# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/21301bc3-1043-4702-8d2f-d730deaece1b/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 Ag4Bi2O5 / Pnna (52) / materials id 28996](https://mdr.nims.go.jp/datasets/0ab3cd1c-dfc6-435c-8b62-93cd037fe2f7)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "Pnna"  number: 52  Hall_symbol: "-P 2a 2bc"supercell_matrix:- [   1,   0,   0 ]- [   0,   2,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [    14.329737939999999,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     5.748571050000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     8.470991590000001 ] # c  points:  - symbol: O  # 1    coordinates: [  0.615658890000000,  0.629793000000000,  0.906474430000000 ]    mass: 15.999400  - symbol: O  # 2    coordinates: [  0.884341110000000,  0.129793000000000,  0.593525570000000 ]    mass: 15.999400  - symbol: O  # 3    coordinates: [  0.884341110000000,  0.370207000000000,  0.906474430000000 ]    mass: 15.999400  - symbol: O  # 4    coordinates: [  0.615658890000000,  0.870207000000000,  0.593525570000000 ]    mass: 15.999400  - symbol: O  # 5    coordinates: [  0.384341110000000,  0.370207000000000,  0.093525570000000 ]    mass: 15.999400  - symbol: O  # 6    coordinates: [  0.115658890000000,  0.870207000000000,  0.406474430000000 ]    mass: 15.999400  - symbol: O  # 7    coordinates: [  0.115658890000000,  0.629793000000000,  0.093525570000000 ]    mass: 15.999400  - symbol: O  # 8    coordinates: [  0.384341110000000,  0.129793000000000,  0.406474430000000 ]    mass: 15.999400  - symbol: O  # 9    coordinates: [  0.043710380000000,  0.449130240000000,  0.631416790000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.456289620000000,  0.949130240000000,  0.868583210000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.543710380000000,  0.449130240000000,  0.368583210000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.956289620000000,  0.949130240000000,  0.131416790000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.956289620000000,  0.550869760000000,  0.368583210000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.543710380000000,  0.050869760000000,  0.131416790000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.250000000000000,  0.500000000000000,  0.559293160000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.250000000000000,  0.000000000000000,  0.940706840000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.750000000000000,  0.500000000000000,  0.440706840000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.043710380000000,  0.050869760000000,  0.868583210000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.750000000000000,  0.000000000000000,  0.059293160000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.456289620000000,  0.550869760000000,  0.631416790000000 ]    mass: 15.999400  - symbol: Ag # 21    coordinates: [  0.082169650000000,  0.989789200000000,  0.636495030000000 ]    mass: 107.868200  - symbol: Ag # 22    coordinates: [  0.417830350000000,  0.489789200000000,  0.863504970000000 ]    mass: 107.868200  - symbol: Ag # 23    coordinates: [  0.417830350000000,  0.010210800000000,  0.636495030000000 ]    mass: 107.868200  - symbol: Ag # 24    coordinates: [  0.082169650000000,  0.510210800000000,  0.863504970000000 ]    mass: 107.868200  - symbol: Ag # 25    coordinates: [  0.582169650000000,  0.989789200000000,  0.363504970000000 ]    mass: 107.868200  - symbol: Ag # 26    coordinates: [  0.917830350000000,  0.010210800000000,  0.363504970000000 ]    mass: 107.868200  - symbol: Ag # 27    coordinates: [  0.750000000000000,  0.500000000000000,  0.931004100000000 ]    mass: 107.868200  - symbol: Ag # 28    coordinates: [  0.750000000000000,  0.000000000000000,  0.568995900000000 ]    mass: 107.868200  - symbol: Ag # 29    coordinates: [  0.250000000000000,  0.500000000000000,  0.068995900000000 ]    mass: 107.868200  - symbol: Ag # 30    coordinates: [  0.250000000000000,  0.000000000000000,  0.431004100000000 ]    mass: 107.868200  - symbol: Ag # 31    coordinates: [  0.248428380000000,  0.250000000000000,  0.750000000000000 ]    mass: 107.868200  - symbol: Ag # 32    coordinates: [  0.251571620000000,  0.750000000000000,  0.750000000000000 ]    mass: 107.868200  - symbol: Ag # 33    coordinates: [  0.751571620000000,  0.750000000000000,  0.250000000000000 ]    mass: 107.868200  - symbol: Ag # 34    coordinates: [  0.748428380000000,  0.250000000000000,  0.250000000000000 ]    mass: 107.868200  - symbol: Ag # 35    coordinates: [  0.582169650000000,  0.510210800000000,  0.136495030000000 ]    mass: 107.868200  - symbol: Ag # 36    coordinates: [  0.917830350000000,  0.489789200000000,  0.136495030000000 ]    mass: 107.868200  - symbol: Bi # 37    coordinates: [  0.610910490000000,  0.497039110000000,  0.592859300000000 ]    mass: 208.980400  - symbol: Bi # 38    coordinates: [  0.889089510000000,  0.997039110000000,  0.907140700000000 ]    mass: 208.980400  - symbol: Bi # 39    coordinates: [  0.889089510000000,  0.502960890000000,  0.592859300000000 ]    mass: 208.980400  - symbol: Bi # 40    coordinates: [  0.610910490000000,  0.002960890000000,  0.907140700000000 ]    mass: 208.980400  - symbol: Bi # 41    coordinates: [  0.389089510000000,  0.502960890000000,  0.407140700000000 ]    mass: 208.980400  - symbol: Bi # 42    coordinates: [  0.110910490000000,  0.002960890000000,  0.092859300000000 ]    mass: 208.980400  - symbol: Bi # 43    coordinates: [  0.110910490000000,  0.497039110000000,  0.407140700000000 ]    mass: 208.980400  - symbol: Bi # 44    coordinates: [  0.389089510000000,  0.997039110000000,  0.092859300000000 ]    mass: 208.980400  reciprocal_lattice: # without 2pi  - [     0.069784946813898,     0.000000000000000,     0.000000000000000 ] # a*  - [     0.000000000000000,     0.173956273881315,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.118049934222636 ] # c*unit_cell:  lattice:  - [    14.329737939999999,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     5.748571050000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     8.470991590000001 ] # c  points:  - symbol: O  # 1    coordinates: [  0.615658890000000,  0.629793000000000,  0.906474430000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.884341110000000,  0.129793000000000,  0.593525570000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 3    coordinates: [  0.884341110000000,  0.370207000000000,  0.906474430000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.615658890000000,  0.870207000000000,  0.593525570000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 5    coordinates: [  0.384341110000000,  0.370207000000000,  0.093525570000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.115658890000000,  0.870207000000000,  0.406474430000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 7    coordinates: [  0.115658890000000,  0.629793000000000,  0.093525570000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.384341110000000,  0.129793000000000,  0.406474430000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 9    coordinates: [  0.043710380000000,  0.449130240000000,  0.631416790000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.456289620000000,  0.949130240000000,  0.868583210000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.543710380000000,  0.449130240000000,  0.368583210000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.956289620000000,  0.949130240000000,  0.131416790000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.956289620000000,  0.550869760000000,  0.368583210000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.543710380000000,  0.050869760000000,  0.131416790000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.250000000000000,  0.500000000000000,  0.559293160000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.250000000000000,  0.000000000000000,  0.940706840000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.750000000000000,  0.500000000000000,  0.440706840000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.043710380000000,  0.050869760000000,  0.868583210000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.750000000000000,  0.000000000000000,  0.059293160000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.456289620000000,  0.550869760000000,  0.631416790000000 ]    mass: 15.999400    reduced_to: 20  - symbol: Ag # 21    coordinates: [  0.082169650000000,  0.989789200000000,  0.636495030000000 ]    mass: 107.868200    reduced_to: 21  - symbol: Ag # 22    coordinates: [  0.417830350000000,  0.489789200000000,  0.863504970000000 ]    mass: 107.868200    reduced_to: 22  - symbol: Ag # 23    coordinates: [  0.417830350000000,  0.010210800000000,  0.636495030000000 ]    mass: 107.868200    reduced_to: 23  - symbol: Ag # 24    coordinates: [  0.082169650000000,  0.510210800000000,  0.863504970000000 ]    mass: 107.868200    reduced_to: 24  - symbol: Ag # 25    coordinates: [  0.582169650000000,  0.989789200000000,  0.363504970000000 ]    mass: 107.868200    reduced_to: 25  - symbol: Ag # 26    coordinates: [  0.917830350000000,  0.010210800000000,  0.363504970000000 ]    mass: 107.868200    reduced_to: 26  - symbol: Ag # 27    coordinates: [  0.750000000000000,  0.500000000000000,  0.931004100000000 ]    mass: 107.868200    reduced_to: 27  - symbol: Ag # 28    coordinates: [  0.750000000000000,  0.000000000000000,  0.568995900000000 ]    mass: 107.868200    reduced_to: 28  - symbol: Ag # 29    coordinates: [  0.250000000000000,  0.500000000000000,  0.068995900000000 ]    mass: 107.868200    reduced_to: 29  - symbol: Ag # 30    coordinates: [  0.250000000000000,  0.000000000000000,  0.431004100000000 ]    mass: 107.868200    reduced_to: 30  - symbol: Ag # 31    coordinates: [  0.248428380000000,  0.250000000000000,  0.750000000000000 ]    mass: 107.868200    reduced_to: 31  - symbol: Ag # 32    coordinates: [  0.251571620000000,  0.750000000000000,  0.750000000000000 ]    mass: 107.868200    reduced_to: 32  - symbol: Ag # 33    coordinates: [  0.751571620000000,  0.750000000000000,  0.250000000000000 ]    mass: 107.868200    reduced_to: 33  - symbol: Ag # 34    coordinates: [  0.748428380000000,  0.250000000000000,  0.250000000000000 ]    mass: 107.868200    reduced_to: 34  - symbol: Ag # 35    coordinates: [  0.582169650000000,  0.510210800000000,  0.136495030000000 ]    mass: 107.868200    reduced_to: 35  - symbol: Ag # 36    coordinates: [  0.917830350000000,  0.489789200000000,  0.136495030000000 ]    mass: 107.868200    reduced_to: 36  - symbol: Bi # 37    coordinates: [  0.610910490000000,  0.497039110000000,  0.592859300000000 ]    mass: 208.980400    reduced_to: 37  - symbol: Bi # 38    coordinates: [  0.889089510000000,  0.997039110000000,  0.907140700000000 ]    mass: 208.980400    reduced_to: 38  - symbol: Bi # 39    coordinates: [  0.889089510000000,  0.502960890000000,  0.592859300000000 ]    mass: 208.980400    reduced_to: 39  - symbol: Bi # 40    coordinates: [  0.610910490000000,  0.002960890000000,  0.907140700000000 ]    mass: 208.980400    reduced_to: 40  - symbol: Bi # 41    coordinates: [  0.389089510000000,  0.502960890000000,  0.407140700000000 ]    mass: 208.980400    reduced_to: 41  - symbol: Bi # 42    coordinates: [  0.110910490000000,  0.002960890000000,  0.092859300000000 ]    mass: 208.980400    reduced_to: 42  - symbol: Bi # 43    coordinates: [  0.110910490000000,  0.497039110000000,  0.407140700000000 ]    mass: 208.980400    reduced_to: 43  - symbol: Bi # 44    coordinates: [  0.389089510000000,  0.997039110000000,  0.092859300000000 ]    mass: 208.980400    reduced_to: 44supercell:  lattice:  - [    14.329737939999999,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    11.497142100000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     8.470991590000001 ] # c  points:  - symbol: O  # 1    coordinates: [  0.615658890000000,  0.314896500000000,  0.906474430000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.615658890000000,  0.814896500000000,  0.906474430000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 3    coordinates: [  0.884341110000000,  0.064896500000000,  0.593525570000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.884341110000000,  0.564896500000000,  0.593525570000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 5    coordinates: [  0.884341110000000,  0.185103500000000,  0.906474430000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.884341110000000,  0.685103500000000,  0.906474430000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 7    coordinates: [  0.615658890000000,  0.435103500000000,  0.593525570000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.615658890000000,  0.935103500000000,  0.593525570000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 9    coordinates: [  0.384341110000000,  0.185103500000000,  0.093525570000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.384341110000000,  0.685103500000000,  0.093525570000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 11    coordinates: [  0.115658890000000,  0.435103500000000,  0.406474430000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.115658890000000,  0.935103500000000,  0.406474430000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 13    coordinates: [  0.115658890000000,  0.314896500000000,  0.093525570000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.115658890000000,  0.814896500000000,  0.093525570000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 15    coordinates: [  0.384341110000000,  0.064896500000000,  0.406474430000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.384341110000000,  0.564896500000000,  0.406474430000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 17    coordinates: [  0.043710380000000,  0.224565120000000,  0.631416790000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.043710380000000,  0.724565120000000,  0.631416790000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 19    coordinates: [  0.456289620000000,  0.474565120000000,  0.868583210000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.456289620000000,  0.974565120000000,  0.868583210000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 21    coordinates: [  0.543710380000000,  0.224565120000000,  0.368583210000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.543710380000000,  0.724565120000000,  0.368583210000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 23    coordinates: [  0.956289620000000,  0.474565120000000,  0.131416790000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.956289620000000,  0.974565120000000,  0.131416790000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 25    coordinates: [  0.956289620000000,  0.275434880000000,  0.368583210000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.956289620000000,  0.775434880000000,  0.368583210000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 27    coordinates: [  0.543710380000000,  0.025434880000000,  0.131416790000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.543710380000000,  0.525434880000000,  0.131416790000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 29    coordinates: [  0.250000000000000,  0.250000000000000,  0.559293160000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.250000000000000,  0.750000000000000,  0.559293160000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 31    coordinates: [  0.250000000000000,  0.000000000000000,  0.940706840000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.250000000000000,  0.500000000000000,  0.940706840000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 33    coordinates: [  0.750000000000000,  0.250000000000000,  0.440706840000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.750000000000000,  0.750000000000000,  0.440706840000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 35    coordinates: [  0.043710380000000,  0.025434880000000,  0.868583210000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.043710380000000,  0.525434880000000,  0.868583210000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 37    coordinates: [  0.750000000000000,  0.000000000000000,  0.059293160000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.750000000000000,  0.500000000000000,  0.059293160000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 39    coordinates: [  0.456289620000000,  0.275434880000000,  0.631416790000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.456289620000000,  0.775434880000000,  0.631416790000000 ]    mass: 15.999400    reduced_to: 39  - symbol: Ag # 41    coordinates: [  0.082169650000000,  0.494894600000000,  0.636495030000000 ]    mass: 107.868200    reduced_to: 41  - symbol: Ag # 42    coordinates: [  0.082169650000000,  0.994894600000000,  0.636495030000000 ]    mass: 107.868200    reduced_to: 41  - symbol: Ag # 43    coordinates: [  0.417830350000000,  0.244894600000000,  0.863504970000000 ]    mass: 107.868200    reduced_to: 43  - symbol: Ag # 44    coordinates: [  0.417830350000000,  0.744894600000000,  0.863504970000000 ]    mass: 107.868200    reduced_to: 43  - symbol: Ag # 45    coordinates: [  0.417830350000000,  0.005105400000000,  0.636495030000000 ]    mass: 107.868200    reduced_to: 45  - symbol: Ag # 46    coordinates: [  0.417830350000000,  0.505105400000000,  0.636495030000000 ]    mass: 107.868200    reduced_to: 45  - symbol: Ag # 47    coordinates: [  0.082169650000000,  0.255105400000000,  0.863504970000000 ]    mass: 107.868200    reduced_to: 47  - symbol: Ag # 48    coordinates: [  0.082169650000000,  0.755105400000000,  0.863504970000000 ]    mass: 107.868200    reduced_to: 47  - symbol: Ag # 49    coordinates: [  0.582169650000000,  0.494894600000000,  0.363504970000000 ]    mass: 107.868200    reduced_to: 49  - symbol: Ag # 50    coordinates: [  0.582169650000000,  0.994894600000000,  0.363504970000000 ]    mass: 107.868200    reduced_to: 49  - symbol: Ag # 51    coordinates: [  0.917830350000000,  0.005105400000000,  0.363504970000000 ]    mass: 107.868200    reduced_to: 51  - symbol: Ag # 52    coordinates: [  0.917830350000000,  0.505105400000000,  0.363504970000000 ]    mass: 107.868200    reduced_to: 51  - symbol: Ag # 53    coordinates: [  0.750000000000000,  0.250000000000000,  0.931004100000000 ]    mass: 107.868200    reduced_to: 53  - symbol: Ag # 54    coordinates: [  0.750000000000000,  0.750000000000000,  0.931004100000000 ]    mass: 107.868200    reduced_to: 53  - symbol: Ag # 55    coordinates: [  0.750000000000000,  0.000000000000000,  0.568995900000000 ]    mass: 107.868200    reduced_to: 55  - symbol: Ag # 56    coordinates: [  0.750000000000000,  0.500000000000000,  0.568995900000000 ]    mass: 107.868200    reduced_to: 55  - symbol: Ag # 57    coordinates: [  0.250000000000000,  0.250000000000000,  0.068995900000000 ]    mass: 107.868200    reduced_to: 57  - symbol: Ag # 58    coordinates: [  0.250000000000000,  0.750000000000000,  0.068995900000000 ]    mass: 107.868200    reduced_to: 57  - symbol: Ag # 59    coordinates: [  0.250000000000000,  0.000000000000000,  0.431004100000000 ]    mass: 107.868200    reduced_to: 59  - symbol: Ag # 60    coordinates: [  0.250000000000000,  0.500000000000000,  0.431004100000000 ]    mass: 107.868200    reduced_to: 59  - symbol: Ag # 61    coordinates: [  0.248428380000000,  0.125000000000000,  0.750000000000000 ]    mass: 107.868200    reduced_to: 61  - symbol: Ag # 62    coordinates: [  0.248428380000000,  0.625000000000000,  0.750000000000000 ]    mass: 107.868200    reduced_to: 61  - symbol: Ag # 63    coordinates: [  0.251571620000000,  0.375000000000000,  0.750000000000000 ]    mass: 107.868200    reduced_to: 63  - symbol: Ag # 64    coordinates: [  0.251571620000000,  0.875000000000000,  0.750000000000000 ]    mass: 107.868200    reduced_to: 63  - symbol: Ag # 65    coordinates: [  0.751571620000000,  0.375000000000000,  0.250000000000000 ]    mass: 107.868200    reduced_to: 65  - symbol: Ag # 66    coordinates: [  0.751571620000000,  0.875000000000000,  0.250000000000000 ]    mass: 107.868200    reduced_to: 65  - symbol: Ag # 67    coordinates: [  0.748428380000000,  0.125000000000000,  0.250000000000000 ]    mass: 107.868200    reduced_to: 67  - symbol: Ag # 68    coordinates: [  0.748428380000000,  0.625000000000000,  0.250000000000000 ]    mass: 107.868200    reduced_to: 67  - symbol: Ag # 69    coordinates: [  0.582169650000000,  0.255105400000000,  0.136495030000000 ]    mass: 107.868200    reduced_to: 69  - symbol: Ag # 70    coordinates: [  0.582169650000000,  0.755105400000000,  0.136495030000000 ]    mass: 107.868200    reduced_to: 69  - symbol: Ag # 71    coordinates: [  0.917830350000000,  0.244894600000000,  0.136495030000000 ]    mass: 107.868200    reduced_to: 71  - symbol: Ag # 72    coordinates: [  0.917830350000000,  0.744894600000000,  0.136495030000000 ]    mass: 107.868200    reduced_to: 71  - symbol: Bi # 73    coordinates: [  0.610910490000000,  0.248519555000000,  0.592859300000000 ]    mass: 208.980400    reduced_to: 73  - symbol: Bi # 74    coordinates: [  0.610910490000000,  0.748519555000000,  0.592859300000000 ]    mass: 208.980400    reduced_to: 73  - symbol: Bi # 75    coordinates: [  0.889089510000000,  0.498519555000000,  0.907140700000000 ]    mass: 208.980400    reduced_to: 75  - symbol: Bi # 76    coordinates: [  0.889089510000000,  0.998519555000000,  0.907140700000000 ]    mass: 208.980400    reduced_to: 75  - symbol: Bi # 77    coordinates: [  0.889089510000000,  0.251480445000000,  0.592859300000000 ]    mass: 208.980400    reduced_to: 77  - symbol: Bi # 78    coordinates: [  0.889089510000000,  0.751480445000000,  0.592859300000000 ]    mass: 208.980400    reduced_to: 77  - symbol: Bi # 79    coordinates: [  0.610910490000000,  0.001480445000000,  0.907140700000000 ]    mass: 208.980400    reduced_to: 79  - symbol: Bi # 80    coordinates: [  0.610910490000000,  0.501480445000000,  0.907140700000000 ]    mass: 208.980400    reduced_to: 79  - symbol: Bi # 81    coordinates: [  0.389089510000000,  0.251480445000000,  0.407140700000000 ]    mass: 208.980400    reduced_to: 81  - symbol: Bi # 82    coordinates: [  0.389089510000000,  0.751480445000000,  0.407140700000000 ]    mass: 208.980400    reduced_to: 81  - symbol: Bi # 83    coordinates: [  0.110910490000000,  0.001480445000000,  0.092859300000000 ]    mass: 208.980400    reduced_to: 83  - symbol: Bi # 84    coordinates: [  0.110910490000000,  0.501480445000000,  0.092859300000000 ]    mass: 208.980400    reduced_to: 83  - symbol: Bi # 85    coordinates: [  0.110910490000000,  0.248519555000000,  0.407140700000000 ]    mass: 208.980400    reduced_to: 85  - symbol: Bi # 86    coordinates: [  0.110910490000000,  0.748519555000000,  0.407140700000000 ]    mass: 208.980400    reduced_to: 85  - symbol: Bi # 87    coordinates: [  0.389089510000000,  0.498519555000000,  0.092859300000000 ]    mass: 208.980400    reduced_to: 87  - symbol: Bi # 88    coordinates: [  0.389089510000000,  0.998519555000000,  0.092859300000000 ]    mass: 208.980400    reduced_to: 87displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0987621500000000,  0.0304973500000000, -0.0040892600000000 ]  - [  -0.0038869100000000,  0.0044610400000000, -0.0082313200000000 ]  - [   0.0034931400000000,  0.0044007600000000,  0.0080500300000000 ]  - [   0.0034933100000000,  0.0048760700000000,  0.0078476900000000 ]  - [  -0.0013289100000000, -0.0054612300000000, -0.0045357600000000 ]  - [   0.0037044800000000, -0.0038659400000000, -0.0083425600000000 ]  - [  -0.0047354100000000, -0.0050082500000000,  0.0085969200000000 ]  - [  -0.0037240300000000, -0.0047901300000000,  0.0080642400000000 ]  - [   0.0048121800000000, -0.0029843600000000,  0.0068191700000000 ]  - [   0.0036439300000000, -0.0053565700000000,  0.0078030100000000 ]  - [  -0.0030662800000000, -0.0044528500000000, -0.0080166600000000 ]  - [  -0.0031611700000000, -0.0044578800000000, -0.0080512200000000 ]  - [  -0.0027854500000000,  0.0044069400000000,  0.0080716200000000 ]  - [  -0.0030213100000000,  0.0044724500000000,  0.0080901700000000 ]  - [   0.0033763100000000,  0.0049248500000000, -0.0082608800000000 ]  - [   0.0033768500000000,  0.0044512900000000, -0.0082710400000000 ]  - [   0.0022040000000000, -0.0031496000000000, -0.0047041400000000 ]  - [   0.0016886700000000, -0.0029962600000000, -0.0045891700000000 ]  - [   0.0038169300000000, -0.0104807400000000,  0.0049111000000000 ]  - [  -0.0021716800000000, -0.0029603900000000,  0.0048079600000000 ]  - [  -0.0027629200000000, -0.0024037700000000,  0.0051782100000000 ]  - [   0.0007106300000000, -0.0031385100000000,  0.0044374500000000 ]  - [  -0.0002232300000000, -0.0028749400000000, -0.0042927500000000 ]  - [  -0.0005492600000000, -0.0030641600000000, -0.0043555100000000 ]  - [  -0.0003189200000000,  0.0028242800000000,  0.0041744000000000 ]  - [  -0.0007047000000000,  0.0029823000000000,  0.0046440800000000 ]  - [   0.0007621100000000,  0.0041466100000000, -0.0046020900000000 ]  - [   0.0007452200000000,  0.0000317200000000, -0.0048670800000000 ]  - [   0.0007092500000000, -0.0000400900000000,  0.0054213300000000 ]  - [   0.0003865000000000, -0.0001157800000000,  0.0048428200000000 ]  - [   0.0006026100000000,  0.0004010900000000, -0.0048601800000000 ]  - [   0.0013476900000000, -0.0001322700000000, -0.0049684800000000 ]  - [  -0.0010590100000000, -0.0000516600000000, -0.0035288000000000 ]  - [  -0.0003644900000000, -0.0000515700000000, -0.0047358600000000 ]  - [   0.0020638900000000,  0.0029322700000000,  0.0045672800000000 ]  - [   0.0025570400000000,  0.0031565000000000,  0.0047518000000000 ]  - [  -0.0002357400000000, -0.0013453600000000,  0.0046429000000000 ]  - [   0.0000945100000000,  0.0054290900000000,  0.0061135600000000 ]  - [  -0.0014282700000000,  0.0039593700000000, -0.0009151700000000 ]  - [  -0.0017368800000000,  0.0029104800000000, -0.0045608400000000 ]  - [  -0.0020921200000000,  0.0032820200000000,  0.0051035000000000 ]  - [  -0.0020395900000000,  0.0032436900000000,  0.0050715000000000 ]  - [   0.0012609800000000,  0.0018250900000000, -0.0044888600000000 ]  - [   0.0019645800000000,  0.0035220000000000, -0.0050811900000000 ]  - [   0.0019354400000000, -0.0034341600000000,  0.0050216400000000 ]  - [   0.0018439300000000, -0.0031941600000000,  0.0039084700000000 ]  - [  -0.0021369800000000, -0.0033222100000000, -0.0050707700000000 ]  - [  -0.0020749700000000, -0.0033141900000000, -0.0050243600000000 ]  - [  -0.0017118800000000,  0.0031500500000000, -0.0046614600000000 ]  - [  -0.0016804500000000,  0.0032962200000000, -0.0047864200000000 ]  - [   0.0018490100000000, -0.0031740700000000, -0.0050065300000000 ]  - [   0.0017903900000000, -0.0032333600000000, -0.0049253100000000 ]  - [   0.0805241600000000, -0.0271567200000000, -0.0022119300000000 ]  - [   0.0000853300000000, -0.0003178500000000, -0.0015614400000000 ]  - [   0.0001034100000000,  0.0001008400000000,  0.0015982900000000 ]  - [   0.0004546500000000,  0.0002005900000000,  0.0015374300000000 ]  - [  -0.0007331300000000,  0.0003111900000000,  0.0015879400000000 ]  - [  -0.0003063400000000,  0.0001121300000000,  0.0015731600000000 ]  - [  -0.0001961700000000, -0.0000954600000000, -0.0015879000000000 ]  - [  -0.0002004000000000, -0.0000257100000000, -0.0016299500000000 ]  - [   0.0005352100000000, -0.0002820900000000, -0.0001908700000000 ]  - [   0.0009633900000000,  0.0001384400000000, -0.0000984800000000 ]  - [  -0.0015991000000000,  0.0000996300000000, -0.0001304700000000 ]  - [  -0.0012583000000000, -0.0000416700000000, -0.0000497800000000 ]  - [  -0.0007233200000000,  0.0005877200000000,  0.0007629900000000 ]  - [  -0.0010422800000000,  0.0000919800000000, -0.0001653200000000 ]  - [   0.0014184100000000, -0.0002352100000000,  0.0004919900000000 ]  - [   0.0014184000000000, -0.0002294200000000, -0.0006574900000000 ]  - [   0.0036058900000000, -0.0007997100000000, -0.0069155100000000 ]  - [  -0.0016559400000000, -0.0029424500000000,  0.0049293200000000 ]  - [   0.0019572300000000,  0.0030506600000000,  0.0048807200000000 ]  - [   0.0018374600000000,  0.0031893300000000,  0.0048727000000000 ]  - [   0.0002679100000000,  0.0024120100000000,  0.0017910500000000 ]  - [  -0.0025648000000000,  0.0036784200000000,  0.0046254200000000 ]  - [   0.0016352500000000,  0.0027536900000000, -0.0045303100000000 ]  - [   0.0028679500000000,  0.0048851400000000, -0.0045378300000000 ]  - [   0.0025837600000000, -0.0030726200000000,  0.0056819700000000 ]  - [   0.0032332000000000, -0.0037476100000000,  0.0048025300000000 ]  - [  -0.0018026600000000, -0.0039172400000000, -0.0051653900000000 ]  - [   0.0084009700000000,  0.0010804800000000, -0.0047214100000000 ]  - [   0.0037900600000000, -0.0039685400000000, -0.0051021600000000 ]  - [   0.0037127000000000, -0.0033033800000000, -0.0044257000000000 ]  - [  -0.0047398400000000, -0.0034992400000000,  0.0045815500000000 ]  - [  -0.0050624700000000, -0.0034196600000000,  0.0046325100000000 ]  - [  -0.0049941000000000,  0.0034932100000000, -0.0045773800000000 ]  - [  -0.0043730800000000,  0.0035083200000000, -0.0046530400000000 ]  - [   0.0015338600000000,  0.0042306700000000,  0.0071242600000000 ]  - [   0.0038518300000000,  0.0024010400000000,  0.0043213300000000 ]- atom:    1  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0881762300000000, -0.0194432900000000, -0.0126080700000000 ]  - [  -0.0029657700000000,  0.0046646500000000, -0.0080241200000000 ]  - [   0.0033547600000000,  0.0047371000000000,  0.0082002800000000 ]  - [   0.0033548800000000,  0.0042645000000000,  0.0084014800000000 ]  - [   0.0081987400000000, -0.0037673800000000, -0.0116912700000000 ]  - [   