000, -0.0086374400000000 ]  - [  -0.0004077100000000, -0.0044804500000000, -0.0006471600000000 ]  - [   0.0020736000000000, -0.0071936900000000,  0.0055005200000000 ]  - [  -0.0001911500000000,  0.0006354900000000, -0.0015021000000000 ]  - [   0.0034350000000000,  0.0066625100000000,  0.0053314700000000 ]  - [   0.0004032000000000,  0.0024764100000000, -0.0016730400000000 ]  - [   0.0015347000000000,  0.0015687000000000, -0.0003274900000000 ]  - [   0.0000066800000000, -0.0006850300000000,  0.0004525600000000 ]  - [  -0.0006756400000000,  0.0019183100000000, -0.0019632300000000 ]  - [  -0.0006102400000000,  0.0000978200000000,  0.0007500600000000 ]  - [  -0.0020632500000000, -0.0087839600000000,  0.0026198800000000 ]  - [  -0.0004964600000000, -0.0009510700000000,  0.0011299100000000 ]  - [   0.0004905100000000,  0.0107395400000000,  0.0052503800000000 ]  - [   0.0003342900000000,  0.0027051900000000,  0.0036225100000000 ]  - [  -0.0068464600000000,  0.0104843600000000,  0.0001278800000000 ]  - [   0.0004602400000000,  0.0005629200000000, -0.0001752100000000 ]  - [   0.0012758100000000,  0.0066905000000000,  0.0009913500000000 ]  - [  -0.0004417100000000,  0.0004950600000000,  0.0001132300000000 ]  - [  -0.0022342500000000,  0.0070655200000000,  0.0022910300000000 ]  - [  -0.0008290800000000,  0.0023741900000000, -0.0029759300000000 ]  - [  -0.0044170500000000, -0.0055202600000000, -0.0012290600000000 ]  - [   0.0000237900000000, -0.0007397600000000,  0.0016286400000000 ]  - [   0.0010505200000000, -0.0180830700000000, -0.0014721700000000 ]  - [  -0.0000332100000000,  0.0001380000000000,  0.0004701700000000 ]  - [  -0.0040392800000000,  0.0046472400000000, -0.0008245700000000 ]  - [   0.0004481300000000, -0.0000777300000000,  0.0007530500000000 ]  - [  -0.0246055400000000, -0.0376594600000000, -0.0167121300000000 ]  - [   0.0006666800000000, -0.0000606000000000,  0.0011659200000000 ]  - [  -0.0062725700000000,  0.0003157100000000, -0.0034128100000000 ]  - [   0.0002542100000000,  0.0000855800000000,  0.0005037000000000 ]  - [  -0.0035882400000000, -0.0026769800000000, -0.0025034700000000 ]  - [  -0.0014461000000000, -0.0017687300000000, -0.0011055100000000 ]  - [  -0.0020778100000000,  0.0020597800000000,  0.0003968500000000 ]  - [   0.0003838200000000, -0.0010966300000000,  0.0016678600000000 ]  - [   0.0001508600000000, -0.0007545000000000, -0.0001478100000000 ]  - [  -0.0011880100000000, -0.0010167000000000,  0.0025315200000000 ]  - [  -0.0254364800000000, -0.2676715600000000,  0.0557995900000000 ]  - [  -0.0000933500000000,  0.0002143800000000,  0.0004790100000000 ]- atom:    7  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0005020000000000,  0.0019039000000000,  0.0030491300000000 ]  - [  -0.0031488900000000, -0.0052913500000000,  0.0024280000000000 ]  - [  -0.0002089900000000, -0.0017201300000000,  0.0024797800000000 ]  - [   0.0033644900000000,  0.0035777200000000,  0.0029787700000000 ]  - [  -0.0053461100000000,  0.0361750900000000,  0.0229117500000000 ]  - [   0.0067752800000000, -0.0106363800000000,  0.0098556100000000 ]  - [  -0.0720755400000000,  0.0100957800000000, -0.2745673700000000 ]  - [   0.0012337400000000,  0.0018134000000000,  0.0103793700000000 ]  - [  -0.0281762400000000,  0.0594735000000000, -0.0005477400000000 ]  - [   0.0000702600000000, -0.0036899200000000,  0.0076060900000000 ]  - [   0.0050128800000000,  0.0046250900000000, -0.0226676000000000 ]  - [  -0.0019927100000000,  0.0007861100000000,  0.0080564200000000 ]  - [  -0.0077547700000000,  0.0058252100000000, -0.0154940600000000 ]  - [  -0.0016936400000000, -0.0011799500000000,  0.0074786200000000 ]  - [   0.0089236300000000, -0.0108554900000000, -0.0227443600000000 ]  - [   0.0009821400000000,  0.0001104600000000,  0.0080417600000000 ]  - [   0.0011390800000000, -0.0050506500000000,  0.0047091900000000 ]  - [   0.0005141700000000,  0.0016622400000000, -0.0022577300000000 ]  - [  -0.0007321200000000, -0.0012606000000000,  0.0027044300000000 ]  - [   0.0028773300000000, -0.0023073100000000, -0.0054189800000000 ]  - [   0.0035898800000000, -0.0142944600000000, -0.0096498300000000 ]  - [  -0.0006143000000000, -0.0001742400000000, -0.0034406400000000 ]  - [  -0.0007107700000000,  0.0064608100000000,  0.0046779400000000 ]  - [  -0.0001808100000000, -0.0029009900000000, -0.0038437900000000 ]  - [  -0.0047846600000000, -0.0078183400000000,  0.0146899400000000 ]  - [   0.0016957600000000,  0.0017914800000000, -0.0039417500000000 ]  - [  -0.0025609800000000, -0.0007837400000000,  0.0034827400000000 ]  - [   0.0019785400000000, -0.0004120300000000, -0.0019568700000000 ]  - [  -0.0031167200000000, -0.0088029200000000,  0.0047605300000000 ]  - [   0.0004532300000000,  0.0018925100000000, -0.0020387800000000 ]  - [  -0.0117867200000000,  0.0029269900000000,  0.0093686900000000 ]  - [  -0.0013558900000000, -0.0001140600000000, -0.0028120300000000 ]  - [  -0.0340231000000000, -0.0234711500000000,  0.0769240700000000 ]  - [   0.0004089200000000,  0.0010549000000000, -0.0037278100000000 ]  - [   0.0096859200000000, -0.0097626500000000,  0.0113227000000000 ]  - [  -0.0007379000000000, -0.0000673700000000, -0.0021521800000000 ]  - [   0.1211789000000000,  0.0146784900000000,  0.1233616000000000 ]  - [  -0.0022304300000000,  0.0008047200000000, -0.0060105100000000 ]  - [   0.0102585500000000, -0.0030121700000000,  0.0114737400000000 ]  - [  -0.0011928600000000, -0.0010857000000000, -0.0035101300000000 ]  - [   0.0042419400000000, -0.0027830500000000, -0.0013488800000000 ]  - [  -0.0001994600000000, -0.0010448400000000, -0.0027869700000000 ]  - [   0.0032332800000000, -0.0096253900000000,  0.0077791000000000 ]  - [  -0.0013530200000000,  0.0024110000000000, -0.0043137100000000 ]  - [  -0.0013557800000000,  0.0053041300000000, -0.0007032600000000 ]  - [   0.0003212500000000,  0.0012862800000000, -0.0027930300000000 ]  - [  -0.0006745800000000, -0.0343183300000000,  0.0404318200000000 ]  - [  -0.0004341800000000, -0.0021965700000000, -0.0022237900000000 ]- atom:    7  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0005111100000000, -0.0019179500000000, -0.0030520000000000 ]  - [   0.0031033000000000,  0.0052499200000000, -0.0024362400000000 ]  - [   0.0002126300000000,  0.0017371300000000, -0.0024847400000000 ]  - [  -0.0033286900000000, -0.0035432200000000, -0.0029853300000000 ]  - [   0.0054664800000000, -0.0364450200000000, -0.0245561300000000 ]  - [  -0.0066871300000000,  0.0105750700000000, -0.0113269900000000 ]  - [   0.0704792500000000, -0.0123094100000000,  0.2693909100000000 ]  - [  -0.0006615400000000, -0.0022469900000000, -0.0106201700000000 ]  - [   0.0281168200000000, -0.0592342300000000,  0.0019834100000000 ]  - [  -0.0000798900000000,  0.0037230900000000, -0.0062064800000000 ]  - [  -0.0054682200000000, -0.0051329900000000,  0.0231891200000000 ]  - [   0.0015523600000000, -0.0013809200000000, -0.0078208200000000 ]  - [   0.0071960400000000, -0.0054074700000000,  0.0152853300000000 ]  - [   0.0011132200000000,  0.0016090300000000, -0.0077280700000000 ]  - [  -0.0085566400000000,  0.0114911200000000,  0.0231130800000000 ]  - [  -0.0005514600000000,  0.0004839500000000, -0.0078365600000000 ]  - [  -0.0009108700000000,  0.0052060700000000, -0.0047027700000000 ]  - [  -0.0002798200000000, -0.0015385700000000,  0.0022807100000000 ]  - [   0.0007880300000000,  0.0007596100000000, -0.0034694500000000 ]  - [  -0.0028285100000000,  0.0018103200000000,  0.0046569200000000 ]  - [  -0.0040303600000000,  0.0146310800000000,  0.0100413500000000 ]  - [  -0.0001002900000000,  0.0005568100000000,  0.0040576200000000 ]  - [   0.0012112400000000, -0.0064912000000000, -0.0040063700000000 ]  - [   0.0006983900000000,  0.0029441600000000,  0.0046234600000000 ]  - [   0.0050615300000000,  0.0085836200000000, -0.0152149700000000 ]  - [  -0.0013455700000000, -0.0011125200000000,  0.0033260000000000 ]  - [   0.0024224000000000,  0.0010118200000000, -0.0035381200000000 ]  - [  -0.0020962300000000,  0.0006489600000000,  0.0019446000000000 ]  - [   0.0035728000000000,  0.0092609200000000, -0.0051673000000000 ]  - [  -0.0000146900000000, -0.0014916700000000,  0.0016752100000000 ]  - [   0.0118305800000000, -0.0031768300000000, -0.0095565600000000 ]  - [   0.0015034500000000, -0.0001275400000000,  0.0028079800000000 ]  - [   0.0307671100000000,  0.0244220500000000, -0.0733146200000000 ]  - [  -0.0007767600000000, -0.0006189500000000,  0.0041025200000000 ]  - [  -0.0093577200000000,  0.0093362300000000, -0.0109742300000000 ]  - [   0.0011187100000000, -0.0003824000000000,  0.0025128900000000 ]  - [  -0.1163297800000000, -0.0134817700000000, -0.1217157800000000 ]  - [   0.0021709300000000, -0.0002985700000000,  0.0052514300000000 ]  - [  -0.0106443300000000,  0.0022894000000000, -0.0121521200000000 ]  - [   0.0008466500000000,  0.0003989000000000,  0.0028981200000000 ]  - [  -0.0047121500000000,  0.0023820700000000,  0.0009671300000000 ]  - [  -0.0002503000000000,  0.0006675000000000,  0.0024416900000000 ]  - [  -0.0025453700000000,  0.0093104400000000, -0.0071798900000000 ]  - [   0.0020406600000000, -0.0027808400000000,  0.0049664700000000 ]  - [   0.0008406000000000, -0.0053515200000000,  0.0014596200000000 ]  - [  -0.0008295100000000, -0.0013443100000000,  0.0035808600000000 ]  - [   0.0005813300000000,  0.0346430400000000, -0.0407529500000000 ]  - [   0.0002024300000000,  0.0020825900000000,  0.0022422400000000 ]- atom:   17  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [  -0.0000716200000000, -0.0000421000000000,  0.0006283900000000 ]  - [  -0.0002804200000000, -0.0001696000000000, -0.0021546700000000 ]  - [  -0.0000559300000000, -0.0001587600000000, -0.0000293400000000 ]  - [  -0.0002073400000000, -0.0007373000000000,  0.0005683700000000 ]  - [  -0.0014045600000000,  0.0038153300000000, -0.0044400800000000 ]  - [  -0.0009825100000000,  0.0008333500000000,  0.0031517300000000 ]  - [  -0.0052753800000000, -0.0016489600000000,  0.0009031500000000 ]  - [  -0.0007119600000000, -0.0001097800000000,  0.0002891000000000 ]  - [  -0.0008215700000000,  0.0025759000000000,  0.0026885200000000 ]  - [   0.0000641600000000, -0.0000102700000000,  0.0017127700000000 ]  - [  -0.0068174000000000, -0.0007055500000000,  0.0010021400000000 ]  - [  -0.0006024400000000, -0.0008612100000000,  0.0006433700000000 ]  - [   0.0328786900000000,  0.0250635700000000,  0.0006259400000000 ]  - [   0.0005149700000000,  0.0001930400000000,  0.0002107100000000 ]  - [   0.0056176000000000, -0.0033450000000000,  0.0032283200000000 ]  - [   0.0008458400000000,  0.0006596000000000,  0.0001210100000000 ]  - [  -0.0368734100000000, -0.0277496800000000, -0.0068086500000000 ]  - [   0.0000175700000000, -0.0000449200000000, -0.0000260200000000 ]  - [   0.0005872000000000,  0.0157203400000000,  0.0009224900000000 ]  - [  -0.0002241600000000, -0.0001920400000000, -0.0000315600000000 ]  - [   0.0006435100000000, -0.0011700900000000,  0.0000021500000000 ]  - [  -0.0002584500000000, -0.0004498100000000, -0.0008236800000000 ]  - [   0.0014098500000000, -0.0005011100000000, -0.0001956500000000 ]  - [   0.0006473600000000,  0.0002894300000000,  0.0004857500000000 ]  - [   0.0008225700000000,  0.0005674100000000, -0.0005542900000000 ]  - [   0.0003147600000000,  0.0003626300000000, -0.0005568700000000 ]  - [   0.0031815000000000, -0.0030869400000000, -0.0015600200000000 ]  - [   0.0002014300000000,  0.0001432000000000,  0.0000433600000000 ]  - [   0.0013677800000000,  0.0003384100000000, -0.0005183700000000 ]  - [   0.0012866100000000,  0.0008784500000000, -0.0008912500000000 ]  - [  -0.0005324300000000,  0.0030783400000000, -0.0015803000000000 ]  - [  -0.0001361600000000, -0.0001447300000000,  0.0002949200000000 ]  - [   0.0018841500000000,  0.0000161900000000, -0.0013797500000000 ]  - [   0.0001358000000000,  0.0001115600000000, -0.0002333900000000 ]  - [   0.0005996200000000, -0.0138855400000000,  0.0017518700000000 ]  - [  -0.0001271300000000, -0.0001051300000000, -0.0001973800000000 ]  - [   0.0019584400000000, -0.0000565800000000,  0.0004265800000000 ]  - [   0.0002245600000000,  0.0000505200000000, -0.0002445400000000 ]  - [  -0.0017868300000000, -0.0007076300000000, -0.0015777600000000 ]  - [  -0.0003086400000000, -0.0003386900000000, -0.0005201900000000 ]  - [  -0.0018631000000000, -0.0012227400000000, -0.0005599600000000 ]  - [  -0.0014734100000000, -0.0005887800000000, -0.0003352500000000 ]  - [   0.0040875700000000,  0.0023738600000000,  0.0057504800000000 ]  - [   0.0002475600000000, -0.0000356500000000, -0.0002310400000000 ]  - [  -0.0007339600000000,  0.0004161400000000,  0.0000538400000000 ]  - [  -0.0006868600000000,  0.0000200400000000,  0.0004983400000000 ]  - [   0.0026823200000000,  0.0005442500000000, -0.0005052200000000 ]  - [   0.0000142800000000,  0.0000170300000000, -0.0000480700000000 ]- atom:   17  displacement:    [  -0.0100000000000000,  0.0000000001998174,  0.0000000000000000 ]  forces:  - [   0.0000716400000000,  0.0000414100000000, -0.0006258000000000 ]  - [   0.0003257000000000,  0.0001705800000000,  0.0022090200000000 ]  - [   0.0000569400000000,  0.0001590000000000,  0.0000300900000000 ]  - [   0.0002044000000000,  0.0007287000000000, -0.0005622200000000 ]  - [   0.0013946700000000, -0.0038135700000000,  0.0030862600000000 ]  - [   0.0009706500000000, -0.0008058200000000, -0.0045050000000000 ]  - [   0.0058729500000000,  0.0011767300000000, -0.0011457000000000 ]  - [   0.0012908600000000, -0.0003330300000000, -0.0005039200000000 ]  - [   0.0008560300000000, -0.0026136200000000, -0.0013023500000000 ]  - [  -0.0000724700000000,  0.0000109700000000, -0.0003394500000000 ]  - [   0.0063579800000000,  0.0001410800000000, -0.0007962200000000 ]  - [   0.0001555300000000,  0.0002885000000000, -0.0004189300000000 ]  - [  -0.0331082000000000, -0.0235372700000000, -0.0006295100000000 ]  - [  -0.0010930500000000,  0.0002431400000000, -0.0004246900000000 ]  - [  -0.0052029800000000,  0.0037994000000000, -0.0028772100000000 ]  - [  -0.0004017000000000, -0.0000813600000000,  0.0001056200000000 ]  - [   0.0368121300000000,  0.0271885800000000,  0.0064665000000000 ]  - [   0.0002180200000000,  0.0001552800000000,  0.0000362700000000 ]  - [  -0.0005786000000000, -0.0164760900000000, -0.0016401400000000 ]  - [   0.0002843200000000, -0.0003105000000000, -0.0007398200000000 ]  - [  -0.0013367400000000,  0.0014990100000000,  0.0005965600000000 ]  - [  -0.0004209800000000,  0.0007803900000000,  0.0014326700000000 ]  - [  -0.0009009700000000,  0.0005521600000000,  0.0009630900000000 ]  - [  -0.0001446300000000, -0.0002353700000000,  0.0002772200000000 ]  - [  -0.0004985200000000,  0.0001166200000000, -0.0000485600000000 ]  - [   0.0000185300000000,  0.0003192300000000, -0.0000576300000000 ]  - [  -0.0032545000000000,  0.0032778600000000,  0.0015109800000000 ]  - [  -0.0003061200000000,  0.0000889600000000, -0.0000549900000000 ]  - [  -0.0009116400000000,  0.0000366900000000,  0.0001739700000000 ]  - [  -0.0008370600000000, -0.0005077500000000,  0.0005484300000000 ]  - [   0.0006634200000000, -0.0032865800000000,  0.0015570600000000 ]  - [   0.0002456400000000, -0.0000900700000000, -0.0003067300000000 ]  - [  -0.0022809800000000,  0.0004521300000000,  0.0017440700000000 ]  - [  -0.0005128700000000,  0.0003415900000000,  0.0005785500000000 ]  - [  -0.0002690200000000,  0.0134192100000000, -0.0013531900000000 ]  - [   0.0005039100000000, -0.0003488400000000,  0.0005431000000000 ]  - [  -0.0020192500000000,  0.0005652100000000, -0.0011877200000000 ]  - [  -0.0002850600000000,  0.0004513100000000, -0.0005271900000000 ]  - [   0.0014382300000000,  0.0000553000000000,  0.0009466400000000 ]  - [  -0.0000220200000000, -0.0003426000000000, -0.0000941700000000 ]  - [   0.0014167700000000,  0.0008293200000000,  0.0002161900000000 ]  - [   0.0010158500000000,  0.0002052400000000, -0.0000233800000000 ]  - [  -0.0034347100000000, -0.0027485900000000, -0.0052038100000000 ]  - [   0.0004365000000000, -0.0003018600000000,  0.0008389200000000 ]  - [   0.0002432600000000, -0.0004290500000000,  0.0006724100000000 ]  - [   0.0001870500000000, -0.0000736200000000,  0.0002624000000000 ]  - [  -0.0028993000000000, -0.0006351900000000,  0.0005160500000000 ]  - [  -0.0002495900000000, -0.0001228100000000,  0.0000562600000000 ]- atom:   17  displacement:    [   0.0000000001998174,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0005887600000000,  0.0008251500000000,  0.0005836500000000 ]  - [  -0.0013324100000000,  0.0020588600000000, -0.0016520800000000 ]  - [   0.0012218300000000, -0.0005991300000000,  0.0003909500000000 ]  - [  -0.0003901900000000, -0.0025197200000000,  0.0014286900000000 ]  - [   0.0057385500000000,  0.0091490500000000,  0.0001686200000000 ]  - [   0.0024529000000000,  0.0070714100000000,  0.0002319100000000 ]  - [   0.0003586000000000, -0.0017140400000000, -0.0052427300000000 ]  - [  -0.0008625800000000,  0.0005220400000000,  0.0014882600000000 ]  - [   0.0055358400000000, -0.0141183500000000,  0.0002800900000000 ]  - [  -0.0042018000000000, -0.0019695300000000,  0.0040076400000000 ]  - [   0.0011428400000000,  0.0008596300000000, -0.0023655700000000 ]  - [  -0.0006142400000000, -0.0001390400000000,  0.0021623300000000 ]  - [   0.0281722500000000,  0.2508838700000000,  0.0330034600000000 ]  - [   0.0003426400000000, -0.0000553700000000,  0.0020279800000000 ]  - [  -0.0042823100000000, -0.0151371700000000,  0.0120778700000000 ]  - [   0.0002005400000000, -0.0013228400000000,  0.0015601400000000 ]  - [  -0.0264132300000000, -0.2808613000000000, -0.0249587800000000 ]  - [   0.0000166300000000, -0.0000003800000000, -0.0004572600000000 ]  - [   0.0101452200000000,  0.0043479700000000, -0.0074370800000000 ]  - [  -0.0000770000000000, -0.0001348900000000, -0.0007552700000000 ]  - [  -0.0033896900000000, -0.0021590200000000, -0.0018447600000000 ]  - [  -0.0002225900000000, -0.0009472300000000, -0.0013725500000000 ]  - [   0.0002452500000000,  0.0014316100000000,  0.0017476700000000 ]  - [   0.0005821000000000, -0.0003470000000000, -0.0007738900000000 ]  - [  -0.0007211300000000,  0.0022097800000000,  0.0004302200000000 ]  - [   0.0013568300000000,  0.0009991200000000, -0.0020493500000000 ]  - [  -0.0046413200000000, -0.0004639100000000,  0.0016643800000000 ]  - [  -0.0000388000000000, -0.0000695500000000, -0.0007696800000000 ]  - [  -0.0007905200000000, -0.0024821900000000,  0.0019028800000000 ]  - [  -0.0000056300000000, -0.0001596500000000, -0.0004198400000000 ]  - [   0.0046455000000000,  0.0031070000000000, -0.0028215700000000 ]  - [   0.0000373800000000,  0.0001338100000000, -0.0003747500000000 ]  - [  -0.0030256100000000,  0.0055720300000000,  0.0045064700000000 ]  - [   0.0005818600000000, -0.0001330900000000, -0.0009835300000000 ]  - [  -0.0104831400000000,  0.0213027900000000, -0.0058034300000000 ]  - [  -0.0000888500000000,  0.0003006800000000, -0.0005667400000000 ]  - [  -0.0014503800000000,  0.0007702500000000,  0.0010888600000000 ]  - [  -0.0000689300000000, -0.0001249100000000, -0.0007586400000000 ]  - [   0.0007039000000000,  0.0104741100000000,  0.0024336100000000 ]  - [   0.0003398900000000, -0.0000933100000000, -0.0012591500000000 ]  - [  -0.0038609700000000, -0.0026840300000000, -0.0046583800000000 ]  - [  -0.0015232400000000,  0.0002384600000000,  0.0026435300000000 ]  - [   0.0020547800000000, -0.0054710500000000,  0.0055093900000000 ]  - [   0.0003140100000000, -0.0010314900000000, -0.0007586600000000 ]  - [   0.0024421000000000,  0.0124083400000000, -0.0127087800000000 ]  - [   0.0000225100000000,  0.0011885600000000, -0.0011316600000000 ]  - [   0.0004661900000000, -0.0004826900000000,  0.0008406800000000 ]  - [  -0.0000468000000000, -0.0006336300000000, -0.0002551800000000 ]- atom:   17  displacement:    [  -0.0000000001998174, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0005932000000000, -0.0008169700000000, -0.0005935100000000 ]  - [   0.0013750300000000, -0.0020333700000000,  0.0016967800000000 ]  - [  -0.0012114700000000,  0.0005956900000000, -0.0003851700000000 ]  - [   0.0003885500000000,  0.0025249000000000, -0.0014334800000000 ]  - [  -0.0057844700000000, -0.0090832900000000, -0.0016010900000000 ]  - [  -0.0025103900000000, -0.0070907500000000, -0.0015588700000000 ]  - [   0.0001784700000000,  0.0013260300000000,  0.0050271800000000 ]  - [   0.0014268400000000, -0.0009600800000000, -0.0016977400000000 ]  - [  -0.0055674400000000,  0.0142156100000000,  0.0011393800000000 ]  - [   0.0041600400000000,  0.0019508000000000, -0.0025895500000000 ]  - [  -0.0015524700000000, -0.0014781100000000,  0.0026012700000000 ]  - [   0.0001689700000000, -0.0004667200000000, -0.0019319700000000 ]  - [  -0.0307025700000000, -0.2671735100000000, -0.0360126700000000 ]  - [  -0.0009124500000000,  0.0004937200000000, -0.0022378700000000 ]  - [   0.0047104500000000,  0.0157717000000000, -0.0115569600000000 ]  - [   0.0002628100000000,  0.0019352900000000, -0.0013160300000000 ]  - [   0.0285758000000000,  0.2977091900000000,  0.0273094700000000 ]  - [   0.0002143900000000,  0.0001139700000000,  0.0004674400000000 ]  - [  -0.0102814300000000, -0.0048487000000000,  0.0067855100000000 ]  - [   0.0001089100000000, -0.0003722700000000,  0.0000056300000000 ]  - [   0.0026991200000000,  0.0024628500000000,  0.0024407400000000 ]  - [  -0.0004569100000000,  0.0012875500000000,  0.0019800100000000 ]  - [   0.0002592100000000, -0.0013739900000000, -0.0009800400000000 ]  - [  -0.0000685500000000,  0.0003884400000000,  0.0015358700000000 ]  - [   0.0010801500000000, -0.0015234300000000, -0.0010660400000000 ]  - [  -0.0010022100000000, -0.0003108500000000,  0.0014169900000000 ]  - [   0.0044509000000000,  0.0007277700000000, -0.0016404000000000 ]  - [  -0.0000742400000000,  0.0003075000000000,  0.0007621800000000 ]  - [   0.0012411600000000,  0.0028491100000000, -0.0022538300000000 ]  - [   0.0004671200000000,  0.0005531400000000,  0.0000478400000000 ]  - [  -0.0044484300000000, -0.0033265900000000,  0.0027460000000000 ]  - [   0.0000726500000000, -0.0003720900000000,  0.0003658900000000 ]  - [   0.0026858000000000, -0.0051524400000000, -0.0041688800000000 ]  - [  -0.0009518700000000,  0.0005780400000000,  0.0013283100000000 ]  - [   0.0110099100000000, -0.0220546100000000,  0.0062618300000000 ]  - [   0.0004593500000000, -0.0007443100000000,  0.0009137300000000 ]  - [   0.0014005900000000, -0.0002724000000000, -0.0018353200000000 ]  - [   0.0000377600000000,  0.0006321300000000,  0.0000061300000000 ]  - [  -0.0010241900000000, -0.0111777700000000, -0.0030254400000000 ]  - [  -0.0006841800000000, -0.0005952500000000,  0.0006248900000000 ]  - [   0.0034145000000000,  0.0022207400000000,  0.0043352100000000 ]  - [   0.0010678300000000, -0.0006587100000000, -0.0030292000000000 ]  - [  -0.0012868100000000,  0.0051642300000000, -0.0048017100000000 ]  - [   0.0003710500000000,  0.0006953900000000,  0.0013741500000000 ]  - [  -0.0029287600000000, -0.0122402800000000,  0.0132091200000000 ]  - [  -0.0005370300000000, -0.0012351100000000,  0.0018943900000000 ]  - [  -0.0007108000000000,  0.0003367000000000, -0.0008252100000000 ]  - [  -0.0001838800000000,  0.0005211200000000,  0.0002650300000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0004648700000000, -0.0000509700000000, -0.0010303000000000 ]  - [  -0.0019990500000000, -0.0003579200000000, -0.0008660300000000 ]  - [  -0.0002950200000000, -0.0000948000000000, -0.0006610400000000 ]  - [   0.0000092700000000,  0.0001466300000000,  0.0000116100000000 ]  - [  -0.0050260700000000,  0.0018090200000000, -0.0048054600000000 ]  - [   0.0052278300000000,  0.0008721600000000, -0.0041848800000000 ]  - [  -0.0005388400000000,  0.0001131900000000,  0.0045855900000000 ]  - [   0.0002821700000000, -0.0006707200000000, -0.0023824300000000 ]  - [   0.0005621500000000,  0.0058779900000000,  0.0060269500000000 ]  - [   0.0004828000000000,  0.0000952700000000, -0.0019653500000000 ]  - [   0.0007799400000000, -0.0011133200000000,  0.0036126800000000 ]  - [  -0.0001072500000000,  0.0008242600000000, -0.0018345700000000 ]  - [   0.0025762300000000,  0.0546987900000000,  0.0407344500000000 ]  - [  -0.0001348400000000,  0.0006948300000000, -0.0023437100000000 ]  - [   0.0014560000000000, -0.0004198400000000,  0.0095469600000000 ]  - [  -0.0014152900000000, -0.0021497300000000, -0.0026876700000000 ]  - [  -0.0065846000000000, -0.0264771100000000, -0.0488914700000000 ]  - [   0.0000859400000000, -0.0004128800000000,  0.0008543000000000 ]  - [  -0.0013647500000000, -0.0143925100000000, -0.0073878800000000 ]  - [  -0.0005223700000000, -0.0001342100000000,  0.0008425700000000 ]  - [   0.0014807800000000, -0.0011084700000000, -0.0006570800000000 ]  - [  -0.0011739000000000,  0.0008637300000000,  0.0015975500000000 ]  - [   0.0000062600000000,  0.0006331900000000,  0.0005267200000000 ]  - [   0.0001366100000000, -0.0000245300000000,  0.0005462500000000 ]  - [   0.0009827100000000,  0.0003054300000000, -0.0019448600000000 ]  - [  -0.0002191800000000,  0.0000855700000000,  0.0007095100000000 ]  - [  -0.0028289300000000,  0.0016740800000000, -0.0001184200000000 ]  - [  -0.0004187100000000, -0.0001860300000000,  0.0005311000000000 ]  - [   0.0011026100000000,  0.0004571800000000, -0.0007064200000000 ]  - [  -0.0005411400000000, -0.0010451300000000,  0.0013242600000000 ]  - [  -0.0015962300000000, -0.0016444500000000, -0.0001230000000000 ]  - [   0.0008189600000000, -0.0000681800000000,  0.0005304100000000 ]  - [   0.0018521500000000, -0.0007083400000000, -0.0027749400000000 ]  - [  -0.0005782700000000,  0.0002721400000000,  0.0010531700000000 ]  - [   0.0053379400000000, -0.0194930200000000, -0.0004873300000000 ]  - [   0.0004800900000000, -0.0000560800000000,  0.0010718900000000 ]  - [  -0.0006421800000000,  0.0006500900000000, -0.0016104900000000 ]  - [   0.0004831500000000, -0.0000405600000000,  0.0008107700000000 ]  - [  -0.0043095700000000, -0.0002266700000000, -0.0059479000000000 ]  - [   0.0005112400000000,  0.0003706300000000,  0.0014031900000000 ]  - [   0.0020390700000000, -0.0036296800000000,  0.0042251400000000 ]  - [  -0.0007290600000000,  0.0034299900000000,  0.0063645800000000 ]  - [   0.0043287100000000,  0.0027017200000000,  0.0035893300000000 ]  - [   0.0004048500000000, -0.0008600200000000,  0.0012135900000000 ]  - [  -0.0008736200000000, -0.0010578700000000,  0.0021219400000000 ]  - [  -0.0003204500000000,  0.0005209500000000,  0.0003328700000000 ]  - [   0.0003920200000000, -0.0008840700000000, -0.0013327400000000 ]  - [  -0.0000650300000000,  0.0002102800000000,  0.0005766000000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0004714100000000,  0.0000516800000000,  0.0010343400000000 ]  - [   0.0020559300000000,  0.0003569800000000,  0.0009349200000000 ]  - [   0.0002947400000000,  0.0000957000000000,  0.0006612900000000 ]  - [  -0.0000123000000000, -0.0001592000000000,  0.0000010100000000 ]  - [   0.0050707800000000, -0.0018081900000000,  0.0034476900000000 ]  - [  -0.0052048300000000, -0.0008507400000000,  0.0028164700000000 ]  - [   0.0011253100000000, -0.0005516400000000, -0.0048192700000000 ]  - [   0.0002997600000000,  0.0002260800000000,  0.0021676800000000 ]  - [  -0.0005281800000000, -0.0059167000000000, -0.0046407200000000 ]  - [  -0.0004892000000000, -0.0000957400000000,  0.0033234200000000 ]  - [  -0.0012099500000000,  0.0005331400000000, -0.0034172600000000 ]  - [  -0.0003426600000000, -0.0013940200000000,  0.0020573600000000 ]  - [  -0.0030346900000000, -0.0535312200000000, -0.0404438700000000 ]  - [  -0.0004445200000000, -0.0002528700000000,  0.0021316000000000 ]  - [  -0.0010229800000000,  0.0011022800000000, -0.0093825700000000 ]  - [   0.0018460800000000,  0.0027228100000000,  0.0029236700000000 ]  - [   0.0066914600000000,  0.0257239400000000,  0.0484189100000000 ]  - [   0.0001501600000000,  0.0005150200000000, -0.0008444100000000 ]  - [   0.0013605000000000,  0.0138875600000000,  0.0065700000000000 ]  - [   0.0005821900000000, -0.0003691800000000, -0.0016093500000000 ]  - [  -0.0021733100000000,  0.0014425800000000,  0.0012821000000000 ]  - [   0.0004914600000000, -0.0005326000000000, -0.0009840100000000 ]  - [   0.0004992300000000, -0.0005774400000000,  0.0002440300000000 ]  - [   0.0003677300000000,  0.0000772800000000,  0.0002141900000000 ]  - [  -0.0006484000000000,  0.0003727200000000,  0.0013353200000000 ]  - [   0.0005497900000000,  0.0005962400000000, -0.0013187600000000 ]  - [   0.0027338800000000, -0.0014616100000000,  0.0001189200000000 ]  - [   0.0003182900000000,  0.0004170400000000, -0.0005399900000000 ]  - [  -0.0006587400000000, -0.0000856600000000,  0.0003716500000000 ]  - [   0.0009886800000000,  0.0014123400000000, -0.0016617900000000 ]  - [   0.0017115200000000,  0.0014251600000000,  0.0001147200000000 ]  - [  -0.0007089300000000, -0.0001681300000000, -0.0005406600000000 ]  - [  -0.0022327800000000,  0.0011663100000000,  0.0031282800000000 ]  - [   0.0002015100000000,  0.0001831500000000, -0.0007059400000000 ]  - [  -0.0049019700000000,  0.0190208800000000,  0.0008442200000000 ]  - [  -0.0001009900000000, -0.0003990200000000, -0.0007225200000000 ]  - [   0.0005851000000000, -0.0001459500000000,  0.0008435700000000 ]  - [  -0.0005453300000000,  0.0005430400000000, -0.0015766800000000 ]  - [   0.0039597200000000, -0.0004460800000000,  0.0053197600000000 ]  - [  -0.0008346400000000, -0.0010461400000000, -0.0020044300000000 ]  - [  -0.0025276700000000,  0.0033199200000000, -0.0046931600000000 ]  - [   0.0002761800000000, -0.0037569100000000, -0.0066227200000000 ]  - [  -0.0037314100000000, -0.0030943400000000, -0.0030091800000000 ]  - [   0.0002778500000000,  0.0005254000000000, -0.0006080600000000 ]  - [   0.0003703900000000,  0.0010279700000000, -0.0013609300000000 ]  - [  -0.0001819300000000, -0.0005666000000000,  0.0004225200000000 ]  - [  -0.0006303400000000,  0.0007781500000000,  0.0013456200000000 ]  - [  -0.0001710800000000, -0.0003134100000000, -0.0005669700000000 ]- atom:   19  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [  -0.0001493700000000, -0.0001449100000000,  0.0008598000000000 ]  - [  -0.0011736200000000, -0.0009223700000000, -0.0017139300000000 ]  - [   0.0002292200000000, -0.0000092400000000,  0.0003570400000000 ]  - [   0.0013635200000000,  0.0012469100000000, -0.0008486800000000 ]  - [   0.0008756300000000, -0.0004948300000000,  0.0019316100000000 ]  - [   0.0031941100000000,  0.0098159600000000,  0.0087634300000000 ]  - [  -0.0046241900000000,  0.0004710500000000, -0.0008702100000000 ]  - [  -0.0019732600000000,  0.0004184800000000,  0.0027343000000000 ]  - [  -0.0078652300000000,  0.0119810700000000, -0.0014653700000000 ]  - [  -0.0010344400000000,  0.0004151000000000,  0.0030634800000000 ]  - [  -0.0109588900000000,  0.0010174900000000, -0.0063243300000000 ]  - [  -0.0029023500000000, -0.0012337600000000,  0.0030247900000000 ]  - [   0.1855013700000000,  0.0253168400000000, -0.1223714000000000 ]  - [   0.0015422600000000, -0.0004736000000000,  0.0020855100000000 ]  - [   0.0009712300000000, -0.0040434900000000,  0.0054502400000000 ]  - [   0.0012281000000000,  0.0017946100000000,  0.0014262500000000 ]  - [   0.0006847700000000,  0.0103251100000000, -0.0013652000000000 ]  - [  -0.0001376600000000, -0.0000356700000000, -0.0005435900000000 ]  - [  -0.2053657700000000, -0.0370011100000000,  0.1259123800000000 ]  - [   0.0000488300000000, -0.0002256500000000, -0.0011035400000000 ]  - [  -0.0011586200000000,  0.0000140400000000, -0.0001137500000000 ]  - [   0.0008680900000000, -0.0029941100000000, -0.0049944400000000 ]  - [   0.0015823500000000, -0.0010632500000000,  0.0002141800000000 ]  - [   0.0020473300000000,  0.0004005400000000, -0.0003206800000000 ]  - [   0.0046613500000000, -0.0004527400000000, -0.0016585600000000 ]  - [   0.0008424100000000,  0.0004541900000000, -0.0014099800000000 ]  - [   0.0122503700000000, -0.0003054200000000, -0.0010725800000000 ]  - [   0.0011543000000000,  0.0000701000000000,  0.0005382600000000 ]  - [   0.0006531100000000,  0.0005229300000000, -0.0000668900000000 ]  - [   0.0017928800000000,  0.0007882100000000, -0.0018464600000000 ]  - [   0.0014577700000000,  0.0004102500000000, -0.0006130000000000 ]  - [  -0.0003115000000000, -0.0003772500000000,  0.0000453100000000 ]  - [   0.0027333200000000, -0.0019332000000000, -0.0017264400000000 ]  - [   0.0006632000000000, -0.0000729700000000, -0.0010547800000000 ]  - [   0.0161315400000000, -0.0076856100000000,  0.0017555600000000 ]  - [  -0.0002731300000000, -0.0002079500000000, -0.0007383600000000 ]  - [   0.0019241900000000,  0.0002447800000000,  0.0018971400000000 ]  - [  -0.0002257200000000,  0.0001687200000000, -0.0013459500000000 ]  - [   0.0015406800000000, -0.0027950200000000,  0.0003307100000000 ]  - [  -0.0002952400000000, -0.0004282800000000, -0.0010559300000000 ]  - [  -0.0010208600000000, -0.0007075600000000, -0.0015348200000000 ]  - [  -0.0034614700000000, -0.0010661500000000, -0.0009786300000000 ]  - [  -0.0028789100000000,  0.0001998600000000,  0.0006298900000000 ]  - [  -0.0009269300000000, -0.0004872800000000, -0.0030976900000000 ]  - [   0.0000464800000000,  0.0010651700000000, -0.0017474600000000 ]  - [  -0.0012615500000000, -0.0003970600000000,  0.0008508400000000 ]  - [   0.0018711700000000, -0.0014744500000000,  0.0006177600000000 ]  - [   0.0001391200000000, -0.0001084700000000, -0.0005058100000000 ]- atom:   19  displacement:    [  -0.0100000000000000,  0.0000000001998174,  0.0000000000000000 ]  forces:  - [   0.0001482900000000,  0.0001461500000000, -0.0008607800000000 ]  - [   0.0011794200000000,  0.0009180900000000,  0.0017126500000000 ]  - [  -0.0002306100000000,  0.0000086400000000, -0.0003606700000000 ]  - [  -0.0013653600000000, -0.0012700500000000,  0.0008862500000000 ]  - [  -0.0008927800000000,  0.0005319300000000, -0.0033157100000000 ]  - [  -0.0032732300000000, -0.0098984700000000, -0.0102114700000000 ]  - [   0.0051783500000000, -0.0009185100000000,  0.0006587700000000 ]  - [   0.0025508100000000, -0.0008645100000000, -0.0029656500000000 ]  - [   0.0078927500000000, -0.0118763900000000,  0.0028557600000000 ]  - [   0.0010372900000000, -0.0004155100000000, -0.0016950500000000 ]  - [   0.0105594900000000, -0.0016125100000000,  0.0066233500000000 ]  - [   0.0024630900000000,  0.0006486800000000, -0.0028232200000000 ]  - [  -0.1782859400000000, -0.0232600600000000,  0.1152034000000000 ]  - [  -0.0021192800000000,  0.0009218300000000, -0.0023076800000000 ]  - [  -0.0005234000000000,  0.0046049400000000, -0.0052093800000000 ]  - [  -0.0007766900000000, -0.0012266500000000, -0.0012064300000000 ]  - [  -0.0004793300000000, -0.0101026300000000,  0.0013576100000000 ]  - [   0.0003700300000000,  0.0001503400000000,  0.0005555200000000 ]  - [   0.1972711700000000,  0.0348484100000000, -0.1197258200000000 ]  - [  -0.0000152900000000, -0.0002856800000000,  0.0003553400000000 ]  - [   0.0004811200000000,  0.0003216200000000,  0.0007205400000000 ]  - [  -0.0015682000000000,  0.0033589200000000,  0.0056400700000000 ]  - [  -0.0010648800000000,  0.0010889500000000,  0.0005315800000000 ]  - [  -0.0015386100000000, -0.0003676200000000,  0.0010838100000000 ]  - [  -0.0043187200000000,  0.0011198800000000,  0.0010345000000000 ]  - [  -0.0004995300000000,  0.0002287700000000,  0.0007973800000000 ]  - [  -0.0123958500000000,  0.0005397500000000,  0.0010160200000000 ]  - [  -0.0012690400000000,  0.0001633300000000, -0.0005451800000000 ]  - [  -0.0001919100000000, -0.0001348300000000, -0.0003054200000000 ]  - [  -0.0013317200000000, -0.0003852000000000,  0.0014956900000000 ]  - [  -0.0013472000000000, -0.0006429000000000,  0.0006022400000000 ]  - [   0.0004249800000000,  0.0001473600000000, -0.0000519000000000 ]  - [  -0.0030997100000000,  0.0023770400000000,  0.0020662100000000 ]  - [  -0.0010401500000000,  0.0005248800000000,  0.0014123600000000 ]  - [  -0.0153905300000000,  0.0071621000000000, -0.0014510700000000 ]  - [   0.0006478300000000, -0.0002423900000000,  0.0010925600000000 ]  - [  -0.0019483200000000,  0.0002673500000000, -0.0026455900000000 ]  - [   0.0001977000000000,  0.0003391000000000,  0.0006008400000000 ]  - [  -0.0019151100000000,  0.0021163500000000, -0.0009753700000000 ]  - [  -0.0000474300000000, -0.0002552200000000,  0.0004411300000000 ]  - [   0.0005674900000000,  0.0003290200000000,  0.0011777600000000 ]  - [   0.0030271900000000,  0.0006997300000000,  0.0006353700000000 ]  - [   0.0035832100000000, -0.0005928100000000,  0.0000748600000000 ]  - [   0.0016439100000000,  0.0001306200000000,  0.0037291600000000 ]  - [  -0.0005615500000000, -0.0010877600000000,  0.0024961800000000 ]  - [   0.0007424600000000,  0.0003709200000000, -0.0001034900000000 ]  - [  -0.0021060600000000,  0.0013769100000000, -0.0006140600000000 ]  - [  -0.0003701600000000, -0.0000019200000000,  0.0005170100000000 ]- atom:   19  displacement:    [   0.0000000001998174,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000464600000000,  0.0001946600000000, -0.0002083500000000 ]  - [  -0.0003852500000000,  0.0001706200000000, -0.0001473600000000 ]  - [   0.0000844200000000, -0.0001374600000000, -0.0005060100000000 ]  - [   0.0013429100000000,  0.0087222700000000, -0.0038357600000000 ]  - [   0.0013040300000000,  0.0001917800000000, -0.0009454700000000 ]  - [   0.0002433900000000,  0.0037872200000000, -0.0045837500000000 ]  - [   0.0004596500000000, -0.0023949100000000, -0.0011075500000000 ]  - [   0.0025325100000000, -0.0005785100000000, -0.0021828000000000 ]  - [   0.0031002900000000, -0.0007906100000000,  0.0043892500000000 ]  - [  -0.0001194400000000, -0.0007351400000000, -0.0002357400000000 ]  - [   0.0000548600000000,  0.0019911800000000, -0.0008387000000000 ]  - [  -0.0001356700000000,  0.0023328600000000, -0.0003459800000000 ]  - [   0.0229774000000000,  0.0375825500000000, -0.0138726800000000 ]  - [  -0.0008620500000000,  0.0005361200000000, -0.0006647600000000 ]  - [   0.0006363900000000, -0.0061350700000000,  0.0012191600000000 ]  - [  -0.0007335800000000, -0.0026577300000000, -0.0004755100000000 ]  - [   0.0163579200000000,  0.0047675700000000, -0.0142129100000000 ]  - [   0.0001746400000000,  0.0001734900000000,  0.0001254000000000 ]  - [  -0.0355254400000000, -0.0526389800000000,  0.0311098500000000 ]  - [   0.0000469500000000, -0.0002742700000000, -0.0001978300000000 ]  - [  -0.0006655200000000,  0.0001751900000000,  0.0003865700000000 ]  - [  -0.0012631400000000,  0.0030515700000000,  0.0054993300000000 ]  - [   0.0003823700000000,  0.0003320200000000,  0.0010430900000000 ]  - [   0.0006815300000000, -0.0009847100000000, -0.0009782200000000 ]  - [   0.0004419300000000,  0.0006367900000000, -0.0003839000000000 ]  - [   0.0000457000000000,  0.0005214500000000, -0.0000094600000000 ]  - [  -0.0028071100000000, -0.0003729400000000,  0.0006205800000000 ]  - [  -0.0003434400000000, -0.0003222100000000,  0.0000627100000000 ]  - [  -0.0004613400000000, -0.0009008700000000,  0.0008692200000000 ]  - [  -0.0017421300000000, -0.0027044500000000,  0.0015650000000000 ]  - [   0.0000639700000000,  0.0010402700000000, -0.0002563000000000 ]  - [  -0.0002676300000000,  0.0002811200000000, -0.0001227400000000 ]  - [  -0.0009380500000000,  0.0015271700000000,  0.0002079000000000 ]  - [  -0.0007286600000000,  0.0004469000000000,  0.0009018500000000 ]  - [  -0.0016119400000000, -0.0030625700000000, -0.0003447900000000 ]  - [   0.0003317200000000, -0.0001535100000000,  0.0004935300000000 ]  - [  -0.0000389400000000,  0.0033131500000000, -0.0014366100000000 ]  - [  -0.0001012800000000,  0.0003444700000000,  0.0002783000000000 ]  - [  -0.0041169500000000,  0.0014675300000000,  0.0007359200000000 ]  - [  -0.0000377000000000, -0.0001912800000000, -0.0000527600000000 ]  - [  -0.0006384700000000, -0.0000283500000000, -0.0002788000000000 ]  - [   0.0023919700000000,  0.0008172000000000,  0.0010117500000000 ]  - [   0.0014799500000000, -0.0008835200000000, -0.0015311000000000 ]  - [   0.0002503500000000, -0.0015662400000000,  0.0008397700000000 ]  - [  -0.0003849400000000,  0.0013081600000000, -0.0001721100000000 ]  - [  -0.0006801100000000,  0.0017750600000000, -0.0013366500000000 ]  - [  -0.0004329800000000,  0.0004608100000000, -0.0003958400000000 ]  - [  -0.0003166000000000, -0.0004358600000000,  0.0003012500000000 ]- atom:   19  displacement:    [  -0.0000000001998174, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000448700000000, -0.0001892500000000,  0.0002018400000000 ]  - [   0.0003885000000000, -0.0001611600000000,  0.0001556300000000 ]  - [  -0.0000832200000000,  0.0001361800000000,  0.0005042800000000 ]  - [  -0.0015058200000000, -0.0091670800000000,  0.0041908200000000 ]  - [  -0.0012939300000000, -0.0001482600000000, -0.0004390900000000 ]  - [  -0.0002869300000000, -0.0036551300000000,  0.0032752500000000 ]  - [   0.0001496100000000,  0.0019593900000000,  0.0009070500000000 ]  - [  -0.0019284100000000,  0.0001294700000000,  0.0019286500000000 ]  - [  -0.0031028400000000,  0.0006787000000000, -0.0030236500000000 ]  - [   0.0001174100000000,  0.0007226000000000,  0.0015836000000000 ]  - [  -0.0004216000000000, -0.0025933000000000,  0.0010887700000000 ]  - [  -0.0002972000000000, -0.0029008200000000,  0.0005413600000000 ]  - [  -0.0242982900000000, -0.0375956500000000,  0.0142671000000000 ]  - [   0.0002783900000000, -0.0000907100000000,  0.0004321100000000 ]  - [  -0.0001911700000000,  0.0067296100000000, -0.0009694700000000 ]  - [   0.0011604800000000,  0.0032361100000000,  0.0006825000000000 ]  - [  -0.0158354800000000, -0.0044335500000000,  0.0140677200000000 ]  - [   0.0000595800000000, -0.0000662800000000, -0.0001106500000000 ]  - [   0.0363066800000000,  0.0527616600000000, -0.0328064900000000 ]  - [  -0.0000021000000000, -0.0002323800000000, -0.0005543600000000 ]  - [  -0.0000171400000000,  0.0001527200000000,  0.0002175000000000 ]  - [   0.0005659200000000, -0.0026640500000000, -0.0048043000000000 ]  - [   0.0001155200000000, -0.0002667200000000, -0.0002736200000000 ]  - [  -0.0001801800000000,  0.0010285500000000,  0.0017412600000000 ]  - [  -0.0001121200000000,  0.0000675200000000, -0.0002354900000000 ]  - [   0.0002899300000000,  0.0001618300000000, -0.0005947300000000 ]  - [   0.0025700300000000,  0.0006058100000000, -0.0006211900000000 ]  - [   0.0002222500000000,  0.0005531500000000, -0.0000731000000000 ]  - [   0.0008944500000000,  0.0012593000000000, -0.0012075700000000 ]  - [   0.0021644700000000,  0.0030489400000000, -0.0018945800000000 ]  - [   0.0000475300000000, -0.0012745800000000,  0.0002382900000000 ]  - [   0.0003813300000000, -0.0005155000000000,  0.0001101400000000 ]  - [   0.0005602100000000, -0.0010683500000000,  0.0001542300000000 ]  - [   0.0003452400000000,  0.0000079400000000, -0.0005389200000000 ]  - [   0.0019060100000000,  0.0026728600000000,  0.0006443400000000 ]  - [   0.0000468300000000, -0.0002977900000000, -0.0001348400000000 ]  - [  -0.0000280100000000, -0.0028093300000000,  0.0006551200000000 ]  - [   0.0000576700000000,  0.0001604800000000, -0.0010239400000000 ]  - [   0.0038595800000000, -0.0021773500000000, -0.0013526200000000 ]  - [  -0.0002971600000000, -0.0004877300000000, -0.0005522200000000 ]  - [   0.0001784800000000, -0.0003596200000000, -0.0000820300000000 ]  - [  -0.0028212100000000, -0.0012005600000000, -0.0013708600000000 ]  - [  -0.0007812000000000,  0.0004965700000000,  0.0021646800000000 ]  - [   0.0004427900000000,  0.0012091900000000, -0.0002297900000000 ]  - [  -0.0001181800000000, -0.0013512000000000,  0.0009283200000000 ]  - [   0.0001814300000000, -0.0018212000000000,  0.0020996400000000 ]  - [   0.0001858300000000, -0.0005773200000000,  0.0003980900000000 ]  - [   0.0000811800000000,  0.0003263000000000, -0.0002848200000000 ]- atom:   19  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000046600000000,  0.0003800200000000, -0.0014069800000000 ]  - [   0.0004033300000000, -0.0000336400000000,  0.0017836500000000 ]  - [   0.0000127300000000, -0.0002500100000000, -0.0012510700000000 ]  - [  -0.0010170700000000, -0.0047595200000000,  0.0046681100000000 ]  - [  -0.0006132000000000,  0.0060864800000000, -0.0048610700000000 ]  - [   0.0023260300000000, -0.0127575100000000, -0.0068621900000000 ]  - [   0.0029317400000000,  0.0013549600000000,  0.0029764000000000 ]  - [   0.0023959000000000, -0.0013613700000000, -0.0051611700000000 ]  - [   0.0012539800000000, -0.0006097800000000,  0.0045060600000000 ]  - [   0.0001055500000000, -0.0007814600000000, -0.0035580100000000 ]  - [   0.0046717500000000, -0.0020780500000000,  0.0044291700000000 ]  - [   0.0030446400000000,  0.0014565300000000, -0.0041353200000000 ]  - [  -0.1162127400000000, -0.0155303200000000,  0.1213664700000000 ]  - [  -0.0027644600000000,  0.0017804100000000, -0.0057526500000000 ]  - [   0.0007434000000000,  0.0039178300000000, -0.0010020500000000 ]  - [  -0.0019440900000000, -0.0011291400000000, -0.0030848400000000 ]  - [   0.0013535700000000, -0.0070548800000000, -0.0069304800000000 ]  - [   0.0004722000000000, -0.0003230000000000,  0.0012323800000000 ]  - [   0.1205708300000000,  0.0313932900000000, -0.1217588200000000 ]  - [  -0.0007120200000000, -0.0000817500000000,  0.0021794600000000 ]  - [   0.0004306300000000, -0.0012173800000000, -0.0007088300000000 ]  - [  -0.0021284400000000,  0.0045904900000000,  0.0070211400000000 ]  - [  -0.0002879300000000,  0.0021383000000000,  0.0017589300000000 ]  - [  -0.0014637500000000, -0.0004659200000000,  0.0009233800000000 ]  - [  -0.0000094000000000,  0.0006929700000000, -0.0024818700000000 ]  - [  -0.0005663800000000,  0.0000326400000000,  0.0015590200000000 ]  - [  -0.0130073400000000,  0.0004287400000000,  0.0017185900000000 ]  - [  -0.0015734700000000, -0.0000034400000000, -0.0000509100000000 ]  - [  -0.0013769400000000, -0.0014330000000000,  0.0011205700000000 ]  - [  -0.0022027000000000, -0.0016245300000000,  