0.0031440100000000, -0.0052631200000000, -0.0079088600000000 ]  - [  -0.0021223300000000, -0.0041339800000000,  0.0076784500000000 ]  - [  -0.0031274700000000, -0.0043557900000000,  0.0081873400000000 ]  - [   0.0020377700000000, -0.0061653600000000,  0.0094478700000000 ]  - [   0.0032103300000000, -0.0037870200000000,  0.0084531000000000 ]  - [  -0.0037844300000000, -0.0046864900000000, -0.0082347100000000 ]  - [  -0.0036890300000000, -0.0046839700000000, -0.0082001100000000 ]  - [  -0.0040636900000000,  0.0047346300000000,  0.0081816200000000 ]  - [  -0.0038288500000000,  0.0046650000000000,  0.0081627100000000 ]  - [   0.0034757000000000,  0.0042146100000000, -0.0079907600000000 ]  - [   0.0034763100000000,  0.0046897800000000, -0.0079833400000000 ]  - [   0.0002098300000000, -0.0028099500000000, -0.0044487200000000 ]  - [   0.0007217900000000, -0.0029627200000000, -0.0045643100000000 ]  - [  -0.0063243000000000,  0.0046416900000000,  0.0042046600000000 ]  - [  -0.0002429800000000, -0.0030015400000000,  0.0043464200000000 ]  - [   0.0051983000000000, -0.0035545400000000,  0.0040636100000000 ]  - [   0.0017017900000000, -0.0028238900000000,  0.0047168300000000 ]  - [  -0.0021891300000000, -0.0030836100000000, -0.0048559500000000 ]  - [  -0.0018586700000000, -0.0028978800000000, -0.0047935000000000 ]  - [  -0.0020894000000000,  0.0031341600000000,  0.0049761400000000 ]  - [  -0.0017068600000000,  0.0029758200000000,  0.0045092900000000 ]  - [   0.0016494100000000,  0.0018192200000000, -0.0045488100000000 ]  - [   0.0016878400000000,  0.0059410700000000, -0.0042872500000000 ]  - [  -0.0007062100000000,  0.0000409100000000,  0.0039888700000000 ]  - [  -0.0003841500000000,  0.0001151800000000,  0.0045721100000000 ]  - [  -0.0006011000000000, -0.0004049000000000, -0.0045530000000000 ]  - [  -0.0013456300000000,  0.0001327100000000, -0.0044419300000000 ]  - [   0.0010424500000000,  0.0000517400000000, -0.0058725500000000 ]  - [   0.0003582600000000,  0.0000505000000000, -0.0046775900000000 ]  - [   0.0003542800000000,  0.0030222200000000,  0.0045868300000000 ]  - [  -0.0001389700000000,  0.0028026300000000,  0.0044022500000000 ]  - [   0.0002352200000000,  0.0013205800000000,  0.0047722800000000 ]  - [  -0.0000908300000000, -0.0053572300000000,  0.0033258200000000 ]  - [  -0.0009985700000000,  0.0019928700000000, -0.0082800200000000 ]  - [  -0.0006686000000000,  0.0030474000000000, -0.0045939400000000 ]  - [  -0.0016616700000000,  0.0032238800000000,  0.0048641500000000 ]  - [  -0.0017152400000000,  0.0032639500000000,  0.0048964400000000 ]  - [   0.0024981800000000,  0.0046946000000000, -0.0054811300000000 ]  - [   0.0017879800000000,  0.0029824100000000, -0.0048858900000000 ]  - [   0.0018170900000000, -0.0030725400000000,  0.0049470700000000 ]  - [   0.0019063900000000, -0.0033114500000000,  0.0060666900000000 ]  - [  -0.0016198200000000, -0.0031866100000000, -0.0048980900000000 ]  - [  -0.0016790900000000, -0.0031934500000000, -0.0049436700000000 ]  - [  -0.0020421100000000,  0.0033609600000000, -0.0053027100000000 ]  - [  -0.0020726100000000,  0.0032116100000000, -0.0051819200000000 ]  - [   0.0019039200000000, -0.0033297200000000, -0.0049603900000000 ]  - [   0.0019620400000000, -0.0032733900000000, -0.0050415300000000 ]  - [  -0.0768955900000000,  0.0255795300000000, -0.0004959700000000 ]  - [  -0.0000887300000000,  0.0003100400000000, -0.0015809500000000 ]  - [  -0.0001010900000000, -0.0000990900000000,  0.0015439200000000 ]  - [  -0.0004498200000000, -0.0001989800000000,  0.0016042500000000 ]  - [   0.0007347100000000, -0.0003111900000000,  0.0015514400000000 ]  - [   0.0003054400000000, -0.0001118100000000,  0.0015691700000000 ]  - [   0.0001951800000000,  0.0000948100000000, -0.0015538300000000 ]  - [   0.0001995100000000,  0.0000240600000000, -0.0015116500000000 ]  - [   0.0018002400000000,  0.0002867600000000,  0.0001943800000000 ]  - [   0.0013690700000000, -0.0001388300000000,  0.0000995500000000 ]  - [  -0.0007312500000000, -0.0001027900000000,  0.0001319200000000 ]  - [  -0.0010732000000000,  0.0000419500000000,  0.0000501200000000 ]  - [  -0.0016045000000000, -0.0005911300000000, -0.0007572600000000 ]  - [  -0.0012881700000000, -0.0000895300000000,  0.0001629900000000 ]  - [   0.0009120900000000,  0.0002340000000000, -0.0004881100000000 ]  - [   0.0009144400000000,  0.0002253900000000,  0.0006515200000000 ]  - [  -0.0072003200000000, -0.0057143600000000,  0.0167444000000000 ]  - [  -0.0020955100000000, -0.0035654600000000,  0.0050346200000000 ]  - [   0.0018072600000000,  0.0034520900000000,  0.0050891800000000 ]  - [   0.0019143600000000,  0.0033165000000000,  0.0050946600000000 ]  - [  -0.0073388400000000,  0.0046401000000000,  0.0073996200000000 ]  - [  -0.0045044500000000,  0.0033830000000000,  0.0045777000000000 ]  - [   0.0054363700000000,  0.0042940200000000, -0.0046792600000000 ]  - [   0.0042088700000000,  0.0021915100000000, -0.0046699400000000 ]  - [   0.0044858700000000, -0.0039826000000000,  0.0035341300000000 ]  - [   0.0038391600000000, -0.0033083700000000,  0.0044038400000000 ]  - [  -0.0052600900000000, -0.0031310900000000, -0.0040421300000000 ]  - [  -0.0154559400000000, -0.0085341800000000, -0.0044429900000000 ]  - [   0.0032621900000000, -0.0030858900000000, -0.0040968600000000 ]  - [   0.0033488200000000, -0.0037522400000000, -0.0047771400000000 ]  - [  -0.0023339600000000, -0.0035553600000000,  0.0046198100000000 ]  - [  -0.0020079100000000, -0.0036380100000000,  0.0045706600000000 ]  - [  -0.0020773400000000,  0.0035623300000000, -0.0046283500000000 ]  - [  -0.0026966500000000,  0.0035488200000000, -0.0045515500000000 ]  - [   0.0055130500000000,  0.0028215700000000,  0.0020692200000000 ]  - [   0.0032107000000000,  0.0046578700000000,  0.0048806700000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0214945500000000, -0.1275615800000000,  0.0102931800000000 ]  - [  -0.0035256100000000,  0.0081524100000000, -0.0076142000000000 ]  - [   0.0031201200000000,  0.0046494000000000,  0.0079373900000000 ]  - [   0.0035952300000000,  0.0046479600000000,  0.0080795700000000 ]  - [   0.0026355700000000, -0.0072000800000000, -0.0100728700000000 ]  - [   0.0041283400000000, -0.0046401900000000, -0.0084054100000000 ]  - [  -0.0029876400000000, -0.0058530300000000,  0.0036642500000000 ]  - [  -0.0032079300000000, -0.0022061700000000,  0.0084466400000000 ]  - [   0.0050224000000000, -0.0039873700000000,  0.0077450600000000 ]  - [   0.0026370000000000, -0.0034665700000000,  0.0083503700000000 ]  - [  -0.0035429200000000, -0.0051034700000000, -0.0080526800000000 ]  - [  -0.0035388700000000, -0.0042142700000000, -0.0081987100000000 ]  - [  -0.0035892200000000,  0.0039327300000000,  0.0081962400000000 ]  - [  -0.0035219700000000,  0.0050596200000000,  0.0081015800000000 ]  - [   0.0035449900000000,  0.0047495200000000, -0.0083245200000000 ]  - [   0.0030682900000000,  0.0047481500000000, -0.0077499500000000 ]  - [   0.0004203600000000, -0.0029022800000000, -0.0043859400000000 ]  - [   0.0012404300000000, -0.0029346200000000, -0.0046315600000000 ]  - [  -0.0082959600000000, -0.0024291000000000,  0.0051722300000000 ]  - [  -0.0001913200000000, -0.0023101500000000,  0.0047369900000000 ]  - [   0.0028935200000000, -0.0061187000000000,  0.0127366000000000 ]  - [   0.0010315800000000, -0.0023039800000000,  0.0045025600000000 ]  - [  -0.0009814500000000, -0.0034169200000000, -0.0044351500000000 ]  - [  -0.0016796500000000, -0.0025546500000000, -0.0046280900000000 ]  - [  -0.0019704100000000,  0.0027798600000000,  0.0050778200000000 ]  - [  -0.0010712400000000,  0.0032462900000000,  0.0045016300000000 ]  - [   0.0025903700000000,  0.0063241500000000, -0.0048870500000000 ]  - [  -0.0030537800000000,  0.0019760600000000,  0.0022307700000000 ]  - [   0.0002522800000000, -0.0002049600000000,  0.0045829400000000 ]  - [  -0.0004390800000000,  0.0003157400000000,  0.0045911000000000 ]  - [   0.0002061600000000,  0.0003967700000000, -0.0044270200000000 ]  - [  -0.0015232200000000, -0.0004000800000000, -0.0050705300000000 ]  - [  -0.0021564800000000, -0.0009927600000000, -0.0048297200000000 ]  - [   0.0007195700000000,  0.0002875400000000, -0.0052445700000000 ]  - [   0.0007689900000000,  0.0031385600000000,  0.0045760000000000 ]  - [   0.0014354800000000,  0.0029171200000000,  0.0046940100000000 ]  - [  -0.0009391900000000,  0.0027870500000000,  0.0048331700000000 ]  - [   0.0043077600000000, -0.0002352400000000,  0.0078163800000000 ]  - [  -0.0002389800000000,  0.0021310000000000, -0.0041494000000000 ]  - [  -0.0016059500000000,  0.0034998100000000, -0.0046108100000000 ]  - [  -0.0019017900000000,  0.0033589300000000,  0.0050520800000000 ]  - [  -0.0017771700000000,  0.0030912600000000,  0.0048962400000000 ]  - [   0.0023401100000000,  0.0041962200000000, -0.0047759900000000 ]  - [   0.0017122600000000,  0.0027585400000000, -0.0047623900000000 ]  - [   0.0018860100000000, -0.0035187500000000,  0.0048736900000000 ]  - [   0.0020729000000000, -0.0029454300000000,  0.0060918000000000 ]  - [  -0.0016796300000000, -0.0031135100000000, -0.0048975100000000 ]  - [  -0.0018704800000000, -0.0033712400000000, -0.0050189200000000 ]  - [  -0.0022018700000000,  0.0030677000000000, -0.0059981600000000 ]  - [  -0.0018066400000000,  0.0027693200000000, -0.0044088000000000 ]  - [   0.0020024000000000, -0.0034754500000000, -0.0050508400000000 ]  - [   0.0018097200000000, -0.0029978100000000, -0.0049246400000000 ]  - [  -0.0276515700000000,  0.0175734700000000,  0.0009070100000000 ]  - [   0.0006410000000000, -0.0002033000000000, -0.0014362300000000 ]  - [  -0.0000897700000000, -0.0004237400000000,  0.0016647200000000 ]  - [  -0.0003240400000000,  0.0001243300000000,  0.0013611000000000 ]  - [  -0.0003322300000000,  0.0002912700000000,  0.0014462000000000 ]  - [   0.0004180700000000, -0.0002248700000000,  0.0016051500000000 ]  - [  -0.0000688800000000, -0.0001100100000000, -0.0015500500000000 ]  - [   0.0002683500000000,  0.0002076800000000, -0.0015657700000000 ]  - [   0.0010721400000000, -0.0000809200000000, -0.0000421000000000 ]  - [   0.0013244300000000, -0.0000945300000000,  0.0000398200000000 ]  - [  -0.0011530600000000,  0.0004903400000000,  0.0002120300000000 ]  - [  -0.0010989400000000, -0.0002743000000000, -0.0001532000000000 ]  - [  -0.0009762400000000,  0.0011170200000000, -0.0012696800000000 ]  - [  -0.0012553900000000, -0.0008120600000000,  0.0003796000000000 ]  - [   0.0010868000000000, -0.0001575000000000, -0.0006739800000000 ]  - [   0.0011744900000000, -0.0001358100000000, -0.0005703700000000 ]  - [   0.0035168500000000,  0.0060307800000000, -0.0171290000000000 ]  - [  -0.0022774800000000, -0.0036891000000000,  0.0055063800000000 ]  - [   0.0020163800000000,  0.0037186200000000,  0.0053368400000000 ]  - [   0.0017086100000000,  0.0030640100000000,  0.0048726200000000 ]  - [  -0.0053505700000000,  0.0095758500000000,  0.0016719100000000 ]  - [  -0.0035956500000000,  0.0018701600000000,  0.0052268500000000 ]  - [   0.0020196500000000,  0.0045280100000000, -0.0037058300000000 ]  - [   0.0047992900000000,  0.0016851600000000, -0.0049771200000000 ]  - [   0.0053263500000000, -0.0035547300000000,  0.0039908300000000 ]  - [   0.0031804200000000, -0.0038547200000000,  0.0047414700000000 ]  - [  -0.0039986300000000, -0.0071515500000000, -0.0049152000000000 ]  - [  -0.0023089700000000,  0.0967593800000000, -0.0115105100000000 ]  - [   0.0024922000000000, -0.0034585000000000, -0.0039691500000000 ]  - [   0.0041085500000000, -0.0041669200000000, -0.0048293600000000 ]  - [  -0.0031415700000000, -0.0040173000000000,  0.0047527400000000 ]  - [  -0.0030796800000000, -0.0029222300000000,  0.0042639100000000 ]  - [  -0.0030831800000000,  0.0039892300000000, -0.0047121300000000 ]  - [  -0.0032959900000000,  0.0031815300000000, -0.0044709300000000 ]  - [   0.0079053600000000,  0.0039288100000000,  0.0028836900000000 ]  - [   0.0023849400000000,  0.0026731100000000,  0.0043929100000000 ]- atom:    1  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0284211700000000,  0.1309503400000000, -0.0267086500000000 ]  - [  -0.0033218300000000,  0.0009919700000000, -0.0086287600000000 ]  - [   0.0037315800000000,  0.0044931700000000,  0.0083124200000000 ]  - [   0.0032586900000000,  0.0044916700000000,  0.0081737200000000 ]  - [   0.0043285700000000, -0.0018994100000000, -0.0062101400000000 ]  - [   0.0027311200000000, -0.0045075400000000, -0.0078489900000000 ]  - [  -0.0038620100000000, -0.0032966300000000,  0.0125340300000000 ]  - [  -0.0036424500000000, -0.0069120400000000,  0.0077982900000000 ]  - [   0.0018413200000000, -0.0051386000000000,  0.0085028200000000 ]  - [   0.0042065700000000, -0.0056702100000000,  0.0079035400000000 ]  - [  -0.0033093400000000, -0.0040410000000000, -0.0081988100000000 ]  - [  -0.0033128300000000, -0.0049244800000000, -0.0080535900000000 ]  - [  -0.0032615300000000,  0.0052036900000000,  0.0080584500000000 ]  - [  -0.0033294800000000,  0.0040836400000000,  0.0081506400000000 ]  - [   0.0033062200000000,  0.0043947800000000, -0.0079285400000000 ]  - [   0.0037783500000000,  0.0043933100000000, -0.0084985900000000 ]  - [   0.0019853900000000, -0.0030551600000000, -0.0047693300000000 ]  - [   0.0011703700000000, -0.0030240800000000, -0.0045222700000000 ]  - [   0.0057842500000000, -0.0035095700000000,  0.0039696800000000 ]  - [  -0.0022290700000000, -0.0036416400000000,  0.0044181100000000 ]  - [  -0.0004718100000000,  0.0001944100000000, -0.0034920900000000 ]  - [   0.0013740000000000, -0.0036521200000000,  0.0046460500000000 ]  - [  -0.0014277700000000, -0.0025434600000000, -0.0047166100000000 ]  - [  -0.0007328100000000, -0.0034016300000000, -0.0045240200000000 ]  - [  -0.0004470300000000,  0.0031789200000000,  0.0040769000000000 ]  - [  -0.0013392600000000,  0.0027139900000000,  0.0046514800000000 ]  - [  -0.0001839500000000, -0.0003567000000000, -0.0042582800000000 ]  - [   0.0054031900000000,  0.0039820900000000, -0.0112781500000000 ]  - [  -0.0002485100000000,  0.0002038000000000,  0.0048325700000000 ]  - [   0.0004347700000000, -0.0003140600000000,  0.0048236600000000 ]  - [  -0.0002071500000000, -0.0003918400000000, -0.0049875400000000 ]  - [   0.0015072600000000,  0.0003986600000000, -0.0043466700000000 ]  - [   0.0021454700000000,  0.0009827300000000, -0.0045960100000000 ]  - [  -0.0007094700000000, -0.0002859900000000, -0.0041746500000000 ]  - [   0.0016402400000000,  0.0028209200000000,  0.0045761700000000 ]  - [   0.0009720200000000,  0.0030406200000000,  0.0044592700000000 ]  - [   0.0009462400000000, -0.0027702800000000,  0.0046028200000000 ]  - [  -0.0042397600000000,  0.0002335600000000,  0.0016514600000000 ]  - [  -0.0021550600000000,  0.0038246300000000, -0.0049813300000000 ]  - [  -0.0008088200000000,  0.0024617000000000, -0.0045462800000000 ]  - [  -0.0018518200000000,  0.0031480200000000,  0.0049144400000000 ]  - [  -0.0019761100000000,  0.0034147100000000,  0.0050705800000000 ]  - [   0.0013945700000000,  0.0023043700000000, -0.0051862400000000 ]  - [   0.0020426800000000,  0.0037444700000000, -0.0052042200000000 ]  - [   0.0018690900000000, -0.0029916700000000,  0.0050974700000000 ]  - [   0.0016810800000000, -0.0035559100000000,  0.0038909600000000 ]  - [  -0.0020757600000000, -0.0033945000000000, -0.0050700200000000 ]  - [  -0.0018831700000000, -0.0031366200000000, -0.0049492900000000 ]  - [  -0.0015603300000000,  0.0034428500000000, -0.0039830700000000 ]  - [  -0.0019463500000000,  0.0037334000000000, -0.0055578900000000 ]  - [   0.0017499800000000, -0.0030310100000000, -0.0049156400000000 ]  - [   0.0019410000000000, -0.0035062300000000, -0.0050414100000000 ]  - [   0.0279250600000000, -0.0175968800000000, -0.0039397500000000 ]  - [  -0.0006663300000000,  0.0001909000000000, -0.0017100700000000 ]  - [   0.0000866800000000,  0.0004225800000000,  0.0014776200000000 ]  - [   0.0003216400000000, -0.0001202200000000,  0.0017780800000000 ]  - [   0.0003291800000000, -0.0002876900000000,  0.0016946700000000 ]  - [  -0.0004139500000000,  0.0002227600000000,  0.0015374500000000 ]  - [   0.0000682000000000,  0.0001084800000000, -0.0015915200000000 ]  - [  -0.0002657100000000, -0.0002062000000000, -0.0015762600000000 ]  - [   0.0012549400000000,  0.0000786800000000,  0.0000413000000000 ]  - [   0.0010108100000000,  0.0000940100000000, -0.0000379100000000 ]  - [  -0.0011774100000000, -0.0004866900000000, -0.0002090800000000 ]  - [  -0.0012301700000000,  0.0002714200000000,  0.0001525900000000 ]  - [  -0.0013561600000000, -0.0011094400000000,  0.0012511300000000 ]  - [  -0.0010771400000000,  0.0008077100000000, -0.0003807400000000 ]  - [   0.0012441200000000,  0.0001569100000000,  0.0006635500000000 ]  - [   0.0011606100000000,  0.0001293900000000,  0.0005674200000000 ]  - [  -0.0072816000000000, -0.0125491500000000,  0.0272293800000000 ]  - [  -0.0014753800000000, -0.0028286200000000,  0.0044500100000000 ]  - [   0.0017396500000000,  0.0027877900000000,  0.0046290600000000 ]  - [   0.0020412500000000,  0.0034409900000000,  0.0050937500000000 ]  - [  -0.0017310800000000, -0.0024888700000000,  0.0074156500000000 ]  - [  -0.0034773300000000,  0.0051636900000000,  0.0040080300000000 ]  - [   0.0050436400000000,  0.0025411500000000, -0.0054900800000000 ]  - [   0.0022642000000000,  0.0053656600000000, -0.0042263500000000 ]  - [   0.0017561800000000, -0.0035054800000000,  0.0052145900000000 ]  - [   0.0038844000000000, -0.0032031300000000,  0.0044641900000000 ]  - [  -0.0030666800000000,  0.0001171000000000, -0.0043143200000000 ]  - [  -0.0049322700000000, -0.0981701800000000,  0.0021943100000000 ]  - [   0.0045615600000000, -0.0035981900000000, -0.0052333700000000 ]  - [   0.0029678700000000, -0.0028938700000000, -0.0043762000000000 ]  - [  -0.0039243600000000, -0.0030418400000000,  0.0044515200000000 ]  - [  -0.0039823300000000, -0.0041316100000000,  0.0049377400000000 ]  - [  -0.0039819200000000,  0.0030701300000000, -0.0044930400000000 ]  - [  -0.0037690900000000,  0.0038728800000000, -0.0047320100000000 ]  - [  -0.0008102400000000,  0.0031325700000000,  0.0063144800000000 ]  - [   0.0046898100000000,  0.0043692500000000,  0.0048057900000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0014180000000000,  0.0237573100000000, -0.0820375300000000 ]  - [  -0.0035284000000000,  0.0050717400000000, -0.0086925600000000 ]  - [   0.0031509500000000,  0.0046160700000000,  0.0082615500000000 ]  - [   0.0033512600000000,  0.0047574300000000,  0.0082626200000000 ]  - [  -0.0001206300000000, -0.0026470400000000, -0.0103453900000000 ]  - [   0.0036418700000000, -0.0042923900000000, -0.0083767900000000 ]  - [  -0.0038843800000000, -0.0089548500000000,  0.0152580800000000 ]  - [  -0.0033640000000000, -0.0042530900000000,  0.0083008700000000 ]  - [   0.0021065800000000, -0.0049502500000000,  0.0085574600000000 ]  - [   0.0031012500000000, -0.0043475200000000,  0.0080458300000000 ]  - [  -0.0033166000000000, -0.0046427800000000, -0.0080888800000000 ]  - [  -0.0033514100000000, -0.0044985800000000, -0.0080953300000000 ]  - [  -0.0033709000000000,  0.0045015200000000,  0.0080075500000000 ]  - [  -0.0033893600000000,  0.0045938400000000,  0.0081152300000000 ]  - [   0.0035657600000000,  0.0049398600000000, -0.0079517400000000 ]  - [   0.0035595800000000,  0.0043728500000000, -0.0079521900000000 ]  - [   0.0013739700000000, -0.0030104100000000, -0.0044609200000000 ]  - [   0.0012014100000000, -0.0029753000000000, -0.0045654500000000 ]  - [  -0.0001917700000000, -0.0038609100000000,  0.0032299400000000 ]  - [  -0.0011739300000000, -0.0029428800000000,  0.0043272600000000 ]  - [   0.0062628200000000, -0.0052766200000000,  0.0062751800000000 ]  - [   0.0013249200000000, -0.0030954700000000,  0.0052003300000000 ]  - [  -0.0007699300000000, -0.0030589300000000, -0.0048039600000000 ]  - [  -0.0011434500000000, -0.0029016900000000, -0.0048263400000000 ]  - [  -0.0011423500000000,  0.0028495200000000,  0.0044895000000000 ]  - [  -0.0011338200000000,  0.0029991900000000,  0.0046323500000000 ]  - [   0.0006105300000000,  0.0010924700000000, -0.0041046500000000 ]  - [   0.0009260600000000,  0.0080110500000000, -0.0071323000000000 ]  - [   0.0005943200000000,  0.0000786900000000,  0.0045508600000000 ]  - [   0.0000985200000000,  0.0000089600000000,  0.0047270100000000 ]  - [  -0.0000366800000000,  0.0000744800000000, -0.0049772400000000 ]  - [   0.0000761000000000, -0.0000506900000000, -0.0050212700000000 ]  - [  -0.0034805200000000, -0.0009268000000000, -0.0001941400000000 ]  - [  -0.0002293300000000, -0.0000813900000000, -0.0045998900000000 ]  - [   0.0012169800000000,  0.0031528400000000,  0.0045457300000000 ]  - [   0.0016604600000000,  0.0030576400000000,  0.0045479400000000 ]  - [   0.0001219400000000, -0.0009842200000000,  0.0037695400000000 ]  - [   0.0018082500000000,  0.0042536200000000,  0.0041105800000000 ]  - [   0.0009350500000000,  0.0031001500000000, -0.0033309300000000 ]  - [  -0.0011070700000000,  0.0030338600000000, -0.0045102500000000 ]  - [  -0.0019184400000000,  0.0032813100000000,  0.0050295000000000 ]  - [  -0.0019004200000000,  0.0032342700000000,  0.0049629800000000 ]  - [   0.0007998700000000,  0.0028635000000000, -0.0050749600000000 ]  - [   0.0018677500000000,  0.0032374500000000, -0.0048676800000000 ]  - [   0.0018717700000000, -0.0033692500000000,  0.0050353500000000 ]  - [   0.0014373400000000, -0.0028028100000000,  0.0046893800000000 ]  - [  -0.0018222000000000, -0.0032133400000000, -0.0049705200000000 ]  - [  -0.0019190200000000, -0.0032826000000000, -0.0049683900000000 ]  - [  -0.0023007500000000,  0.0039105000000000, -0.0063575900000000 ]  - [  -0.0017477600000000,  0.0029642600000000, -0.0053210800000000 ]  - [   0.0018665400000000, -0.0032805500000000, -0.0050270600000000 ]  - [   0.0018287900000000, -0.0033032700000000, -0.0050778800000000 ]  - [   0.0102498800000000, -0.0028200100000000,  0.0002862900000000 ]  - [   0.0000589200000000, -0.0000551400000000, -0.0015125500000000 ]  - [   0.0001077900000000, -0.0001367800000000,  0.0014687400000000 ]  - [   0.0010175800000000,  0.0002306800000000,  0.0014048000000000 ]  - [   0.0001320100000000, -0.0001736500000000,  0.0017911700000000 ]  - [   0.0000391600000000, -0.0000045100000000,  0.0016059500000000 ]  - [  -0.0001117700000000, -0.0000543900000000, -0.0015636700000000 ]  - [  -0.0000834500000000, -0.0000022700000000, -0.0015667800000000 ]  - [   0.0010896700000000, -0.0001370900000000,  0.0000668500000000 ]  - [   0.0010944900000000,  0.0000096100000000,  0.0000247000000000 ]  - [  -0.0012684500000000,  0.0000877900000000,  0.0001028300000000 ]  - [  -0.0011954900000000, -0.0000022700000000,  0.0000223100000000 ]  - [  -0.0009577500000000,  0.0009694100000000,  0.0005046100000000 ]  - [  -0.0011808500000000,  0.0001552800000000, -0.0001580300000000 ]  - [   0.0013683500000000, -0.0005994200000000,  0.0002457600000000 ]  - [   0.0012385500000000, -0.0005649300000000, -0.0004886000000000 ]  - [  -0.0163415100000000, -0.0167838000000000,  0.0666681800000000 ]  - [  -0.0019168200000000, -0.0037979400000000,  0.0048556100000000 ]  - [   0.0019936600000000,  0.0034515400000000,  0.0054146000000000 ]  - [   0.0018871800000000,  0.0031985300000000,  0.0049117300000000 ]  - [  -0.0040679900000000,  0.0040699400000000, -0.0055204700000000 ]  - [  -0.0035267300000000,  0.0037377800000000,  0.0042889900000000 ]  - [   0.0023397400000000,  0.0035766100000000, -0.0037337100000000 ]  - [   0.0031671000000000,  0.0026884500000000, -0.0044204800000000 ]  - [   0.0036297700000000, -0.0034414900000000,  0.0048244300000000 ]  - [   0.0036802400000000, -0.0036328000000000,  0.0046984600000000 ]  - [  -0.0035677900000000, -0.0037066900000000, -0.0032043600000000 ]  - [  -0.0034955000000000, -0.0067072500000000,  0.0079902000000000 ]  - [   0.0018127700000000, -0.0039689400000000, -0.0054955100000000 ]  - [   0.0035281500000000, -0.0035126000000000, -0.0047911700000000 ]  - [  -0.0035919800000000, -0.0035748600000000,  0.0046757400000000 ]  - [  -0.0039488600000000, -0.0034300900000000,  0.0045851500000000 ]  - [  -0.0037874000000000,  0.0035593700000000, -0.0047828800000000 ]  - [  -0.0037154100000000,  0.0034957900000000, -0.0046691500000000 ]  - [   0.0050394400000000,  0.0035313400000000,  0.0054850800000000 ]  - [   0.0038478000000000,  0.0035340700000000,  0.0047854500000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0071301500000000, -0.0132629800000000,  0.0632615900000000 ]  - [  -0.0033210900000000,  0.0040567600000000, -0.0075588400000000 ]  - [   0.0037046000000000,  0.0045221600000000,  0.0079926100000000 ]  - [   0.0035012300000000,  0.0043824700000000,  0.0079936800000000 ]  - [   0.0070344700000000, -0.0065097300000000, -0.0059488500000000 ]  - [   0.0032079900000000, -0.0048488000000000, -0.0078726600000000 ]  - [  -0.0029660000000000, -0.0000844700000000,  0.0008331300000000 ]  - [  -0.0034872500000000, -0.0049014700000000,  0.0079531800000000 ]  - [   0.0047351300000000, -0.0041924900000000,  0.0076862800000000 ]  - [   0.0037512300000000, -0.0047943900000000,  0.0082052100000000 ]  - [  -0.0035345900000000, -0.0044966100000000, -0.0081627400000000 ]  - [  -0.0035001800000000, -0.0046436800000000, -0.0081562700000000 ]  - [  -0.0034808900000000,  0.0046395200000000,  0.0082451000000000 ]  - [  -0.0034619200000000,  0.0045449800000000,  0.0081375400000000 ]  - [   0.0032779100000000,  0.0041913000000000, -0.0083013000000000 ]  - [   0.0032892400000000,  0.0047688500000000, -0.0083017200000000 ]  - [   0.0010404200000000, -0.0029479400000000, -0.0046929300000000 ]  - [   0.0012094700000000, -0.0029836100000000, -0.0045872600000000 ]  - [  -0.0021970800000000, -0.0020973700000000,  0.0059274000000000 ]  - [  -0.0012374500000000, -0.0030167100000000,  0.0048263300000000 ]  - [  -0.0040129000000000, -0.0007308300000000,  0.0027781200000000 ]  - [   0.0010850100000000, -0.0028590100000000,  0.0039489000000000 ]  - [  -0.0016403300000000, -0.0028992400000000, -0.0043519700000000 ]  - [  -0.0012673200000000, -0.0030574500000000, -0.0043271800000000 ]  - [  -0.0012665800000000,  0.0031100100000000,  0.0046625400000000 ]  - [  -0.0012782900000000,  0.0029590200000000,  0.0045205800000000 ]  - [   0.0017965100000000,  0.0048597400000000, -0.0050441400000000 ]  - [   0.0014794300000000, -0.0020186200000000, -0.0020284400000000 ]  - [  -0.0006060700000000, -0.0000793300000000,  0.0048742000000000 ]  - [  -0.0000984800000000, -0.0000100400000000,  0.0046894100000000 ]  - [   0.0000361000000000, -0.0000751500000000, -0.0044367300000000 ]  - [  -0.0000737900000000,  0.0000505600000000, -0.0043930400000000 ]  - [   0.0035367600000000,  0.0009368000000000, -0.0092300900000000 ]  - [   0.0002286100000000,  0.0000831500000000, -0.0048121700000000 ]  - [   0.0011930600000000,  0.0028048200000000,  0.0046079100000000 ]  - [   0.0007458200000000,  0.0029004600000000,  0.0046054600000000 ]  - [  -0.0001150400000000,  0.0009833800000000,  0.0056472200000000 ]  - [  -0.0017889800000000, -0.0042488200000000,  0.0052929200000000 ]  - [  -0.0033688200000000,  0.0028580900000000, -0.0058279300000000 ]  - [  -0.0013036500000000,  0.0029226400000000, -0.0046424900000000 ]  - [  -0.0018358500000000,  0.0032242500000000,  0.0049359800000000 ]  - [  -0.0018544000000000,  0.0032729400000000,  0.0050039600000000 ]  - [   0.0029627800000000,  0.0036398100000000, -0.0048903700000000 ]  - [   0.0018863500000000,  0.0032679500000000, -0.0050993800000000 ]  - [   0.0018820000000000, -0.0031363200000000,  0.0049310100000000 ]  - [   0.0023195500000000, -0.0037080200000000,  0.0052734400000000 ]  - [  -0.0019327100000000, -0.0032953600000000, -0.0049978000000000 ]  - [  -0.0018341000000000, -0.0032245400000000, -0.0049993100000000 ]  - [  -0.0014460900000000,  0.0025903400000000, -0.0035858800000000 ]  - [  -0.0020086400000000,  0.0035469300000000, -0.0046448200000000 ]  - [   0.0018842900000000, -0.0032237900000000, -0.0049372200000000 ]  - [   0.0019215900000000, -0.0032041900000000, -0.0048879400000000 ]  - [  -0.0106529400000000,  0.0029283900000000, -0.0034249700000000 ]  - [  -0.0000655000000000,  0.0000503000000000, -0.0016299500000000 ]  - [  -0.0001094200000000,  0.0001425600000000,  0.0016744200000000 ]  - [  -0.0010325700000000, -0.0002330800000000,  0.0017346700000000 ]  - [  -0.0001315700000000,  0.0001729700000000,  0.0013516100000000 ]  - [  -0.0000392200000000,  0.0000042600000000,  0.0015368800000000 ]  - [   0.0001138200000000,  0.0000549800000000, -0.0015786300000000 ]  - [   0.0000839600000000,  0.0000015800000000, -0.0015754800000000 ]  - [   0.0012388400000000,  0.0001378500000000, -0.0000686400000000 ]  - [   0.0012373700000000, -0.0000100500000000, -0.0000243800000000 ]  - [  -0.0010632200000000, -0.0000893600000000, -0.0001047400000000 ]  - [  -0.0011351900000000,  0.0000022400000000, -0.0000223600000000 ]  - [  -0.0013837300000000, -0.0009721900000000, -0.0005069700000000 ]  - [  -0.0011512000000000, -0.0001541600000000,  0.0001612100000000 ]  - [   0.0009637600000000,  0.0006020900000000, -0.0002480100000000 ]  - [   0.0010927900000000,  0.0005632900000000,  0.0004947700000000 ]  - [   0.0118678100000000,  0.0092420900000000, -0.0538526300000000 ]  - [  -0.0018365900000000, -0.0027133300000000,  0.0051107000000000 ]  - [   0.0017538300000000,  0.0030552200000000,  0.0045506400000000 ]  - [   0.0018648200000000,  0.0033079900000000,  0.0050576100000000 ]  - [  -0.0029491400000000,  0.0028965100000000,  0.0146789900000000 ]  - [  -0.0035414100000000,  0.0033222800000000,  0.0049119100000000 ]  - [   0.0047364800000000,  0.0034814100000000, -0.0054739500000000 ]  - [   0.0039032700000000,  