0.0019896100000000 ]  - [  -0.0013100000000000, -0.0006974100000000,  0.0001428100000000 ]  - [   0.0012127000000000, -0.0000103500000000,  0.0001609300000000 ]  - [  -0.0009365300000000,  0.0007617100000000, -0.0002108000000000 ]  - [  -0.0011342900000000,  0.0004538000000000,  0.0019454200000000 ]  - [   0.0052167200000000,  0.0010163200000000, -0.0106904200000000 ]  - [   0.0010845300000000, -0.0002928100000000,  0.0020697500000000 ]  - [  -0.0022933100000000,  0.0013168700000000, -0.0044392400000000 ]  - [   0.0009561500000000, -0.0003889800000000,  0.0022746100000000 ]  - [  -0.0010578100000000,  0.0006462100000000, -0.0037452900000000 ]  - [   0.0005062700000000,  0.0000155600000000,  0.0014772800000000 ]  - [  -0.0008515000000000, -0.0012742000000000, -0.0001238500000000 ]  - [   0.0030622600000000,  0.0010167300000000,  0.0008637500000000 ]  - [   0.0024520500000000, -0.0058561800000000,  0.0093207400000000 ]  - [  -0.0007505600000000,  0.0026264600000000,  0.0080662200000000 ]  - [  -0.0009201100000000, -0.0001793900000000,  0.0017642900000000 ]  - [   0.0011042700000000, -0.0007154300000000,  0.0009221600000000 ]  - [  -0.0009228800000000, -0.0015219300000000, -0.0012241700000000 ]  - [  -0.0002589300000000,  0.0003250500000000,  0.0011991300000000 ]- atom:   19  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0000053900000000, -0.0003791400000000,  0.0013989400000000 ]  - [  -0.0004024200000000,  0.0000385900000000, -0.0017681100000000 ]  - [  -0.0000143000000000,  0.0002508600000000,  0.0012425100000000 ]  - [   0.0009310000000000,  0.0045263500000000, -0.0045673300000000 ]  - [   0.0006091400000000, -0.0061046500000000,  0.0034243900000000 ]  - [  -0.0023041000000000,  0.0126438900000000,  0.0053848900000000 ]  - [  -0.0023309000000000, -0.0017985200000000, -0.0032063200000000 ]  - [  -0.0017822300000000,  0.0009080200000000,  0.0049058600000000 ]  - [  -0.0012089500000000,  0.0005622400000000, -0.0030780000000000 ]  - [  -0.0001017700000000,  0.0007814500000000,  0.0048964800000000 ]  - [  -0.0051145500000000,  0.0015059300000000, -0.0042480800000000 ]  - [  -0.0034682200000000, -0.0020061800000000,  0.0043437400000000 ]  - [   0.1203439600000000,  0.0167425800000000, -0.1237067400000000 ]  - [   0.0021612000000000, -0.0013256500000000,  0.0055022400000000 ]  - [  -0.0003096100000000, -0.0033280100000000,  0.0011697600000000 ]  - [   0.0023746400000000,  0.0016834800000000,  0.0032962400000000 ]  - [  -0.0012107600000000,  0.0071602300000000,  0.0070292600000000 ]  - [  -0.0002348600000000,  0.0004340400000000, -0.0012147200000000 ]  - [  -0.1249944700000000, -0.0325230400000000,  0.1229661900000000 ]  - [   0.0007548600000000, -0.0004282100000000, -0.0029246800000000 ]  - [  -0.0011100700000000,  0.0015611300000000,  0.0013464000000000 ]  - [   0.0014198200000000, -0.0041887500000000, -0.0063183300000000 ]  - [   0.0008016700000000, -0.0020988000000000, -0.0009922200000000 ]  - [   0.0019631500000000,  0.0004943900000000, -0.0001772700000000 ]  - [   0.0003364200000000, -0.0000014200000000,  0.0018688000000000 ]  - [   0.0008994100000000,  0.0006492700000000, -0.0021596100000000 ]  - [   0.0129169600000000, -0.0001898000000000, -0.0017640500000000 ]  - [   0.0014605200000000,  0.0002330700000000,  0.0000378000000000 ]  - [   0.0018331000000000,  0.0018040600000000, -0.0014584700000000 ]  - [   0.0026348300000000,  0.0019886200000000, -0.0023251700000000 ]  - [   0.0014140400000000,  0.0004605800000000, -0.0001424800000000 ]  - [  -0.0011009900000000, -0.0002193400000000, -0.0001739400000000 ]  - [   0.0005443800000000, -0.0002942400000000,  0.0005639900000000 ]  - [   0.0007476300000000,  0.0000041800000000, -0.0015774300000000 ]  - [  -0.0049291500000000, -0.0014655800000000,  0.0111350600000000 ]  - [  -0.0007025200000000, -0.0001636300000000, -0.0017070700000000 ]  - [   0.0022408000000000, -0.0007858900000000,  0.0036561700000000 ]  - [  -0.0009992200000000,  0.0009029700000000, -0.0030224300000000 ]  - [   0.0006738600000000, -0.0012976200000000,  0.0031279600000000 ]  - [  -0.0008402900000000, -0.0006967800000000, -0.0020795300000000 ]  - [   0.0004069500000000,  0.0009098500000000, -0.0002062900000000 ]  - [  -0.0034905800000000, -0.0013858500000000, -0.0012087800000000 ]  - [  -0.0017354400000000,  0.0055979800000000, -0.0088531100000000 ]  - [   0.0014097000000000, -0.0029488500000000, -0.0073032000000000 ]  - [   0.0004062100000000,  0.0001301800000000, -0.0009853300000000 ]  - [  -0.0016055900000000,  0.0006823000000000, -0.0001776700000000 ]  - [   0.0006897600000000,  0.0014075700000000,  0.0012340300000000 ]  - [   0.0000224100000000, -0.0004338800000000, -0.0011843800000000 ]- atom:   21  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [  -0.0027391900000000,  0.0008089300000000,  0.0004158300000000 ]  - [  -0.0009075100000000, -0.0006525700000000,  0.0005210800000000 ]  - [   0.0016173800000000,  0.0001189000000000,  0.0000388500000000 ]  - [   0.0004581600000000,  0.0005127800000000,  0.0002657600000000 ]  - [   0.0451849600000000, -0.0240617600000000, -0.0291710800000000 ]  - [   0.0014753000000000, -0.0016312100000000,  0.0007560900000000 ]  - [  -0.0014116600000000,  0.0015731300000000,  0.0036833500000000 ]  - [  -0.0003394300000000, -0.0000687500000000, -0.0003691000000000 ]  - [  -0.0083405400000000,  0.0059584900000000,  0.0004656400000000 ]  - [  -0.0034573100000000,  0.0000811700000000,  0.0016043000000000 ]  - [  -0.0008649300000000, -0.0046854500000000,  0.0027918100000000 ]  - [  -0.0006455000000000, -0.0006988500000000,  0.0008423400000000 ]  - [  -0.0025825200000000,  0.0026210700000000, -0.0029582100000000 ]  - [  -0.0014361000000000,  0.0001899900000000,  0.0015697900000000 ]  - [  -0.0097522300000000, -0.0098782200000000, -0.0080644400000000 ]  - [   0.0000011000000000,  0.0000847200000000,  0.0015496500000000 ]  - [   0.0011011100000000, -0.0030034700000000,  0.0018319800000000 ]  - [   0.0001926000000000,  0.0001600200000000, -0.0008275100000000 ]  - [  -0.0007921200000000, -0.0005721000000000,  0.0003789200000000 ]  - [   0.0012199400000000, -0.0011397200000000, -0.0021228300000000 ]  - [  -0.0739863200000000,  0.0316166900000000,  0.0465102900000000 ]  - [  -0.0004899100000000,  0.0003557000000000, -0.0000336200000000 ]  - [   0.0005352200000000,  0.0008236400000000,  0.0007269800000000 ]  - [   0.0004305300000000, -0.0000786500000000,  0.0000815600000000 ]  - [   0.0027342900000000, -0.0024303500000000, -0.0023700600000000 ]  - [   0.0009049100000000,  0.0005046100000000, -0.0009015000000000 ]  - [   0.0018144400000000, -0.0001097600000000, -0.0000396200000000 ]  - [   0.0005949600000000,  0.0000961100000000, -0.0002565900000000 ]  - [   0.0021013800000000,  0.0140135000000000,  0.0051511800000000 ]  - [   0.0001652000000000,  0.0006407200000000, -0.0008816100000000 ]  - [   0.0109321500000000,  0.0002618900000000, -0.0001320300000000 ]  - [   0.0003092000000000, -0.0001208400000000, -0.0007099600000000 ]  - [   0.0063648900000000, -0.0023607300000000, -0.0074005200000000 ]  - [   0.0012084300000000, -0.0003486100000000, -0.0000545000000000 ]  - [   0.0026122900000000, -0.0008203500000000,  0.0021313400000000 ]  - [   0.0007745800000000, -0.0007771200000000,  0.0001309500000000 ]  - [  -0.0032469800000000,  0.0013737900000000, -0.0024321500000000 ]  - [  -0.0012994400000000,  0.0001508200000000,  0.0007227400000000 ]  - [   0.0045273700000000,  0.0024645500000000,  0.0049494500000000 ]  - [   0.0003903600000000, -0.0004998200000000, -0.0006375300000000 ]  - [   0.0227733900000000, -0.0101750200000000, -0.0125745200000000 ]  - [  -0.0003216500000000, -0.0002490800000000, -0.0005231300000000 ]  - [  -0.0024503200000000, -0.0045410500000000,  0.0007311500000000 ]  - [  -0.0002374000000000,  0.0004898200000000, -0.0007794300000000 ]  - [   0.0015708400000000,  0.0024423700000000, -0.0006012300000000 ]  - [  -0.0001025300000000,  0.0000539000000000,  0.0000336600000000 ]  - [   0.0036187500000000,  0.0015838600000000, -0.0039858000000000 ]  - [  -0.0002101100000000, -0.0000777300000000, -0.0000577600000000 ]- atom:   21  displacement:    [  -0.0100000000000000,  0.0000000001998174,  0.0000000000000000 ]  forces:  - [   0.0027308200000000, -0.0007937800000000, -0.0004031200000000 ]  - [   0.0009108200000000,  0.0006573900000000, -0.0005310100000000 ]  - [  -0.0016212700000000, -0.0001203000000000, -0.0000356500000000 ]  - [  -0.0004628400000000, -0.0005229000000000, -0.0002738700000000 ]  - [  -0.0453488400000000,  0.0238947400000000,  0.0277370100000000 ]  - [  -0.0014906500000000,  0.0016677100000000, -0.0021585300000000 ]  - [   0.0020766000000000, -0.0019917500000000, -0.0039444800000000 ]  - [   0.0008727800000000, -0.0003802600000000,  0.0001429800000000 ]  - [   0.0083445600000000, -0.0060117900000000,  0.0008811200000000 ]  - [   0.0034579300000000, -0.0001082900000000, -0.0002104000000000 ]  - [   0.0003686800000000,  0.0040751900000000, -0.0025052900000000 ]  - [   0.0002065700000000,  0.0001137100000000, -0.0006397800000000 ]  - [   0.0020848000000000, -0.0021923900000000,  0.0028179700000000 ]  - [   0.0009278000000000,  0.0002740100000000, -0.0018270000000000 ]  - [   0.0103522000000000,  0.0104332200000000,  0.0083393800000000 ]  - [   0.0004366700000000,  0.0005049400000000, -0.0013506100000000 ]  - [  -0.0008813200000000,  0.0030882300000000, -0.0018215100000000 ]  - [   0.0000270800000000, -0.0000726500000000,  0.0008379400000000 ]  - [   0.0008349500000000,  0.0000695900000000, -0.0011556000000000 ]  - [  -0.0012290400000000,  0.0006824600000000,  0.0014310600000000 ]  - [   0.0726968800000000, -0.0307885500000000, -0.0457652400000000 ]  - [  -0.0001942600000000, -0.0000190900000000,  0.0006621300000000 ]  - [  -0.0000264600000000, -0.0007617800000000,  0.0000254000000000 ]  - [   0.0000781800000000,  0.0001352600000000,  0.0006917100000000 ]  - [  -0.0023908800000000,  0.0031431500000000,  0.0017521800000000 ]  - [  -0.0005636200000000,  0.0001799900000000,  0.0002842700000000 ]  - [  -0.0019235800000000,  0.0003397400000000,  0.0000266600000000 ]  - [  -0.0007193700000000,  0.0001384100000000,  0.0002530600000000 ]  - [  -0.0016780100000000, -0.0137601000000000, -0.0055465500000000 ]  - [   0.0002852900000000, -0.0002724700000000,  0.0005435400000000 ]  - [  -0.0107203900000000, -0.0004987500000000,  0.0000875300000000 ]  - [  -0.0001911600000000, -0.0001148100000000,  0.0007061400000000 ]  - [  -0.0068236300000000,  0.0028417900000000,  0.0078548400000000 ]  - [  -0.0015791500000000,  0.0008038000000000,  0.0003845400000000 ]  - [  -0.0022588000000000,  0.0003870500000000, -0.0018020500000000 ]  - [  -0.0004151600000000,  0.0003334500000000,  0.0002083000000000 ]  - [   0.0032293100000000, -0.0008797000000000,  0.0017630300000000 ]  - [   0.0012842600000000,  0.0003505100000000, -0.0014302500000000 ]  - [  -0.0048532100000000, -0.0031092800000000, -0.0055336000000000 ]  - [  -0.0007342900000000, -0.0001748300000000,  0.0000208400000000 ]  - [  -0.0225734700000000,  0.0095229600000000,  0.0118746500000000 ]  - [  -0.0001301100000000, -0.0001256800000000,  0.0001814800000000 ]  - [   0.0030849100000000,  0.0042521700000000, -0.0002086300000000 ]  - [   0.0009282300000000, -0.0008419200000000,  0.0014132500000000 ]  - [  -0.0020808000000000, -0.0024561700000000,  0.0013367100000000 ]  - [  -0.0004060400000000, -0.0001068000000000,  0.0007400800000000 ]  - [  -0.0039027500000000, -0.0017615400000000,  0.0040752100000000 ]  - [  -0.0000202400000000, -0.0000239000000000,  0.0000701700000000 ]- atom:   21  displacement:    [   0.0000000001998174,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000784000000000,  0.0008857700000000, -0.0001943200000000 ]  - [   0.0002654800000000,  0.0008445000000000, -0.0002322800000000 ]  - [  -0.0005653100000000, -0.0043006300000000,  0.0020922600000000 ]  - [  -0.0003107500000000, -0.0008751600000000, -0.0004935000000000 ]  - [  -0.0255930700000000,  0.1155373200000000,  0.0771206600000000 ]  - [  -0.0006727800000000,  0.0030202700000000, -0.0020809000000000 ]  - [   0.0119609300000000,  0.0087607600000000, -0.0145954000000000 ]  - [   0.0010595600000000,  0.0008869500000000, -0.0004939100000000 ]  - [   0.0026465900000000, -0.0075630400000000, -0.0005978100000000 ]  - [   0.0001381600000000, -0.0031703300000000,  0.0021525300000000 ]  - [  -0.0063441000000000, -0.0099871200000000,  0.0105242000000000 ]  - [   0.0001927800000000, -0.0008700900000000, -0.0008952400000000 ]  - [   0.0062281300000000, -0.0020312400000000,  0.0093138400000000 ]  - [   0.0035071000000000,  0.0011301700000000, -0.0027179200000000 ]  - [  -0.0068684600000000,  0.0090202000000000,  0.0050447700000000 ]  - [   0.0005100600000000,  0.0010905100000000, -0.0014004800000000 ]  - [  -0.0012182700000000, -0.0022487600000000, -0.0012682500000000 ]  - [  -0.0004948100000000, -0.0010638100000000,  0.0007016000000000 ]  - [  -0.0001280500000000, -0.0002405300000000, -0.0017718100000000 ]  - [  -0.0031513000000000,  0.0025997300000000,  0.0039952800000000 ]  - [   0.0299793200000000, -0.1394182400000000, -0.0885163800000000 ]  - [  -0.0001508700000000, -0.0004611000000000,  0.0005544300000000 ]  - [  -0.0000258900000000,  0.0045165400000000,  0.0005594700000000 ]  - [   0.0003776700000000,  0.0007006400000000,  0.0011199400000000 ]  - [   0.0004540300000000,  0.0050214100000000, -0.0012338100000000 ]  - [   0.0003151700000000,  0.0008996600000000, -0.0005359200000000 ]  - [   0.0008366200000000,  0.0007811000000000, -0.0008127700000000 ]  - [  -0.0012316600000000,  0.0002686700000000,  0.0003801400000000 ]  - [   0.0069202300000000,  0.0116797400000000,  0.0010771200000000 ]  - [   0.0000800700000000, -0.0001921800000000,  0.0002679300000000 ]  - [  -0.0007951000000000, -0.0017309800000000, -0.0041413600000000 ]  - [  -0.0004544900000000, -0.0002621200000000,  0.0006678100000000 ]  - [  -0.0067286300000000,  0.0027692800000000,  0.0093501100000000 ]  - [  -0.0009215900000000,  0.0004540300000000,  0.0001042800000000 ]  - [  -0.0021064800000000,  0.0017240900000000, -0.0025448400000000 ]  - [  -0.0008195400000000,  0.0010103100000000, -0.0002239500000000 ]  - [   0.0003616200000000, -0.0004396600000000,  0.0053656600000000 ]  - [  -0.0003318200000000, -0.0011365100000000, -0.0031529100000000 ]  - [  -0.0004529600000000,  0.0022207000000000,  0.0004409600000000 ]  - [  -0.0003152000000000,  0.0003971500000000, -0.0002455800000000 ]  - [  -0.0085678100000000, -0.0073296900000000, -0.0017340400000000 ]  - [  -0.0003595400000000, -0.0004239000000000,  0.0001632500000000 ]  - [  -0.0040061400000000,  0.0133661700000000, -0.0011647000000000 ]  - [   0.0010037000000000, -0.0011153600000000,  0.0016891500000000 ]  - [   0.0037577800000000,  0.0017134600000000, -0.0004825900000000 ]  - [  -0.0003848600000000, -0.0001518300000000,  0.0010607900000000 ]  - [   0.0024701400000000, -0.0053758100000000, -0.0029114700000000 ]  - [   0.0000127300000000, -0.0009110600000000,  0.0006959900000000 ]- atom:   21  displacement:    [  -0.0000000001998174, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000801100000000, -0.0008929200000000,  0.0001986200000000 ]  - [  -0.0002729000000000, -0.0008433200000000,  0.0002359500000000 ]  - [   0.0005613500000000,  0.0043151700000000, -0.0020779200000000 ]  - [   0.0003108400000000,  0.0008776100000000,  0.0004906700000000 ]  - [   0.0273323600000000, -0.1200857600000000, -0.0834780600000000 ]  - [   0.0006784100000000, -0.0030180500000000,  0.0007123300000000 ]  - [  -0.0113405200000000, -0.0089674300000000,  0.0143526200000000 ]  - [  -0.0005022100000000, -0.0013378600000000,  0.0002623200000000 ]  - [  -0.0026540100000000,  0.0075621300000000,  0.0019730300000000 ]  - [  -0.0001386500000000,  0.0031869600000000, -0.0007624800000000 ]  - [   0.0059266600000000,  0.0094322900000000, -0.0104036400000000 ]  - [  -0.0006374900000000,  0.0002849000000000,  0.0011182400000000 ]  - [  -0.0068302100000000,  0.0024477300000000, -0.0096026200000000 ]  - [  -0.0040686500000000, -0.0006838900000000,  0.0024971000000000 ]  - [   0.0073195700000000, -0.0083904400000000, -0.0048270000000000 ]  - [  -0.0000702500000000, -0.0005047900000000,  0.0016188200000000 ]  - [   0.0014449900000000,  0.0023771300000000,  0.0012821200000000 ]  - [   0.0007299100000000,  0.0011739200000000, -0.0006950000000000 ]  - [   0.0001698400000000, -0.0002608500000000,  0.0010198600000000 ]  - [   0.0031913400000000, -0.0031144900000000, -0.0047705300000000 ]  - [  -0.0324647000000000,  0.1443794700000000,  0.0942738700000000 ]  - [  -0.0005332500000000,  0.0008021200000000,  0.0000642600000000 ]  - [   0.0005269100000000, -0.0044743200000000,  0.0002008000000000 ]  - [   0.0001312200000000, -0.0006512000000000, -0.0003581900000000 ]  - [  -0.0001051200000000, -0.0043513000000000,  0.0006176800000000 ]  - [   0.0000254100000000, -0.0002176900000000, -0.0000835300000000 ]  - [  -0.0009701700000000, -0.0005471900000000,  0.0008185900000000 ]  - [   0.0011217700000000, -0.0000335800000000, -0.0003889800000000 ]  - [  -0.0066290500000000, -0.0115286300000000, -0.0015307400000000 ]  - [   0.0003717700000000,  0.0005710000000000, -0.0006223300000000 ]  - [   0.0009357300000000,  0.0014990200000000,  0.0041287500000000 ]  - [   0.0005718900000000,  0.0000282400000000, -0.0006773900000000 ]  - [   0.0063199200000000, -0.0023056500000000, -0.0089439200000000 ]  - [   0.0005541300000000, -0.0000088300000000,  0.0002426200000000 ]  - [   0.0024984000000000, -0.0021821100000000,  0.0029136000000000 ]  - [   0.0011905900000000, -0.0014619100000000,  0.0005681000000000 ]  - [  -0.0004200200000000,  0.0009390800000000, -0.0060751800000000 ]  - [   0.0002982300000000,  0.0016367800000000,  0.0024345500000000 ]  - [   0.0001054100000000, -0.0029124500000000, -0.0010588900000000 ]  - [  -0.0000250900000000, -0.0010802500000000, -0.0003714900000000 ]  - [   0.0081164100000000,  0.0070351100000000,  0.0014191500000000 ]  - [  -0.0000930800000000,  0.0000485600000000, -0.0005140100000000 ]  - [   0.0047951600000000, -0.0139591700000000,  0.0017418500000000 ]  - [  -0.0003206800000000,  0.0007775500000000, -0.0010752700000000 ]  - [  -0.0042161200000000, -0.0017327900000000,  0.0012352100000000 ]  - [  -0.0001231300000000,  0.0001044000000000, -0.0002982800000000 ]  - [  -0.0026459800000000,  0.0052559800000000,  0.0028840200000000 ]  - [  -0.0002470400000000,  0.0008117400000000, -0.0006892800000000 ]- atom:   21  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0004011600000000,  0.0002077900000000,  0.0003952900000000 ]  - [   0.0008385400000000,  0.0009541200000000, -0.0016308600000000 ]  - [  -0.0000594400000000,  0.0003872900000000,  0.0011211100000000 ]  - [  -0.0005345000000000, -0.0011547400000000, -0.0012637300000000 ]  - [  -0.0297246700000000,  0.0758323700000000,  0.1018030200000000 ]  - [  -0.0014943400000000,  0.0030952100000000, -0.0060740200000000 ]  - [   0.0124671900000000, -0.0025542400000000, -0.0099681600000000 ]  - [  -0.0043120500000000, -0.0010286500000000, -0.0038680700000000 ]  - [   0.0048206200000000, -0.0089831400000000, -0.0026565400000000 ]  - [   0.0001870700000000, -0.0006429100000000,  0.0029708700000000 ]  - [  -0.0033521500000000, -0.0029942700000000,  0.0119361200000000 ]  - [   0.0005861300000000, -0.0010815700000000, -0.0030976800000000 ]  - [   0.0051973700000000,  0.0002857300000000,  0.0073775000000000 ]  - [   0.0055233500000000,  0.0015619800000000, -0.0047557100000000 ]  - [  -0.0001276700000000,  0.0049022000000000,  0.0151121200000000 ]  - [   0.0000893300000000,  0.0013850000000000, -0.0035293600000000 ]  - [  -0.0001788800000000, -0.0020793600000000, -0.0009670900000000 ]  - [  -0.0010092300000000, -0.0016183200000000,  0.0012942200000000 ]  - [  -0.0003983200000000, -0.0001740100000000, -0.0014043500000000 ]  - [  -0.0052975600000000,  0.0048719000000000,  0.0062746300000000 ]  - [   0.0452474800000000, -0.0891624900000000, -0.1135939900000000 ]  - [  -0.0006887700000000,  0.0004186800000000,  0.0025641300000000 ]  - [   0.0001875000000000,  0.0013561800000000, -0.0018038200000000 ]  - [   0.0005502600000000,  0.0011224900000000,  0.0022385200000000 ]  - [  -0.0005720900000000,  0.0055940700000000, -0.0000641200000000 ]  - [   0.0001089700000000,  0.0000117500000000, -0.0001534600000000 ]  - [   0.0006872500000000,  0.0003665700000000, -0.0016452000000000 ]  - [  -0.0017931900000000,  0.0003660900000000,  0.0010089500000000 ]  - [   0.0045465300000000,  0.0059516100000000, -0.0069375200000000 ]  - [   0.0001203800000000, -0.0006716100000000,  0.0015322300000000 ]  - [  -0.0026798700000000, -0.0013793800000000, -0.0056467000000000 ]  - [   0.0009941700000000, -0.0003290300000000,  0.0016987600000000 ]  - [  -0.0084563700000000,  0.0041386300000000,  0.0108937200000000 ]  - [   0.0007523800000000, -0.0005945700000000, -0.0003526600000000 ]  - [  -0.0024361700000000,  0.0018003600000000, -0.0022146300000000 ]  - [  -0.0010005400000000,  0.0008786200000000, -0.0003924100000000 ]  - [  -0.0002873500000000,  0.0021477800000000,  0.0087953700000000 ]  - [   0.0033788900000000, -0.0002624000000000,  0.0072403600000000 ]  - [  -0.0011117000000000,  0.0017171500000000, -0.0000694600000000 ]  - [  -0.0004005000000000,  0.0002532500000000, -0.0001549100000000 ]  - [  -0.0149861500000000, -0.0004950900000000, -0.0044973500000000 ]  - [  -0.0000563600000000,  0.0002252200000000,  0.0013345100000000 ]  - [  -0.0001258600000000,  0.0013033500000000, -0.0151719000000000 ]  - [   0.0014395400000000, -0.0015593700000000,  0.0029873200000000 ]  - [  -0.0013218700000000,  0.0006341300000000, -0.0030613900000000 ]  - [  -0.0005082000000000, -0.0007654700000000,  0.0021577600000000 ]  - [  -0.0056284500000000, -0.0052457600000000,  0.0033194300000000 ]  - [   0.0004181700000000,  0.0010068600000000,  0.0009191500000000 ]- atom:   21  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0003989700000000, -0.0002109500000000, -0.0004011900000000 ]  - [  -0.0008376200000000, -0.0009492300000000,  0.0016276200000000 ]  - [   0.0000583700000000, -0.0003699300000000, -0.0011452000000000 ]  - [   0.0005338600000000,  0.0011562400000000,  0.0012644700000000 ]  - [   0.0309578500000000, -0.0801102000000000, -0.1061926400000000 ]  - [   0.0014904900000000, -0.0030854400000000,  0.0046981800000000 ]  - [  -0.0119689300000000,  0.0021775800000000,  0.0097275100000000 ]  - [   0.0049317500000000,  0.0005988600000000,  0.0036325300000000 ]  - [  -0.0047932700000000,  0.0089276000000000,  0.0040434100000000 ]  - [  -0.0001769100000000,  0.0006432300000000, -0.0016223200000000 ]  - [   0.0028738300000000,  0.0024105800000000, -0.0116947900000000 ]  - [  -0.0010259900000000,  0.0005065100000000,  0.0033099400000000 ]  - [  -0.0057751300000000,  0.0001536200000000, -0.0075792100000000 ]  - [  -0.0060997500000000, -0.0011149200000000,  0.0045251300000000 ]  - [   