0.0043692400000000, -0.0047867100000000 ]  - [   0.0034281100000000, -0.0036149800000000,  0.0043719000000000 ]  - [   0.0033867900000000, -0.0034236100000000,  0.0045042100000000 ]  - [  -0.0035004600000000, -0.0033482200000000, -0.0060105900000000 ]  - [  -0.0035914400000000, -0.0007031300000000, -0.0171766700000000 ]  - [   0.0053020100000000, -0.0030892700000000, -0.0037116700000000 ]  - [   0.0035389900000000, -0.0035425700000000, -0.0044117700000000 ]  - [  -0.0034746400000000, -0.0034810200000000,  0.0045289500000000 ]  - [  -0.0031194300000000, -0.0036280900000000,  0.0046213000000000 ]  - [  -0.0032766900000000,  0.0034945200000000, -0.0044172400000000 ]  - [  -0.0033518800000000,  0.0035614000000000, -0.0045339700000000 ]  - [   0.0020129300000000,  0.0035246700000000,  0.0037340600000000 ]  - [   0.0032197200000000,  0.0035212400000000,  0.0044212400000000 ]- atom:   17  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0024313000000000,  0.0037912300000000, -0.0079588200000000 ]  - [  -0.0029428300000000,  0.0046045400000000, -0.0081300200000000 ]  - [   0.0084505800000000,  0.0115496200000000,  0.0091174100000000 ]  - [   0.0024675100000000,  0.0035578200000000,  0.0081575600000000 ]  - [   0.0032075400000000, -0.0036205400000000, -0.0102588300000000 ]  - [   0.0028945300000000, -0.0049668400000000, -0.0082237900000000 ]  - [  -0.0020829700000000, -0.0047986700000000,  0.0076702200000000 ]  - [  -0.0025752500000000, -0.0041357900000000,  0.0081140300000000 ]  - [   0.0043070100000000, -0.0053317600000000,  0.0081846800000000 ]  - [   0.0039235400000000, -0.0044349700000000,  0.0081972600000000 ]  - [  -0.0039018200000000, -0.0003426000000000, -0.0084004800000000 ]  - [  -0.0038703000000000, -0.0059501000000000, -0.0087169100000000 ]  - [  -0.0074015700000000,  0.0062731500000000,  0.0030550000000000 ]  - [  -0.0039201300000000,  0.0044005200000000,  0.0080058100000000 ]  - [   0.0044058700000000,  0.0043402800000000, -0.0085621300000000 ]  - [   0.0040768900000000,  0.0050427800000000, -0.0081876700000000 ]  - [  -0.0990973500000000, -0.0074311100000000, -0.0044338200000000 ]  - [  -0.0001002500000000, -0.0030107800000000, -0.0046991500000000 ]  - [   0.0003946900000000, -0.0027886200000000,  0.0046480800000000 ]  - [   0.0003961300000000, -0.0030554700000000,  0.0046890100000000 ]  - [   0.0058731900000000, -0.0035094600000000,  0.0048756200000000 ]  - [   0.0022162000000000, -0.0030296300000000,  0.0046501000000000 ]  - [  -0.0034508100000000, -0.0040120500000000, -0.0042833500000000 ]  - [  -0.0034475200000000, -0.0026293600000000, -0.0046725600000000 ]  - [  -0.0022717300000000,  0.0006068600000000,  0.0192492100000000 ]  - [  -0.0026022900000000,  0.0032848100000000,  0.0046429400000000 ]  - [   0.0028023500000000,  0.0032192400000000, -0.0044610500000000 ]  - [   0.0026426200000000,  0.0029482400000000, -0.0045531600000000 ]  - [   0.0113552700000000,  0.0002130000000000, -0.0006579300000000 ]  - [   0.0000837000000000, -0.0000612000000000,  0.0045166300000000 ]  - [   0.0003935400000000, -0.0009159800000000, -0.0039673400000000 ]  - [   0.0008445100000000,  0.0010181400000000, -0.0040120300000000 ]  - [   0.0131483000000000,  0.0017027100000000,  0.0072606600000000 ]  - [   0.0000497800000000,  0.0000273700000000, -0.0048617400000000 ]  - [  -0.0023165500000000,  0.0029187000000000,  0.0050066500000000 ]  - [  -0.0013620900000000,  0.0033859500000000,  0.0044160400000000 ]  - [   0.0003143400000000,  0.0004590400000000,  0.0049776000000000 ]  - [   0.0001646200000000, -0.0003125900000000,  0.0049701900000000 ]  - [   0.0021292400000000,  0.0027751500000000, -0.0044762900000000 ]  - [  -0.0001302800000000,  0.0028832200000000, -0.0045374700000000 ]  - [  -0.0015787500000000,  0.0033455000000000,  0.0042602800000000 ]  - [  -0.0004184000000000,  0.0027347800000000,  0.0043869900000000 ]  - [   0.0011889800000000,  0.0030942800000000, -0.0049463800000000 ]  - [   0.0016717000000000,  0.0032031800000000, -0.0048760700000000 ]  - [   0.0012940800000000, -0.0029701100000000,  0.0048168200000000 ]  - [   0.0014399100000000, -0.0032810600000000,  0.0048789400000000 ]  - [   0.0112023300000000,  0.0043535400000000,  0.0147184800000000 ]  - [  -0.0017026200000000, -0.0031760100000000, -0.0049819300000000 ]  - [  -0.0022414800000000,  0.0034696400000000, -0.0052238100000000 ]  - [  -0.0022504700000000,  0.0032738800000000, -0.0051663900000000 ]  - [   0.0026198300000000, -0.0041786900000000, -0.0060716400000000 ]  - [   0.0022412200000000, -0.0028213200000000, -0.0051012400000000 ]  - [  -0.0001915700000000,  0.0002486400000000, -0.0019173600000000 ]  - [  -0.0000758300000000, -0.0000273300000000, -0.0016240100000000 ]  - [  -0.0014819900000000, -0.0004200000000000,  0.0011258000000000 ]  - [   0.0001546900000000,  0.0003254300000000,  0.0018367600000000 ]  - [  -0.0000900000000000,  0.0002373300000000,  0.0010781600000000 ]  - [  -0.0000473300000000, -0.0000069300000000,  0.0014995300000000 ]  - [   0.0000157100000000,  0.0004125900000000, -0.0014377600000000 ]  - [  -0.0009767300000000, -0.0007292200000000, -0.0016212100000000 ]  - [   0.0011809900000000,  0.0007355400000000, -0.0007570800000000 ]  - [   0.0011266300000000, -0.0003279500000000,  0.0001362500000000 ]  - [  -0.0013934700000000, -0.0008323100000000, -0.0009883400000000 ]  - [  -0.0012520700000000,  0.0003521400000000,  0.0001068500000000 ]  - [  -0.0009146800000000,  0.0014636400000000, -0.0014136800000000 ]  - [  -0.0012276300000000, -0.0002259900000000,  0.0000497800000000 ]  - [   0.0014974700000000, -0.0014177700000000, -0.0013041800000000 ]  - [   0.0011201100000000,  0.0001875300000000, -0.0000533400000000 ]  - [  -0.0025015800000000, -0.0033912500000000,  0.0053635500000000 ]  - [  -0.0020795100000000, -0.0033242100000000,  0.0050392900000000 ]  - [   0.0024802500000000,  0.0037324800000000,  0.0044877900000000 ]  - [   0.0021013500000000,  0.0032683700000000,  0.0050623300000000 ]  - [  -0.0094549900000000,  0.0037997400000000,  0.0061034700000000 ]  - [  -0.0050055800000000,  0.0032645200000000,  0.0045977300000000 ]  - [   0.0060126200000000,  0.0043276100000000, -0.0042763600000000 ]  - [   0.0059322200000000,  0.0015770200000000, -0.0031199000000000 ]  - [   0.0399311000000000, -0.0141224500000000, -0.0033701000000000 ]  - [   0.0052889100000000, -0.0032636700000000,  0.0045769500000000 ]  - [  -0.0055940600000000, -0.0037886000000000, -0.0045284000000000 ]  - [  -0.0052729300000000, -0.0028599700000000, -0.0043340500000000 ]  - [  -0.0034920900000000, -0.0026485300000000, -0.0029826600000000 ]  - [   0.0021946700000000, -0.0037869900000000, -0.0046621000000000 ]  - [  -0.0009871600000000, -0.0030682500000000,  0.0047776100000000 ]  - [  -0.0011712200000000, -0.0057904000000000,  0.0050284800000000 ]  - [   0.0272941300000000,  0.0030667800000000, -0.0298406100000000 ]  - [  -0.0021092100000000,  0.0039165500000000, -0.0046125100000000 ]  - [   0.0013300100000000,  0.0031985400000000,  0.0044290500000000 ]  - [   0.0015555900000000,  0.0042049400000000,  0.0045000600000000 ]- atom:   17  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0044168800000000,  0.0053579800000000, -0.0082821100000000 ]  - [  -0.0039016300000000,  0.0045357600000000, -0.0081125700000000 ]  - [  -0.0017012400000000, -0.0025294900000000,  0.0071026300000000 ]  - [   0.0043864600000000,  0.0055974300000000,  0.0080834200000000 ]  - [   0.0036286100000000, -0.0055374200000000, -0.0059457700000000 ]  - [   0.0039546700000000, -0.0041716000000000, -0.0080181300000000 ]  - [  -0.0047701000000000, -0.0043372100000000,  0.0085754000000000 ]  - [  -0.0042765200000000, -0.0050089600000000,  0.0081286200000000 ]  - [   0.0025276100000000, -0.0038103700000000,  0.0080509600000000 ]  - [   0.0029124900000000, -0.0047042100000000,  0.0080442600000000 ]  - [  -0.0029507900000000, -0.0088007200000000, -0.0078387300000000 ]  - [  -0.0029752400000000, -0.0031782500000000, -0.0075224000000000 ]  - [   0.0005671500000000,  0.0029095600000000,  0.0133226600000000 ]  - [  -0.0029213800000000,  0.0047447100000000,  0.0082362500000000 ]  - [   0.0024301000000000,  0.0047887900000000, -0.0076826100000000 ]  - [   0.0027579600000000,  0.0040971100000000, -0.0080544400000000 ]  - [   0.1046885200000000,  0.0008406500000000, -0.0033953700000000 ]  - [   0.0025315600000000, -0.0029560200000000, -0.0044504300000000 ]  - [  -0.0028186600000000, -0.0031721500000000,  0.0045028800000000 ]  - [  -0.0028166700000000, -0.0029052400000000,  0.0044646000000000 ]  - [  -0.0034678500000000, -0.0024542600000000,  0.0042748500000000 ]  - [   0.0001891100000000, -0.0029298500000000,  0.0045010600000000 ]  - [   0.0010554300000000, -0.0019434200000000, -0.0048745100000000 ]  - [   0.0010592000000000, -0.0033318000000000, -0.0044835600000000 ]  - [  -0.0001244700000000,  0.0053923400000000, -0.0102135300000000 ]  - [   0.0002016200000000,  0.0026713600000000,  0.0045087400000000 ]  - [  -0.0004005600000000,  0.0027380700000000, -0.0046915400000000 ]  - [  -0.0002396900000000,  0.0030127700000000, -0.0045983200000000 ]  - [  -0.0111154600000000, -0.0001816600000000,  0.0100169300000000 ]  - [  -0.0000898500000000,  0.0000638400000000,  0.0049106300000000 ]  - [  -0.0004026900000000,  0.0009228000000000, -0.0054627100000000 ]  - [  -0.0008570100000000, -0.0010294100000000, -0.0054206600000000 ]  - [  -0.0132539900000000, -0.0017212100000000, -0.0168308600000000 ]  - [  -0.0000479000000000, -0.0000281700000000, -0.0045592600000000 ]  - [   0.0047618000000000,  0.0030926800000000,  0.0041021000000000 ]  - [   0.0037957100000000,  0.0025556600000000,  0.0047221300000000 ]  - [  -0.0003106400000000, -0.0004666800000000,  0.0044386300000000 ]  - [  -0.0001600300000000,  0.0003169700000000,  0.0044464200000000 ]  - [  -0.0045503500000000,  0.0031888700000000, -0.0046734600000000 ]  - [  -0.0022923200000000,  0.0030771000000000, -0.0046145900000000 ]  - [  -0.0021727000000000,  0.0031589200000000,  0.0057149600000000 ]  - [  -0.0033308000000000,  0.0037391100000000,  0.0055885700000000 ]  - [   0.0025620900000000,  0.0034101500000000, -0.0050285700000000 ]  - [   0.0020754900000000,  0.0033058200000000, -0.0050918400000000 ]  - [   0.0024503000000000, -0.0035346700000000,  0.0051543400000000 ]  - [   0.0023082100000000, -0.0032301500000000,  0.0050883500000000 ]  - [  -0.0151674500000000, -0.0109142400000000, -0.0246559800000000 ]  - [  -0.0020441000000000, -0.0033309200000000, -0.0049877500000000 ]  - [  -0.0014991000000000,  0.0030328100000000, -0.0047411800000000 ]  - [  -0.0014951400000000,  0.0032379000000000, -0.0048049600000000 ]  - [   0.0011182500000000, -0.0023265200000000, -0.0038805700000000 ]  - [   0.0015001300000000, -0.0036836500000000, -0.0048638100000000 ]  - [   0.0001955000000000, -0.0002479100000000, -0.0012200500000000 ]  - [   0.0000744200000000,  0.0000278200000000, -0.0015095700000000 ]  - [   0.0015033100000000,  0.0004190900000000,  0.0020088700000000 ]  - [  -0.0001501200000000, -0.0003374500000000,  0.0012983400000000 ]  - [   0.0000841300000000, -0.0002416100000000,  0.0020684900000000 ]  - [   0.0000486100000000,  0.0000066800000000,  0.0016349700000000 ]  - [  -0.0000049800000000, -0.0004093000000000, -0.0016994000000000 ]  - [   0.0009866800000000,  0.0007314600000000, -0.0015116000000000 ]  - [   0.0011422400000000, -0.0007281100000000,  0.0007452500000000 ]  - [   0.0012053900000000,  0.0003323900000000, -0.0001368700000000 ]  - [  -0.0009308600000000,  0.0008209600000000,  0.0009743000000000 ]  - [  -0.0010704400000000, -0.0003550200000000, -0.0001054200000000 ]  - [  -0.0014247000000000, -0.0014750600000000,  0.0014186300000000 ]  - [  -0.0011012700000000,  0.0002283000000000, -0.0000503200000000 ]  - [   0.0008195600000000,  0.0014309000000000,  0.0013125600000000 ]  - [   0.0012099500000000, -0.0001887800000000,  0.0000547100000000 ]  - [  -0.0012385100000000, -0.0031157600000000,  0.0046062800000000 ]  - [  -0.0016656200000000, -0.0031806900000000,  0.0049260900000000 ]  - [   0.0012657900000000,  0.0027757000000000,  0.0054830000000000 ]  - [   0.0016443000000000,  0.0032394900000000,  0.0049105500000000 ]  - [   0.0024034400000000,  0.0032558600000000,  0.0030980900000000 ]  - [  -0.0020592600000000,  0.0037995300000000,  0.0046027600000000 ]  - [   0.0010267900000000,  0.0027269700000000, -0.0049286700000000 ]  - [   0.0011030900000000,  0.0055023600000000, -0.0060928400000000 ]  - [  -0.0359495100000000,  0.0076317600000000,  0.0122936800000000 ]  - [   0.0017656900000000, -0.0037975300000000,  0.0046225900000000 ]  - [  -0.0014712500000000, -0.0032692400000000, -0.0046750100000000 ]  - [  -0.0017933000000000, -0.0042083400000000, -0.0048712900000000 ]  - [   0.0105537500000000, -0.0043978100000000, -0.0061963100000000 ]  - [   0.0048934600000000, -0.0032722800000000, -0.0045389500000000 ]  - [  -0.0060963600000000, -0.0040000700000000,  0.0044384500000000 ]  - [  -0.0059145900000000, -0.0012630900000000,  0.0041874200000000 ]  - [  -0.0342708500000000,  0.0041299200000000,  0.0197651800000000 ]  - [  -0.0049784900000000,  0.0031404500000000, -0.0045931100000000 ]  - [   0.0057656100000000,  0.0038602600000000,  0.0047761100000000 ]  - [   0.0055371700000000,  0.0028572000000000,  0.0047038400000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0035945100000000,  0.0046453700000000, -0.0081573200000000 ]  - [  -0.0034419700000000,  0.0046156800000000, -0.0081221900000000 ]  - [   0.0109508600000000,  0.0050841200000000,  0.0090022800000000 ]  - [   0.0034025100000000,  0.0052325500000000,  0.0080889600000000 ]  - [   0.0044052500000000, -0.0054125200000000, -0.0082461400000000 ]  - [   0.0033559900000000, -0.0040532400000000, -0.0081815500000000 ]  - [  -0.0036008700000000, -0.0046324300000000,  0.0082039200000000 ]  - [  -0.0033812300000000, -0.0044115200000000,  0.0083000000000000 ]  - [   0.0032706000000000, -0.0047685500000000,  0.0079962900000000 ]  - [   0.0034289000000000, -0.0043053500000000,  0.0081461100000000 ]  - [  -0.0004476400000000, -0.0055653700000000, -0.0131804800000000 ]  - [  -0.0045820700000000, -0.0012512300000000, -0.0062543600000000 ]  - [  -0.0028432500000000,  0.0014190700000000,  0.0104449200000000 ]  - [  -0.0035816800000000,  0.0052428500000000,  0.0082429600000000 ]  - [   0.0033216800000000,  0.0041344600000000, -0.0082052900000000 ]  - [   0.0035104600000000,  0.0049932800000000, -0.0080480800000000 ]  - [  -0.0029173300000000, -0.0231312000000000, -0.0015675600000000 ]  - [   0.0011737600000000, -0.0012281000000000, -0.0044412600000000 ]  - [  -0.0011284900000000, -0.0029718500000000,  0.0046342300000000 ]  - [  -0.0013951700000000, -0.0029710300000000,  0.0045417700000000 ]  - [   0.0006795800000000, -0.0031117100000000,  0.0046370300000000 ]  - [   0.0011559100000000, -0.0028758100000000,  0.0046050100000000 ]  - [  -0.0015592900000000, -0.0029498400000000, -0.0043385900000000 ]  - [  -0.0001763900000000, -0.0029449700000000, -0.0058409500000000 ]  - [  -0.0035885500000000,  0.0003214800000000,  0.0000191600000000 ]  - [  -0.0009010000000000,  0.0031876700000000,  0.0045652900000000 ]  - [   0.0009650500000000,  0.0028502900000000, -0.0046368000000000 ]  - [   0.0012383700000000,  0.0030758900000000, -0.0045759400000000 ]  - [   0.0007776200000000, -0.0014149000000000,  0.0046236100000000 ]  - [  -0.0003546800000000,  0.0010074100000000,  0.0047708400000000 ]  - [  -0.0006752200000000,  0.0000238900000000, -0.0052286000000000 ]  - [   0.0004938400000000,  0.0002054200000000, -0.0044638800000000 ]  - [  -0.0026691200000000, -0.0001245000000000, -0.0073670200000000 ]  - [   0.0001455400000000,  0.0003198300000000, -0.0046528400000000 ]  - [   0.0012906200000000,  0.0055062900000000, -0.0032224900000000 ]  - [   0.0007879300000000,  0.0042839800000000,  0.0065555000000000 ]  - [   0.0004379600000000, -0.0001634200000000,  0.0045351900000000 ]  - [  -0.0002199300000000,  0.0000933300000000,  0.0048265500000000 ]  - [  -0.0014105600000000,  0.0029748800000000, -0.0045804600000000 ]  - [  -0.0012998800000000,  0.0031040800000000, -0.0045346100000000 ]  - [  -0.0009847800000000,  0.0035872700000000,  0.0041847600000000 ]  - [  -0.0017258700000000,  0.0013659300000000,  0.0062228000000000 ]  - [   0.0019442200000000,  0.0033856300000000, -0.0050920600000000 ]  - [   0.0019065100000000,  0.0031179700000000, -0.0049460400000000 ]  - [   0.0019880700000000, -0.0032321100000000,  0.0049738100000000 ]  - [   0.0018705000000000, -0.0032960600000000,  0.0050133200000000 ]  - [   0.0037696100000000,  0.0029129300000000,  0.0100079700000000 ]  - [  -0.0020560200000000, -0.0042240500000000, -0.0050027900000000 ]  - [  -0.0018580100000000,  0.0031965100000000, -0.0049754000000000 ]  - [  -0.0018930900000000,  0.0033001700000000, -0.0049913100000000 ]  - [   0.0018733500000000, -0.0031795600000000, -0.0050056300000000 ]  - [   0.0020786100000000, -0.0035126800000000, -0.0050561300000000 ]  - [  -0.0001741100000000,  0.0000757100000000, -0.0014017700000000 ]  - [   0.0000431000000000, -0.0000668400000000, -0.0015900100000000 ]  - [  -0.0006534700000000, -0.0000791400000000,  0.0011018900000000 ]  - [   0.0001239900000000, -0.0001608700000000,  0.0015408300000000 ]  - [  -0.0002654700000000,  0.0002638600000000,  0.0016017900000000 ]  - [   0.0002038900000000, -0.0002122200000000,  0.0015485200000000 ]  - [   0.0007430000000000,  0.0003066200000000, -0.0014676900000000 ]  - [  -0.0009373700000000, -0.0003789300000000, -0.0017737100000000 ]  - [   0.0009618400000000,  0.0002988400000000, -0.0005326300000000 ]  - [   0.0008286300000000, -0.0005385700000000,  0.0000669500000000 ]  - [  -0.0011339100000000,  0.0003002300000000, -0.0000736100000000 ]  - [  -0.0004225400000000, -0.0003568400000000,  0.0000780100000000 ]  - [  -0.0012100200000000, -0.0002449700000000,  0.0002549400000000 ]  - [  -0.0012632200000000, -0.0000744600000000,  0.0000198300000000 ]  - [   0.0009592000000000,  0.0004891500000000,  0.0002447400000000 ]  - [   0.0011882300000000, -0.0001703200000000, -0.0000575700000000 ]  - [  -0.0018444400000000, -0.0031756000000000,  0.0049777700000000 ]  - [  -0.0018845800000000, -0.0033159000000000,  0.0049958400000000 ]  - [   0.0018937400000000,  0.0031715600000000,  0.0054638000000000 ]  - [   0.0017663500000000,  0.0030033400000000,  0.0048699000000000 ]  - [  -0.0026992600000000,  0.0036193500000000,  0.0042491200000000 ]  - [  -0.0035466500000000,  0.0032537000000000,  0.0046010100000000 ]  - [   0.0047953500000000,  0.0032663600000000, -0.0047867300000000 ]  - [   0.0009585500000000,  0.0035671100000000, -0.0034906800000000 ]  - [  -0.0060351000000000,  0.0050348000000000,  0.0043291600000000 ]  - [   0.0030946600000000, -0.0043483400000000,  0.0047469200000000 ]  - [  -0.0035269600000000, -0.0035439800000000, -0.0045703300000000 ]  - [  -0.0034481600000000, -0.0036474700000000, -0.0046190600000000 ]  - [   0.0036059200000000, -0.0030666600000000, -0.0044084000000000 ]  - [   0.0038163500000000, -0.0039525300000000, -0.0047230100000000 ]  - [  -0.0025939800000000, -0.0037033000000000,  0.0059827400000000 ]  - [  -0.0039450000000000, -0.0033730000000000,  0.0043561800000000 ]  - [  -0.0008846900000000,  0.0119859000000000, -0.0108294800000000 ]  - [  -0.0038771100000000,  0.0012962400000000, -0.0042538700000000 ]  - [   0.0032229300000000,  0.0033075400000000,  0.0045290000000000 ]  - [   0.0042036300000000,  0.0037134100000000,  0.0047931300000000 ]- atom:   17  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0032458200000000,  0.0044940900000000, -0.0080845900000000 ]  - [  -0.0033996300000000,  0.0045275700000000, -0.0081208300000000 ]  - [  -0.0041797000000000,  0.0040050200000000,  0.0072306400000000 ]  - [   0.0034348200000000,  0.0039026700000000,  0.0081532600000000 ]  - [   0.0024309400000000, -0.0037201900000000, -0.0079955600000000 ]  - [   0.0034853600000000, -0.0050934200000000, -0.0080607500000000 ]  - [  -0.0032378800000000, -0.0045112800000000,  0.0080383900000000 ]  - [  -0.0034625500000000, -0.0047313400000000,  0.0079433600000000 ]  - [   0.0035721600000000, -0.0043714900000000,  0.0082472600000000 ]  - [   0.0034143100000000, -0.0048389500000000,  0.0080976200000000 ]  - [  -0.0063486400000000, -0.0035614100000000, -0.0031403400000000 ]  - [  -0.0022465800000000, -0.0079347200000000, -0.0100129500000000 ]  - [  -0.0039856200000000,  0.0077338900000000,  0.0058908900000000 ]  - [  -0.0032589000000000,  0.0038962400000000,  0.0079975500000000 ]  - [   0.0035212900000000,  0.0050097500000000, -0.0080366900000000 ]  - [   0.0033353700000000,  0.0041470600000000, -0.0081946700000000 ]  - [   0.0053710500000000,  0.0179147100000000, -0.0077937600000000 ]  - [   0.0012327400000000, -0.0047351800000000, -0.0047102000000000 ]  - [  -0.0012819000000000, -0.0029907100000000,  0.0045162900000000 ]  - [  -0.0010161900000000, -0.0029880100000000,  0.0046118000000000 ]  - [   0.0017387900000000, -0.0028487300000000,  0.0045127100000000 ]  - [   0.0012606100000000, -0.0030853700000000,  0.0045475900000000 ]  - [  -0.0008612800000000, -0.0030188500000000, -0.0048118900000000 ]  - [  -0.0022475200000000, -0.0030155900000000, -0.0033036200000000 ]  - [   0.0011919200000000,  0.0056164800000000,  0.0091701700000000 ]  - [  -0.0015176300000000,  0.0027713200000000,  0.0045863200000000 ]  - [   0.0014495900000000,  0.0031113500000000, -0.0045157100000000 ]  - [   0.0011777500000000,  0.0028835000000000, -0.0045778400000000 ]  - [  -0.0007759600000000,  0.0014123300000000,  0.0048037400000000 ]  - [   0.0003620000000000, -0.0010076200000000,  0.0046484700000000 ]  - [   0.0006768100000000, -0.0000175700000000, -0.0041944300000000 ]  - [  -0.0004928000000000, -0.0002126300000000, -0.0049576500000000 ]  - [   0.0027077900000000,  0.0001407800000000, -0.0020104500000000 ]  - [  -0.0001490100000000, -0.0003222200000000, -0.0047695700000000 ]  - [   0.0011208100000000,  0.0004207100000000,  0.0124800100000000 ]  - [   0.0016214300000000,  0.0016775000000000,  0.0026286100000000 ]  - [  -0.0004412600000000,  0.0001657900000000,  0.0048869200000000 ]  - [   0.0002202100000000, -0.0000959100000000,  0.0045961300000000 ]  - [  -0.0009997400000000,  0.0029840500000000, -0.0045717700000000 ]  - [  -0.0011106500000000,  0.0028573900000000, -0.0046173800000000 ]  - [  -0.0027686500000000,  0.0029048700000000,  0.0057793600000000 ]  - [  -0.0019822900000000,  0.0050048000000000,  0.0037278400000000 ]  - [   0.0018029000000000,  0.0031188300000000, -0.0048770300000000 ]  - [   0.0018385000000000,  0.0033903800000000, -0.0050203400000000 ]  - [   0.0017563300000000, -0.0032744700000000,  0.0049971800000000 ]  - [   0.0018737200000000, -0.0032124600000000,  0.0049549800000000 ]  - [  -0.0075827000000000, -0.0096638000000000, -0.0201925200000000 ]  - [  -0.0016882600000000, -0.0022783800000000, -0.0049683600000000 ]  - [  -0.0018871900000000,  0.0033110600000000, -0.0049956500000000 ]  - [  -0.0018533100000000,  0.0032080100000000, -0.0049813900000000 ]  - [   0.0018733900000000, -0.0033322800000000, -0.0049620600000000 ]  - [   0.0016679200000000, -0.0029835000000000, -0.0049111000000000 ]  - [   0.0001753700000000, -0.0000751200000000, -0.0017344000000000 ]  - [  -0.0000432800000000,  0.0000668800000000, -0.0015436000000000 ]  - [   0.0006581300000000,  0.0000811900000000,  0.0020330700000000 ]  - [  -0.0001181800000000,  0.0001610200000000,  0.0015964500000000 ]  - [   0.0002593500000000, -0.0002663500000000,  0.0015366600000000 ]  - [  -0.0002072900000000,  0.0002127400000000,  0.0015857200000000 ]  - [  -0.0007444900000000, -0.0003114000000000, -0.0016695500000000 ]  - [   0.0009252700000000,  0.0003775000000000, -0.0013629600000000 ]  - [   0.0013639600000000, -0.0002987900000000,  0.0005344500000000 ]  - [   0.0014944300000000,  0.0005390600000000, -0.0000698000000000 ]  - [  -0.0011928800000000, -0.0002987900000000,  0.0000740200000000 ]  - [  -0.0019139100000000,  0.0003544800000000, -0.0000790400000000 ]  - [  -0.0011196300000000,  0.0002493100000000, -0.0002603500000000 ]  - [  -0.0010640700000000,  0.0000749200000000, -0.0000205600000000 ]  - [   0.0013696400000000, -0.0004948000000000, -0.0002496600000000 ]  - [   0.0011430800000000,  0.0001714200000000,  0.0000580100000000 ]  - [  -0.0019009900000000, -0.0033331500000000,  0.0049899700000000 ]  - [  -0.0018600800000000, -0.0031893600000000,  0.0049707400000000 ]  - [   0.0018541500000000,  0.0033325100000000,  0.0044956700000000 ]  - [   0.0019820000000000,  0.0035048400000000,  0.0051039000000000 ]  - [  -0.0043892500000000,  0.0034427800000000,  0.0049574500000000 ]  - [  -0.0035298700000000,  0.0038093800000000,  0.0045984500000000 ]  - [   0.0022917700000000,  0.0037995300000000, -0.0044170800000000 ]  - [   0.0061279700000000,  0.0034890900000000, -0.0057120400000000 ]  - [   0.0132029700000000, -0.0122041900000000,  0.0048606000000000 ]  - [   0.0039885000000000, -0.0027102400000000,  0.0044529600000000 ]  - [  -0.0035492200000000, -0.0035190500000000, -0.0046295100000000 ]  - [  -0.0036298100000000, -0.0034114000000000, -0.0045793600000000 ]  - [   0.0034713300000000, -0.0039969700000000, -0.0047900200000000 ]  - [   0.0032526300000000, -0.0031091600000000, -0.0044756000000000 ]  - [  -0.0044847000000000, -0.0033586500000000,  0.0032186400000000 ]  - [  -0.0031276500000000, -0.0036741300000000,  0.0048518500000000 ]  - [  -0.0063296000000000, -0.0050453300000000,  0.0018852400000000 ]  - [  -0.0031917700000000,  0.0057665800000000, -0.0049496700000000 ]  - [   0.0038499700000000,  0.0037551300000000,  0.0046740300000000 ]  - [   0.0028693300000000,  0.0033444300000000,  0.0044073300000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0035504500000000,  0.0047605300000000, -0.0080085600000000 ]  - [  -0.0034367600000000,  0.0045158500000000, -0.0081153600000000 ]  - [   0.0038095600000000,  0.0039981800000000,  0.0067843500000000 ]  - [   0.0036533400000000,  0.0044098500000000,  0.0078781400000000 ]  - [  -0.0002806300000000, -0.0049897200000000, -0.0068724000000000 ]  - [   0.0034080700000000, -0.0045373500000000, -0.0080609600000000 ]  - [  -0.0035962800000000, -0.0044523100000000,  0.0080958800000000 ]  - [  -0.0034131200000000, -0.0045690400000000,  0.0080957500000000 ]  - [   0.0030316900000000, -0.0040739900000000,  0.0080384700000000 ]  - [   0.0034942600000000, -0.0046442700000000,  0.0081822000000000 ]  - [  -0.0037190300000000, -0.0112744300000000, -0.0106600600000000 ]  - [  -0.0034587100000000, -0.0042493200000000, -0.0076451100000000 ]  - [  -0.0039835200000000, -0.0035411900000000,  0.0098364700000000 ]  - [  -0.0032872500000000,  0.0046373700000000,  0.0087540700000000 ]  - [   0.0031479600000000,  0.0047093300000000, -0.0083527300000000 ]  - [   0.0032078800000000,  0.0045194400000000, -0.0083750300000000 ]  - [  -0.0008589100000000, -0.0006348800000000, -0.1823311800000000 ]  - [   0.0010810900000000, -0.0028461200000000, -0.0048494800000000 ]  - [  -0.0010891900000000, -0.0029447400000000,  0.0049102600000000 ]  - [  -0.0011300100000000, -0.0030385600000000,  0.0049103300000000 ]  - [   0.0009178800000000, -0.0030412700000000,  0.0046372900000000 ]  - [   0.0011339300000000, -0.0030075500000000,  0.0045462600000000 ]  - [  -0.0011154300000000, -0.0042419300000000, -0.0032670700000000 ]  - [  -0.0015051300000000, -0.0027432200000000, -0.0032656200000000 ]  - [   0.0133400500000000, -0.0015296300000000,  0.0249398400000000 ]  - [  -0.0011408300000000,  0.0029695800000000,  0.0043908000000000 ]  - [   0.0013256900000000,  0.0030403400000000, -0.0044600800000000 ]  - [   0.0012316100000000,  0.0029782900000000, -0.0044690400000000 ]  - [  -0.0013768900000000,  0.0003258800000000, -0.0004088900000000 ]  - [   0.0000108100000000,  0.0000684700000000,  0.0044981000000000 ]  - [   0.0004656400000000, -0.0009303200000000, -0.0035385200000000 ]  - [  -0.0001083000000000,  0.0004795700000000, -0.0036321300000000 ]  - [  -0.0015518000000000, -0.0002109900000000, -0.0074162300000000 ]  - [   0.0000654200000000, -0.0000558700000000, -0.0048277900000000 ]  - [   0.0007431700000000, -0.0049053200000000,  0.0089018400000000 ]  - [   0.0013532500000000,  0.0049549200000000,  0.0073964900000000 ]  - [  -0.0002692100000000,  0.0000079700000000,  0.0054848300000000 ]  - [   0.0001409800000000, -0.0001360500000000,  0.0052501200000000 ]  - [  -0.0012974400000000,  0.0029816400000000, -0.0046252500000000 ]  - [  -0.0012417600000000,  0.0029369300000000, -0.0046443700000000 ]  - [  -0.0016532400000000,  0.0034888700000000,  0.0049994300000000 ]  - [  -0.0025879300000000,  0.0051079200000000,  0.0049146500000000 ]  - [   0.0018774800000000,  0.0032577300000000, -0.0051257500000000 ]  - [   0.0018829800000000,  0.0032826800000000, -0.0049866200000000 ]  - [   0.0017568400000000, -0.0032732200000000,  0.0050584200000000 ]  - [   0.0018238200000000, -0.0033798600000000,  0.0050774900000000 ]  - [   0.0181764900000000,  0.0184232100000000,  0.0713346700000000 ]  - [  -0.0019296400000000, -0.0033843100000000, -0.0050559900000000 ]  - [  -0.0018931500000000,  0.0032545200000000, -0.0049521000000000 ]  - [  -0.0019201000000000,  0.0032748500000000, -0.0049955300000000 ]  - [   0.0019632500000000, -0.0034794600000000, -0.0049654200000000 ]  - [   0.0015070100000000, -0.0021243700000000, -0.0048446900000000 ]  - [   0.0004784100000000, -0.0004185000000000, -0.0020389200000000 ]  - [  -0.0000018000000000,  0.0000373900000000, -0.0015977000000000 ]  - [   0.0000026900000000, -0.0000904700000000,  0.0014131600000000 ]  - [  -0.0000487600000000, -0.0001978600000000,  0.0016103100000000 ]  - [   0.0003256600000000, -0.0004579400000000,  0.0028541300000000 ]  - [  -0.0000403500000000,  0.0000941100000000,  0.0015422200000000 ]  - [   0.0001264300000000,  0.0000094500000000, -0.0015020400000000 ]  - [   0.0009223500000000,  0.0003487700000000, -0.0010424000000000 ]  - [   0.0009284700000000, -0.0005101800000000,  0.0004044200000000 ]  - [   0.0010344500000000, -0.0002571300000000,  0.0000676500000000 ]  - [  -0.0015585700000000,  0.0005043000000000,  0.0002892700000000 ]  - [  -0.0011984000000000,  0.0002481100000000,  0.0002158900000000 ]  - [  -0.0017563600000000, -0.0001673100000000,  0.0001296300000000 ]  - [  -0.0012319300000000,  0.0000219400000000, -0.0001040300000000 ]  - [   0.0007504300000000,  0.0001294000000000,  0.0001124300000000 ]  - [   0.0010492300000000,  0.0000652200000000,  0.0000150400000000 ]  - [  -0.0019067100000000, -0.0032345700000000,  0.0049613000000000 ]  - [  -0.0018944700000000, -0.0032305000000000,  0.0049552400000000 ]  - [   0.0017255600000000,  0.0026360100000000,  0.0019962900000000 ]  - [   0.0018736500000000,  0.0033047900000000,  0.0048934900000000 ]  - [  -0.0033200600000000,  0.0034875500000000,  0.0043335700000000 ]  - [  -0.0035448400000000,  0.0035472600000000,  0.0046884900000000 ]  - [   0.0041625700000000,  0.0033249100000000, -0.0058106500000000 ]  - [   0.0054677200000000,  0.0044713200000000, -0.0060171900000000 ]  - [   0.0096659800000000, -0.0041910500000000,  0.0188733500000000 ]  - [   0.0036404800000000, -0.0034120900000000,  0.0049498900000000 ]  - [  -0.0035016600000000, -0.0034736800000000, -0.0046074900000000 ]  - [  -0.0037110200000000, -0.0036512900000000, -0.0047428900000000 ]  - [   0.0042603300000000, -0.0035190300000000, -0.0047183300000000 ]  - [   0.0036523400000000, -0.0034077000000000, -0.0045660600000000 ]  - [  -0.0044501000000000, -0.0033294200000000,  0.0012282700000000 ]  - [  -0.0037420000000000, -0.0008119000000000,  0.0016894700000000 ]  - [  -0.0344934500000000,  0.0017407800000000,  0.0670603700000000 ]  - [  -0.0035886500000000,  0.0035476900000000, -0.0042584100000000 ]  - [   0.0035800600000000,  0.0036658400000000,  0.0043320300000000 ]  - [   0.0031868800000000,  0.0030311600000000,  0.0042260200000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0032953300000000,  0.0043769000000000, -0.0082415700000000 ]  - [  -0.0034121200000000,  0.0046249300000000, -0.0081381900000000 ]  - [   0.0031038800000000,  0.0052006900000000,  0.0094810000000000 ]  - [   0.0031921000000000,  0.0047287600000000,  0.0083766500000000 ]  - [   0.0070847500000000, -0.0041575500000000, -0.0093705500000000 ]  - [   0.0034413100000000, -0.0046015200000000, -0.0081942400000000 ]  - [  -0.0032470500000000, -0.0046867900000000,  0.0081527700000000 ]  - [  -0.0034329100000000, -0.0045687300000000,  0.0081572200000000 ]  - [   0.0038337400000000, -0.0050748200000000,  0.0082107300000000 ]  - [   0.0033596400000000, -0.0044942500000000,  0.0080697400000000 ]  - [  -0.0031390800000000,  0.0022338800000000, -0.0055565400000000 ]  - [  -0.0034058000000000, -0.0048776100000000, -0.0085856200000000 ]  - [  -0.0028699400000000,  0.0126875600000000,  0.0063405000000000 ]  - [  -0.0035668900000000,  0.0044939800000000,  0.0075018700000000 ]  - [   0.0037113700000000,  0.0044277000000000, -0.0079018400000000 ]  - [   0.0036461200000000,  0.0046235300000000, -0.0078769000000000 ]  - [   0.0001712500000000, -0.0068578100000000,  0.1733839600000000 ]  - [   0.0013287200000000, -0.0031162700000000, -0.0043035700000000 ]  - [  -0.0013144900000000, -0.0030136300000000,  0.0042421000000000 ]  - [  -0.0012736200000000, -0.0029220500000000,  0.0042421400000000 ]  - [   0.0015171400000000, -0.0029179600000000,  0.0045145900000000 ]  - [   0.0012814100000000, -0.0029512500000000,  0.0046083200000000 ]  - [  -0.0013035400000000, -0.0017053800000000, -0.0059008200000000 ]  - [  -0.0009137900000000, -0.0032163000000000, -0.0058992900000000 ]  - [  -0.0161232500000000,  0.0076234500000000, -0.0162154000000000 ]  - [  -0.0012744700000000,  0.0029916200000000,  0.0047649000000000 ]  - [   0.0010947900000000,  0.0029193600000000, -0.0046934900000000 ]  - [   0.0011856900000000,  0.0029806200000000, -0.0046851200000000 ]  - [   0.0013721400000000, -0.0003333000000000,  0.0098288600000000 ]  - [  -0.0000139400000000, -0.0000670200000000,  0.0049200100000000 ]  - [  -0.0004578000000000,  0.0009126000000000, -0.0058730600000000 ]  - [   0.0001174200000000, -0.0004624100000000, -0.0057799900000000 ]  - [   0.0016406400000000,  0.0002236200000000, -0.0018635100000000 ]  - [  -0.0000637400000000,  0.0000563300000000, -0.0045861800000000 ]  - [   0.0016476900000000,  0.0107969700000000,  0.0002245200000000 ]  - [   0.0010467500000000,  0.0010282900000000,  0.0017342900000000 ]  - [   0.0002683300000000, -0.0000112700000000,  0.0039290400000000 ]  - [  -0.0001449700000000,  0.0001406400000000,  0.0041617300000000 ]  - [  -0.0010999600000000,  0.0029740400000000, -0.0045255600000000 ]  - [  -0.0011634500000000,  0.0030212600000000, -0.0045089000000000 ]  - [  -0.0021065100000000,  0.0030055800000000,  0.0049573700000000 ]  - [  -0.0011591800000000,  0.0013714000000000,  0.0050711600000000 ]  - [   0.0018735200000000,  0.0032471300000000, -0.0048388900000000 ]  - [   0.0018691600000000,  0.0032224900000000, -0.0049793400000000 ]  - [   0.0019936300000000, -0.0032321000000000,  0.0049092600000000 ]  - [   0.0019267500000000, -0.0031279100000000,  0.0048905800000000 ]  - [  -0.0207468200000000, -0.0240607000000000, -0.0774409300000000 ]  - [  -0.0018225800000000, -0.0031246100000000, -0.0049081600000000 ]  - [  -0.0018614100000000,  0.0032536100000000, -0.0050181400000000 ]  - [  -0.0018347900000000,  0.0032321000000000, -0.0049753300000000 ]  - [   0.0017915300000000, -0.0030337000000000, -0.0050125700000000 ]  - [   0.0022475100000000, -0.0043921900000000, -0.0051256000000000 ]  - [  -0.0004690700000000,  0.0004152800000000, -0.0011098000000000 ]  - [   0.0000018200000000, -0.0000376100000000, -0.0015445500000000 ]  - [  -0.0000146100000000,  0.0000879000000000,  0.0017212900000000 ]  - [   0.0000505100000000,  0.0001982100000000,  0.0015326900000000 ]  - [  -0.0003192200000000,  0.0004563300000000,  0.0003101200000000 ]  - [   0.0000414200000000, -0.0000950000000000,  0.0015994500000000 ]  - [  -0.0001242200000000, -0.0000012400000000, -0.0016411600000000 ]  - [  -0.0009309400000000, -0.0003516800000000, -0.0021037600000000 ]  - [   0.0013959200000000,  0.0005217400000000, -0.0004037000000000 ]  - [   0.0013004900000000,  0.0002541200000000, -0.0000632600000000 ]  - [  -0.0007832700000000, -0.0005110200000000, -0.0002851400000000 ]  - [  -0.0011269500000000, -0.0002459800000000, -0.0002134300000000 ]  - [  -0.0005622500000000,  0.0001770100000000, -0.0001437600000000 ]  - [  -0.0010996000000000, -0.0000229200000000,  0.0001034100000000 ]  - [   0.0015895200000000, -0.0001386300000000, -0.0001237900000000 ]  - [   0.0012816100000000, -0.0000659900000000, -0.0000168400000000 ]  - [  -0.0018494700000000, -0.0032732700000000,  0.0050060100000000 ]  - [  -0.0018601200000000, -0.0032767100000000,  0.0050111200000000 ]  - [   0.0020289000000000,  0.0038910400000000,  0.0080191900000000 ]  - [   0.0018794900000000,  0.0032004300000000,  0.0050742800000000 ]  - [  -0.0037793500000000,  0.0035699900000000,  0.0048829800000000 ]  - [  -0.0035309500000000,  0.0035068600000000,  0.0045152200000000 ]  - [   0.0029179900000000,  0.0037269300000000, -0.0033806200000000 ]  - [   0.0015984000000000,  0.0025830500000000, -0.0031733000000000 ]  - [  -0.0027178800000000, -0.0028872500000000, -0.0097433000000000 ]  - [   0.0034298400000000, -0.0036450100000000,  0.0042514100000000 ]  - [  -0.0035752900000000, -0.0035835600000000, -0.0045942600000000 ]  - [  -0.0033615700000000, -0.0034014500000000, -0.0044575500000000 ]  - [   0.0027779200000000, -0.0035345200000000, -0.0044896000000000 ]  - [   0.0034110000000000, -0.0036506100000000, -0.0046410400000000 ]  - [  -0.0025938600000000, -0.0037141600000000,  0.0079987100000000 ]  - [  -0.0033191800000000, -0.0062644800000000,  0.0075279400000000 ]  - [   0.0297428200000000,  0.0057995900000000, -0.0799914700000000 ]  - [  -0.0034746200000000,  0.0035017900000000, -0.0049555200000000 ]  - [   0.0034743000000000,  0.0033868500000000,  0.0048706400000000 ]  - [   0.0038709500000000,  0.0040321200000000,  0.0049774000000000 ]- atom:   29  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0027080500000000,  0.0048246900000000, -0.0075139200000000 ]  - [  -0.0030317900000000,  0.0041341200000000, -0.0080187200000000 ]  - [   0.0047612000000000,  0.0060804700000000,  0.0081912200000000 ]  - [   0.0040201300000000,  0.0043667900000000,  0.0080799300000000 ]  - [   0.0041247700000000, -0.0043231400000000, -0.0087159300000000 ]  - [   0.0038038600000000, -0.0050080800000000, -0.0082157400000000 ]  - [  -0.0020667600000000, -0.0030502200000000,  0.0080416100000000 ]  - [  -0.0028161600000000, -0.0047797200000000,  0.0081535100000000 ]  - [   0.0023626900000000, -0.0067220200000000,  0.0045941900000000 ]  - [   0.0030561800000000, -0.0038543600000000,  0.0078898200000000 ]  - [  -0.0033244900000000, -0.0088170600000000, -0.0063269200000000 ]  - [  -0.0036482900000000, -0.0036260700000000, -0.0079953200000000 ]  - [  -0.0044636800000000,  0.0024191400000000,  0.0116117600000000 ]  - [  -0.0037786300000000,  0.0052834400000000,  0.0083471100000000 ]  - [   0.0035100700000000,  0.0002694000000000, -0.0099244600000000 ]  - [   0.0031769600000000,  0.0055101400000000, -0.0082314400000000 ]  - [   0.0123063700000000, -0.0022179100000000, -0.0059258000000000 ]  - [   0.0012958200000000, -0.0033400800000000, -0.0045634100000000 ]  - [  -0.0008141300000000, -0.0023047600000000,  0.0050340900000000 ]  - [  -0.0003592300000000, -0.0034739700000000,  0.0044603200000000 ]  - [   0.0144096500000000, -0.0056731200000000,  0.0061671600000000 ]  - [   0.0012550700000000, -0.0028332100000000,  0.0045112900000000 ]  - [  -0.0008945000000000, -0.0034187800000000, -0.0043080500000000 ]  - [  -0.0010436600000000, -0.0027620600000000, -0.0047181800000000 ]  - [   0.0119921400000000,  0.0002964900000000,  0.0029742700000000 ]  - [  -0.0011565500000000,  0.0031274700000000,  0.0046404100000000 ]  - [   0.0015189100000000,  0.0025401100000000, -0.0048454200000000 ]  - [   0.0013687000000000,  0.0032014500000000, -0.0044327800000000 ]  - [  -0.0631190900000000, -0.0025466900000000,  0.0054903800000000 ]  - [  -0.0009271100000000, -0.0001144800000000,  0.0047158100000000 ]  - [  -0.0042175600000000, -0.0003675000000000, -0.0043461700000000 ]  - [  -0.0042165300000000, -0.0003058900000000, -0.0050170700000000 ]  - [   0.0054475500000000,  0.0004181800000000, -0.0047308100000000 ]  - [   0.0008442600000000,  0.0000169300000000, -0.0047128800000000 ]  - [   0.0016107200000000,  0.0036551300000000,  0.0041127400000000 ]  - [   0.0020605700000000,  0.0024879800000000,  0.0046854900000000 ]  - [   0.0012184000000000,  0.0000424500000000,  0.0047273300000000 ]  - [   0.0012190500000000,  0.0000433900000000,  0.0047011800000000 ]  - [   0.0101659400000000,  0.0037709200000000, -0.0031763700000000 ]  - [  -0.0011223800000000,  0.0026236800000000, -0.0045878800000000 ]  - [  -0.0019341000000000,  0.0036008900000000,  0.0057512600000000 ]  - [  -0.0012244700000000,  0.0025852300000000,  0.0049049000000000 ]  - [   0.0026071200000000,  0.0028077700000000, -0.0055278300000000 ]  - [   0.0019912000000000,  0.0033296600000000, -0.0050315800000000 ]  - [   0.0017962200000000, -0.0029001600000000,  0.0042185000000000 ]  - [   0.0025140700000000, -0.0039317700000000,  0.0050690700000000 ]  - [  -0.0011234500000000, -0.0036950100000000, -0.0044659500000000 ]  - [  -0.0017482000000000, -0.0031806900000000, -0.0049347200000000 ]  - [  -0.0019695800000000,  0.0029204600000000, -0.0047173300000000 ]  - [  -0.0023852300000000,  0.0040069100000000, -0.0050178500000000 ]  - [   0.0017656200000000, -0.0035869500000000, -0.0052522000000000 ]  - [   0.0013573700000000, -0.0025015200000000, -0.0049541900000000 ]  - [  -0.0007199700000000,  0.0002952500000000, -0.0015624900000000 ]  - [  -0.0003747200000000,  0.0000826900000000, -0.0015627900000000 ]  - [  -0.0007373500000000, -0.0002319300000000,  0.0015046500000000 ]  - [  -0.0007357300000000, -0.0002329600000000,  0.0016224400000000 ]  - [   0.0015192800000000, -0.0006939300000000,  0.0015581500000000 ]  - [   0.0004521800000000, -0.0000171600000000,  0.0015626200000000 ]  - [   0.0015540300000000,  0.0007402800000000, -0.0014317500000000 ]  - [   0.0015410400000000,  0.0007269200000000, -0.0016892300000000 ]  - [   0.0078734300000000,  0.0002948500000000, -0.0004256500000000 ]  - [   0.0015266300000000,  0.0000668000000000, -0.0000860900000000 ]  - [   0.0055305400000000,  0.0001429100000000,  0.0002615600000000 ]  - [  -0.0007981000000000,  0.0000733000000000,  0.0000905500000000 ]  - [  -0.0017579900000000,  0.0000005600000000, -0.0000136400000000 ]  - [  -0.0014410500000000,  0.0000074400000000,  0.0000225800000000 ]  - [   0.0005667700000000,  0.0000033100000000,  0.0000148800000000 ]  - [   0.0008865200000000,  0.0000046900000000, -0.0000234800000000 ]  - [  -0.0022772500000000, -0.0034395800000000,  0.0064523300000000 ]  - [  -0.0019822900000000, -0.0032423600000000,  0.0050056600000000 ]  - [   0.0014576500000000,  0.0030711400000000,  0.0035093800000000 ]  - [   0.0017582000000000,  0.0032644400000000,  0.0049639400000000 ]  - [  -0.0111136800000000,  0.0026952400000000,  0.0035601100000000 ]  - [  -0.0043688000000000,  0.0035817700000000,  0.0047353000000000 ]  - [   0.0017665700000000,  0.0038872200000000, -0.0044723800000000 ]  - [   0.0021568700000000,  0.0029382500000000, -0.0041171900000000 ]  - [  -0.0039863800000000, -0.0043726800000000,  0.0056869000000000 ]  - [   0.0027086300000000, -0.0034861800000000,  0.0044619100000000 ]  - [  -0.0053108000000000, -0.0031763600000000, -0.0047237000000000 ]  - [  -0.0049193300000000, -0.0041337700000000, -0.0050818400000000 ]  - [   0.0088074600000000,  0.0035854100000000, -0.0101878600000000 ]  - [   0.0042918200000000, -0.0037695500000000, -0.0046866100000000 ]  - [  -0.0021438700000000, -0.0042600700000000,  0.0041044700000000 ]  - [  -0.0025759300000000, -0.0016037900000000,  0.0034966000000000 ]  - [   0.0007294700000000,  0.0106189800000000,  0.0003050600000000 ]  - [  -0.0027966100000000,  0.0032912400000000, -0.0045113100000000 ]  - [   0.0049385800000000,  0.0028014000000000,  0.0050912800000000 ]  - [   0.0045072200000000,  0.0054581700000000,  0.0057012400000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0034560900000000,  0.0043659400000000, -0.0080391900000000 ]  - [  -0.0035311600000000,  0.0048867100000000, -0.0081076700000000 ]  - [   0.0035494500000000,  0.0041755100000000,  0.0081673800000000 ]  - [   0.0030111900000000,  0.0049657500000000,  0.0080410400000000 ]  - [   0.0033758400000000, -0.0047735100000000, -0.0081988200000000 ]  - [   0.0033012800000000, -0.0042565100000000, -0.0081269300000000 ]  - [  -0.0032841800000000, -0.0049739400000000,  0.0080658200000000 ]  - [  -0.0038175800000000, -0.0041764900000000,  0.0081923300000000 ]  - [   0.0033702000000000, -0.0055544600000000,  0.0072003800000000 ]  - [   0.0033667400000000, -0.0042884000000000,  0.0080350700000000 ]  - [  -0.0088568900000000, -0.0047746000000000, -0.0123931500000000 ]  - [  -0.0020927400000000, -0.0017993100000000, -0.0071361800000000 ]  - [  -0.0034732400000000,  0.0035786800000000,  0.0090638900000000 ]  - [  -0.0034692000000000,  0.0048626100000000,  0.0081994700000000 ]  - [  -0.0019299500000000,  0.0043059900000000, -0.0038892200000000 ]  - [   0.0047578200000000,  0.0073563300000000, -0.0091037100000000 ]  - [   0.0014074900000000, -0.0043968900000000, -0.0042545900000000 ]  - [   0.0011421900000000, -0.0019737700000000, -0.0045073900000000 ]  - [  -0.0002846300000000, -0.0029611400000000,  0.0054988800000000 ]  - [  -0.0022250800000000, -0.0027702700000000,  0.0041046900000000 ]  - [   0.0028724700000000, -0.0030973500000000,  0.0047825700000000 ]  - [   0.0012409300000000, -0.0026601600000000,  0.0046319500000000 ]  - [  -0.0016755600000000, -0.0031467100000000, -0.0045673800000000 ]  - [  -0.0008951300000000, -0.0028863400000000, -0.0047145800000000 ]  - [   0.0005506200000000,  0.0028331000000000,  0.0043479500000000 ]  - [  -0.0011850500000000,  0.0033015300000000,  0.0045202800000000 ]  - [   0.0007491100000000,  0.0028187000000000, -0.0045868500000000 ]  - [   0.0015250700000000,  0.0030745000000000, -0.0044379400000000 ]  - [  -0.0025459900000000, -0.0554744400000000,  0.0036164300000000 ]  - [  -0.0001151100000000,  0.0013056700000000,  0.0047160500000000 ]  - [   0.0003314400000000, -0.0044616300000000, -0.0012861800000000 ]  - [   0.0003414400000000, -0.0044681400000000, -0.0080839300000000 ]  - [   0.0004179200000000, -0.0004886800000000, -0.0047122600000000 ]  - [   0.0000174000000000,  0.0002776100000000, -0.0047148600000000 ]  - [   0.0021237000000000,  0.0030010100000000,  0.0036574600000000 ]  - [   0.0001776500000000,  0.0031885600000000,  0.0050470600000000 ]  - [  -0.0000425700000000,  0.0000212900000000,  0.0046229200000000 ]  - [  -0.0000437600000000,  0.0000184400000000,  0.0048079100000000 ]  - [  -0.0010127100000000,  0.0015685200000000, -0.0049147500000000 ]  - [  -0.0012669400000000,  0.0039898300000000, -0.0046422200000000 ]  - [  -0.0024168200000000,  0.0032575700000000,  0.0039866700000000 ]  - [  -0.0013332500000000,  0.0037335800000000,  0.0050984000000000 ]  - [   0.0018136600000000,  0.0031845100000000, -0.0051370600000000 ]  - [   0.0017779200000000,  0.0028647000000000, -0.0049090700000000 ]  - [   0.0013197900000000, -0.0032464100000000,  0.0059766300000000 ]  - [   0.0024062400000000, -0.0027704000000000,  0.0048696300000000 ]  - [  -0.0019123900000000, -0.0033253600000000, -0.0048343700000000 ]  - [  -0.0019607400000000, -0.0036467700000000, -0.0050588900000000 ]  - [  -0.0020520200000000,  0.0033034300000000, -0.0049343100000000 ]  - [  -0.0015100500000000,  0.0032059200000000, -0.0050356800000000 ]  - [   0.0016882600000000, -0.0032085600000000, -0.0050353800000000 ]  - [   0.0022350300000000, -0.0032963200000000, -0.0049352300000000 ]  - [  -0.0000571700000000,  0.0000385900000000, -0.0015640400000000 ]  - [   0.0000967300000000, -0.0000749800000000, -0.0015641200000000 ]  - [   0.0000394300000000,  0.0000240400000000,  0.0015461300000000 ]  - [   0.0000446700000000,  0.0000256800000000,  0.0015824200000000 ]  - [  -0.0000480500000000, -0.0000579000000000,  0.0015637700000000 ]  - [   0.0000962900000000, -0.0000723800000000,  0.0015632800000000 ]  - [  -0.0002936200000000,  0.0004809000000000, -0.0004678500000000 ]  - [  -0.0002996200000000,  0.0004719100000000, -0.0026687600000000 ]  - [   0.0013721500000000,  0.0239620500000000, -0.0236442400000000 ]  - [   0.0011477500000000,  0.0002459100000000,  0.0000080800000000 ]  - [  -0.0009595300000000,  0.0246314300000000,  0.0246642600000000 ]  - [  -0.0011773600000000,  0.0002411200000000, -0.0000055600000000 ]  - [  -0.0011661900000000,  0.0001197300000000, -0.0000387900000000 ]  - [  -0.0011413300000000, -0.0001206000000000,  0.0000340900000000 ]  - [   0.0011593500000000,  0.0001159100000000,  0.0000344800000000 ]  - [   0.0011874500000000, -0.0001214800000000, -0.0000351500000000 ]  - [  -0.0017926500000000, -0.0031125800000000,  0.0050558600000000 ]  - [  -0.0019175100000000, -0.0034024200000000,  0.0050501500000000 ]  - [   0.0019424300000000,  0.0033979400000000,  0.0048980300000000 ]  - [   0.0018238900000000,  0.0031039600000000,  0.0049195600000000 ]  - [  -0.0034384700000000,  0.0039003400000000,  0.0044745500000000 ]  - [  -0.0036460800000000,  0.0029427100000000,  0.0044775200000000 ]  - [   0.0043982600000000,  0.0034827200000000, -0.0046931900000000 ]  - [   0.0028052300000000,  0.0036139800000000, -0.0044835700000000 ]  - [   0.0036378800000000, -0.0031743800000000,  0.0047447800000000 ]  - [   0.0034429800000000, -0.0041247400000000,  0.0047177100000000 ]  - [  -0.0026929300000000, -0.0035867700000000, -0.0045039600000000 ]  - [  -0.0042812300000000, -0.0034481800000000, -0.0047124300000000 ]  - [   0.0068921400000000,  0.0043066300000000, -0.0074199200000000 ]  - [   0.0037316400000000, -0.0064465300000000, -0.0048983100000000 ]  - [  -0.0037597000000000, -0.0037702500000000,  0.0040315200000000 ]  - [  -0.0032397100000000, -0.0033195900000000,  0.0064508600000000 ]  - [  -0.0001849300000000,  0.0114996800000000, -0.0016942200000000 ]  - [  -0.0033391000000000,  0.0006191700000000, -0.0043023700000000 ]  - [   0.0033054500000000,  0.0033014300000000,  0.0051651600000000 ]  - [   0.0038294500000000,  0.0037375300000000,  0.0027611900000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0027017100000000,  0.0044461300000000, -0.0082785200000000 ]  - [  -0.0032814900000000,  0.0044555700000000, -0.0080983200000000 ]  - [   0.0031542300000000,  0.0049332900000000,  0.0078050900000000 ]  - [   0.0032630500000000,  0.0042920900000000,  0.0078481100000000 ]  - [   0.0027017100000000, -0.0044461300000000, -0.0082785200000000 ]  - [   0.0032814900000000, -0.0044555700000000, -0.0080983200000000 ]  - [  -0.0031542300000000, -0.0049332900000000,  0.0078050900000000 ]  - [  -0.0032630500000000, -0.0042920900000000,  0.0078481100000000 ]  - [   0.0045897200000000, -0.0046815100000000,  0.0126511900000000 ]  - [   0.0033882100000000, -0.0051038700000000,  0.0082234700000000 ]  - [  -0.0020311800000000, -0.0076508100000000, -0.0087054400000000 ]  - [  -0.0034832700000000, -0.0046908700000000, -0.0090583300000000 ]  - [  -0.0045897200000000,  0.0046815100000000,  0.0126511900000000 ]  - [  -0.0033882100000000,  0.0051038700000000,  0.0082234700000000 ]  - [   0.0020311800000000,  0.0076508100000000, -0.0087054400000000 ]  - [   0.0034832700000000,  0.0046908700000000, -0.0090583300000000 ]  - [  -0.0041143300000000, -0.0030644000000000, -0.0096778400000000 ]  - [   0.0010145100000000, -0.0029177000000000, -0.0047848300000000 ]  - [  -0.0004603200000000, -0.0024633700000000,  0.0057449400000000 ]  - [  -0.0005041300000000, -0.0032232600000000,  0.0056536100000000 ]  - [  -0.0108050600000000, -0.0003085900000000,  0.0017897300000000 ]  - [   0.0013618700000000, -0.0030364900000000,  0.0044558400000000 ]  - [  -0.0014801300000000, -0.0031525700000000, -0.0038001700000000 ]  - [  -0.0014728300000000, -0.0028632900000000, -0.0040327200000000 ]  - [   0.0108050600000000,  0.0003085900000000,  0.0017897300000000 ]  - [  -0.0013618700000000,  0.0030364900000000,  0.0044558400000000 ]  - [   0.0014801300000000,  0.0031525700000000, -0.0038001700000000 ]  - [   0.0014728300000000,  0.0028632900000000, -0.0040327200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0798346600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038815000000000 ]  - [  -0.0003369700000000,  0.0033760200000000, -0.0091523900000000 ]  - [   0.0003369700000000, -0.0033760200000000, -0.0091523900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059146800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0049614500000000 ]  - [   0.0004603200000000,  0.0024633700000000,  0.0057449400000000 ]  - [   0.0005041300000000,  0.0032232600000000,  0.0056536100000000 ]  - [   0.0000126900000000,  0.0000929500000000,  0.0051501900000000 ]  - [  -0.0000126900000000, -0.0000929500000000,  0.0051501900000000 ]  - [   0.0041143300000000,  0.0030644000000000, -0.0096778400000000 ]  - [  -0.0010145100000000,  0.0029177000000000, -0.0047848300000000 ]  - [  -0.0025997900000000,  0.0039115300000000,  0.0056928400000000 ]  - [  -0.0019737100000000,  0.0033777700000000,  0.0049951400000000 ]  - [   0.0032021100000000,  0.0035502800000000, -0.0033537500000000 ]  - [   0.0018226000000000,  0.0032925700000000, -0.0051078900000000 ]  - [   0.0025997900000000, -0.0039115300000000,  0.0056928400000000 ]  - [   0.0019737100000000, -0.0033777700000000,  0.0049951400000000 ]  - [  -0.0032021100000000, -0.0035502800000000, -0.0033537500000000 ]  - [  -0.0018226000000000, -0.0032925700000000, -0.0051078900000000 ]  - [  -0.0020094800000000,  0.0034544700000000, -0.0050356200000000 ]  - [  -0.0017426700000000,  0.0026190700000000, -0.0049877600000000 ]  - [   0.0020094800000000, -0.0034544700000000, -0.0050356200000000 ]  - [   0.0017426700000000, -0.0026190700000000, -0.0049877600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017335400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0016095100000000 ]  - [  -0.0000497600000000, -0.0000858200000000,  0.0016184000000000 ]  - [   0.0000497600000000,  0.0000858200000000,  0.0016184000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0024263600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014855200000000 ]  - [  -0.0000609000000000, -0.0003473200000000, -0.0018243600000000 ]  - [   0.0000609000000000,  0.0003473200000000, -0.0018243600000000 ]  - [   0.0008159600000000, -0.0275657100000000,  0.0306803100000000 ]  - [   0.0012318800000000,  0.0003214700000000, -0.0000113300000000 ]  - [  -0.0008159600000000,  0.0275657100000000,  0.0306803100000000 ]  - [  -0.0012318800000000, -0.0003214700000000, -0.0000113300000000 ]  - [  -0.0012431700000000,  0.0002411600000000, -0.0002069100000000 ]  - [  -0.0011423000000000, -0.0000434100000000, -0.0000228300000000 ]  - [   0.0012431700000000, -0.0002411600000000, -0.0002069100000000 ]  - [   0.0011423000000000,  0.0000434100000000, -0.0000228300000000 ]  - [  -0.0018644700000000, -0.0031828800000000,  0.0032867700000000 ]  - [  -0.0018952500000000, -0.0032501000000000,  0.0049378700000000 ]  - [   0.0018644700000000,  0.0031828800000000,  0.0032867700000000 ]  - [   0.0018952500000000,  0.0032501000000000,  0.0049378700000000 ]  - [  -0.0053379500000000,  0.0048116000000000,  0.0088482600000000 ]  - [  -0.0039983300000000,  0.0034260500000000,  0.0048246500000000 ]  - [   0.0043503300000000,  0.0035047400000000, -0.0049123700000000 ]  - [   0.0043601800000000,  0.0035282200000000, -0.0049021600000000 ]  - [   0.0053379500000000, -0.0048116000000000,  0.0088482600000000 ]  - [   0.0039983300000000, -0.0034260500000000,  0.0048246500000000 ]  - [  -0.0043503300000000, -0.0035047400000000, -0.0049123700000000 ]  - [  -0.0043601800000000, -0.0035282200000000, -0.0049021600000000 ]  - [   0.0016238800000000, -0.0105669500000000,  0.0121281900000000 ]  - [   0.0034915600000000, -0.0036769000000000, -0.0042936900000000 ]  - [  -0.0035016900000000, -0.0036197100000000,  0.0033042500000000 ]  - [  -0.0032870700000000, -0.0040252600000000,  0.0037385900000000 ]  - [  -0.0016238800000000,  0.0105669500000000,  0.0121281900000000 ]  - [  -0.0034915600000000,  0.0036769000000000, -0.0042936900000000 ]  - [   0.0035016900000000,  0.0036197100000000,  0.0033042500000000 ]  - [   0.0032870700000000,  0.0040252600000000,  0.0037385900000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0041340000000000,  0.0046954300000000, -0.0079557600000000 ]  - [  -0.0035519000000000,  0.0046872500000000, -0.0081351900000000 ]  - [   0.0036801800000000,  0.0042091500000000,  0.0084320200000000 ]  - [   0.0035694800000000,  0.0048522200000000,  0.0083873900000000 ]  - [   0.0041340000000000, -0.0046954300000000, -0.0079557600000000 ]  - [   0.0035519000000000, -0.0046872500000000, -0.0081351900000000 ]  - [  -0.0036801800000000, -0.0042091500000000,  0.0084320200000000 ]  - [  -0.0035694800000000, -0.0048522200000000,  0.0083873900000000 ]  - [   0.0022459600000000, -0.0044471900000000,  0.0036138000000000 ]  - [   0.0034462400000000, -0.0040342400000000,  0.0080119600000000 ]  - [  -0.0048182200000000, -0.0014857500000000, -0.0075227500000000 ]  - [  -0.0033537600000000, -0.0044598300000000, -0.0071800300000000 ]  - [  -0.0022459600000000,  0.0044471900000000,  0.0036138000000000 ]  - [  -0.0034462400000000,  0.0040342400000000,  0.0080119600000000 ]  - [   0.0048182200000000,  0.0014857500000000, -0.0075227500000000 ]  - [   0.0033537600000000,  0.0044598300000000, -0.0071800300000000 ]  - [   0.0065533900000000, -0.0028900300000000,  0.0005621000000000 ]  - [   0.0014022400000000, -0.0030463300000000, -0.0043632700000000 ]  - [  -0.0019488400000000, -0.0035041400000000,  0.0034096600000000 ]  - [  -0.0019069600000000, -0.0027354700000000,  0.0035049400000000 ]  - [   0.0132803100000000, -0.0056721100000000,  0.0073426200000000 ]  - [   0.0010544800000000, -0.0029246900000000,  0.0046961900000000 ]  - [  -0.0009350100000000, -0.0028083000000000, -0.0053544600000000 ]  - [  -0.0009438600000000, -0.0031000600000000, -0.0051195500000000 ]  - [  -0.0132803100000000,  0.0056721100000000,  0.0073426200000000 ]  - [  -0.0010544800000000,  0.0029246900000000,  0.0046961900000000 ]  - [   0.0009350100000000,  0.0028083000000000, -0.0053544600000000 ]  - [   0.0009438600000000,  0.0031000600000000, -0.0051195500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0874937700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0055449900000000 ]  - [   0.0003348100000000, -0.0034227300000000, -0.0002890900000000 ]  - [  -0.0003348100000000,  0.0034227300000000, -0.0002890900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035006900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044651300000000 ]  - [   0.0019488400000000,  0.0035041400000000,  0.0034096600000000 ]  - [   0.0019069600000000,  0.0027354700000000,  0.0035049400000000 ]  - [  -0.0000129600000000, -0.0000925300000000,  0.0042782700000000 ]  - [   0.0000129600000000,  0.0000925300000000,  0.0042782700000000 ]  - [  -0.0065533900000000,  0.0028900300000000,  0.0005621000000000 ]  - [  -0.0014022400000000,  0.0030463300000000, -0.0043632700000000 ]  - [  -0.0011299300000000,  0.0025969500000000,  0.0042774800000000 ]  - [  -0.0017540600000000,  0.0031315800000000,  0.0049684400000000 ]  - [   0.0005459400000000,  0.0029585000000000, -0.0066182000000000 ]  - [   0.0019112200000000,  0.0032180100000000, -0.0048605700000000 ]  - [   0.0011299300000000, -0.0025969500000000,  0.0042774800000000 ]  - [   0.0017540600000000, -0.0031315800000000,  0.0049684400000000 ]  - [  -0.0005459400000000, -0.0029585000000000, -0.0066182000000000 ]  - [  -0.0019112200000000, -0.0032180100000000, -0.0048605700000000 ]  - [  -0.0017252200000000,  0.0030537900000000, -0.0049325000000000 ]  - [  -0.0019971800000000,  0.0038901400000000, -0.0049824100000000 ]  - [   0.0017252200000000, -0.0030537900000000, -0.0049325000000000 ]  - [   0.0019971800000000, -0.0038901400000000, -0.0049824100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0013912500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015148800000000 ]  - [   0.0000456100000000,  0.0000857400000000,  0.0015082400000000 ]  - [  -0.0000456100000000, -0.0000857400000000,  0.0015082400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0006806400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016393600000000 ]  - [   0.0000587600000000,  0.0003524100000000, -0.0012915500000000 ]  - [  -0.0000587600000000, -0.0003524100000000, -0.0012915500000000 ]  - [   0.0015025200000000,  0.0264336100000000, -0.0295204500000000 ]  - [   0.0010934600000000, -0.0003148500000000,  0.0000138200000000 ]  - [  -0.0015025200000000, -0.0264336100000000, -0.0295204500000000 ]  - [  -0.0010934600000000,  0.0003148500000000,  0.0000138200000000 ]  - [  -0.0010817200000000, -0.0002405300000000,  0.0002059300000000 ]  - [  -0.0011860700000000,  0.0000452700000000,  0.0000220900000000 ]  - [   0.0010817200000000,  0.0002405300000000,  0.0002059300000000 ]  - [   0.0011860700000000, -0.0000452700000000,  0.0000220900000000 ]  - [  -0.0018704600000000, -0.0033269800000000,  0.0066835100000000 ]  - [  -0.0018419900000000, -0.0032579400000000,  0.0050355500000000 ]  - [   0.0018704600000000,  0.0033269800000000,  0.0066835100000000 ]  - [   0.0018419900000000,  0.0032579400000000,  0.0050355500000000 ]  - [  -0.0017241200000000,  0.0022482800000000,  0.0003426500000000 ]  - [  -0.0030814300000000,  0.0036393600000000,  0.0043720300000000 ]  - [   0.0027308100000000,  0.0035607000000000, -0.0042833000000000 ]  - [   0.0027216600000000,  0.0035343900000000, -0.0042924100000000 ]  - [   0.0017241200000000, -0.0022482800000000,  0.0003426500000000 ]  - [   0.0030814300000000, -0.0036393600000000,  0.0043720300000000 ]  - [  -0.0027308100000000, -0.0035607000000000, -0.0042833000000000 ]  - [  -0.0027216600000000, -0.0035343900000000, -0.0042924100000000 ]  - [   0.0059969800000000,  0.0035344800000000, -0.0216604200000000 ]  - [   0.0035888800000000, -0.0033874100000000, -0.0049037900000000 ]  - [  -0.0035750000000000, -0.0034403300000000,  0.0058976100000000 ]  - [  -0.0037916800000000, -0.0030295000000000,  0.0054560000000000 ]  - [  -0.0059969800000000, -0.0035344800000000, -0.0216604200000000 ]  - [  -0.0035888800000000,  0.0033874100000000, -0.0049037900000000 ]  - [   0.0035750000000000,  0.0034403300000000,  0.0058976100000000 ]  - [   0.0037916800000000,  0.0030295000000000,  0.0054560000000000 ]- atom:   41  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0036413100000000,  0.0045460200000000, -0.0081679100000000 ]  - [  -0.0035878500000000,  0.0046700500000000, -0.0081494500000000 ]  - [   0.0035140000000000,  0.0047341700000000,  0.0081159000000000 ]  - [   0.0027862800000000,  0.0041105300000000,  0.0070402000000000 ]  - [   0.0034844500000000, -0.0045632600000000, -0.0081214300000000 ]  - [   0.0033898000000000, -0.0043697100000000, -0.0076883700000000 ]  - [  -0.0036831600000000, -0.0047668100000000,  0.0080724700000000 ]  - [  -0.0036231000000000, -0.0045774600000000,  0.0081681500000000 ]  - [   0.0033996200000000, -0.0044439200000000,  0.0081162800000000 ]  - [   0.0033401400000000, -0.0046359600000000,  0.0080772900000000 ]  - [   0.0019228900000000, -0.0100623300000000, -0.0223747100000000 ]  - [  -0.0032027700000000, -0.0041667300000000, -0.0081645700000000 ]  - [  -0.0032568900000000,  0.0042350300000000,  0.0085410400000000 ]  - [  -0.0032274200000000,  0.0046414500000000,  0.0079960900000000 ]  - [   0.0033874700000000,  0.0047374700000000, -0.0081377900000000 ]  - [   0.0035075400000000,  0.0044360600000000, -0.0082494300000000 ]  - [   0.0015069900000000, -0.0020798900000000, -0.0043399400000000 ]  - [   0.0026728500000000, -0.0028546100000000, -0.0053014500000000 ]  - [  -0.0018963500000000, -0.0030468900000000,  0.0045793100000000 ]  - [  -0.0014104100000000, -0.0030103200000000,  0.0045834000000000 ]  - [   0.0008383800000000, -0.0029592400000000,  0.0045932400000000 ]  - [   0.0008294600000000, -0.0029954800000000,  0.0046198300000000 ]  - [  -0.0006214000000000, -0.0030018100000000, -0.0044005200000000 ]  - [  -0.0009791800000000, -0.0028689400000000, -0.0045735200000000 ]  - [  -0.0004618300000000,  0.0029746100000000,  0.0046642300000000 ]  - [  -0.0008399800000000,  0.0031812100000000,  0.0042065500000000 ]  - [   0.0010035700000000,  0.0029876600000000, -0.0045935400000000 ]  - [   0.0005720000000000,  0.0029467100000000, -0.0046042500000000 ]  - [  -0.0000649500000000, -0.0005470900000000,  0.0039818200000000 ]  - [   0.0006432100000000,  0.0005267000000000,  0.0046088200000000 ]  - [   0.0001246200000000,  0.0000909000000000, -0.0047537200000000 ]  - [   0.0007474300000000,  0.0000486700000000, -0.0034078900000000 ]  - [  -0.0001060300000000, -0.0001829000000000, -0.0045653500000000 ]  - [  -0.0005124300000000,  0.0003635700000000, -0.0048332300000000 ]  - [   0.0013793000000000,  0.0031597200000000,  0.0046295000000000 ]  - [   0.0144672300000000, -0.0026828800000000, -0.0146723300000000 ]  - [  -0.0001137700000000,  0.0000475500000000,  0.0046822200000000 ]  - [  -0.0004136300000000, -0.0000754700000000,  0.0047132500000000 ]  - [  -0.0017903200000000,  0.0030923400000000, -0.0044561600000000 ]  - [  -0.0016455500000000,  0.0029721000000000, -0.0045233400000000 ]  - [  -0.0425277800000000,  0.0156515700000000,  0.0445791800000000 ]  - [  -0.0018842900000000,  0.0031005600000000,  0.0049545600000000 ]  - [   0.0018831200000000,  0.0032973700000000, -0.0050704700000000 ]  - [   0.0018841300000000,  0.0032579700000000, -0.0050822000000000 ]  - [   0.0019165000000000, -0.0032857500000000,  0.0050076600000000 ]  - [   0.0024870300000000, -0.0032654200000000,  0.0050352800000000 ]  - [  -0.0019909000000000, -0.0034174200000000, -0.0049990700000000 ]  - [  -0.0023468500000000, -0.0039533600000000, -0.0056250600000000 ]  - [  -0.0017471200000000,  0.0032125400000000, -0.0049198900000000 ]  - [  -0.0018151300000000,  0.0032265800000000, -0.0049611800000000 ]  - [   0.0018666700000000, -0.0033248600000000, -0.0049869200000000 ]  - [   0.0015412700000000, -0.0024511900000000, -0.0037028000000000 ]  - [   0.0000653800000000,  0.0000319000000000, -0.0015408500000000 ]  - [   0.0001651400000000, -0.0000844900000000, -0.0015433100000000 ]  - [   0.0000367900000000, -0.0000360100000000,  0.0015506000000000 ]  - [   0.0010294700000000,  0.0006506900000000,  0.0018924400000000 ]  - [  -0.0000350600000000, -0.0000430500000000,  0.0016204500000000 ]  - [  -0.0001235600000000,  0.0001461900000000,  0.0016081100000000 ]  - [  -0.0001413100000000, -0.0000810500000000, -0.0015789100000000 ]  - [   0.0076370000000000,  0.0010157500000000, -0.0057227900000000 ]  - [   0.0011149800000000, -0.0002157900000000,  0.0000633000000000 ]  - [   0.0061105400000000,  0.0040598600000000,  0.0021397800000000 ]  - [   0.0052430900000000, -0.0039619900000000,  0.0029618800000000 ]  - [  -0.0012212000000000,  0.0000672700000000,  0.0000020700000000 ]  - [  -0.0010802900000000,  0.0001245600000000, -0.0000134400000000 ]  - [  -0.0011347700000000, -0.0001008800000000,  0.0000990100000000 ]  - [   0.0011898500000000,  0.0000075000000000,  0.0000217800000000 ]  - [   0.0013459700000000, -0.0000437800000000,  0.0000855200000000 ]  - [  -0.0017977900000000, -0.0032330500000000,  0.0049826700000000 ]  - [  -0.0017829300000000, -0.0032413800000000,  0.0049728500000000 ]  - [   0.0018198800000000,  0.0032952300000000,  0.0048921500000000 ]  - [   0.0018178500000000,  0.0031221700000000,  0.0049873800000000 ]  - [  -0.0029168700000000,  0.0036902000000000,  0.0045651100000000 ]  - [  -0.0027718800000000,  0.0034522000000000,  0.0044963500000000 ]  - [   0.0061602900000000,  0.0041534600000000, -0.0093741000000000 ]  - [   0.0034193200000000,  0.0034157200000000, -0.0046461700000000 ]  - [   0.0032611400000000, -0.0033286100000000,  0.0045277500000000 ]  - [   0.0046100800000000, -0.0068893600000000,  0.0051154300000000 ]  - [  -0.0031843800000000, -0.0035975300000000, -0.0045980400000000 ]  - [  -0.0026959900000000, -0.0034821400000000, -0.0046277900000000 ]  - [   0.0042169200000000, -0.0039005100000000, -0.0048174400000000 ]  - [   0.0039582300000000, -0.0030292200000000, -0.0046582000000000 ]  - [  -0.0039039700000000, -0.0037115700000000,  0.0045963300000000 ]  - [  -0.0061041400000000, -0.0018172000000000,  0.0018016700000000 ]  - [  -0.0048103500000000,  0.0001351500000000, -0.0053353300000000 ]  - [  -0.0051438700000000,  0.0037334500000000, -0.0037925200000000 ]  - [   0.0042375200000000,  0.0036072900000000,  0.0045172000000000 ]  - [   0.0037033400000000,  0.0034296500000000,  0.0046092600000000 ]- atom:   41  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0032032300000000,  0.0045978600000000, -0.0080753900000000 ]  - [  -0.0032565000000000,  0.0044725500000000, -0.0080946500000000 ]  - [   0.0033281700000000,  0.0044049300000000,  0.0081268100000000 ]  - [   0.0040130900000000,  0.0050587400000000,  0.0091921900000000 ]  - [   0.0033569200000000, -0.0045818200000000, -0.0081242200000000 ]  - [   0.0034432600000000, -0.0047637600000000, -0.0085629400000000 ]  - [  -0.0031586600000000, -0.0043722000000000,  0.0081752700000000 ]  - [  -0.0032202900000000, -0.0045663700000000,  0.0080757800000000 ]  - [   0.0034443700000000, -0.0046979700000000,  0.0081247200000000 ]  - [   0.0035024800000000, -0.0045061800000000,  0.0081618800000000 ]  - [  -0.0088746100000000,  0.0007344000000000,  0.0058308200000000 ]  - [  -0.0036353300000000, -0.0049720000000000, -0.0080757800000000 ]  - [  -0.0035801600000000,  0.0048787500000000,  0.0076787000000000 ]  - [  -0.0036121900000000,  0.0045042400000000,  0.0082474200000000 ]  - [   0.0034527700000000,  0.0044070200000000, -0.0081053300000000 ]  - [   0.0033470100000000,  0.0047126500000000, -0.0080001800000000 ]  - [   0.0009085400000000, -0.0038685500000000, -0.0047922200000000 ]  - [  -0.0002464900000000, -0.0031172700000000, -0.0038720700000000 ]  - [  -0.0005205300000000, -0.0029150900000000,  0.0045735300000000 ]  - [  -0.0010019200000000, -0.0029503800000000,  0.0045711700000000 ]  - [   0.0015716400000000, -0.0030007500000000,  0.0045614400000000 ]  - [   0.0015794200000000, -0.0029650700000000,  0.0045345000000000 ]  - [  -0.0018302600000000, -0.0029720900000000, -0.0047049800000000 ]  - [  -0.0014349100000000, -0.0030922600000000, -0.0045787600000000 ]  - [  -0.0019597100000000,  0.0029833500000000,  0.0044926600000000 ]  - [  -0.0015785800000000,  0.0027768900000000,  0.0049472900000000 ]  - [   0.0014096700000000,  0.0029726600000000, -0.0045596000000000 ]  - [   0.0018298000000000,  0.0030123400000000, -0.0045469200000000 ]  - [   0.0000702300000000,  0.0005519600000000,  0.0054558000000000 ]  - [  -0.0006466900000000, -0.0005476100000000,  0.0048339000000000 ]  - [  -0.0001196200000000, -0.0000911700000000, -0.0046700900000000 ]  - [  -0.0007358400000000, -0.0000528000000000, -0.0060671300000000 ]  - [   0.0001004500000000,  0.0001824200000000, -0.0048558000000000 ]  - [   0.0005125700000000, -0.0003637900000000, -0.0045825100000000 ]  - [   0.0010322700000000,  0.0027990300000000,  0.0045226400000000 ]  - [  -0.0119104700000000,  0.0086773000000000,  0.0242283100000000 ]  - [   0.0001107900000000, -0.0000478900000000,  0.0047399100000000 ]  - [   0.0004022500000000,  0.0000745800000000,  0.0047121100000000 ]  - [  -0.0006273200000000,  0.0028695800000000, -0.0046924300000000 ]  - [  -0.0007719600000000,  0.0029862600000000, -0.0046254500000000 ]  - [   0.0381470300000000, -0.0090632900000000, -0.0347695300000000 ]  - [  -0.0018629800000000,  0.0034044000000000,  0.0050150400000000 ]  - [   0.0018649400000000,  0.0032045600000000, -0.0048979500000000 ]  - [   0.0018646700000000,  0.0032531100000000, -0.0048850100000000 ]  - [   0.0018292400000000, -0.0032212700000000,  0.0049642200000000 ]  - [   0.0012602400000000, -0.0032438300000000,  0.0049311000000000 ]  - [  -0.0017572500000000, -0.0030793900000000, -0.0049728300000000 ]  - [  -0.0014034300000000, -0.0025868000000000, -0.0043507500000000 ]  - [  -0.0019963300000000,  0.0032933900000000, -0.0050510100000000 ]  - [  -0.0019321300000000,  0.0032845500000000, -0.0050113600000000 ]  - [   0.0018799800000000, -0.0031827100000000, -0.0049806700000000 ]  - [   0.0022004400000000, -0.0040655900000000, -0.0063112400000000 ]  - [  -0.0000644800000000, -0.0000311100000000, -0.0015936500000000 ]  - [  -0.0001628200000000,  0.0000833300000000, -0.0015931200000000 ]  - [  -0.0000351600000000,  0.0000376500000000,  0.0015838600000000 ]  - [  -0.0010394700000000, -0.0006600900000000,  0.0012336000000000 ]  - [   0.0000276500000000,  0.0000439900000000,  0.0015177400000000 ]  - [   0.0001187200000000, -0.0001436400000000,  0.0015294000000000 ]  - [   0.0001410400000000,  0.0000818400000000, -0.0015568400000000 ]  - [  -0.0074661000000000, -0.0010190000000000,  0.0024004900000000 ]  - [   0.0012137600000000,  0.0002093200000000, -0.0000611500000000 ]  - [  -0.0035530800000000, -0.0038711300000000, -0.0020044000000000 ]  - [  -0.0072802700000000,  0.0037699500000000, -0.0028148800000000 ]  - [  -0.0011082600000000, -0.0000600900000000,  0.0000024200000000 ]  - [  -0.0012468000000000, -0.0001250300000000,  0.0000133700000000 ]  - [  -0.0011928600000000,  0.0001017700000000, -0.0001001700000000 ]  - [   0.0011381300000000, -0.0000067600000000, -0.0000224100000000 ]  - [   0.0009856000000000,  0.0000413800000000, -0.0000871200000000 ]  - [  -0.0019474400000000, -0.0032752300000000,  0.0049852500000000 ]  - [  -0.0019612300000000, -0.0032639000000000,  0.0049909700000000 ]  - [   0.0019268900000000,  0.0032167100000000,  0.0050785100000000 ]  - [   0.0019305100000000,  0.0033833900000000,  0.0049826200000000 ]  - [  -0.0041536100000000,  0.0033689800000000,  0.0046344400000000 ]  - [  -0.0042998800000000,  0.0036121900000000,  0.0047045000000000 ]  - [   0.0009714100000000,  0.0029005900000000,  0.0002353900000000 ]  - [   0.0036609700000000,  0.0036475800000000, -0.0045535600000000 ]  - [   0.0038257600000000, -0.0037247500000000,  0.0046764500000000 ]  - [   0.0024702100000000, -0.0001303500000000,  0.0040843400000000 ]  - [  -0.0038888800000000, -0.0034634300000000, -0.0046003800000000 ]  - [  -0.0043734800000000, -0.0035820100000000, -0.0045714000000000 ]  - [   0.0028633500000000, -0.0031636400000000, -0.0043868000000000 ]  - [   0.0031240800000000, -0.0040357800000000, -0.0045480000000000 ]  - [  -0.0031738800000000, -0.0033492400000000,  0.0046048700000000 ]  - [  -0.0010446600000000, -0.0052301300000000,  0.0073769000000000 ]  - [  -0.0022699600000000,  0.0070199900000000, -0.0038900000000000 ]  - [  -0.0019476600000000,  0.0033171000000000, -0.0054065100000000 ]  - [   0.0028564200000000,  0.0034575900000000,  0.0046845800000000 ]  - [   0.0033706100000000,  0.0036323500000000,  0.0045902800000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0033880400000000,  0.0046768700000000, -0.0080874000000000 ]  - [  -0.0034273100000000,  0.0044106100000000, -0.0081357300000000 ]  - [   0.0031489300000000,  0.0040799200000000,  0.0081324700000000 ]  - [   0.0048567500000000,  0.0055263500000000,  0.0084989000000000 ]  - [   0.0032370300000000, -0.0048362600000000, -0.0080016000000000 ]  - [   0.0034740600000000, -0.0042597700000000, -0.0085716000000000 ]  - [  -0.0033480200000000, -0.0044320500000000,  0.0081586900000000 ]  - [  -0.0033564000000000, -0.0046887100000000,  0.0080882100000000 ]  - [   0.0034939200000000, -0.0047937800000000,  0.0080864100000000 ]  - [   0.0034361000000000, -0.0043161100000000,  0.0080671500000000 ]  - [  -0.0058064400000000,  0.0046506400000000,  0.0046610200000000 ]  - [  -0.0037267300000000, -0.0049861300000000, -0.0075701600000000 ]  - [  -0.0035210500000000,  0.0043689800000000,  0.0074456700000000 ]  - [  -0.0033733600000000,  0.0040894100000000,  0.0084118400000000 ]  - [   0.0034787100000000,  0.0043825700000000, -0.0081701600000000 ]  - [   0.0036186700000000,  0.0050402300000000, -0.0079163100000000 ]  - [   0.0012846300000000, -0.0026619800000000, -0.0043132700000000 ]  - [   0.0006815900000000, -0.0047151000000000, -0.0026982800000000 ]  - [  -0.0010504900000000, -0.0028497100000000,  0.0045684500000000 ]  - [  -0.0011588000000000, -0.0031146100000000,  0.0045468000000000 ]  - [   0.0014249500000000, -0.0030392500000000,  0.0045754200000000 ]  - [   0.0012267900000000, -0.0029327700000000,  0.0045548700000000 ]  - [  -0.0017061000000000, -0.0030664900000000, -0.0051758900000000 ]  - [  -0.0012226000000000, -0.0032312200000000, -0.0045238900000000 ]  - [  -0.0021365700000000,  0.0030506500000000,  0.0043605100000000 ]  - [  -0.0007751100000000,  0.0027157900000000,  0.0057155500000000 ]  - [   0.0012779300000000,  0.0029179900000000, -0.0045994000000000 ]  - [   0.0013440600000000,  0.0030587500000000, -0.0045952600000000 ]  - [   0.0003502800000000,  0.0000042100000000,  0.0053779700000000 ]  - [  -0.0006773700000000,  0.0004796500000000,  0.0048454100000000 ]  - [  -0.0000744700000000, -0.0003922900000000, -0.0047543500000000 ]  - [   0.0004498000000000, -0.0000733900000000, -0.0050275300000000 ]  - [  -0.0003295700000000,  0.0000486200000000, -0.0049111600000000 ]  - [   0.0007529100000000, -0.0000442700000000, -0.0040718600000000 ]  - [   0.0011332500000000,  0.0020083400000000,  0.0044438600000000 ]  - [  -0.0064389700000000,  0.0091180600000000,  0.0259068300000000 ]  - [  -0.0000101100000000, -0.0001498500000000,  0.0047100300000000 ]  - [   0.0001747600000000,  0.0001430700000000,  0.0046468100000000 ]  - [  -0.0009270700000000,  0.0030020100000000, -0.0045528200000000 ]  - [  -0.0012364800000000,  0.0029382100000000, -0.0044486200000000 ]  - [   0.0104150200000000, -0.0279458900000000, -0.0375840500000000 ]  - [  -0.0020186800000000,  0.0042058000000000,  0.0051155700000000 ]  - [   0.0018659800000000,  0.0032195800000000, -0.0049875500000000 ]  - [   0.0018225300000000,  0.0032247400000000, -0.0050256900000000 ]  - [   0.0018365600000000, -0.0031477900000000,  0.0049493200000000 ]  - [   0.0018537300000000, -0.0033371600000000,  0.0049256100000000 ]  - [  -0.0016959700000000, -0.0023354800000000, -0.0059073900000000 ]  - [  -0.0011803900000000, -0.0004705600000000, -0.0011494300000000 ]  - [  -0.0019074400000000,  0.0032055100000000, -0.0049838600000000 ]  - [  -0.0018964000000000,  0.0033135600000000, -0.0050088500000000 ]  - [   0.0017952400000000, -0.0030106200000000, -0.0049260100000000 ]  - [   0.0026820400000000, -0.0038856400000000, -0.0056318300000000 ]  - [   0.0000484600000000, -0.0000393300000000, -0.0015647000000000 ]  - [  -0.0000603200000000,  0.0000438400000000, -0.0015833000000000 ]  - [   0.0000867700000000,  0.0000938800000000,  0.0015944400000000 ]  - [  -0.0004384700000000, -0.0003015000000000,  0.0013637300000000 ]  - [  -0.0002433800000000,  0.0000920900000000,  0.0014780000000000 ]  - [   0.0000878200000000, -0.0000392600000000,  0.0016923600000000 ]  - [   0.0001716900000000,  0.0001713700000000, -0.0015195700000000 ]  - [  -0.0025445000000000, -0.0017681100000000, -0.0015946000000000 ]  - [   0.0010546400000000,  0.0004099400000000, -0.0001500800000000 ]  - [   0.0045461000000000,  0.0012492300000000,  0.0012769400000000 ]  - [  -0.0051943600000000,  0.0014394100000000, -0.0018582400000000 ]  - [  -0.0009554400000000,  0.0003399400000000,  0.0001112900000000 ]  - [  -0.0011219100000000, -0.0001218400000000,  0.0000708100000000 ]  - [  -0.0011740100000000,  0.0001492300000000, -0.0001254500000000 ]  - [   0.0011744900000000,  0.0000904200000000,  0.0000319600000000 ]  - [   0.0011661000000000, -0.0001184400000000, -0.0000671600000000 ]  - [  -0.0018882500000000, -0.0032602600000000,  0.0050143400000000 ]  - [  -0.0018786300000000, -0.0032539300000000,  0.0049947900000000 ]  - [   0.0019960000000000,  0.0032881700000000,  0.0051657500000000 ]  - [   0.0018298600000000,  0.0032830100000000,  0.0048482500000000 ]  - [  -0.0036347100000000,  0.0034118900000000,  0.0045285200000000 ]  - [  -0.0038138100000000,  0.0036317700000000,  0.0046900500000000 ]  - [   0.0035537900000000,  0.0025699900000000, -0.0032092700000000 ]  - [   0.0035102200000000,  0.0039842100000000, -0.0046776100000000 ]  - [   0.0063041000000000, -0.0032112800000000,  0.0046847000000000 ]  - [  -0.0018994600000000, -0.0017111000000000,  0.0032474100000000 ]  - [  -0.0036072500000000, -0.0033539800000000, -0.0045519900000000 ]  - [  -0.0037361000000000, -0.0036863300000000, -0.0045987900000000 ]  - [   0.0028902800000000, -0.0032554000000000, -0.0043925800000000 ]  - [   0.0039896200000000, -0.0038701700000000, -0.0048832400000000 ]  - [  -0.0034885000000000, -0.0027262100000000,  0.0044143400000000 ]  - [  -0.0027001100000000, -0.0040849300000000,  0.0078808800000000 ]  - [  -0.0049609600000000,  0.0123346500000000,  0.0022189900000000 ]  - [  -0.0005864200000000,  0.0060508600000000, -0.0113428500000000 ]  - [   0.0032784300000000,  0.0031794100000000,  0.0046796000000000 ]  - [   0.0035119300000000,  0.0038255000000000,  0.0046688700000000 ]- atom:   41  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0034467200000000,  0.0044662700000000, -0.0081451300000000 ]  - [  -0.0034076300000000,  0.0047341300000000, -0.0080979000000000 ]  - [   0.0036878800000000,  0.0050653000000000,  0.0081017200000000 ]  - [   0.0019877300000000,  0.0036347000000000,  0.0077243500000000 ]  - [   0.0035993000000000, -0.0043096300000000, -0.0082349200000000 ]  - [   0.0033573100000000, -0.0048707700000000, -0.0076663000000000 ]  - [  -0.0034843600000000, -0.0047135900000000,  0.0080773400000000 ]  - [  -0.0034770700000000, -0.0044544400000000,  0.0081461200000000 ]  - [   0.0033390600000000, -0.0043508900000000,  0.0081434500000000 ]  - [   0.0033971400000000, -0.0048248100000000,  0.0081665800000000 ]  - [  -0.0008927800000000, -0.0139285300000000, -0.0213465200000000 ]  - [  -0.0031045000000000, -0.0041271800000000, -0.0086561100000000 ]  - [  -0.0033110100000000,  0.0047435200000000,  0.0087664500000000 ]  - [  -0.0034585600000000,  0.0050530800000000,  0.0078292500000000 ]  - [   0.0033517000000000,  0.0047598700000000, -0.0080619900000000 ]  - [   0.0032168900000000,  0.0041098400000000, -0.0083138400000000 ]  - [   0.0010925400000000, -0.0033477700000000, -0.0047963200000000 ]  - [   0.0016890500000000, -0.0010779200000000, -0.0064357100000000 ]  - [  -0.0013680800000000, -0.0031146300000000,  0.0045797100000000 ]  - [  -0.0012578200000000, -0.0028459000000000,  0.0046073500000000 ]  - [   0.0009893100000000, -0.0029236300000000,  0.0045765300000000 ]  - [   0.0011872700000000, -0.0030279700000000,  0.0045967800000000 ]  - [  -0.0007472900000000, -0.0029064800000000, -0.0039226800000000 ]  - [  -0.0011914600000000, -0.0027307000000000, -0.0046290300000000 ]  - [  -0.0002810000000000,  0.0029007200000000,  0.0048046800000000 ]  - [  -0.0016387100000000,  0.0032416000000000,  0.0034469400000000 ]  - [   0.0011357100000000,  0.0030425900000000, -0.0045533600000000 ]  - [   0.0010666600000000,  0.0029032600000000, -0.0045572200000000 ]  - [  -0.0003468700000000, -0.0000037600000000,  0.0040642000000000 ]  - [   0.0006653300000000, -0.0004871300000000,  0.0045976300000000 ]  - [   0.0000737700000000,  0.0003909000000000, -0.0046797800000000 ]  - [  -0.0004352900000000,  0.0000663400000000, -0.0044360200000000 ]  - [   0.0003327700000000, -0.0000505800000000, -0.0045100900000000 ]  - [  -0.0007460400000000,  0.0000506400000000, -0.0053453500000000 ]  - [   0.0012865700000000,  0.0039556300000000,  0.0047036800000000 ]  - [   0.0088273700000000, -0.0034549400000000, -0.0165621300000000 ]  - [   0.0000099600000000,  0.0001504600000000,  0.0047187000000000 ]  - [  -0.0001921300000000, -0.0001423200000000,  0.0047904500000000 ]  - [  -0.0014924800000000,  0.0029579500000000, -0.0045946700000000 ]  - [  -0.0011826000000000,  0.0030258900000000, -0.0047001900000000 ]  - [  -0.0143081000000000,  0.0347450900000000,  0.0477986700000000 ]  - [  -0.0017155500000000,  0.0022911200000000,  0.0048543100000000 ]  - [   0.0018759100000000,  0.0032832900000000, -0.0049869200000000 ]  - [   0.0019149800000000,  0.0032864200000000, -0.0049421500000000 ]  - [   0.0019011900000000, -0.0033567600000000,  0.0050241200000000 ]  - [   0.0018801800000000, -0.0031746700000000,  0.0050440600000000 ]  - [  -0.0020378800000000, -0.0041913400000000, -0.0040220400000000 ]  - [  -0.0025493100000000, -0.0060183100000000, -0.0087576500000000 ]  - [  -0.0018255800000000,  0.0032995200000000, -0.0049897000000000 ]  - [  -0.0018437800000000,  0.0031989000000000, -0.0049672500000000 ]  - [   0.0019423700000000, -0.0035036200000000, -0.0050469100000000 ]  - [   0.0010688000000000, -0.0026170700000000, -0.0043372700000000 ]  - [  -0.0000514900000000,  0.0000420000000000, -0.0015584800000000 ]  - [   0.0000617800000000, -0.0000452600000000, -0.0015422700000000 ]  - [  -0.0000896400000000, -0.0000940300000000,  0.0015290000000000 ]  - [   0.0004449700000000,  0.0003001200000000,  0.0017628300000000 ]  - [   0.0002417000000000, -0.0000919700000000,  0.0016526700000000 ]  - [  -0.0000899500000000,  0.0000387100000000,  0.0014352700000000 ]  - [  -0.0001688400000000, -0.0001682500000000, -0.0016080700000000 ]  - [   0.0024620800000000,  0.0017500400000000, -0.0015141200000000 ]  - [   0.0012789400000000, -0.0004170200000000,  0.0001528700000000 ]  - [  -0.0021355500000000, -0.0012247300000000, -0.0012306200000000 ]  - [   0.0029654900000000, -0.0014499600000000,  0.0019037500000000 ]  - [  -0.0013673900000000, -0.0003338600000000, -0.0001076600000000 ]  - [  -0.0012044000000000,  0.0001249000000000, -0.0000734000000000 ]  - [  -0.0011523800000000, -0.0001471000000000,  0.0001231400000000 ]  - [   0.0011488800000000, -0.0000902400000000, -0.0000336400000000 ]  - [   0.0011671900000000,  0.0001138500000000,  0.0000652500000000 ]  - [  -0.0018484600000000, -0.0032489300000000,  0.0049573500000000 ]  - [  -0.0018562600000000, -0.0032510600000000,  0.0049725700000000 ]  - [   0.0017391300000000,  0.0032275500000000,  0.0048027900000000 ]  - [   0.0019103100000000,  0.0032209500000000,  0.0051263800000000 ]  - [  -0.0034470400000000,  0.0036567400000000,  0.0046690300000000 ]  - [  -0.0032672600000000,  0.0034356700000000,  0.0045070500000000 ]  - [   0.0036365900000000,  0.0044925100000000, -0.0060009400000000 ]  - [   0.0035664100000000,  0.0030826100000000, -0.0045146800000000 ]  - [   0.0007365500000000, -0.0038563700000000,  0.0045000400000000 ]  - [   0.0088961700000000, -0.0053517500000000,  0.0059337600000000 ]  - [  -0.0034748200000000, -0.0037130200000000, -0.0046425400000000 ]  - [  -0.0033389500000000, -0.0033802400000000, -0.0045943400000000 ]  - [   0.0041980500000000, -0.0038075400000000, -0.0048062700000000 ]  - [   0.0031028600000000, -0.0032032500000000, -0.0043174200000000 ]  - [  -0.0035953600000000, -0.0043370400000000,  0.0047929300000000 ]  - [  -0.0044553400000000, -0.0029641800000000,  0.0012826300000000 ]  - [  -0.0020654500000000, -0.0052736500000000, -0.0115808500000000 ]  - [  -0.0064640100000000,  0.0010342900000000,  0.0020399800000000 ]  - [   0.0038061800000000,  0.0038857900000000,  0.0045190900000000 ]  - [   0.0035751600000000,  0.0032420500000000,  0.0045289600000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0033059400000000,  0.0046390500000000, -0.0080799300000000 ]  - [  -0.0033379000000000,  0.0044834500000000, -0.0081473100000000 ]  - [   0.0033274400000000,  0.0043498300000000,  0.0082415300000000 ]  - [   0.0039026100000000,  0.0043734300000000,  0.0080418100000000 ]  - [   0.0033876600000000, -0.0044574900000000, -0.0080743100000000 ]  - [   0.0045096500000000, -0.0056715100000000, -0.0084211300000000 ]  - [  -0.0033397000000000, -0.0044840900000000,  0.0081385600000000 ]  - [  -0.0033858500000000, -0.0046046200000000,  0.0081412600000000 ]  - [   0.0034020600000000, -0.0046372000000000,  0.0080806700000000 ]  - [   0.0034836800000000, -0.0045118500000000,  0.0080307200000000 ]  - [  -0.0148420300000000,  0.0169881600000000,  0.0507156100000000 ]  - [  -0.0034763500000000, -0.0050836000000000, -0.0082524000000000 ]  - [  -0.0037444600000000,  0.0055800400000000,  0.0067452300000000 ]  - [  -0.0036234000000000,  0.0039940900000000,  0.0077841600000000 ]  - [   0.0035359600000000,  0.0044605500000000, -0.0081994200000000 ]  - [   0.0035325300000000,  0.0049229500000000, -0.0076958800000000 ]  - [   0.0004784400000000, -0.0037818300000000, -0.0045712700000000 ]  - [   0.0006051300000000, -0.0017371000000000, -0.0046499000000000 ]  - [  -0.0011691800000000, -0.0028704100000000,  0.0044325400000000 ]  - [  -0.0010980200000000, -0.0030163600000000,  0.0045720000000000 ]  - [   0.0014453300000000, -0.0029876800000000,  0.0046086000000000 ]  - [   0.0013882000000000, -0.0029720000000000,  