0.0007709700000000, -0.0042798300000000, -0.0147951500000000 ]  - [   0.0003536400000000, -0.0008049800000000,  0.0037360100000000 ]  - [   0.0004153700000000,  0.0022004300000000,  0.0009687600000000 ]  - [   0.0012479900000000,  0.0017290900000000, -0.0012898900000000 ]  - [   0.0004517400000000, -0.0003332800000000,  0.0006439800000000 ]  - [   0.0053526000000000, -0.0054215500000000, -0.0070709600000000 ]  - [  -0.0470523700000000,  0.0935906600000000,  0.1166172400000000 ]  - [   0.0000073300000000, -0.0000854400000000, -0.0019539300000000 ]  - [   0.0003258900000000, -0.0013217400000000,  0.0025521200000000 ]  - [  -0.0000455200000000, -0.0010713500000000, -0.0014759500000000 ]  - [   0.0009138800000000, -0.0048887200000000, -0.0005595400000000 ]  - [   0.0002198700000000,  0.0006698200000000, -0.0004512800000000 ]  - [  -0.0008012700000000, -0.0001399000000000,  0.0016376800000000 ]  - [   0.0016812800000000, -0.0001337100000000, -0.0010164200000000 ]  - [  -0.0041042800000000, -0.0055921900000000,  0.0066602300000000 ]  - [   0.0003348800000000,  0.0010449100000000, -0.0018785900000000 ]  - [   0.0027762400000000,  0.0011450100000000,  0.0056228100000000 ]  - [  -0.0008940200000000,  0.0000962000000000, -0.0017069800000000 ]  - [   0.0079789200000000, -0.0036431900000000, -0.0104045900000000 ]  - [  -0.0011394900000000,  0.0010556800000000,  0.0007190000000000 ]  - [   0.0028019900000000, -0.0022528000000000,  0.0025511700000000 ]  - [   0.0013754300000000, -0.0013321800000000,  0.0007424300000000 ]  - [   0.0002497100000000, -0.0015592100000000, -0.0093882200000000 ]  - [  -0.0034635200000000,  0.0007968500000000, -0.0081373700000000 ]  - [   0.0007540100000000, -0.0024039000000000, -0.0005633300000000 ]  - [   0.0000668600000000, -0.0009319800000000, -0.0004525100000000 ]  - [   0.0145373800000000,  0.0001282200000000,  0.0043011100000000 ]  - [  -0.0004015700000000, -0.0006022700000000, -0.0016830400000000 ]  - [   0.0008144200000000, -0.0015926100000000,  0.0160160700000000 ]  - [  -0.0007528300000000,  0.0012183300000000, -0.0023671500000000 ]  - [   0.0007780000000000, -0.0006884700000000,  0.0038162000000000 ]  - [   0.0000023200000000,  0.0007174700000000, -0.0013954300000000 ]  - [   0.0053260900000000,  0.0050726500000000, -0.0032821400000000 ]  - [  -0.0006515500000000, -0.0011195800000000, -0.0009058500000000 ]- atom:   29  displacement:    [   0.0100000000000000, -0.0000000001998174,  0.0000000000000000 ]  forces:  - [   0.0068141600000000, -0.0009305300000000,  0.0020783800000000 ]  - [  -0.0003008000000000, -0.0000313400000000,  0.0001459200000000 ]  - [   0.0012831700000000, -0.0003077300000000, -0.0000675500000000 ]  - [   0.0001713100000000, -0.0001527700000000,  0.0000791300000000 ]  - [   0.0560370100000000,  0.0124812100000000, -0.0090728100000000 ]  - [   0.0005831200000000,  0.0006321400000000, -0.0003663200000000 ]  - [   0.0043885200000000,  0.0022058200000000, -0.0034893800000000 ]  - [   0.0038658900000000,  0.0008117400000000,  0.0001316300000000 ]  - [  -0.0043444600000000,  0.0002456600000000,  0.0020748400000000 ]  - [  -0.0041045200000000, -0.0035234800000000, -0.0017712200000000 ]  - [   0.0179156300000000, -0.0197105800000000,  0.0240605900000000 ]  - [  -0.0001320000000000,  0.0001626700000000, -0.0007276800000000 ]  - [  -0.0127590300000000,  0.0036072700000000, -0.0046944100000000 ]  - [  -0.0040459800000000,  0.0014522800000000, -0.0001239300000000 ]  - [  -0.0046703400000000, -0.0092132700000000, -0.0094904200000000 ]  - [   0.0000666800000000, -0.0007049000000000,  0.0002674400000000 ]  - [   0.0012654700000000, -0.0009580400000000,  0.0008952800000000 ]  - [   0.0011845200000000, -0.0001828200000000, -0.0007694100000000 ]  - [   0.0004348600000000, -0.0009328800000000, -0.0019730900000000 ]  - [   0.0015931600000000, -0.0022044000000000, -0.0028070600000000 ]  - [   0.0015589800000000,  0.0070147200000000,  0.0046932600000000 ]  - [  -0.0004008200000000,  0.0000197100000000,  0.0001997300000000 ]  - [  -0.0025952900000000,  0.0075165300000000,  0.0016330500000000 ]  - [   0.0003197800000000,  0.0000103000000000,  0.0003126800000000 ]  - [   0.0027774100000000,  0.0029985700000000, -0.0042821100000000 ]  - [   0.0004013200000000,  0.0009218900000000,  0.0005238100000000 ]  - [   0.0214229100000000,  0.0136473400000000, -0.0191205700000000 ]  - [   0.0004718700000000, -0.0000073500000000,  0.0001677700000000 ]  - [  -0.1318575800000000, -0.0170672300000000, -0.0107290600000000 ]  - [   0.0001941600000000,  0.0001203600000000, -0.0002063000000000 ]  - [   0.0054581400000000,  0.0001099500000000,  0.0009430500000000 ]  - [  -0.0003017000000000, -0.0000008000000000, -0.0000513000000000 ]  - [   0.0000118200000000,  0.0004505100000000,  0.0003754400000000 ]  - [  -0.0008436700000000,  0.0000615800000000,  0.0012913600000000 ]  - [   0.0029810300000000, -0.0004543600000000,  0.0023675400000000 ]  - [   0.0028419300000000, -0.0000646000000000,  0.0022641800000000 ]  - [  -0.0008383300000000, -0.0001592700000000,  0.0002475800000000 ]  - [  -0.0032826400000000,  0.0028631700000000, -0.0036694500000000 ]  - [   0.0018130100000000,  0.0002636900000000,  0.0017400100000000 ]  - [   0.0010782600000000,  0.0002162400000000,  0.0008039600000000 ]  - [   0.0124724800000000,  0.0105375200000000,  0.0126832400000000 ]  - [  -0.0003905800000000, -0.0001551100000000, -0.0001798900000000 ]  - [   0.0233185800000000, -0.0086292200000000,  0.0152663400000000 ]  - [   0.0002432800000000, -0.0002974300000000,  0.0001335500000000 ]  - [   0.0010540800000000,  0.0021398300000000, -0.0001493900000000 ]  - [  -0.0000245800000000,  0.0002739400000000,  0.0001519200000000 ]  - [  -0.0017586000000000, -0.0037235800000000, -0.0022918600000000 ]  - [  -0.0013716400000000, -0.0013529100000000,  0.0005015400000000 ]- atom:   29  displacement:    [  -0.0100000000000000,  0.0000000001998174,  0.0000000000000000 ]  forces:  - [  -0.0073969100000000,  0.0011663800000000, -0.0023368700000000 ]  - [   0.0002899000000000,  0.0000272200000000, -0.0001424100000000 ]  - [  -0.0012544400000000,  0.0002935100000000,  0.0000609300000000 ]  - [  -0.0001646700000000,  0.0001542800000000, -0.0000757000000000 ]  - [  -0.0528586300000000, -0.0110533600000000,  0.0069200900000000 ]  - [  -0.0005673500000000, -0.0006339200000000, -0.0009981600000000 ]  - [  -0.0037224100000000, -0.0026538500000000,  0.0031890100000000 ]  - [  -0.0032551000000000, -0.0012716700000000, -0.0003449600000000 ]  - [   0.0041627400000000, -0.0002033500000000, -0.0006304300000000 ]  - [   0.0040307300000000,  0.0035039200000000,  0.0031000200000000 ]  - [  -0.0186772100000000,  0.0191160900000000, -0.0238370400000000 ]  - [  -0.0003132100000000, -0.0007204200000000,  0.0009549200000000 ]  - [   0.0120857000000000, -0.0031443900000000,  0.0042509800000000 ]  - [   0.0034477900000000, -0.0009973400000000, -0.0000845200000000 ]  - [   0.0050318700000000,  0.0096878800000000,  0.0096166200000000 ]  - [   0.0003683900000000,  0.0012636400000000, -0.0000358900000000 ]  - [  -0.0010128900000000,  0.0010741400000000, -0.0008627600000000 ]  - [  -0.0009381400000000,  0.0002894700000000,  0.0007634500000000 ]  - [  -0.0004150800000000,  0.0004172700000000,  0.0012332800000000 ]  - [  -0.0015346800000000,  0.0016971200000000,  0.0020271500000000 ]  - [  -0.0022200400000000, -0.0065288300000000, -0.0039642700000000 ]  - [  -0.0002799600000000,  0.0003167100000000,  0.0004091200000000 ]  - [   0.0031464800000000, -0.0073344200000000, -0.0008444700000000 ]  - [   0.0001818800000000,  0.0000397000000000,  0.0004447400000000 ]  - [  -0.0022912200000000, -0.0022036500000000,  0.0035036200000000 ]  - [  -0.0000547600000000, -0.0002301700000000, -0.0011220300000000 ]  - [  -0.0219332300000000, -0.0136565200000000,  0.0193897900000000 ]  - [  -0.0005720200000000,  0.0002373700000000, -0.0001781500000000 ]  - [   0.1293707700000000,  0.0157929700000000,  0.0108021100000000 ]  - [   0.0002561400000000,  0.0002556000000000, -0.0001483800000000 ]  - [  -0.0052654100000000, -0.0003278300000000, -0.0009353700000000 ]  - [   0.0004101800000000, -0.0002318500000000,  0.0000346800000000 ]  - [  -0.0003761400000000,  0.0000267600000000, -0.0000348000000000 ]  - [   0.0004573800000000,  0.0003987600000000, -0.0009316700000000 ]  - [  -0.0025313900000000, -0.0000301300000000, -0.0019380000000000 ]  - [  -0.0024581500000000, -0.0004018300000000, -0.0019098100000000 ]  - [   0.0007543400000000,  0.0006623000000000, -0.0010138400000000 ]  - [   0.0032095200000000, -0.0023444000000000,  0.0028789700000000 ]  - [  -0.0020986700000000, -0.0009426900000000, -0.0023071200000000 ]  - [  -0.0013980900000000, -0.0008940800000000, -0.0014020500000000 ]  - [  -0.0125808900000000, -0.0107128700000000, -0.0128287500000000 ]  - [  -0.0000623000000000, -0.0002223500000000, -0.0001702000000000 ]  - [  -0.0220279400000000,  0.0080532500000000, -0.0142665200000000 ]  - [   0.0004341800000000, -0.0000377500000000,  0.0004737100000000 ]  - [  -0.0015446500000000, -0.0021675800000000,  0.0009095400000000 ]  - [  -0.0004683500000000, -0.0003196300000000,  0.0006044500000000 ]  - [   0.0015198700000000,  0.0035526300000000,  0.0022772600000000 ]  - [   0.0011160600000000,  0.0012379300000000, -0.0005002700000000 ]- atom:   29  displacement:    [   0.0000000001998174,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0030261600000000,  0.0032464300000000, -0.0013627900000000 ]  - [   0.0000813400000000,  0.0002117200000000,  0.0002875400000000 ]  - [   0.0021611400000000, -0.0016053400000000, -0.0009014200000000 ]  - [   0.0001576300000000, -0.0004187400000000,  0.0004255400000000 ]  - [  -0.0076419100000000,  0.0188721700000000, -0.0115335100000000 ]  - [  -0.0002070900000000,  0.0014315200000000,  0.0003714900000000 ]  - [   0.0048960000000000, -0.0070990000000000, -0.0091688500000000 ]  - [   0.0013398200000000, -0.0024088700000000,  0.0015929500000000 ]  - [  -0.0068820800000000, -0.0022323700000000,  0.0047701600000000 ]  - [  -0.0048949500000000, -0.0050290200000000, -0.0034878100000000 ]  - [   0.0006683600000000,  0.0479900200000000, -0.0312367000000000 ]  - [  -0.0000643400000000,  0.0015502200000000,  0.0007045800000000 ]  - [  -0.0046011600000000,  0.0026876200000000,  0.0024724100000000 ]  - [  -0.0026944200000000,  0.0018020600000000,  0.0007461800000000 ]  - [  -0.0040406800000000, -0.0083542400000000, -0.0093905200000000 ]  - [   0.0004783000000000, -0.0013717800000000,  0.0010422500000000 ]  - [   0.0002654800000000, -0.0026122200000000,  0.0002767800000000 ]  - [   0.0008083600000000, -0.0002990500000000, -0.0012224800000000 ]  - [   0.0003400400000000, -0.0013368700000000, -0.0019884100000000 ]  - [   0.0006029000000000, -0.0031339800000000, -0.0021857600000000 ]  - [   0.0136955000000000,  0.0118897600000000,  0.0061440300000000 ]  - [   0.0001148900000000, -0.0002123400000000, -0.0005511900000000 ]  - [   0.0020033200000000,  0.0155334400000000, -0.0046031400000000 ]  - [   0.0001128700000000, -0.0004436300000000, -0.0005184000000000 ]  - [   0.0067093300000000,  0.0069288600000000, -0.0085234800000000 ]  - [   0.0009112100000000,  0.0017375900000000,  0.0006343700000000 ]  - [   0.0105984100000000,  0.0005457700000000, -0.0050668100000000 ]  - [   0.0002165400000000, -0.0002000500000000, -0.0002974200000000 ]  - [  -0.0160855300000000, -0.0908731700000000,  0.0562992900000000 ]  - [   0.0001574800000000, -0.0001107900000000, -0.0004638700000000 ]  - [   