0.0045657100000000 ]  - [  -0.0007122400000000, -0.0025013200000000, -0.0075872400000000 ]  - [  -0.0012835400000000, -0.0030942000000000, -0.0046690200000000 ]  - [  -0.0022975200000000,  0.0029559800000000,  0.0045972400000000 ]  - [  -0.0013266200000000,  0.0029074900000000,  0.0047148900000000 ]  - [   0.0012617500000000,  0.0029674400000000, -0.0046053600000000 ]  - [   0.0015884800000000,  0.0029840600000000, -0.0046007600000000 ]  - [   0.0007635600000000, -0.0009857400000000,  0.0054147600000000 ]  - [  -0.0000770800000000,  0.0001154300000000,  0.0047205600000000 ]  - [  -0.0000490500000000, -0.0000738400000000, -0.0048323000000000 ]  - [  -0.0005284700000000,  0.0001489200000000, -0.0030631100000000 ]  - [  -0.0002686300000000, -0.0000524100000000, -0.0047601900000000 ]  - [   0.0000274200000000,  0.0000511100000000, -0.0047101100000000 ]  - [   0.0012034300000000,  0.0029602200000000,  0.0045008100000000 ]  - [  -0.0191149400000000,  0.0185213900000000,  0.0809944800000000 ]  - [   0.0000229500000000, -0.0000684500000000,  0.0046585000000000 ]  - [   0.0014767400000000, -0.0000788000000000,  0.0029986800000000 ]  - [  -0.0010392300000000,  0.0029895000000000, -0.0045037100000000 ]  - [  -0.0011000200000000,  0.0029492700000000, -0.0044853900000000 ]  - [   0.0379595700000000, -0.0392058900000000, -0.1493847100000000 ]  - [  -0.0019057200000000,  0.0033841300000000,  0.0049806000000000 ]  - [   0.0017774900000000,  0.0032941700000000, -0.0050160400000000 ]  - [   0.0017881400000000,  0.0032539200000000, -0.0050163700000000 ]  - [   0.0018533700000000, -0.0032168900000000,  0.0049227300000000 ]  - [   0.0018249400000000, -0.0031945700000000,  0.0047966800000000 ]  - [  -0.0018631000000000, -0.0042071000000000, -0.0049230700000000 ]  - [  -0.0012339400000000,  0.0005735700000000, -0.0043620500000000 ]  - [  -0.0019411200000000,  0.0032515300000000, -0.0049854000000000 ]  - [  -0.0018991500000000,  0.0032744600000000, -0.0049795800000000 ]  - [   0.0018734300000000, -0.0031933200000000, -0.0049187100000000 ]  - [   0.0031684000000000, -0.0038949200000000, -0.0043766500000000 ]  - [  -0.0000265300000000, -0.0000652700000000, -0.0015841900000000 ]  - [  -0.0003095100000000,  0.0001181800000000, -0.0014635100000000 ]  - [   0.0000476100000000,  0.0000434600000000,  0.0015814700000000 ]  - [   0.0000790400000000,  0.0000508100000000,  0.0015366800000000 ]  - [   0.0001736300000000, -0.0000634500000000,  0.0015065300000000 ]  - [   0.0001252000000000, -0.0000284800000000,  0.0016001600000000 ]  - [   0.0000517700000000,  0.0000540100000000, -0.0015580000000000 ]  - [  -0.0091350700000000, -0.0021029500000000,  0.0002736700000000 ]  - [   0.0012913500000000,  0.0001005100000000, -0.0002741100000000 ]  - [   0.0035856100000000,  0.0017862300000000, -0.0003544600000000 ]  - [   0.0008180600000000, -0.0022352000000000, -0.0006974500000000 ]  - [  -0.0010355600000000,  0.0000484900000000, -0.0000682100000000 ]  - [  -0.0010358500000000, -0.0002111800000000,  0.0002835600000000 ]  - [  -0.0011825200000000,  0.0000135000000000,  0.0000201900000000 ]  - [   0.0011625400000000,  0.0000529800000000,  0.0000551100000000 ]  - [   0.0013142100000000,  0.0001227800000000,  0.0002217800000000 ]  - [  -0.0018765600000000, -0.0032815000000000,  0.0050479200000000 ]  - [  -0.0018865400000000, -0.0032632800000000,  0.0050389200000000 ]  - [   0.0018721600000000,  0.0031130800000000,  0.0053081500000000 ]  - [   0.0019689400000000,  0.0034347200000000,  0.0053110400000000 ]  - [  -0.0035742500000000,  0.0034393700000000,  0.0044475200000000 ]  - [  -0.0036741100000000,  0.0035788100000000,  0.0044960600000000 ]  - [  -0.0079386800000000,  0.0025944800000000,  0.0000551300000000 ]  - [   0.0035319600000000,  0.0036380400000000, -0.0046323600000000 ]  - [   0.0045050700000000, -0.0032354700000000,  0.0039813300000000 ]  - [   0.0035037600000000, -0.0033975300000000,  0.0039796100000000 ]  - [  -0.0036575700000000, -0.0034491300000000, -0.0046066300000000 ]  - [  -0.0040058200000000, -0.0035807900000000, -0.0047877100000000 ]  - [   0.0028826500000000, -0.0033191400000000, -0.0044278100000000 ]  - [   0.0033514600000000, -0.0039097500000000, -0.0046398000000000 ]  - [  -0.0034345800000000, -0.0031794200000000,  0.0048815400000000 ]  - [   0.0007893000000000, -0.0053684400000000,  0.0184791300000000 ]  - [  -0.0033595800000000,  0.0135806000000000, -0.0025428000000000 ]  - [  -0.0035811500000000,  0.0021572300000000, -0.0039162600000000 ]  - [   0.0035452200000000,  0.0033900100000000,  0.0052110300000000 ]  - [   0.0034891900000000,  0.0035827300000000,  0.0047097600000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0035447900000000,  0.0045012800000000, -0.0081721900000000 ]  - [  -0.0035127600000000,  0.0046577000000000, -0.0081054500000000 ]  - [   0.0035223500000000,  0.0047918800000000,  0.0080102500000000 ]  - [   0.0029111100000000,  0.0047836600000000,  0.0082272400000000 ]  - [   0.0034623200000000, -0.0046807700000000, -0.0081775900000000 ]  - [   0.0023509100000000, -0.0034710500000000, -0.0078371500000000 ]  - [  -0.0035114500000000, -0.0046559400000000,  0.0081123000000000 ]  - [  -0.0034653200000000, -0.0045348300000000,  0.0081105400000000 ]  - [   0.0034481700000000, -0.0045016300000000,  0.0081713300000000 ]  - [   0.0033671300000000, -0.0046285100000000,  0.0082213400000000 ]  - [   0.0088337900000000, -0.0273938800000000, -0.0698020300000000 ]  - [  -0.0033707100000000, -0.0040268300000000, -0.0079968600000000 ]  - [  -0.0031022000000000,  0.0035661000000000,  0.0095177400000000 ]  - [  -0.0032276400000000,  0.0051430500000000,  0.0084606300000000 ]  - [   0.0033135900000000,  0.0046815900000000, -0.0080524300000000 ]  - [   0.0033233300000000,  0.0042141600000000, -0.0085591700000000 ]  - [   0.0019299600000000, -0.0021907400000000, -0.0046118100000000 ]  - [   0.0018059400000000, -0.0042355900000000, -0.0044920500000000 ]  - [  -0.0012463700000000, -0.0030889100000000,  0.0047202800000000 ]  - [  -0.0013133500000000, -0.0029419100000000,  0.0045809400000000 ]  - [   0.0009619600000000, -0.0029704800000000,  0.0045443200000000 ]  - [   0.0010222600000000, -0.0029873400000000,  0.0045876500000000 ]  - [  -0.0017071900000000, -0.0034653700000000, -0.0015633500000000 ]  - [  -0.0011270700000000, -0.0028642900000000, -0.0044862500000000 ]  - [  -0.0001065300000000,  0.0029996900000000,  0.0045513400000000 ]  - [  -0.0010884600000000,  0.0030524300000000,  0.0044353700000000 ]  - [   0.0011492000000000,  0.0029920700000000, -0.0045477700000000 ]  - [   0.0008278900000000,  0.0029746400000000, -0.0045536300000000 ]  - [  -0.0007684700000000,  0.0010068600000000,  0.0040026000000000 ]  - [   0.0000886700000000, -0.0001105200000000,  0.0046942900000000 ]  - [   0.0000508000000000,  0.0000732800000000, -0.0045836500000000 ]  - [   0.0005318000000000, -0.0001502000000000, -0.0063257500000000 ]  - [   0.0002663400000000,  0.0000504200000000, -0.0046562300000000 ]  - [  -0.0000301900000000, -0.0000489100000000, -0.0047053500000000 ]  - [   0.0012071500000000,  0.0029962400000000,  0.0046497800000000 ]  - [   0.0202846900000000, -0.0116924400000000, -0.0677805300000000 ]  - [  -0.0000239700000000,  0.0000683600000000,  0.0047561100000000 ]  - [  -0.0014626400000000,  0.0000770100000000,  0.0063957900000000 ]  - [  -0.0013729900000000,  0.0029699400000000, -0.0046507000000000 ]  - [  -0.0013098600000000,  0.0030096300000000, -0.0046704100000000 ]  - [  -0.0414313900000000,  0.0461765600000000,  0.1580497700000000 ]  - [  -0.0018466600000000,  0.0031227800000000,  0.0049824200000000 ]  - [   0.0019749400000000,  0.0032118200000000, -0.0049505900000000 ]  - [   0.0019628200000000,  0.0032513600000000, -0.0049508100000000 ]  - [   0.0018994300000000, -0.0032909800000000,  0.0050455000000000 ]  - [   0.0019278900000000, -0.0033112300000000,  0.0051717800000000 ]  - [  -0.0018905600000000, -0.0023230900000000, -0.0050296900000000 ]  - [  -0.0025090900000000, -0.0070320000000000, -0.0056038800000000 ]  - [  -0.0018119400000000,  0.0032567100000000, -0.0049838900000000 ]  - [  -0.0018530300000000,  0.0032314800000000, -0.0049894200000000 ]  - [   0.0018808700000000, -0.0033130900000000, -0.0050483200000000 ]  - [   0.0005597500000000, -0.0026017500000000, -0.0056010600000000 ]  - [   0.0000277400000000,  0.0000648400000000, -0.0015591300000000 ]  - [   0.0003078600000000, -0.0001174200000000, -0.0016784700000000 ]  - [  -0.0000465400000000, -0.0000424400000000,  0.0015601100000000 ]  - [  -0.0000738700000000, -0.0000497300000000,  0.0016075700000000 ]  - [  -0.0001748200000000,  0.0000637100000000,  0.0016337600000000 ]  - [  -0.0001245100000000,  0.0000291400000000,  0.0015420400000000 ]  - [  -0.0000566800000000, -0.0000559900000000, -0.0015854100000000 ]  - [   0.0093213300000000,  0.0021245700000000, -0.0034665700000000 ]  - [   0.0010379300000000, -0.0001024900000000,  0.0002764700000000 ]  - [  -0.0012215500000000, -0.0017548100000000,  0.0003460500000000 ]  - [  -0.0031016100000000,  0.0022014100000000,  0.0006931500000000 ]  - [  -0.0012939400000000, -0.0000488700000000,  0.0000664500000000 ]  - [  -0.0012940600000000,  0.0002104800000000, -0.0002824500000000 ]  - [  -0.0011485300000000, -0.0000143700000000, -0.0000193900000000 ]  - [   0.0011686700000000, -0.0000530700000000, -0.0000554000000000 ]  - [   0.0010166100000000, -0.0001211000000000, -0.0002198600000000 ]  - [  -0.0018758600000000, -0.0032249000000000,  0.0049174900000000 ]  - [  -0.0018657200000000, -0.0032430900000000,  0.0049282000000000 ]  - [   0.0018802100000000,  0.0033920500000000,  0.0046575100000000 ]  - [   0.0017833500000000,  0.0030730600000000,  0.0046611200000000 ]  - [  -0.0034911600000000,  0.0036171500000000,  0.0047554700000000 ]  - [  -0.0033917100000000,  0.0034780600000000,  0.0047065500000000 ]  - [   0.0148596800000000,  0.0044505100000000, -0.0091981600000000 ]  - [   0.0035374600000000,  0.0034181700000000, -0.0045721800000000 ]  - [   0.0025680800000000, -0.0038237600000000,  0.0052300500000000 ]  - [   0.0035669200000000, -0.0036665900000000,  0.0052201400000000 ]  - [  -0.0034099700000000, -0.0036074000000000, -0.0045974700000000 ]  - [  -0.0030604200000000, -0.0034740600000000, -0.0044174700000000 ]  - [   0.0041935400000000, -0.0037401300000000, -0.0047785800000000 ]  - [   0.0037143200000000, -0.0031410100000000, -0.0045618000000000 ]  - [  -0.0036358600000000, -0.0038757300000000,  0.0043242300000000 ]  - [  -0.0078493700000000, -0.0016727600000000, -0.0091297100000000 ]  - [  -0.0037105800000000, -0.0066782700000000, -0.0067087800000000 ]  - [  -0.0034895100000000,  0.0048993000000000, -0.0052954800000000 ]  - [   0.0035224600000000,  0.0036653700000000,  0.0039958900000000 ]  - [   0.0035797000000000,  0.0034717400000000,  0.0044927800000000 ]- atom:   53  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0734258200000000, -0.0223348400000000,  0.0020700300000000 ]  - [  -0.0033379500000000,  0.0052138700000000, -0.0080629200000000 ]  - [   0.0038767900000000,  0.0048923900000000,  0.0091553300000000 ]  - [   0.0035265000000000,  0.0046592500000000,  0.0082318600000000 ]  - [   0.0839921400000000, -0.0332712700000000, -0.0188455900000000 ]  - [   0.0035110200000000, -0.0039056900000000, -0.0081872500000000 ]  - [  -0.0029734000000000, -0.0042465000000000,  0.0071051100000000 ]  - [  -0.0033231400000000, -0.0044825900000000,  0.0080144500000000 ]  - [   0.0026930400000000, -0.0048989200000000,  0.0082559900000000 ]  - [   0.0031188000000000, -0.0041550300000000,  0.0081647300000000 ]  - [  -0.0036254800000000, -0.0048374400000000, -0.0082102200000000 ]  - [  -0.0036215800000000, -0.0045017500000000, -0.0082393400000000 ]  - [  -0.0041622900000000,  0.0042372700000000,  0.0079926400000000 ]  - [  -0.0037315900000000,  0.0049869100000000,  0.0080865900000000 ]  - [   0.0032244200000000,  0.0043028900000000, -0.0080430300000000 ]  - [   0.0032287800000000,  0.0046382800000000, -0.0080137800000000 ]  - [   0.0010140700000000, -0.0031572500000000, -0.0040993700000000 ]  - [   0.0011301000000000, -0.0029364700000000, -0.0045795200000000 ]  - [  -0.0027028100000000, -0.0023216800000000,  0.0045841000000000 ]  - [  -0.0010573200000000, -0.0031008500000000,  0.0045277400000000 ]  - [   0.0011063500000000, -0.0032398100000000,  0.0042524500000000 ]  - [   0.0011545900000000, -0.0027750300000000,  0.0046164100000000 ]  - [  -0.0011928200000000, -0.0037249500000000, -0.0047021000000000 ]  - [  -0.0021897200000000, -0.0020435200000000, -0.0055041300000000 ]  - [  -0.0012812600000000,  0.0027153300000000,  0.0048964600000000 ]  - [  -0.0012546900000000,  0.0031842200000000,  0.0045345000000000 ]  - [   0.0012131400000000,  0.0022363600000000, -0.0044515900000000 ]  - [   0.0002243000000000,  0.0039072100000000, -0.0036515300000000 ]  - [  -0.0007192600000000, -0.0000552600000000,  0.0047088300000000 ]  - [  -0.0003752300000000,  0.0000975900000000,  0.0047072200000000 ]  - [  -0.0007381500000000, -0.0000410100000000, -0.0046597500000000 ]  - [  -0.0007372400000000, -0.0000420100000000, -0.0047557000000000 ]  - [   0.0015177600000000, -0.0000474200000000, -0.0046986200000000 ]  - [   0.0004529700000000,  0.0000973300000000, -0.0047081700000000 ]  - [  -0.0002840000000000,  0.0036345300000000,  0.0045670700000000 ]  - [   0.0013631300000000,  0.0028559800000000,  0.0046274200000000 ]  - [   0.0015485600000000,  0.0002995300000000,  0.0046440000000000 ]  - [   0.0015426500000000,  0.0002951700000000,  0.0047631700000000 ]  - [  -0.0014045700000000,  0.0028057500000000, -0.0050469300000000 ]  - [  -0.0012815900000000,  0.0030223400000000, -0.0045756900000000 ]  - [  -0.0018147000000000,  0.0033031400000000,  0.0049557100000000 ]  - [  -0.0017149300000000,  0.0031922300000000,  0.0046746100000000 ]  - [   0.0029086500000000,  0.0036953300000000, -0.0049089600000000 ]  - [   0.0019107400000000,  0.0031640800000000, -0.0049373100000000 ]  - [   0.0019391400000000, -0.0032038400000000,  0.0050109100000000 ]  - [   0.0020386000000000, -0.0033133500000000,  0.0052924800000000 ]  - [  -0.0008403300000000, -0.0028125900000000, -0.0050622800000000 ]  - [  -0.0018428400000000, -0.0033421900000000, -0.0050318200000000 ]  - [  -0.0019092000000000,  0.0030118900000000, -0.0051581900000000 ]  - [  -0.0019998800000000,  0.0033427500000000, -0.0051092200000000 ]  - [   0.0018432800000000, -0.0034952600000000, -0.0048082800000000 ]  - [   0.0017526200000000, -0.0031653100000000, -0.0048581300000000 ]  - [  -0.1800183400000000,  0.0636721700000000, -0.0011380000000000 ]  - [  -0.0000728700000000, -0.0000772200000000, -0.0015719200000000 ]  - [  -0.0004586300000000, -0.0001221400000000,  0.0015196200000000 ]  - [  -0.0004565400000000, -0.0001197900000000,  0.0016192700000000 ]  - [   0.0004277600000000, -0.0001981600000000,  0.0015702800000000 ]  - [   0.0002774400000000, -0.0001057800000000,  0.0015705300000000 ]  - [   0.0001866100000000,  0.0000710000000000, -0.0015852500000000 ]  - [   0.0001866000000000,  0.0000710200000000, -0.0015576800000000 ]  - [   0.0014164400000000,  0.0000578300000000, -0.0000096800000000 ]  - [   0.0012807600000000, -0.0000562300000000,  0.0000258700000000 ]  - [  -0.0009138200000000,  0.0000585000000000,  0.0000072200000000 ]  - [  -0.0010504700000000, -0.0000564400000000, -0.0000272300000000 ]  - [  -0.0022742600000000,  0.0002643600000000, -0.0006614800000000 ]  - [  -0.0012632600000000, -0.0001955900000000,  0.0000870100000000 ]  - [   0.0000568800000000,  0.0002642500000000,  0.0006627300000000 ]  - [   0.0010680000000000, -0.0001950800000000, -0.0000880300000000 ]  - [   0.0055633800000000, -0.0007620600000000, -0.0041188700000000 ]  - [  -0.0020173700000000, -0.0034227200000000,  0.0050364100000000 ]  - [   0.0095371900000000,  0.0057678400000000,  0.0143387000000000 ]  - [   0.0017342600000000,  0.0030825800000000,  0.0049281600000000 ]  - [  -0.0028603900000000,  0.0048185000000000,  0.0111317400000000 ]  - [  -0.0038312200000000,  0.0032939200000000,  0.0047339500000000 ]  - [   0.0031189100000000,  0.0057141900000000, -0.0046725800000000 ]  - [   0.0055579400000000, -0.0079663700000000, -0.0047736200000000 ]  - [   0.0042259400000000, -0.0022103800000000, -0.0020273700000000 ]  - [   0.0032360100000000, -0.0037627700000000,  0.0044707900000000 ]  - [  -0.0039597200000000, -0.0013809700000000, -0.0045434300000000 ]  - [  -0.0015544100000000, -0.0148951000000000, -0.0044495800000000 ]  - [   0.0046794500000000, -0.0033720600000000, -0.0047540200000000 ]  - [   0.0039212400000000, -0.0036732500000000, -0.0047239300000000 ]  - [  -0.0017748500000000, -0.0038727200000000,  0.0049838300000000 ]  - [  -0.0029623500000000, -0.0031685100000000,  0.0044492700000000 ]  - [  -0.0023952800000000,  0.0036854400000000, -0.0044517800000000 ]  - [  -0.0031481100000000,  0.0033827200000000, -0.0044807500000000 ]  - [   0.0052864200000000,  0.0031859300000000,  0.0042177700000000 ]  - [   0.0041086200000000,  0.0038832700000000,  0.0047516400000000 ]- atom:   53  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0301628400000000,  0.0221613800000000, -0.0110562800000000 ]  - [  -0.0037365600000000,  0.0043762800000000, -0.0081785900000000 ]  - [   0.0032266700000000,  0.0046906600000000,  0.0078876800000000 ]  - [   0.0033261400000000,  0.0041452800000000,  0.0082696100000000 ]  - [  -0.0225473100000000,  0.0130073500000000, -0.0053067900000000 ]  - [   0.0031091300000000, -0.0047695200000000, -0.0080733900000000 ]  - [  -0.0036261700000000, -0.0044453500000000,  0.0083518600000000 ]  - [  -0.0035259200000000, -0.0049909900000000,  0.0079901900000000 ]  - [   0.0037353900000000, -0.0042834100000000,  0.0079540400000000 ]  - [   0.0035373000000000, -0.0047928400000000,  0.0081218100000000 ]  - [  -0.0034008600000000, -0.0043622300000000, -0.0081246100000000 ]  - [  -0.0033303200000000, -0.0046803500000000, -0.0080713900000000 ]  - [  -0.0031129600000000,  0.0048623000000000,  0.0083006300000000 ]  - [  -0.0033135100000000,  0.0043447100000000,  0.0081309900000000 ]  - [   0.0034505800000000,  0.0047760200000000, -0.0081285900000000 ]  - [   0.0035204200000000,  0.0044617800000000, -0.0081806700000000 ]  - [   0.0014546500000000, -0.0029017600000000, -0.0049985200000000 ]  - [   0.0011762900000000, -0.0030464300000000, -0.0045391200000000 ]  - [  -0.0007946100000000, -0.0030496100000000,  0.0046647600000000 ]  - [  -0.0015279500000000, -0.0031386000000000,  0.0047713300000000 ]  - [   0.0014457700000000, -0.0027164400000000,  0.0050342000000000 ]  - [   0.0012005700000000, -0.0031904400000000,  0.0044818900000000 ]  - [  -0.0016190000000000, -0.0026672800000000, -0.0045740800000000 ]  - [  -0.0004757400000000, -0.0033621000000000, -0.0042223300000000 ]  - [  -0.0009675500000000,  0.0032461700000000,  0.0041203200000000 ]  - [  -0.0012134500000000,  0.0027662800000000,  0.0046709300000000 ]  - [   0.0007967100000000,  0.0032858700000000, -0.0045847700000000 ]  - [   0.0019365400000000,  0.0026052600000000, -0.0049225200000000 ]  - [   0.0002948500000000,  0.0000378200000000,  0.0047060600000000 ]  - [   0.0000828700000000, -0.0000753100000000,  0.0047070600000000 ]  - [   0.0002350000000000,  0.0000239000000000, -0.0047922600000000 ]  - [   0.0002302900000000,  0.0000255900000000, -0.0046208000000000 ]  - [  -0.0006934700000000, -0.0000581300000000, -0.0047125200000000 ]  - [  -0.0000175200000000, -0.0000729100000000, -0.0047064700000000 ]  - [   0.0016340000000000,  0.0028890200000000,  0.0044862300000000 ]  - [   0.0008652000000000,  0.0028161400000000,  0.0043753000000000 ]  - [  -0.0007432800000000,  0.0004566200000000,  0.0050702700000000 ]  - [  -0.0007235000000000,  0.0004976100000000,  0.0043714200000000 ]  - [  -0.0009572800000000,  0.0030531300000000, -0.0041651500000000 ]  - [  -0.0012316600000000,  0.0029127500000000, -0.0046145200000000 ]  - [  -0.0018441700000000,  0.0032121500000000,  0.0049169800000000 ]  - [  -0.0019615300000000,  0.0032984500000000,  0.0051032500000000 ]  - [   0.0012282800000000,  0.0029580900000000, -0.0050333000000000 ]  - [   0.0019121200000000,  0.0033450600000000, -0.0050266700000000 ]  - [   0.0019079800000000, -0.0032940100000000,  0.0050478600000000 ]  - [   0.0017929800000000, -0.0032083700000000,  0.0048686800000000 ]  - [  -0.0025395100000000, -0.0035601800000000, -0.0049314400000000 ]  - [  -0.0018392300000000, -0.0031585900000000, -0.0049408800000000 ]  - [  -0.0019210100000000,  0.0033455100000000, -0.0049195100000000 ]  - [  -0.0017325400000000,  0.0032151600000000, -0.0049557700000000 ]  - [   0.0018327800000000, -0.0031602500000000, -0.0050461000000000 ]  - [   0.0020226200000000, -0.0032926100000000, -0.0050122400000000 ]  - [   0.0636424000000000, -0.0500688400000000, -0.0014838400000000 ]  - [  -0.0000772200000000,  0.0008415500000000, -0.0015712700000000 ]  - [   0.0001238900000000, -0.0001271900000000,  0.0013738500000000 ]  - [   0.0001188300000000, -0.0001307500000000,  0.0017684500000000 ]  - [  -0.0001982400000000,  0.0001052100000000,  0.0015704900000000 ]  - [  -0.0001052600000000,  0.0000416900000000,  0.0015709700000000 ]  - [  -0.0000714200000000, -0.0000212300000000, -0.0015670400000000 ]  - [  -0.0000710600000000, -0.0000210800000000, -0.0015750100000000 ]  - [   0.0010210200000000, -0.0000438600000000,  0.0000097000000000 ]  - [   0.0011393700000000,  0.0000411800000000, -0.0000131900000000 ]  - [  -0.0013100800000000, -0.0000452000000000, -0.0000096700000000 ]  - [  -0.0011929300000000,  0.0000416300000000,  0.0000130300000000 ]  - [  -0.0007344400000000, -0.0000238900000000,  0.0033684400000000 ]  - [  -0.0011660600000000,  0.0005335600000000, -0.0006646300000000 ]  - [   0.0015982800000000, -0.0000239000000000, -0.0032977400000000 ]  - [   0.0011662100000000,  0.0005369400000000,  0.0006732000000000 ]  - [  -0.0028671000000000, -0.0050067900000000,  0.0070661100000000 ]  - [  -0.0017957000000000, -0.0030853100000000,  0.0049287500000000 ]  - [   0.0008341100000000,  0.0014878800000000,  0.0028381800000000 ]  - [   0.0019577400000000,  0.0034243200000000,  0.0050392100000000 ]  - [  -0.0034371600000000,  0.0024481200000000,  0.0023463400000000 ]  - [  -0.0034954600000000,  0.0039429000000000,  0.0046546300000000 ]  - [   0.0066981300000000,  0.0051432100000000, -0.0054246600000000 ]  - [  -0.0027015000000000,  0.0111963100000000, -0.0028467200000000 ]  - [   0.0036334700000000, -0.0046237000000000,  0.0069041400000000 ]  - [   0.0035769000000000, -0.0031100900000000,  0.0045473500000000 ]  - [  -0.0004344500000000, -0.0019482600000000, -0.0037806800000000 ]  - [  -0.0098812400000000,  0.0041226100000000, -0.0063993000000000 ]  - [   0.0030543500000000, -0.0036734400000000, -0.0046023600000000 ]  - [   0.0034732500000000, -0.0033888000000000, -0.0045380600000000 ]  - [  -0.0043333700000000, -0.0033302800000000,  0.0045766100000000 ]  - [  -0.0033786800000000, -0.0038044200000000,  0.0047548600000000 ]  - [  -0.0040145200000000,  0.0033806800000000, -0.0045996800000000 ]  - [  -0.0035911500000000,  0.0036691400000000, -0.0046663000000000 ]  - [   0.0027413900000000,  0.0037233500000000,  0.0046181100000000 ]  - [   0.0036820000000000,  0.0032581100000000,  0.0044536800000000 ]- atom:   53  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0042612500000000,  0.0070071800000000, -0.0063421900000000 ]  - [  -0.0034066300000000,  0.0047131000000000, -0.0080572200000000 ]  - [   0.0033819200000000,  0.0047783700000000,  0.0079481100000000 ]  - [   0.0034432000000000,  0.0044759100000000,  0.0080158700000000 ]  - [   0.0042612500000000, -0.0070071800000000, -0.0063421900000000 ]  - [   0.0034066300000000, -0.0047131000000000, -0.0080572200000000 ]  - [  -0.0033819200000000, -0.0047783700000000,  0.0079481100000000 ]  - [  -0.0034432000000000, -0.0044759100000000,  0.0080158700000000 ]  - [   0.0034357400000000, -0.0046965000000000,  0.0083387100000000 ]  - [   0.0034191800000000, -0.0045360900000000,  0.0081531500000000 ]  - [  -0.0034751500000000, -0.0045766300000000, -0.0081130300000000 ]  - [  -0.0034337500000000, -0.0045929400000000, -0.0081096900000000 ]  - [  -0.0034357400000000,  0.0046965000000000,  0.0083387100000000 ]  - [  -0.0034191800000000,  0.0045360900000000,  0.0081531500000000 ]  - [   0.0034751500000000,  0.0045766300000000, -0.0081130300000000 ]  - [   0.0034337500000000,  0.0045929400000000, -0.0081096900000000 ]  - [   0.0008643700000000, -0.0028086100000000, -0.0050419100000000 ]  - [   0.0011529800000000, -0.0030009500000000, -0.0046017700000000 ]  - [  -0.0016634100000000, -0.0025029400000000,  0.0044227800000000 ]  - [  -0.0009346600000000, -0.0029489600000000,  0.0046149200000000 ]  - [   0.0017038900000000, -0.0030124600000000,  0.0058405500000000 ]  - [   0.0012816100000000, -0.0029569900000000,  0.0045463900000000 ]  - [  -0.0013428100000000, -0.0028717300000000, -0.0045081900000000 ]  - [  -0.0011556200000000, -0.0031833000000000, -0.0040416600000000 ]  - [  -0.0017038900000000,  0.0030124600000000,  0.0058405500000000 ]  - [  -0.0012816100000000,  0.0029569900000000,  0.0045463900000000 ]  - [   0.0013428100000000,  0.0028717300000000, -0.0045081900000000 ]  - [   0.0011556200000000,  0.0031833000000000, -0.0040416600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045404700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0046675300000000 ]  - [   0.0000600800000000, -0.0000182100000000, -0.0046587600000000 ]  - [  -0.0000600800000000,  0.0000182100000000, -0.0046587600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0038563300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0047919900000000 ]  - [   0.0016634100000000,  0.0025029400000000,  0.0044227800000000 ]  - [   0.0009346600000000,  0.0029489600000000,  0.0046149200000000 ]  - [   0.0001189300000000, -0.0010895300000000,  0.0044557800000000 ]  - [  -0.0001189300000000,  0.0010895300000000,  0.0044557800000000 ]  - [  -0.0008643700000000,  0.0028086100000000, -0.0050419100000000 ]  - [  -0.0011529800000000,  0.0030009500000000, -0.0046017700000000 ]  - [  -0.0018374400000000,  0.0032494500000000,  0.0049748900000000 ]  - [  -0.0018402700000000,  0.0032324000000000,  0.0050943300000000 ]  - [   0.0022014300000000,  0.0034571600000000, -0.0050175300000000 ]  - [   0.0018474800000000,  0.0032208900000000, -0.0049724200000000 ]  - [   0.0018374400000000, -0.0032494500000000,  0.0049748900000000 ]  - [   0.0018402700000000, -0.0032324000000000,  0.0050943300000000 ]  - [  -0.0022014300000000, -0.0034571600000000, -0.0050175300000000 ]  - [  -0.0018474800000000, -0.0032208900000000, -0.0049724200000000 ]  - [  -0.0019169700000000,  0.0033424800000000, -0.0050460100000000 ]  - [  -0.0019057800000000,  0.0031242100000000, -0.0049571700000000 ]  - [   0.0019169700000000, -0.0033424800000000, -0.0050460100000000 ]  - [   0.0019057800000000, -0.0031242100000000, -0.0049571700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0230550400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015491900000000 ]  - [   0.0000492200000000, -0.0001963800000000,  0.0013066100000000 ]  - [  -0.0000492200000000,  0.0001963800000000,  0.0013066100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015622100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015589600000000 ]  - [  -0.0000127900000000, -0.0000037900000000, -0.0015481200000000 ]  - [   0.0000127900000000,  0.0000037900000000, -0.0015481200000000 ]  - [   0.0011744300000000, -0.0000119200000000,  0.0000559200000000 ]  - [   0.0011803100000000,  0.0000013700000000,  0.0000033100000000 ]  - [  -0.0011744300000000,  0.0000119200000000,  0.0000559200000000 ]  - [  -0.0011803100000000, -0.0000013700000000,  0.0000033100000000 ]  - [  -0.0009956500000000,  0.0022724400000000,  0.0036835300000000 ]  - [  -0.0011372100000000, -0.0000661100000000,  0.0001532700000000 ]  - [   0.0009956500000000, -0.0022724400000000,  0.0036835300000000 ]  - [   0.0011372100000000,  0.0000661100000000,  0.0001532700000000 ]  - [  -0.0059683900000000, -0.0032050500000000,  0.0068529500000000 ]  - [  -0.0018767600000000, -0.0032967100000000,  0.0050003400000000 ]  - [   0.0059683900000000,  0.0032050500000000,  0.0068529500000000 ]  - [   0.0018767600000000,  0.0032967100000000,  0.0050003400000000 ]  - [  -0.0032642900000000,  0.0041548600000000,  0.0077409000000000 ]  - [  -0.0036472600000000,  0.0034588100000000,  0.0046625300000000 ]  - [   0.0040722100000000,  0.0033578000000000, -0.0050301500000000 ]  - [   0.0042952600000000,  0.0061445800000000, -0.0052548900000000 ]  - [   0.0032642900000000, -0.0041548600000000,  0.0077409000000000 ]  - [   0.0036472600000000, -0.0034588100000000,  0.0046625300000000 ]  - [  -0.0040722100000000, -0.0033578000000000, -0.0050301500000000 ]  - [  -0.0042952600000000, -0.0061445800000000, -0.0052548900000000 ]  - [   0.0032991600000000, -0.0034747500000000, -0.0044205000000000 ]  - [   0.0034496400000000, -0.0035666200000000, -0.0045885100000000 ]  - [  -0.0036840900000000, -0.0034943200000000,  0.0043286800000000 ]  - [  -0.0033438900000000, -0.0035671800000000,  0.0045779200000000 ]  - [  -0.0032991600000000,  0.0034747500000000, -0.0044205000000000 ]  - [  -0.0034496400000000,  0.0035666200000000, -0.0045885100000000 ]  - [   0.0036840900000000,  0.0034943200000000,  0.0043286800000000 ]  - [   0.0033438900000000,  0.0035671800000000,  0.0045779200000000 ]- atom:   53  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0025364300000000,  0.0021602900000000, -0.0100531800000000 ]  - [  -0.0034262600000000,  0.0044391700000000, -0.0081759900000000 ]  - [   0.0034486300000000,  0.0043615900000000,  0.0082769500000000 ]  - [   0.0033883600000000,  0.0046629900000000,  