0.0029173500000000,  0.0019604600000000,  0.0020307900000000 ]  - [  -0.0007106900000000,  0.0002082400000000, -0.0003963100000000 ]  - [  -0.0007434300000000,  0.0029868200000000,  0.0010191500000000 ]  - [  -0.0014877900000000,  0.0028793000000000,  0.0002857100000000 ]  - [   0.0007380800000000, -0.0000306300000000, -0.0005243900000000 ]  - [   0.0014802100000000, -0.0008704800000000,  0.0013916400000000 ]  - [  -0.0005380700000000,  0.0004203700000000,  0.0007190800000000 ]  - [  -0.0008838800000000,  0.0012512500000000, -0.0015686800000000 ]  - [   0.0021326900000000,  0.0020957000000000,  0.0023116400000000 ]  - [   0.0008294300000000,  0.0002511700000000,  0.0008730600000000 ]  - [   0.0104072900000000,  0.0084847300000000,  0.0115327500000000 ]  - [  -0.0001907500000000, -0.0001910000000000, -0.0004076900000000 ]  - [  -0.0095317200000000, -0.0073280100000000,  0.0006254000000000 ]  - [   0.0002815000000000, -0.0004081500000000, -0.0001053100000000 ]  - [   0.0004962000000000,  0.0028996400000000, -0.0003644000000000 ]  - [   0.0002822300000000,  0.0008351000000000, -0.0005664600000000 ]  - [  -0.0011431500000000, -0.0025168200000000,  0.0034797500000000 ]  - [  -0.0005160800000000,  0.0003865800000000, -0.0036007400000000 ]- atom:   29  displacement:    [  -0.0000000001998174, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0030144200000000, -0.0032813400000000,  0.0013470400000000 ]  - [  -0.0000836800000000, -0.0002116900000000, -0.0002852400000000 ]  - [  -0.0021717200000000,  0.0016012600000000,  0.0009098200000000 ]  - [  -0.0001580900000000,  0.0004173000000000, -0.0004254500000000 ]  - [   0.0078704200000000, -0.0186863900000000,  0.0100667300000000 ]  - [   0.0002065900000000, -0.0014280400000000, -0.0017360900000000 ]  - [  -0.0042819400000000,  0.0066696400000000,  0.0088956600000000 ]  - [  -0.0007735200000000,  0.0019484100000000, -0.0017902000000000 ]  - [   0.0068486900000000,  0.0022229000000000, -0.0033645300000000 ]  - [   0.0049230100000000,  0.0050198000000000,  0.0048914300000000 ]  - [  -0.0016293500000000, -0.0500986900000000,  0.0335363300000000 ]  - [  -0.0003791700000000, -0.0021283000000000, -0.0004800500000000 ]  - [   0.0040738600000000, -0.0022537700000000, -0.0026926300000000 ]  - [   0.0021211100000000, -0.0013690900000000, -0.0009639000000000 ]  - [   0.0044204600000000,  0.0089813700000000,  0.0096544100000000 ]  - [  -0.0000351300000000,  0.0019562700000000, -0.0008171800000000 ]  - [  -0.0000346000000000,  0.0027171800000000, -0.0002677600000000 ]  - [  -0.0005753700000000,  0.0004135600000000,  0.0012335500000000 ]  - [  -0.0003020900000000,  0.0008298700000000,  0.0012387700000000 ]  - [  -0.0005553800000000,  0.0026253500000000,  0.0014168700000000 ]  - [  -0.0140765700000000, -0.0113258500000000, -0.0054053500000000 ]  - [  -0.0007951600000000,  0.0005444500000000,  0.0011617700000000 ]  - [  -0.0015208200000000, -0.0159760600000000,  0.0055540500000000 ]  - [   0.0003921500000000,  0.0004910400000000,  0.0012782100000000 ]  - [  -0.0063458500000000, -0.0062627400000000,  0.0079134500000000 ]  - [  -0.0005716200000000, -0.0010540800000000, -0.0012535700000000 ]  - [  -0.0108910800000000, -0.0003224400000000,  0.0051771400000000 ]  - [  -0.0003267900000000,  0.0004315400000000,  0.0002862300000000 ]  - [   0.0167681400000000,  0.0929216000000000, -0.0590511600000000 ]  - [   0.0002959900000000,  0.0004866200000000,  0.0001113000000000 ]  - [  -0.0027964500000000, -0.0022070200000000, -0.0020519800000000 ]  - [   0.0008218800000000, -0.0004428000000000,  0.0003848100000000 ]  - [   0.0003621500000000, -0.0025231300000000, -0.0006664700000000 ]  - [   0.0011029500000000, -0.0024178200000000,  0.0000513100000000 ]  - [  -0.0003685300000000, -0.0004230900000000,  0.0008636600000000 ]  - [  -0.0011105900000000,  0.0004269800000000, -0.0010477100000000 ]  - [   0.0004813100000000,  0.0000839800000000, -0.0014769600000000 ]  - [   0.0008649200000000, -0.0007716400000000,  0.0008224500000000 ]  - [  -0.0024636500000000, -0.0027711300000000, -0.0029224600000000 ]  - [  -0.0011730100000000, -0.0009339200000000, -0.0014985800000000 ]  - [  -0.0108457800000000, -0.0088815500000000, -0.0119347200000000 ]  - [  -0.0002612800000000, -0.0001886700000000,  0.0000559700000000 ]  - [   0.0101586400000000,  0.0070436800000000, -0.0000025200000000 ]  - [   0.0004006000000000,  0.0000721700000000,  0.0007177500000000 ]  - [  -0.0009964800000000, -0.0029495700000000,  0.0011286400000000 ]  - [  -0.0007860100000000, -0.0008829000000000,  0.0013256600000000 ]  - [   0.0009065200000000,  0.0023924700000000, -0.0034712400000000 ]  - [   0.0002758900000000, -0.0005057100000000,  0.0035827300000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0032248100000000, -0.0023184100000000,  0.0024081900000000 ]  - [   0.0003666000000000, -0.0000376000000000, -0.0011141900000000 ]  - [  -0.0007772300000000, -0.0000293100000000,  0.0012854900000000 ]  - [  -0.0002498600000000,  0.0002112600000000, -0.0009377500000000 ]  - [   0.0160465500000000,  0.0017671900000000,  0.0337292200000000 ]  - [  -0.0003398300000000, -0.0006762100000000, -0.0041699000000000 ]  - [  -0.0029254900000000, -0.0026743000000000,  0.0049061000000000 ]  - [  -0.0004526600000000,  0.0025651400000000, -0.0019702400000000 ]  - [   0.0090451000000000,  0.0006005700000000, -0.0055738000000000 ]  - [   0.0017741800000000,  0.0015793700000000,  0.0051834900000000 ]  - [  -0.0020085700000000, -0.0435498600000000,  0.0765267400000000 ]  - [   0.0000787900000000, -0.0022216200000000, -0.0038146400000000 ]  - [   0.0031622900000000, -0.0021125500000000, -0.0012509700000000 ]  - [   0.0017039600000000, -0.0007248500000000, -0.0027255000000000 ]  - [   0.0012055500000000,  0.0098274100000000,  0.0112898100000000 ]  - [  -0.0003570800000000,  0.0020780800000000, -0.0022331300000000 ]  - [  -0.0002331800000000,  0.0021409000000000, -0.0005381100000000 ]  - [  -0.0006040100000000, -0.0001735400000000,  0.0015033100000000 ]  - [   0.0001492900000000,  0.0007940400000000,  0.0009120400000000 ]  - [  -0.0016338100000000,  0.0014902700000000,  0.0017739300000000 ]  - [   0.0049586900000000,  0.0014375100000000, -0.0065082500000000 ]  - [  -0.0010554700000000,  0.0006093600000000,  0.0020168000000000 ]  - [  -0.0002282700000000, -0.0016022200000000, -0.0106334700000000 ]  - [   0.0005629300000000,  0.0009462800000000,  0.0022750500000000 ]  - [  -0.0090231000000000, -0.0073448700000000,  0.0104087400000000 ]  - [   0.0002290900000000,  0.0001198700000000, -0.0008472000000000 ]  - [  -0.0061920000000000, -0.0014582700000000, -0.0006435300000000 ]  - [  -0.0007958900000000,  0.0004877200000000,  0.0008924000000000 ]  - [  -0.0100822700000000,  0.0592983300000000, -0.1043892400000000 ]  - [   0.0001983200000000, -0.0000953000000000,  0.0013112400000000 ]  - [  -0.0042843900000000, -0.0016844700000000, -0.0029645400000000 ]  - [   0.0012159200000000, -0.0005234700000000,  0.0008743700000000 ]  - [  -0.0008915500000000, -0.0019314000000000,  0.0006305400000000 ]  - [   0.0010261200000000, -0.0018631000000000, -0.0003134400000000 ]  - [  -0.0006625900000000, -0.0000186400000000,  0.0006198000000000 ]  - [   0.0000772600000000,  0.0008893200000000, -0.0003120200000000 ]  - [   0.0013327700000000,  0.0003513500000000, -0.0003455600000000 ]  - [   0.0007908800000000, -0.0009544000000000,  0.0006630500000000 ]  - [  -0.0029045900000000, -0.0023137500000000, -0.0027072100000000 ]  - [  -0.0005610400000000, -0.0003025900000000, -0.0008797600000000 ]  - [  -0.0129824400000000, -0.0119379400000000, -0.0158182200000000 ]  - [  -0.0002210600000000,  0.0000402100000000,  0.0006773700000000 ]  - [   0.0125693300000000,  0.0014167700000000, -0.0041384400000000 ]  - [   0.0006955400000000, -0.0005016000000000,  0.0018195800000000 ]  - [  -0.0002795300000000, -0.0019336700000000,  0.0000004900000000 ]  - [  -0.0009707800000000, -0.0012653000000000,  0.0021483800000000 ]  - [   0.0002688400000000,  0.0044787900000000,  0.0045214700000000 ]  - [   0.0000339000000000, -0.0028805100000000,  0.0064515400000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0032905400000000,  0.0023378300000000, -0.0023849400000000 ]  - [  -0.0003631200000000,  0.0000388300000000,  0.0011099700000000 ]  - [   0.0007690100000000,  0.0000343600000000, -0.0012887100000000 ]  - [   0.0002459000000000, -0.0002087600000000,  0.0009340000000000 ]  - [  -0.0160075700000000, -0.0017909800000000, -0.0353007900000000 ]  - [   0.0003306200000000,  0.0006721600000000,  0.0027903000000000 ]  - [   0.0034717800000000,  0.0021874600000000, -0.0050336900000000 ]  - [   0.0010171100000000, -0.0029895700000000,  0.0017345200000000 ]  - [  -0.0089903400000000, -0.0006116300000000,  0.0069505200000000 ]  - [  -0.0017475900000000, -0.0015705500000000, -0.0038001800000000 ]  - [   0.0009429400000000,  0.0403172600000000, -0.0736920400000000 ]  - [  -0.0005157800000000,  0.0016349000000000,  0.0040285100000000 ]  - [  -0.0036637900000000,  0.0025279000000000,  0.0010526900000000 ]  - [  -0.0022810400000000,  0.0011525500000000,  0.0024901100000000 ]  - [  -0.0007301200000000, -0.0091746100000000, -0.0109946100000000 ]  - [   0.0007962800000000, -0.0014879100000000,  0.0024446000000000 ]  - [   0.0004594800000000, -0.0020154300000000,  0.0005403500000000 ]  - [   0.0008345700000000,  0.0002923400000000, -0.0014832500000000 ]  - [  -0.0001024500000000, -0.0012931400000000, -0.0016626300000000 ]  - [   0.0016951300000000, -0.0019785800000000, -0.0025350300000000 ]  - [  -0.0057379700000000, -0.0011570800000000,  0.0070852900000000 ]  - [   0.0003713900000000, -0.0002701900000000, -0.0013971100000000 ]  - [   0.0007704700000000,  0.0015924600000000,  0.0111891600000000 ]  - [  -0.0000563600000000, -0.0008967300000000, -0.0015069000000000 ]  - [   0.0092818500000000,  0.0079086100000000, -0.0108817600000000 ]  - [   0.0001017000000000,  0.0005574600000000,  0.0002308900000000 ]  - [   0.0058730900000000,  0.0016491900000000,  0.0006866500000000 ]  - [   0.0006828000000000, -0.0002527900000000, -0.0009006400000000 ]  - [   0.0114362500000000, -0.0560708200000000,  0.1016357300000000 ]  - [   0.0002557800000000,  0.0004728300000000, -0.0016576900000000 ]  - [   0.0043905900000000,  0.0014392800000000,  0.0029404100000000 ]  - [  -0.0010981300000000,  0.0002887700000000, -0.0008822200000000 ]  - [   0.0005044900000000,  0.0023740400000000, -0.0002798500000000 ]  - [  -0.0014065100000000,  0.0023103000000000,  0.0006675000000000 ]  - [   0.0010166500000000, -0.0004277500000000, -0.0002896900000000 ]  - [   0.0003043500000000, -0.0013335500000000,  0.0006681600000000 ]  - [  -0.0013659600000000,  0.0001637300000000, -0.0004213700000000 ]  - [  -0.0008096600000000,  0.0014376500000000, -0.0014035500000000 ]  - [   0.0025413600000000,  0.0016207000000000,  0.0020645000000000 ]  - [   0.0002198700000000, -0.0003791600000000,  0.0002609200000000 ]  - [   0.0125307900000000,  0.0115372200000000,  0.0154039200000000 ]  - [  -0.0002301400000000, -0.0004163900000000, -0.0010259000000000 ]  - [  -0.0118770800000000, -0.0017469700000000,  0.0046572700000000 ]  - [  -0.0000109400000000,  0.0001645500000000, -0.0012011100000000 ]  - [  -0.0002352800000000,  0.0018725300000000,  0.0007684200000000 ]  - [   0.0004601800000000,  0.0012138700000000, -0.0013797600000000 ]  - [  -0.0005066600000000, -0.0045176000000000, -0.0043970300000000 ]  - [  -0.0002774000000000,  0.0027914000000000, -0.0065339400000000 ]