0.0082199600000000 ]  - [   0.0025364300000000, -0.0021602900000000, -0.0100531800000000 ]  - [   0.0034262600000000, -0.0044391700000000, -0.0081759900000000 ]  - [  -0.0034486300000000, -0.0043615900000000,  0.0082769500000000 ]  - [  -0.0033883600000000, -0.0046629900000000,  0.0082199600000000 ]  - [   0.0033995500000000, -0.0044484100000000,  0.0078991800000000 ]  - [   0.0034154500000000, -0.0046037500000000,  0.0080836700000000 ]  - [  -0.0033570600000000, -0.0045661400000000, -0.0081227600000000 ]  - [  -0.0033998900000000, -0.0045513100000000, -0.0081257300000000 ]  - [  -0.0033995500000000,  0.0044484100000000,  0.0078991800000000 ]  - [  -0.0034154500000000,  0.0046037500000000,  0.0080836700000000 ]  - [   0.0033570600000000,  0.0045661400000000, -0.0081227600000000 ]  - [   0.0033998900000000,  0.0045513100000000, -0.0081257300000000 ]  - [   0.0015529500000000, -0.0031505600000000, -0.0041134700000000 ]  - [   0.0012592600000000, -0.0029629900000000, -0.0045492200000000 ]  - [  -0.0007714600000000, -0.0034429200000000,  0.0047310700000000 ]  - [  -0.0014663700000000, -0.0030107400000000,  0.0045375700000000 ]  - [   0.0007058600000000, -0.0029554200000000,  0.0032964100000000 ]  - [   0.0011375400000000, -0.0030025400000000,  0.0046035900000000 ]  - [  -0.0010732200000000, -0.0030818900000000, -0.0046472600000000 ]  - [  -0.0012573800000000, -0.0027805600000000, -0.0051028700000000 ]  - [  -0.0007058600000000,  0.0029554200000000,  0.0032964100000000 ]  - [  -0.0011375400000000,  0.0030025400000000,  0.0046035900000000 ]  - [   0.0010732200000000,  0.0030818900000000, -0.0046472600000000 ]  - [   0.0012573800000000,  0.0027805600000000, -0.0051028700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0048813200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0047599500000000 ]  - [  -0.0000556300000000,  0.0000165700000000, -0.0047684800000000 ]  - [   0.0000556300000000, -0.0000165700000000, -0.0047684800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056010800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0046370500000000 ]  - [   0.0007714600000000,  0.0034429200000000,  0.0047310700000000 ]  - [   0.0014663700000000,  0.0030107400000000,  0.0045375700000000 ]  - [  -0.0001385400000000,  0.0011108400000000,  0.0049854000000000 ]  - [   0.0001385400000000, -0.0011108400000000,  0.0049854000000000 ]  - [  -0.0015529500000000,  0.0031505600000000, -0.0041134700000000 ]  - [  -0.0012592600000000,  0.0029629900000000, -0.0045492200000000 ]  - [  -0.0018980900000000,  0.0032566100000000,  0.0049974800000000 ]  - [  -0.0018973500000000,  0.0032751100000000,  0.0048769000000000 ]  - [   0.0015480000000000,  0.0030565600000000, -0.0049471700000000 ]  - [   0.0018883700000000,  0.0032875400000000, -0.0049946200000000 ]  - [   0.0018980900000000, -0.0032566100000000,  0.0049974800000000 ]  - [   0.0018973500000000, -0.0032751100000000,  0.0048769000000000 ]  - [  -0.0015480000000000, -0.0030565600000000, -0.0049471700000000 ]  - [  -0.0018883700000000, -0.0032875400000000, -0.0049946200000000 ]  - [  -0.0018207800000000,  0.0031673500000000, -0.0049191900000000 ]  - [  -0.0018344400000000,  0.0033814700000000, -0.0050155100000000 ]  - [   0.0018207800000000, -0.0031673500000000, -0.0049191900000000 ]  - [   0.0018344400000000, -0.0033814700000000, -0.0050155100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0199440100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015772100000000 ]  - [  -0.0000508200000000,  0.0001979400000000,  0.0018212100000000 ]  - [   0.0000508200000000, -0.0001979400000000,  0.0018212100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015630900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015659100000000 ]  - [   0.0000149900000000,  0.0000043800000000, -0.0015787600000000 ]  - [  -0.0000149900000000, -0.0000043800000000, -0.0015787600000000 ]  - [   0.0011541400000000,  0.0000109400000000, -0.0000536900000000 ]  - [   0.0011459500000000, -0.0000017300000000, -0.0000017700000000 ]  - [  -0.0011541400000000, -0.0000109400000000, -0.0000536900000000 ]  - [  -0.0011459500000000,  0.0000017300000000, -0.0000017700000000 ]  - [  -0.0013366400000000, -0.0021288300000000, -0.0034946500000000 ]  - [  -0.0011925400000000,  0.0000693900000000, -0.0001549300000000 ]  - [   0.0013366400000000,  0.0021288300000000, -0.0034946500000000 ]  - [   0.0011925400000000, -0.0000693900000000, -0.0001549300000000 ]  - [   0.0021479200000000, -0.0032844500000000,  0.0031099100000000 ]  - [  -0.0018625400000000, -0.0032104400000000,  0.0049710400000000 ]  - [  -0.0021479200000000,  0.0032844500000000,  0.0031099100000000 ]  - [   0.0018625400000000,  0.0032104400000000,  0.0049710400000000 ]  - [  -0.0038741900000000,  0.0029208900000000,  0.0014374700000000 ]  - [  -0.0034390100000000,  0.0036033400000000,  0.0045341300000000 ]  - [   0.0030178900000000,  0.0037049600000000, -0.0041534200000000 ]  - [   0.0027951800000000,  0.0010301700000000, -0.0039550300000000 ]  - [   0.0038741900000000, -0.0029208900000000,  0.0014374700000000 ]  - [   0.0034390100000000, -0.0036033400000000,  0.0045341300000000 ]  - [  -0.0030178900000000, -0.0037049600000000, -0.0041534200000000 ]  - [  -0.0027951800000000, -0.0010301700000000, -0.0039550300000000 ]  - [   0.0037795900000000, -0.0035899000000000, -0.0047741000000000 ]  - [   0.0036289300000000, -0.0034993400000000, -0.0046089400000000 ]  - [  -0.0034040300000000, -0.0035684400000000,  0.0048584500000000 ]  - [  -0.0037341100000000, -0.0035005000000000,  0.0046208900000000 ]  - [  -0.0037795900000000,  0.0035899000000000, -0.0047741000000000 ]  - [  -0.0036289300000000,  0.0034993400000000, -0.0046089400000000 ]  - [   0.0034040300000000,  0.0035684400000000,  0.0048584500000000 ]  - [   0.0037341100000000,  0.0035005000000000,  0.0046208900000000 ]- atom:   61  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0040483600000000,  0.0044793700000000, -0.0081917400000000 ]  - [  -0.0036181300000000,  0.0047306300000000, -0.0081885500000000 ]  - [   0.0029841300000000,  0.0045591500000000,  0.0080160800000000 ]  - [   0.0033239900000000,  0.0045065700000000,  0.0080864900000000 ]  - [   0.0029841300000000, -0.0045591500000000, -0.0080160800000000 ]  - [   0.0033239900000000, -0.0045065700000000, -0.0080864900000000 ]  - [  -0.0036181300000000, -0.0047306300000000,  0.0081885500000000 ]  - [  -0.0040483600000000, -0.0044793700000000,  0.0081917400000000 ]  - [   0.0038547700000000, -0.0043718100000000,  0.0083197100000000 ]  - [   0.0035420200000000, -0.0046623800000000,  0.0081031300000000 ]  - [  -0.0031711000000000, -0.0045740700000000, -0.0080482500000000 ]  - [  -0.0031595900000000, -0.0044878800000000, -0.0079088100000000 ]  - [  -0.0031595900000000,  0.0044878800000000,  0.0079088100000000 ]  - [  -0.0031711000000000,  0.0045740700000000,  0.0080482500000000 ]  - [   0.0038547700000000,  0.0043718100000000, -0.0083197100000000 ]  - [   0.0035420200000000,  0.0046623800000000, -0.0081031300000000 ]  - [   0.0012281300000000, -0.0031835800000000, -0.0047998900000000 ]  - [   0.0011648200000000, -0.0033130500000000, -0.0047089800000000 ]  - [  -0.0012948700000000, -0.0037323500000000,  0.0045398600000000 ]  - [  -0.0014363800000000, -0.0030111100000000,  0.0041770600000000 ]  - [   0.0015557500000000, -0.0031903500000000,  0.0050009200000000 ]  - [   0.0011665400000000, -0.0029578100000000,  0.0046926800000000 ]  - [  -0.0012702400000000, -0.0028825600000000, -0.0045105400000000 ]  - [  -0.0009593400000000, -0.0029389100000000, -0.0039854500000000 ]  - [  -0.0009593400000000,  0.0029389100000000,  0.0039854500000000 ]  - [  -0.0012702400000000,  0.0028825600000000,  0.0045105400000000 ]  - [   0.0015557500000000,  0.0031903500000000, -0.0050009200000000 ]  - [   0.0011665400000000,  0.0029578100000000, -0.0046926800000000 ]  - [   0.0066960800000000,  0.0002542600000000,  0.0043238300000000 ]  - [   0.0003652800000000, -0.0000105500000000,  0.0047855300000000 ]  - [   0.0066960800000000, -0.0002542600000000, -0.0043238300000000 ]  - [   0.0003652800000000,  0.0000105500000000, -0.0047855300000000 ]  - [  -0.0005923400000000, -0.0000029600000000, -0.0047938800000000 ]  - [  -0.0002765600000000,  0.0000222000000000, -0.0046910900000000 ]  - [   0.0012281300000000,  0.0031835800000000,  0.0047998900000000 ]  - [   0.0011648200000000,  0.0033130500000000,  0.0047089800000000 ]  - [  -0.0005923400000000,  0.0000029600000000,  0.0047938800000000 ]  - [  -0.0002765600000000, -0.0000222000000000,  0.0046910900000000 ]  - [  -0.0014363800000000,  0.0030111100000000, -0.0041770600000000 ]  - [  -0.0012948700000000,  0.0037323500000000, -0.0045398600000000 ]  - [  -0.0019192600000000,  0.0031439800000000,  0.0051103000000000 ]  - [   0.0028501300000000,  0.0065029100000000,  0.0073321500000000 ]  - [   0.0082720600000000,  0.0074274400000000, -0.0029643700000000 ]  - [   0.0018129300000000,  0.0030498800000000, -0.0048513600000000 ]  - [   0.0082720600000000, -0.0074274400000000,  0.0029643700000000 ]  - [   0.0018129300000000, -0.0030498800000000,  0.0048513600000000 ]  - [   0.0028501300000000, -0.0065029100000000, -0.0073321500000000 ]  - [  -0.0019192600000000, -0.0031439800000000, -0.0051103000000000 ]  - [  -0.0018450200000000,  0.0032650300000000, -0.0049789800000000 ]  - [  -0.0016895700000000,  0.0032557700000000, -0.0051353200000000 ]  - [   0.0019520200000000, -0.0032146700000000, -0.0048554100000000 ]  - [   0.0019014200000000, -0.0032628100000000, -0.0050023700000000 ]  - [   0.0002515800000000, -0.0001439900000000, -0.0015529200000000 ]  - [   0.0001178000000000, -0.0000275900000000, -0.0015472600000000 ]  - [   0.0002515800000000,  0.0001439900000000,  0.0015529200000000 ]  - [   0.0001178000000000,  0.0000275900000000,  0.0015472600000000 ]  - [  -0.0011075900000000,  0.0004221800000000,  0.0017238300000000 ]  - [  -0.0000971500000000,  0.0000047600000000,  0.0015901400000000 ]  - [  -0.0011075900000000, -0.0004221800000000, -0.0017238300000000 ]  - [  -0.0000971500000000, -0.0000047600000000, -0.0015901400000000 ]  - [  -0.0318798200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0010372000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0028043600000000,  0.0003292500000000,  0.0000144100000000 ]  - [  -0.0028043600000000, -0.0003292500000000, -0.0000144100000000 ]  - [  -0.0011030000000000, -0.0000143200000000,  0.0000153800000000 ]  - [  -0.0011030000000000,  0.0000143200000000, -0.0000153800000000 ]  - [   0.0012310400000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0012039900000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0016895700000000, -0.0032557700000000,  0.0051353200000000 ]  - [  -0.0018450200000000, -0.0032650300000000,  0.0049789800000000 ]  - [   0.0019520200000000,  0.0032146700000000,  0.0048554100000000 ]  - [   0.0019014200000000,  0.0032628100000000,  0.0050023700000000 ]  - [  -0.0021075800000000,  0.0035252800000000,  0.0040298100000000 ]  - [  -0.0031230900000000,  0.0033198500000000,  0.0044320300000000 ]  - [   0.0040049700000000,  0.0033896000000000, -0.0046721900000000 ]  - [   0.0052067800000000,  0.0037892800000000, -0.0052255500000000 ]  - [   0.0052067800000000, -0.0037892800000000,  0.0052255500000000 ]  - [   0.0040049700000000, -0.0033896000000000,  0.0046721900000000 ]  - [  -0.0021075800000000, -0.0035252800000000, -0.0040298100000000 ]  - [  -0.0031230900000000, -0.0033198500000000, -0.0044320300000000 ]  - [   0.0029150100000000, -0.0014072600000000, -0.0069402900000000 ]  - [   0.0032193200000000, -0.0038502600000000, -0.0049813000000000 ]  - [  -0.0047182900000000, -0.0026022500000000,  0.0020238800000000 ]  - [  -0.0038399000000000, -0.0039498900000000,  0.0044020500000000 ]  - [  -0.0047182900000000,  0.0026022500000000, -0.0020238800000000 ]  - [  -0.0038399000000000,  0.0039498900000000, -0.0044020500000000 ]  - [   0.0032193200000000,  0.0038502600000000,  0.0049813000000000 ]  - [   0.0029150100000000,  0.0014072600000000,  0.0069402900000000 ]- atom:   61  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0027845100000000,  0.0046623000000000, -0.0080424900000000 ]  - [  -0.0032145500000000,  0.0044165500000000, -0.0080465200000000 ]  - [   0.0038508600000000,  0.0045834300000000,  0.0082214700000000 ]  - [   0.0035081300000000,  0.0046375300000000,  0.0081473000000000 ]  - [   0.0038508600000000, -0.0045834300000000, -0.0082214700000000 ]  - [   0.0035081300000000, -0.0046375300000000, -0.0081473000000000 ]  - [  -0.0032145500000000, -0.0044165500000000,  0.0080465200000000 ]  - [  -0.0027845100000000, -0.0046623000000000,  0.0080424900000000 ]  - [   0.0029722700000000, -0.0047518500000000,  0.0078930800000000 ]  - [   0.0032955300000000, -0.0044835400000000,  0.0081328800000000 ]  - [  -0.0036769500000000, -0.0045598400000000, -0.0081951600000000 ]  - [  -0.0036675100000000, -0.0046441900000000, -0.0083137700000000 ]  - [  -0.0036675100000000,  0.0046441900000000,  0.0083137700000000 ]  - [  -0.0036769500000000,  0.0045598400000000,  0.0081951600000000 ]  - [   0.0029722700000000,  0.0047518500000000, -0.0078930800000000 ]  - [   0.0032955300000000,  0.0044835400000000, -0.0081328800000000 ]  - [   0.0011898400000000, -0.0027797800000000, -0.0043312600000000 ]  - [   0.0012471200000000, -0.0026438800000000, -0.0044426500000000 ]  - [  -0.0011157400000000, -0.0022398600000000,  0.0046116800000000 ]  - [  -0.0009766900000000, -0.0029510400000000,  0.0049532300000000 ]  - [   0.0008810200000000, -0.0027754800000000,  0.0041618100000000 ]  - [   0.0012546800000000, -0.0030035300000000,  0.0044606100000000 ]  - [  -0.0011481000000000, -0.0030793200000000, -0.0046430400000000 ]  - [  -0.0014708800000000, -0.0030285700000000, -0.0051798200000000 ]  - [  -0.0014708800000000,  0.0030285700000000,  0.0051798200000000 ]  - [  -0.0011481000000000,  0.0030793200000000,  0.0046430400000000 ]  - [   0.0008810200000000,  0.0027754800000000, -0.0041618100000000 ]  - [   0.0012546800000000,  0.0030035300000000, -0.0044606100000000 ]  - [  -0.0067065800000000, -0.0001568400000000,  0.0050093000000000 ]  - [  -0.0003659100000000,  0.0000176100000000,  0.0046473200000000 ]  - [  -0.0067065800000000,  0.0001568400000000, -0.0050093000000000 ]  - [  -0.0003659100000000, -0.0000176100000000, -0.0046473200000000 ]  - [   0.0005951900000000,  0.0000005300000000, -0.0046323700000000 ]  - [   0.0002788300000000, -0.0000211800000000, -0.0047354700000000 ]  - [   0.0011898400000000,  0.0027797800000000,  0.0043312600000000 ]  - [   0.0012471200000000,  0.0026438800000000,  0.0044426500000000 ]  - [   0.0005951900000000, -0.0000005300000000,  0.0046323700000000 ]  - [   0.0002788300000000,  0.0000211800000000,  0.0047354700000000 ]  - [  -0.0009766900000000,  0.0029510400000000, -0.0049532300000000 ]  - [  -0.0011157400000000,  0.0022398600000000, -0.0046116800000000 ]  - [  -0.0018191300000000,  0.0033684900000000,  0.0048562200000000 ]  - [  -0.0068100100000000, -0.0001809200000000,  0.0025213000000000 ]  - [  -0.0042525800000000, -0.0007345700000000, -0.0068857400000000 ]  - [   0.0019222600000000,  0.0034599000000000, -0.0051112100000000 ]  - [  -0.0042525800000000,  0.0007345700000000,  0.0068857400000000 ]  - [   0.0019222600000000, -0.0034599000000000,  0.0051112100000000 ]  - [  -0.0068100100000000,  0.0001809200000000, -0.0025213000000000 ]  - [  -0.0018191300000000, -0.0033684900000000, -0.0048562200000000 ]  - [  -0.0018900600000000,  0.0032391400000000, -0.0049869300000000 ]  - [  -0.0020493200000000,  0.0032557100000000, -0.0048367900000000 ]  - [   0.0017835500000000, -0.0032972100000000, -0.0051128500000000 ]  - [   0.0018404600000000, -0.0032411500000000, -0.0049676800000000 ]  - [  -0.0002539200000000,  0.0001448200000000, -0.0015727800000000 ]  - [  -0.0001138400000000,  0.0000265800000000, -0.0015808200000000 ]  - [  -0.0002539200000000, -0.0001448200000000,  0.0015727800000000 ]  - [  -0.0001138400000000, -0.0000265800000000,  0.0015808200000000 ]  - [   0.0011089000000000, -0.0004419100000000,  0.0013828400000000 ]  - [   0.0000957200000000,  0.0000042000000000,  0.0015343000000000 ]  - [   0.0011089000000000,  0.0004419100000000, -0.0013828400000000 ]  - [   0.0000957200000000, -0.0000042000000000, -0.0015343000000000 ]  - [   0.0340613100000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0012858600000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0004746500000000, -0.0004195400000000, -0.0000537100000000 ]  - [   0.0004746500000000,  0.0004195400000000,  0.0000537100000000 ]  - [  -0.0012234400000000,  0.0000135700000000, -0.0000149000000000 ]  - [  -0.0012234400000000, -0.0000135700000000,  0.0000149000000000 ]  - [   0.0010903700000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0011284100000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0020493200000000, -0.0032557100000000,  0.0048367900000000 ]  - [  -0.0018900600000000, -0.0032391400000000,  0.0049869300000000 ]  - [   0.0017835500000000,  0.0032972100000000,  0.0051128500000000 ]  - [   0.0018404600000000,  0.0032411500000000,  0.0049676800000000 ]  - [  -0.0049606200000000,  0.0035392700000000,  0.0051596600000000 ]  - [  -0.0039583600000000,  0.0037424600000000,  0.0047631100000000 ]  - [   0.0030798400000000,  0.0036787800000000, -0.0045242300000000 ]  - [   0.0018532300000000,  0.0032689200000000, -0.0039609100000000 ]  - [   0.0018532300000000, -0.0032689200000000,  0.0039609100000000 ]  - [   0.0030798400000000, -0.0036787800000000,  0.0045242300000000 ]  - [  -0.0049606200000000, -0.0035392700000000, -0.0051596600000000 ]  - [  -0.0039583600000000, -0.0037424600000000, -0.0047631100000000 ]  - [   0.0040924100000000, -0.0056276300000000, -0.0022476300000000 ]  - [   0.0038563300000000, -0.0032202200000000, -0.0042228100000000 ]  - [  -0.0022709300000000, -0.0044701800000000,  0.0071778100000000 ]  - [  -0.0032341900000000, -0.0031042500000000,  0.0048003600000000 ]  - [  -0.0022709300000000,  0.0044701800000000, -0.0071778100000000 ]  - [  -0.0032341900000000,  0.0031042500000000, -0.0048003600000000 ]  - [   0.0038563300000000,  0.0032202200000000,  0.0042228100000000 ]  - [   0.0040924100000000,  0.0056276300000000,  0.0022476300000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0037086100000000,  0.0044910800000000, -0.0082637500000000 ]  - [  -0.0032869000000000,  0.0044756400000000, -0.0081164400000000 ]  - [   0.0033245200000000,  0.0050583500000000,  0.0080374500000000 ]  - [   0.0034675300000000,  0.0042972100000000,  0.0081284600000000 ]  - [   0.0035268700000000, -0.0040813000000000, -0.0082148400000000 ]  - [   0.0033835600000000, -0.0048432900000000, -0.0081239300000000 ]  - [  -0.0035642600000000, -0.0046634900000000,  0.0081358500000000 ]  - [  -0.0031407300000000, -0.0046507400000000,  0.0079888600000000 ]  - [   0.0040090300000000, -0.0034522200000000,  0.0090889200000000 ]  - [   0.0035157600000000, -0.0053786900000000,  0.0082797900000000 ]  - [  -0.0032000800000000, -0.0046968800000000, -0.0075614700000000 ]  - [  -0.0031848400000000, -0.0047229500000000, -0.0075208300000000 ]  - [  -0.0036539800000000,  0.0044078200000000,  0.0087225800000000 ]  - [  -0.0036547200000000,  0.0044312900000000,  0.0086897500000000 ]  - [   0.0028306400000000,  0.0056779500000000, -0.0071473000000000 ]  - [   0.0033345900000000,  0.0037584200000000, -0.0079707600000000 ]  - [   0.0019376000000000, -0.0026832100000000, -0.0050899900000000 ]  - [   0.0008761900000000, -0.0035178300000000, -0.0048313100000000 ]  - [  -0.0015594900000000, -0.0033327900000000,  0.0043283200000000 ]  - [  -0.0003795500000000, -0.0026803100000000,  0.0040700700000000 ]  - [  -0.0002161000000000, -0.0024881300000000,  0.0044430000000000 ]  - [   0.0013924100000000, -0.0031510200000000,  0.0045117700000000 ]  - [  -0.0009783200000000, -0.0030534800000000, -0.0045540900000000 ]  - [  -0.0026756600000000, -0.0032285800000000, -0.0047490100000000 ]  - [   0.0002628600000000,  0.0027333400000000,  0.0044045500000000 ]  - [  -0.0014310000000000,  0.0029056900000000,  0.0045994900000000 ]  - [   0.0026329900000000,  0.0034715700000000, -0.0047112900000000 ]  - [   0.0010165500000000,  0.0028081500000000, -0.0046423200000000 ]  - [   0.0002244400000000,  0.0246538400000000, -0.0229314900000000 ]  - [   0.0000686700000000,  0.0002317000000000,  0.0050164200000000 ]  - [  -0.0002150700000000,  0.0239372000000000, -0.0310656500000000 ]  - [  -0.0000700700000000,  0.0002547000000000, -0.0043796900000000 ]  - [   0.0000019900000000,  0.0001174500000000, -0.0044670700000000 ]  - [   0.0000060500000000, -0.0001216500000000, -0.0047518300000000 ]  - [   0.0004754300000000,  0.0032784700000000,  0.0040584000000000 ]  - [   0.0015353500000000,  0.0024404100000000,  0.0043203000000000 ]  - [  -0.0000024200000000,  0.0001178800000000,  0.0049479000000000 ]  - [  -0.0000056600000000, -0.0001215200000000,  0.0046629700000000 ]  - [  -0.0020328500000000,  0.0032786900000000, -0.0050856400000000 ]  - [  -0.0008515300000000,  0.0026222200000000, -0.0048224700000000 ]  - [  -0.0020892800000000,  0.0036658500000000,  0.0050832200000000 ]  - [   0.0020310100000000,  0.0044714200000000,  0.0067275600000000 ]  - [   0.0057927800000000,  0.0047075200000000, -0.0027339000000000 ]  - [   0.0018120300000000,  0.0035884100000000, -0.0050314800000000 ]  - [  -0.0019368900000000, -0.0018188400000000,  0.0071725400000000 ]  - [   0.0019408500000000, -0.0029150300000000,  0.0049342900000000 ]  - [  -0.0058975300000000, -0.0019992100000000, -0.0031867200000000 ]  - [  -0.0016630000000000, -0.0028402300000000, -0.0048808400000000 ]  - [  -0.0018699100000000,  0.0033436400000000, -0.0050366200000000 ]  - [  -0.0019201100000000,  0.0031366300000000, -0.0051062300000000 ]  - [   0.0020008400000000, -0.0033755200000000, -0.0051939000000000 ]  - [   0.0017758200000000, -0.0031053900000000, -0.0049691500000000 ]  - [   0.0000583600000000, -0.0000450700000000, -0.0015829800000000 ]  - [  -0.0000562900000000,  0.0000413400000000, -0.0015698300000000 ]  - [  -0.0000577000000000, -0.0000447100000000,  0.0015605900000000 ]  - [   0.0000559900000000,  0.0000416100000000,  0.0015725500000000 ]  - [   0.0002650300000000, -0.0000240400000000,  0.0038064900000000 ]  - [  -0.0001953300000000,  0.0005367600000000,  0.0015017100000000 ]  - [  -0.0002635500000000, -0.0000244300000000,  0.0005911700000000 ]  - [   0.0001948200000000,  0.0005333100000000, -0.0016380700000000 ]  - [   0.0011433100000000, -0.0940423200000000,  0.0478456400000000 ]  - [   0.0011656600000000,  0.0003197800000000, -0.0001247300000000 ]  - [  -0.0007841700000000,  0.0182512800000000,  0.0029967000000000 ]  - [  -0.0015333500000000,  0.0174900200000000,  0.0029839700000000 ]  - [  -0.0011793300000000,  0.0000513900000000, -0.0000421100000000 ]  - [  -0.0011520400000000,  0.0000510700000000, -0.0000418300000000 ]  - [   0.0011654600000000, -0.0002058800000000, -0.0001220600000000 ]  - [   0.0011651500000000,  0.0001058300000000,  0.0000394400000000 ]  - [  -0.0018343400000000, -0.0033702800000000,  0.0048606700000000 ]  - [  -0.0018840700000000, -0.0031632100000000,  0.0049303900000000 ]  - [   0.0017521900000000,  0.0031291300000000,  0.0047730700000000 ]  - [   0.0019773200000000,  0.0034011900000000,  0.0049979200000000 ]  - [  -0.0027498600000000,  0.0034623000000000,  0.0046600000000000 ]  - [  -0.0037999200000000,  0.0037672300000000,  0.0046978900000000 ]  - [   0.0031553800000000,  0.0037868700000000, -0.0046283400000000 ]  - [   0.0045217400000000,  0.0031057500000000, -0.0043855100000000 ]  - [   0.0025439900000000, -0.0039511600000000,  0.0048181100000000 ]  - [   0.0039111100000000, -0.0032700200000000,  0.0045755600000000 ]  - [  -0.0043167300000000, -0.0035934300000000, -0.0045419800000000 ]  - [  -0.0032664500000000, -0.0032904500000000, -0.0045062700000000 ]  - [   0.0084783000000000, -0.0048682100000000, -0.0079873200000000 ]  - [   0.0032985900000000, -0.0026663600000000, -0.0044558400000000 ]  - [   0.0012757800000000, -0.0030258200000000,  0.0012755700000000 ]  - [  -0.0037063000000000, -0.0027838400000000,  0.0045463700000000 ]  - [  -0.0083259200000000,  0.0040211700000000, -0.0079416400000000 ]  - [  -0.0033616300000000,  0.0042655200000000, -0.0046546200000000 ]  - [   0.0037689800000000,  0.0043887300000000,  0.0047470000000000 ]  - [  -0.0014180000000000,  0.0021786800000000,  0.0012298100000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0036091400000000,  0.0045306500000000, -0.0080487900000000 ]  - [  -0.0035156300000000,  0.0046105500000000, -0.0080917500000000 ]  - [   0.0032845300000000,  0.0043611600000000,  0.0082203600000000 ]  - [   0.0033654200000000,  0.0047257800000000,  0.0081379800000000 ]  - [   0.0035472800000000, -0.0047824500000000, -0.0080148700000000 ]  - [   0.0034666500000000, -0.0044192000000000, -0.0080948300000000 ]  - [  -0.0033173100000000, -0.0045333200000000,  0.0081413600000000 ]  - [  -0.0032244900000000, -0.0046138300000000,  0.0081846600000000 ]  - [   0.0041920300000000, -0.0058303400000000,  0.0086307500000000 ]  - [   0.0032524000000000, -0.0041927600000000,  0.0079580500000000 ]  - [  -0.0040757500000000, -0.0039980000000000, -0.0086092300000000 ]  - [  -0.0029331700000000, -0.0039081000000000, -0.0078718100000000 ]  - [  -0.0039126100000000,  0.0052444600000000,  0.0083633100000000 ]  - [  -0.0027679600000000,  0.0051346600000000,  0.0076258100000000 ]  - [   0.0026700200000000,  0.0033101600000000, -0.0076201000000000 ]  - [   0.0035804000000000,  0.0049522800000000, -0.0082760600000000 ]  - [   0.0004558500000000, -0.0035134800000000, -0.0041648600000000 ]  - [   0.0013432900000000, -0.0029129300000000, -0.0045109400000000 ]  - [  -0.0011019600000000, -0.0030609600000000,  0.0047882600000000 ]  - [  -0.0021932500000000, -0.0029054400000000,  0.0048595800000000 ]  - [   0.0025166100000000, -0.0032280200000000,  0.0046949200000000 ]  - [   0.0012618700000000, -0.0029226100000000,  0.0045914800000000 ]  - [  -0.0012581200000000, -0.0029606400000000, -0.0046815400000000 ]  - [   0.0002103200000000, -0.0027235400000000, -0.0044394900000000 ]  - [  -0.0026220900000000,  0.0032394600000000,  0.0047125400000000 ]  - [  -0.0011597400000000,  0.0029989400000000,  0.0044723200000000 ]  - [  -0.0001011200000000,  0.0027334000000000, -0.0044603100000000 ]  - [   0.0011528300000000,  0.0030389200000000, -0.0045612700000000 ]  - [  -0.0003374600000000, -0.0234565300000000,  0.0342122100000000 ]  - [  -0.0000884700000000,  0.0000086900000000,  0.0047028000000000 ]  - [   0.0003517500000000, -0.0248572300000000,  0.0259827000000000 ]  - [   0.0000859700000000,  0.0000063500000000, -0.0047280500000000 ]  - [  -0.0000158600000000, -0.0000375600000000, -0.0049214400000000 ]  - [   0.0000230200000000,  0.0000352200000000, -0.0047356500000000 ]  - [   0.0019565100000000,  0.0024478800000000,  0.0049734800000000 ]  - [   0.0010707200000000,  0.0030489300000000,  0.0046414700000000 ]  - [   0.0000131500000000, -0.0000353400000000,  0.0045075000000000 ]  - [  -0.0000239300000000,  0.0000345200000000,  0.0046915600000000 ]  - [  -0.0002304500000000,  0.0030529700000000, -0.0042853800000000 ]  - [  -0.0013151300000000,  0.0029015300000000, -0.0043615200000000 ]  - [  -0.0018070900000000,  0.0031030000000000,  0.0047110800000000 ]  - [   0.0001833600000000,  0.0044928800000000,  0.0046392700000000 ]  - [   0.0047737200000000,  0.0051426400000000, -0.0056880700000000 ]  - [   0.0018671000000000,  0.0031467800000000, -0.0050528200000000 ]  - [  -0.0010009800000000, -0.0013834300000000,  0.0042960800000000 ]  - [   0.0018657000000000, -0.0033643200000000,  0.0049164900000000 ]  - [  -0.0039569600000000, -0.0019856900000000, -0.0053399600000000 ]  - [  -0.0019318700000000, -0.0034055200000000, -0.0052610200000000 ]  - [  -0.0018898800000000,  0.0032196900000000, -0.0049309400000000 ]  - [  -0.0019575300000000,  0.0033233200000000, -0.0047663900000000 ]  - [   0.0018543200000000, -0.0031838300000000, -0.0047025700000000 ]  - [   0.0019678500000000, -0.0033754300000000, -0.0049640800000000 ]  - [  -0.0000103600000000,  0.0000103800000000, -0.0015087400000000 ]  - [   0.0000251600000000, -0.0000134000000000, -0.0015612700000000 ]  - [   0.0000069500000000,  0.0000099700000000,  0.0016163500000000 ]  - [  -0.0000244100000000, -0.0000129500000000,  0.0015663900000000 ]  - [  -0.0006687100000000,  0.0033974400000000,  0.0052516000000000 ]  - [   0.0000859000000000, -0.0006662000000000,  0.0017150300000000 ]  - [   0.0006587200000000,  0.0032725300000000,  0.0019257100000000 ]  - [  -0.0000887000000000, -0.0006716800000000, -0.0014079900000000 ]  - [   0.0011872100000000,  0.0478476800000000, -0.0808726300000000 ]  - [   0.0011603000000000, -0.0001234600000000,  0.0000455600000000 ]  - [  -0.0012004700000000, -0.0030225800000000, -0.0037715800000000 ]  - [  -0.0011304500000000, -0.0029565100000000, -0.0037642500000000 ]  - [  -0.0011497400000000, -0.0000416400000000,  0.0000562700000000 ]  - [  -0.0011783700000000, -0.0000402300000000,  0.0000554800000000 ]  - [   0.0011603400000000,  0.0001212400000000,  0.0001003700000000 ]  - [   0.0011651300000000, -0.0000404300000000,  0.0000127100000000 ]  - [  -0.0017836500000000, -0.0031883300000000,  0.0052067600000000 ]  - [  -0.0018460900000000, -0.0032854200000000,  0.0050392100000000 ]  - [   0.0018789700000000,  0.0033255000000000,  0.0052680000000000 ]  - [   0.0017716700000000,  0.0031297200000000,  0.0050083000000000 ]  - [  -0.0040658700000000,  0.0034177800000000,  0.0043645000000000 ]  - [  -0.0035061900000000,  0.0035152400000000,  0.0045128300000000 ]  - [   0.0036370600000000,  0.0034395400000000, -0.0046118300000000 ]  - [   0.0029282800000000,  0.0037345700000000, -0.0048715900000000 ]  - [   0.0041561100000000, -0.0033302000000000,  0.0043256000000000 ]  - [   0.0034468400000000, -0.0036279000000000,  0.0045839300000000 ]  - [  -0.0030149500000000, -0.0036500300000000, -0.0048301600000000 ]  - [  -0.0035766600000000, -0.0035515900000000, -0.0046830200000000 ]  - [  -0.0025366800000000, -0.0043021700000000,  0.0003820700000000 ]  - [   0.0035293900000000, -0.0036700000000000, -0.0044820800000000 ]  - [  -0.0096196000000000, -0.0047187400000000,  0.0094321400000000 ]  - [  -0.0036282500000000, -0.0035621200000000,  0.0050416200000000 ]  - [   0.0025124900000000,  0.0023756700000000,  0.0001935800000000 ]  - [  -0.0034600900000000,  0.0035030300000000, -0.0041572600000000 ]  - [   0.0035561500000000,  0.0033965300000000,  0.0047180700000000 ]  - [   0.0096578200000000,  0.0027244700000000,  0.0096280400000000 ]- atom:   73  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0003803100000000,  0.0027807000000000, -0.0086196700000000 ]  - [  -0.0024552300000000,  0.0045088700000000, -0.0081166900000000 ]  - [   0.0015237100000000,  0.0060821200000000,  0.0069270300000000 ]  - [   0.0027606300000000,  0.0033022800000000,  0.0077576700000000 ]  - [   0.0024817200000000, -0.0027857500000000, -0.0082274700000000 ]  - [   0.0031255200000000, -0.0049211200000000, -0.0082747000000000 ]  - [   0.0084835700000000, -0.0060090200000000,  0.0080627500000000 ]  - [  -0.0016944400000000, -0.0041079600000000,  0.0081572900000000 ]  - [   0.0036885600000000, -0.0056061500000000,  0.0063924000000000 ]  - [   0.0036034700000000, -0.0039982200000000,  0.0081195900000000 ]  - [  -0.0049510600000000, -0.0050216700000000, -0.0085392100000000 ]  - [  -0.0046278800000000, -0.0049593400000000, -0.0081842900000000 ]  - [  -0.0048810000000000,  0.0050165100000000,  0.0083809100000000 ]  - [  -0.0042629500000000,  0.0048071400000000,  0.0083075200000000 ]  - [   0.0014388900000000,  0.0002164100000000, -0.0096331200000000 ]  - [   0.0037427800000000,  0.0057206000000000, -0.0084387300000000 ]  - [  -0.0047347300000000, -0.0021361500000000, -0.0043437400000000 ]  - [  -0.0002676700000000, -0.0029908300000000, -0.0045838900000000 ]  - [   0.0012022000000000, -0.0004116900000000,  0.0065018800000000 ]  - [   0.0012826600000000, -0.0042306500000000,  0.0051949600000000 ]  - [   0.0318997200000000, -0.0003097600000000,  0.0362498300000000 ]  - [   0.0026289400000000, -0.0033208400000000,  0.0046325300000000 ]  - [  -0.0031877300000000, -0.0036517000000000, -0.0042329600000000 ]  - [  -0.0034167100000000, -0.0026697900000000, -0.0046285500000000 ]  - [  -0.0082160100000000,  0.0030493000000000,  0.0053168100000000 ]  - [  -0.0025492600000000,  0.0032661200000000,  0.0046974100000000 ]  - [   0.0037471100000000,  0.0020345300000000, -0.0055035100000000 ]  - [   0.0035575600000000,  0.0033949600000000, -0.0047788100000000 ]  - [  -0.0075494600000000,  0.0000967700000000,  0.0028992800000000 ]  - [  -0.0008301800000000, -0.0001011400000000,  0.0042515400000000 ]  - [  -0.0017711500000000, -0.0008505000000000, -0.0038997800000000 ]  - [  -0.0013830000000000,  0.0007376900000000, -0.0038902700000000 ]  - [   0.0053267600000000,  0.0033743000000000, -0.0072726400000000 ]  - [   0.0007522200000000,  0.0001988700000000, -0.0047547100000000 ]  - [  -0.0008566400000000,  0.0029727000000000,  0.0045379400000000 ]  - [  -0.0005331800000000,  0.0028929800000000,  0.0047508900000000 ]  - [   0.0014034500000000,  0.0002202000000000,  0.0047405200000000 ]  - [   0.0009769300000000, -0.0002855600000000,  0.0049548300000000 ]  - [   0.0351104700000000, -0.0063448700000000, -0.0105642000000000 ]  - [   0.0005524000000000,  0.0025387700000000, -0.0046809500000000 ]  - [  -0.0012642800000000,  0.0031580900000000,  0.0049426800000000 ]  - [  -0.0011184700000000,  0.0029805300000000,  0.0048427000000000 ]  - [   0.0044417800000000,  0.0033032100000000, -0.0163328900000000 ]  - [   0.0017599400000000,  0.0032801000000000, -0.0049868800000000 ]  - [   0.0015995700000000, -0.0004806500000000,  0.0040195400000000 ]  - [   0.0029483300000000, -0.0086273800000000,  0.0050135100000000 ]  - [  -0.0010418900000000, -0.0030545300000000, -0.0045098000000000 ]  - [  -0.0015301900000000, -0.0031875700000000, -0.0048595500000000 ]  - [  -0.0031392000000000,  0.0017843700000000, -0.0051320600000000 ]  - [  -0.0034743000000000,  0.0061984900000000, -0.0049349500000000 ]  - [   0.0025573900000000, -0.0039079300000000, -0.0056416000000000 ]  - [   0.0022947300000000, -0.0028076800000000, -0.0051650300000000 ]  - [   0.0006654100000000,  0.0001057600000000, -0.0012741700000000 ]  - [  -0.0002968800000000,  0.0000400800000000, -0.0016726400000000 ]  - [  -0.0004237400000000, -0.0031444500000000,  0.0020979500000000 ]  - [   0.0019790800000000,  0.0062987200000000,  0.0023251200000000 ]  - [   0.0011427800000000, -0.0004786100000000,  0.0013316200000000 ]  - [   0.0003889800000000, -0.0000593700000000,  0.0014813100000000 ]  - [   0.0017528200000000,  0.0007938200000000, -0.0017082700000000 ]  - [   0.0005748900000000, -0.0001523000000000, -0.0013746300000000 ]  - [   0.0025905800000000,  0.0007825300000000, -0.0005244500000000 ]  - [   0.0015817300000000, -0.0002660300000000,  0.0000361200000000 ]  - [   0.0005107400000000, -0.0009865200000000, -0.0006119700000000 ]  - [  -0.0007048500000000,  0.0003762500000000,  0.0000946400000000 ]  - [  -0.0017568800000000,  0.0049574600000000, -0.0061131800000000 ]  - [  -0.0014838200000000, -0.0002350000000000, -0.0000140600000000 ]  - [  -0.0000584600000000, -0.0048077900000000, -0.0060823800000000 ]  - [   0.0008628300000000,  0.0001704600000000, -0.0000871400000000 ]  - [  -0.0044155400000000, -0.0041233500000000,  0.0093034000000000 ]  - [  -0.0022434200000000, -0.0033075800000000,  0.0050847100000000 ]  - [   0.0025714400000000,  0.0035173800000000,  0.0049716600000000 ]  - [   0.0020444800000000,  0.0032837100000000,  0.0050287000000000 ]  - [  -0.1231549700000000,  0.0073412200000000, -0.0285606200000000 ]  - [  -0.0063402900000000,  0.0032816500000000,  0.0047695100000000 ]  - [   0.0052509300000000,  0.0043910600000000, -0.0043364800000000 ]  - [   0.0052554900000000,  0.0016332400000000, -0.0034890300000000 ]  - [   0.0228933000000000, -0.0045998000000000,  0.0113432300000000 ]  - [   0.0050651700000000, -0.0032603600000000,  0.0044968300000000 ]  - [  -0.0091410300000000, -0.0036000300000000, -0.0040612500000000 ]  - [  -0.0087399500000000, -0.0026607400000000, -0.0040719800000000 ]  - [   0.0279575700000000, -0.0006356600000000,  0.0201234000000000 ]  - [   0.0023905900000000, -0.0035927500000000, -0.0044810900000000 ]  - [   0.0000692800000000, -0.0035121300000000,  0.0043796300000000 ]  - [  -0.0005963700000000, -0.0037062100000000,  0.0042209300000000 ]  - [   0.0043345900000000,  0.0033705200000000, -0.0038158600000000 ]  - [  -0.0013115800000000,  0.0037959200000000, -0.0045237200000000 ]  - [   0.0026272600000000,  0.0022562200000000,  0.0036282800000000 ]  - [   0.0026231200000000,  0.0055945400000000,  0.0051645000000000 ]- atom:   73  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0072299600000000,  0.0064001100000000, -0.0075019300000000 ]  - [  -0.0043986700000000,  0.0046270800000000, -0.0081315000000000 ]  - [   0.0053267000000000,  0.0030562200000000,  0.0093241400000000 ]  - [   0.0041002000000000,  0.0058378600000000,  0.0084941300000000 ]  - [   0.0043826200000000, -0.0063568400000000, -0.0080256200000000 ]  - [   0.0037307800000000, -0.0042176900000000, -0.0079797400000000 ]  - [  -0.0153750900000000, -0.0033818400000000,  0.0081587600000000 ]  - [  -0.0051550500000000, -0.0050394700000000,  0.0080901100000000 ]  - [   0.0031610700000000, -0.0035370600000000,  0.0098817100000000 ]  - [   0.0032427000000000, -0.0051402200000000,  0.0081308000000000 ]  - [  -0.0018968600000000, -0.0041189900000000, -0.0077097000000000 ]  - [  -0.0022215500000000, -0.0041766800000000, -0.0080671400000000 ]  - [  -0.0019670800000000,  0.0041179800000000,  0.0078703900000000 ]  - [  -0.0025856700000000,  0.0043339400000000,  0.0079442000000000 ]  - [   0.0054185200000000,  0.0089318400000000, -0.0066052800000000 ]  - [   0.0031015300000000,  0.0034154500000000, -0.0078111500000000 ]  - [   0.0071298400000000, -0.0038184000000000, -0.0048024300000000 ]  - [   0.0026845000000000, -0.0029678500000000, -0.0045690800000000 ]  - [  -0.0036343500000000, -0.0055736300000000,  0.0026315400000000 ]  - [  -0.0037119600000000, -0.0017176500000000,  0.0039492600000000 ]  - [  -0.0296614200000000, -0.0057488200000000, -0.0279535600000000 ]  - [  -0.0002309300000000, -0.0026279200000000,  0.0045191600000000 ]  - [   0.0007867100000000, -0.0023090200000000, -0.0049181300000000 ]  - [   0.0010119000000000, -0.0032871200000000, -0.0045237300000000 ]  - [   0.0058231300000000,  0.0029064300000000,  0.0038347500000000 ]  - [   0.0001444800000000,  0.0026949900000000,  0.0044558000000000 ]  - [  -0.0013527500000000,  0.0039187000000000, -0.0036472000000000 ]  - [  -0.0011780400000000,  0.0025705900000000, -0.0043565500000000 ]  - [   0.0075495400000000, -0.0001033800000000,  0.0065123300000000 ]  - [   0.0008289000000000,  0.0001021500000000,  0.0051672200000000 ]  - [   0.0017731400000000,  0.0008543300000000, -0.0055197100000000 ]  - [   0.0013798500000000, -0.0007383400000000, -0.0055293700000000 ]  - [  -0.0042100500000000, -0.0033329700000000, -0.0028871900000000 ]  - [  -0.0007449800000000, -0.0001944000000000, -0.0046579100000000 ]  - [   0.0032744700000000,  0.0029879200000000,  0.0046126700000000 ]  - [   0.0029542600000000,  0.0030658400000000,  0.0044019800000000 ]  - [  -0.0013937200000000, -0.0002316000000000,  0.0046667200000000 ]  - [  -0.0009559900000000,  0.0003014800000000,  0.0044495900000000 ]  - [  -0.0407849400000000,  0.0128957700000000,  0.0018278800000000 ]  - [  -0.0029772800000000,  0.0034249500000000, -0.0044704500000000 ]  - [  -0.0024900500000000,  0.0033491500000000,  0.0050258700000000 ]  - [  -0.0026354300000000,  0.0035246000000000,  0.0051248000000000 ]  - [  -0.0007540200000000,  0.0032211400000000,  0.0064611000000000 ]  - [   0.0019928200000000,  0.0032239900000000, -0.0049793600000000 ]  - [   0.0021587500000000, -0.0060479800000000,  0.0059571600000000 ]  - [   0.0008023200000000,  0.0021670800000000,  0.0049516100000000 ]  - [  -0.0027130700000000, -0.0034525800000000, -0.0054556200000000 ]  - [  -0.0022237700000000, -0.0033207100000000, -0.0051095300000000 ]  - [  -0.0005921700000000,  0.0046789200000000, -0.0047811300000000 ]  - [  -0.0002703900000000,  0.0003228600000000, -0.0050266700000000 ]  - [   0.0011938900000000, -0.0025984700000000, -0.0043283300000000 ]  - [   0.0014522400000000, -0.0036968700000000, -0.0048006900000000 ]  - [  -0.0006959300000000, -0.0000906700000000, -0.0018824100000000 ]  - [   0.0002939900000000, -0.0000410300000000, -0.0014682700000000 ]  - [   0.0004164600000000,  0.0031204800000000,  0.0010450700000000 ]  - [  -0.0020255900000000, -0.0062859600000000,  0.0008263900000000 ]  - [  -0.0011441500000000,  0.0004816300000000,  0.0018134400000000 ]  - [  -0.0003876000000000,  0.0000583800000000,  0.0016607600000000 ]  - [  -0.0017613000000000, -0.0007989600000000, -0.0014314000000000 ]  - [  -0.0005744200000000,  0.0001521300000000, -0.0017678200000000 ]  - [  -0.0002623900000000, -0.0007835100000000,  0.0005266500000000 ]  - [   0.0007483200000000,  0.0002667600000000, -0.0000352300000000 ]  - [  -0.0028421100000000,  0.0009898300000000,  0.0006161300000000 ]  - [  -0.0016276300000000, -0.0003790300000000, -0.0000956100000000 ]  - [  -0.0005756100000000, -0.0049393800000000,  0.0060778400000000 ]  - [  -0.0008490300000000,  0.0002353200000000,  0.0000150900000000 ]  - [   0.0023928700000000,  0.0047943300000000,  0.0060459000000000 ]  - [   0.0014655500000000, -0.0001739700000000,  0.0000839100000000 ]  - [   0.0006558900000000, -0.0023681900000000,  0.0006682600000000 ]  - [  -0.0015080800000000, -0.0032012800000000,  0.0048828900000000 ]  - [   0.0011770000000000,  0.0029898800000000,  0.0049936400000000 ]  - [   0.0017031700000000,  0.0032212200000000,  0.0049385600000000 ]  - [   0.1187743500000000, -0.0005851500000000,  0.0391252600000000 ]  - [  -0.0007184900000000,  0.0037628900000000,  0.0044380500000000 ]  - [   0.0017966900000000,  0.0026652300000000, -0.0048654800000000 ]  - [   0.0018011600000000,  0.0054197400000000, -0.0057094200000000 ]  - [  -0.0156797100000000, -0.0024505600000000, -0.0021248600000000 ]  - [   0.0019945100000000, -0.0037991500000000,  0.0047069700000000 ]  - [   0.0020941600000000, -0.0034339200000000, -0.0051668800000000 ]  - [   0.0017051900000000, -0.0044566800000000, -0.0051861500000000 ]  - [  -0.0212476300000000, -0.0064093700000000, -0.0296595600000000 ]  - [   0.0046929800000000, -0.0034634200000000, -0.0047279400000000 ]  - [  -0.0071440800000000, -0.0035458200000000,  0.0048257900000000 ]  - [  -0.0064791500000000, -0.0033448900000000,  0.0049815200000000 ]  - [  -0.0114100800000000,  0.0036882700000000, -0.0053995400000000 ]  - [  -0.0057628800000000,  0.0032559400000000, -0.0046804100000000 ]  - [   0.0044639200000000,  0.0048031000000000,  0.0055917200000000 ]  - [   0.0044600300000000,  0.0014509800000000,  0.0040421400000000 ]- atom:   73  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0045302600000000,  0.0106001400000000, -0.0075141500000000 ]  - [  -0.0032689300000000,  0.0029229300000000, -0.0079119600000000 ]  - [   0.0041844200000000,  0.0055553100000000,  0.0080724900000000 ]  - [   0.0020750600000000,  0.0027289900000000,  0.0089615000000000 ]  - [   0.0038736400000000, -0.0046010500000000, -0.0082030000000000 ]  - [   0.0031976200000000, -0.0048952000000000, -0.0080126900000000 ]  - [  -0.0081584000000000,  0.0959920700000000,  0.0050565300000000 ]  - [  -0.0030262400000000, -0.0082051200000000,  0.0079389900000000 ]  - [   0.0029717400000000, -0.0045104100000000,  0.0076704600000000 ]  - [   0.0036433000000000, -0.0052070100000000,  0.0081325700000000 ]  - [  -0.0035268300000000, -0.0039641800000000, -0.0082178100000000 ]  - [  -0.0034465400000000, -0.0050639000000000, -0.0080708200000000 ]  - [  -0.0034528200000000,  0.0050350900000000,  0.0080838000000000 ]  - [  -0.0034387500000000,  0.0042231700000000,  0.0081500300000000 ]  - [   0.0027052900000000,  0.0049501500000000, -0.0081127800000000 ]  - [   0.0045500700000000,  0.0037258400000000, -0.0081099100000000 ]  - [   0.0014867800000000, -0.0028921900000000, -0.0046173400000000 ]  - [   0.0009395600000000, -0.0032551100000000, -0.0045551800000000 ]  - [   0.0007609800000000, -0.0029341900000000,  0.0036260500000000 ]  - [  -0.0020044000000000, -0.0032460000000000,  0.0047747200000000 ]  - [   0.0007000600000000,  0.0056004800000000,  0.0066524700000000 ]  - [   0.0016037600000000, -0.0052147600000000,  0.0045526900000000 ]  - [  -0.0018874300000000, -0.0027928100000000, -0.0050785300000000 ]  - [  -0.0008820000000000, -0.0032042100000000, -0.0044364700000000 ]  - [  -0.0003305300000000,  0.0034453800000000,  0.0045804600000000 ]  - [  -0.0014716300000000,  0.0025543800000000,  0.0046983300000000 ]  - [   0.0007483900000000,  0.0027932500000000, -0.0047735000000000 ]  - [   0.0034786400000000,  0.0031312200000000, -0.0073099500000000 ]  - [  -0.0008581000000000,  0.0003611800000000,  0.0060007700000000 ]  - [   0.0000498600000000, -0.0005897800000000,  0.0046074500000000 ]  - [  -0.0003561500000000, -0.0000571100000000, -0.0046870100000000 ]  - [   0.0005975100000000,  0.0000858100000000, -0.0047099800000000 ]  - [   0.0070899100000000,  0.0078590400000000, -0.0117290200000000 ]  - [  -0.0002409500000000, -0.0029101900000000, -0.0048587500000000 ]  - [   0.0014677600000000,  0.0029630700000000,  0.0046328300000000 ]  - [   0.0005332900000000,  0.0028592600000000,  0.0044512500000000 ]  - [   0.0007239900000000, -0.0002374600000000,  0.0048052600000000 ]  - [  -0.0019275000000000,  0.0002172500000000,  0.0052095700000000 ]  - [  -0.0120332300000000,  0.0115647900000000, -0.0039129400000000 ]  - [  -0.0009391900000000,  0.0021609700000000, -0.0046935800000000 ]  - [  -0.0017058700000000,  0.0031323900000000,  0.0048983400000000 ]  - [  -0.0019422500000000,  0.0033522000000000,  0.0050368100000000 ]  - [   0.0012470500000000,  0.0022901500000000, -0.0040792700000000 ]  - [   0.0019819000000000,  0.0037089300000000, -0.0050929700000000 ]  - [   0.0020647600000000, -0.0029206000000000,  0.0046896900000000 ]  - [  -0.0015265200000000, -0.0014336000000000,  0.0048481700000000 ]  - [  -0.0019143900000000, -0.0034046700000000, -0.0050375100000000 ]  - [  -0.0017983200000000, -0.0030749500000000, -0.0049066100000000 ]  - [  -0.0053228500000000,  0.0121125400000000, -0.0151544600000000 ]  - [  -0.0016716900000000,  0.0057771200000000, -0.0036246200000000 ]  - [   0.0014978600000000, -0.0029821500000000, -0.0047782500000000 ]  - [   0.0023736700000000, -0.0035885500000000, -0.0053724100000000 ]  - [   0.0012924200000000, -0.0010861000000000, -0.0009569000000000 ]  - [  -0.0002353900000000,  0.0004157100000000, -0.0016351800000000 ]  - [  -0.0021414900000000,  0.0015866700000000,  0.0017293400000000 ]  - [   0.0114731700000000,  0.0077227500000000, -0.0010103300000000 ]  - [   0.0001594300000000, -0.0001472000000000,  0.0016207800000000 ]  - [  -0.0001460200000000,  0.0001445400000000,  0.0015284800000000 ]  - [   0.0003505700000000,  0.0001990100000000, -0.0016007500000000 ]  - [  -0.0003603000000000, -0.0002755200000000, -0.0015290800000000 ]  - [   0.0011589500000000, -0.0000616700000000, -0.0001177100000000 ]  - [   0.0009502200000000,  0.0002374600000000, -0.0000165900000000 ]  - [  -0.0014221800000000, -0.0004254500000000, -0.0002037100000000 ]  - [  -0.0010185800000000,  0.0002598600000000,  0.0000951500000000 ]  - [   0.0009435200000000, -0.0013595500000000, -0.0007789900000000 ]  - [  -0.0014755500000000,  0.0008632600000000, -0.0001399200000000 ]  - [   0.0002293000000000,  0.0005092600000000,  0.0011793400000000 ]  - [   0.0015895300000000,  0.0007386600000000,  0.0000278000000000 ]  - [  -0.0035876900000000, -0.0038151600000000,  0.0068629500000000 ]  - [  -0.0016849700000000, -0.0024506400000000,  0.0046328200000000 ]  - [   0.0017894700000000,  0.0029038200000000,  0.0048458800000000 ]  - [   0.0019699400000000,  0.0035478900000000,  0.0050451200000000 ]  - [   0.0002242200000000, -0.1499802700000000,  0.0147377200000000 ]  - [  -0.0037871500000000,  0.0095974500000000,  0.0052145600000000 ]  - [   0.0054401000000000,  0.0037803400000000, -0.0038440000000000 ]  - [   0.0026841700000000,  0.0037879400000000, -0.0048624200000000 ]  - [   0.0024376900000000, -0.0053071300000000,  0.0038419400000000 ]  - [   0.0038197200000000, -0.0010498000000000,  0.0045831300000000 ]  - [  -0.0034647600000000, -0.0003832000000000, -0.0084325200000000 ]  - [  -0.0044392200000000,  0.0011895000000000,  0.0093451500000000 ]  - [   0.0065069900000000, -0.0065742600000000, -0.0083217900000000 ]  - [   0.0034680800000000, -0.0021901700000000, -0.0042625200000000 ]  - [  -0.0035564200000000, -0.0032184400000000,  0.0045274200000000 ]  - [  -0.0033586100000000, -0.0039366200000000,  0.0047876300000000 ]  - [  -0.0036947700000000,  0.0029363200000000, -0.0043922300000000 ]  - [  -0.0032696700000000,  0.0039928200000000, -0.0047279800000000 ]  - [   0.0014609500000000,  0.0036559000000000,  0.0048352100000000 ]  - [   0.0048092400000000,  0.0036741200000000,  0.0048224600000000 ]- atom:   73  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0023115200000000, -0.0014658500000000, -0.0086951500000000 ]  - [  -0.0035728000000000,  0.0062151500000000, -0.0083360800000000 ]  - [   0.0026512000000000,  0.0035674800000000,  0.0081770100000000 ]  - [   0.0047786500000000,  0.0064082200000000,  0.0072911300000000 ]  - [   0.0029714600000000, -0.0045508700000000, -0.0080373200000000 ]  - [   0.0036439200000000, -0.0042414000000000, -0.0082315200000000 ]  - [   0.0014447400000000, -0.0989396000000000,  0.0110695700000000 ]  - [  -0.0038203200000000, -0.0009355700000000,  0.0083062900000000 ]  - [   0.0038623300000000, -0.0046484100000000,  0.0085599200000000 ]  - [   0.0032019800000000, -0.0039317500000000,  0.0081112300000000 ]  - [  -0.0033174400000000, -0.0051713300000000, -0.0080270900000000 ]  - [  -0.0033985500000000, -0.0040830300000000, -0.0081727700000000 ]  - [  -0.0033919500000000,  0.0041130500000000,  0.0081581500000000 ]  - [  -0.0034057100000000,  0.0049150500000000,  0.0080935800000000 ]  - [   0.0041243700000000,  0.0041528100000000, -0.0081280000000000 ]  - [   0.0023019200000000,  0.0054198700000000, -0.0081323800000000 ]  - [   0.0009348900000000, -0.0030746600000000, -0.0045372100000000 ]  - [   0.0014650500000000, -0.0027043900000000, -0.0045962300000000 ]  - [  -0.0031573100000000, -0.0030164600000000,  0.0055159500000000 ]  - [  -0.0003952200000000, -0.0027203700000000,  0.0043722400000000 ]  - [   0.0017554600000000, -0.0114337300000000,  0.0026051200000000 ]  - [   0.0008190900000000, -0.0007479600000000,  0.0046000200000000 ]  - [  -0.0005315300000000, -0.0031640300000000, -0.0040776000000000 ]  - [  -0.0015347500000000, -0.0027599800000000, -0.0047171400000000 ]  - [  -0.0020727800000000,  0.0025197400000000,  0.0045664700000000 ]  - [  -0.0009489500000000,  0.0034029900000000,  0.0044556500000000 ]  - [   0.0016738600000000,  0.0031448700000000, -0.0043886500000000 ]  - [  -0.0010562500000000,  0.0028345000000000, -0.0018592800000000 ]  - [   0.0008195000000000, -0.0003643700000000,  0.0034316400000000 ]  - [  -0.0000453700000000,  0.0005900900000000,  0.0048144600000000 ]  - [   0.0003540000000000,  0.0000493600000000, -0.0047365100000000 ]  - [  -0.0005967100000000, -0.0000788500000000, -0.0047101400000000 ]  - [  -0.0071124000000000, -0.0079479900000000,  0.0023770000000000 ]  - [   0.0002370700000000,  0.0029156100000000, -0.0045642800000000 ]  - [   0.0009411400000000,  0.0029937900000000,  0.0045216500000000 ]  - [   0.0018730400000000,  0.0031019700000000,  0.0047013900000000 ]  - [  -0.0007307900000000,  0.0002298200000000,  0.0046199900000000 ]  - [   0.0019243400000000, -0.0002007400000000,  0.0042079100000000 ]  - [   0.0097174300000000, -0.0056696100000000, -0.0052178100000000 ]  - [  -0.0014649800000000,  0.0037988800000000, -0.0044612100000000 ]  - [  -0.0020377700000000,  0.0033731400000000,  0.0050704100000000 ]  - [  -0.0018010000000000,  0.0031556300000000,  0.0049335100000000 ]  - [   0.0025121000000000,  0.0042116700000000, -0.0059329700000000 ]  - [   0.0017623700000000,  0.0028022300000000, -0.0048724400000000 ]  - [   0.0016815500000000, -0.0035668300000000,  0.0052761200000000 ]  - [   0.0052455000000000, -0.0050736300000000,  0.0051190400000000 ]  - [  -0.0018297900000000, -0.0031011900000000, -0.0049315100000000 ]  - [  -0.0019460700000000, -0.0034326800000000, -0.0050625200000000 ]  - [   0.0015486000000000, -0.0054958300000000,  0.0051064300000000 ]  - [  -0.0020936600000000,  0.0007571400000000, -0.0063642300000000 ]  - [   0.0022500000000000, -0.0035275900000000, -0.0051938000000000 ]  - [   0.0013758500000000, -0.0029218100000000, -0.0046019000000000 ]  - [  -0.0013132800000000,  0.0010869900000000, -0.0021999000000000 ]  - [   0.0002349900000000, -0.0004159700000000, -0.0014990600000000 ]  - [   0.0021955600000000, -0.0016064700000000,  0.0013916900000000 ]  - [  -0.0113936600000000, -0.0075966300000000,  0.0041113500000000 ]  - [  -0.0001546500000000,  0.0001447900000000,  0.0015135600000000 ]  - [   0.0001452000000000, -0.0001442800000000,  0.0016047600000000 ]  - [  -0.0003415800000000, -0.0001960800000000, -0.0015346100000000 ]  - [   0.0003559700000000,  0.0002703100000000, -0.0016043300000000 ]  - [   0.0011732400000000,  0.0000682800000000,  0.0001148100000000 ]  - [   0.0013759100000000, -0.0002391100000000,  0.0000184200000000 ]  - [  -0.0009035900000000,  0.0004173300000000,  0.0001993000000000 ]  - [  -0.0013100600000000, -0.0002563400000000, -0.0000928600000000 ]  - [  -0.0032776800000000,  0.0013328700000000,  0.0008003500000000 ]  - [  -0.0008486900000000, -0.0008607600000000,  0.0001330100000000 ]  - [   0.0021015700000000, -0.0004823400000000, -0.0011635500000000 ]  - [   0.0007440500000000, -0.0007425600000000, -0.0000292300000000 ]  - [  -0.0001833000000000, -0.0026895100000000,  0.0031649000000000 ]  - [  -0.0020603900000000, -0.0040545400000000,  0.0053304400000000 ]  - [   0.0019534500000000,  0.0036039600000000,  0.0051223900000000 ]  - [   0.0017782300000000,  0.0029607100000000,  0.0049285500000000 ]  - [  -0.0076823300000000,  0.1506740200000000, -0.0057124800000000 ]  - [  -0.0032983100000000, -0.0025706100000000,  0.0039988000000000 ]  - [   0.0016452700000000,  0.0032757600000000, -0.0053510800000000 ]  - [   0.0044026700000000,  0.0032833600000000, -0.0043349000000000 ]  - [   0.0045796600000000, -0.0017347200000000,  0.0053376100000000 ]  - [   0.0032731800000000, -0.0060078600000000,  0.0046190100000000 ]  - [  -0.0036229800000000, -0.0066944100000000, -0.0006953700000000 ]  - [  -0.0026350700000000, -0.0082052500000000, -0.0184215600000000 ]  - [   0.0007254100000000, -0.0004776200000000, -0.0008487700000000 ]  - [   0.0035902800000000, -0.0048696200000000, -0.0049391000000000 ]  - [  -0.0035147800000000, -0.0038394700000000,  0.0046708200000000 ]  - [  -0.0037122700000000, -0.0031322400000000,  0.0044139600000000 ]  - [  -0.0033696400000000,  0.0041208100000000, -0.0048003200000000 ]  - [  -0.0038020100000000,  0.0030714500000000, -0.0044750200000000 ]  - [   0.0055972700000000,  0.0033933500000000,  0.0043670300000000 ]  - [   0.0022545900000000,  0.0034098700000000,  0.0043852600000000 ]- atom:   73  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0062505700000000,  0.0016909900000000, -0.0182028100000000 ]  - [  -0.0034004800000000,  0.0051806400000000, -0.0084361800000000 ]  - [   0.0035033800000000,  0.0036752000000000,  0.0089979100000000 ]  - [   0.0034959400000000,  0.0049467400000000,  0.0083076500000000 ]  - [   0.0023435600000000, -0.0039522700000000, -0.0079006800000000 ]  - [   0.0032232300000000, -0.0047101000000000, -0.0080270300000000 ]  - [  -0.0032787100000000, -0.0115093800000000,  0.0207329800000000 ]  - [  -0.0028648600000000, -0.0048771100000000,  0.0095322600000000 ]  - [   0.0029230300000000, -0.0039379900000000,  0.0072269600000000 ]  - [   0.0036026800000000, -0.0047981800000000,  0.0079342700000000 ]  - [  -0.0033951300000000, -0.0042331500000000, -0.0081438400000000 ]  - [  -0.0034455600000000, -0.0047214100000000, -0.0080540000000000 ]  - [  -0.0034519300000000,  0.0046797600000000,  0.0079429200000000 ]  - [  -0.0033751700000000,  0.0044396100000000,  0.0080580200000000 ]  - [   0.0008999800000000,  0.0028460700000000, -0.0072570100000000 ]  - [   0.0037029700000000,  0.0043690000000000, -0.0079476000000000 ]  - [   0.0027017900000000, -0.0033343300000000, -0.0048503500000000 ]  - [   0.0012011700000000, -0.0029795900000000, -0.0044910200000000 ]  - [   0.0002965500000000, -0.0040951400000000,  0.0031612500000000 ]  - [  -0.0008706100000000, -0.0027977000000000,  0.0033647300000000 ]  - [   0.0248706000000000,  0.0031391900000000,  0.0760728900000000 ]  - [   0.0012158400000000, -0.0033300300000000,  0.0049218000000000 ]  - [  -0.0011042100000000, -0.0027888200000000, -0.0049525000000000 ]  - [  -0.0010328200000000, -0.0030525300000000, -0.0048466000000000 ]  - [   0.0004080400000000,  0.0031729400000000,  0.0044588500000000 ]  - [  -0.0012660300000000,  0.0028581200000000,  0.0046119900000000 ]  - [   0.0013802000000000,  0.0015989100000000, -0.0079623200000000 ]  - [   0.0016304500000000,  0.0032244000000000, -0.0074977200000000 ]  - [  -0.0010722900000000, -0.0001357800000000,  0.0089506400000000 ]  - [   0.0001357700000000, -0.0001206100000000,  0.0049335800000000 ]  - [   0.0001263300000000,  0.0000939500000000, -0.0050205900000000 ]  - [   0.0004838100000000, -0.0001134900000000, -0.0050096900000000 ]  - [  -0.0049367200000000, -0.0028546200000000,  0.0120052600000000 ]  - [  -0.0000865500000000, -0.0002954900000000, -0.0044061300000000 ]  - [   0.0011257000000000,  0.0030118600000000,  0.0045693300000000 ]  - [   0.0009308800000000,  0.0029606200000000,  0.0044332500000000 ]  - [  -0.0004970200000000,  0.0005716800000000,  0.0034090800000000 ]  - [  -0.0011097500000000, -0.0018567600000000,  0.0038422800000000 ]  - [   0.0066571100000000,  0.0032408000000000,  0.0097555300000000 ]  - [  -0.0011812600000000,  0.0028333500000000, -0.0042286100000000 ]  - [  -0.0019124800000000,  0.0031836000000000,  0.0048302300000000 ]  - [  -0.0019815900000000,  0.0033440800000000,  0.0048793000000000 ]  - [  -0.0029549800000000,  0.0018498800000000, -0.0003750000000000 ]  - [   0.0018295700000000,  0.0033340800000000, -0.0050107000000000 ]  - [   0.0019534800000000, -0.0033409600000000,  0.0043598200000000 ]  - [   0.0013683600000000, -0.0019239500000000,  0.0043602700000000 ]  - [  -0.0018484200000000, -0.0032554000000000, -0.0051668900000000 ]  - [  -0.0018775300000000, -0.0032086100000000, -0.0049927800000000 ]  - [  -0.0011515500000000, -0.0036441700000000, -0.0028715300000000 ]  - [  -0.0026834600000000,  0.0099208900000000, -0.0042936600000000 ]  - [   0.0016612400000000, -0.0030472600000000, -0.0048046100000000 ]  - [   0.0018218000000000, -0.0035343100000000, -0.0050184900000000 ]  - [   0.0066405500000000, -0.0022967700000000,  0.0016115100000000 ]  - [   0.0001333400000000,  0.0000531300000000, -0.0015046900000000 ]  - [  -0.0000715400000000,  0.0008319500000000,  0.0011323800000000 ]  - [  -0.0001944700000000, -0.0017911000000000,  0.0009321500000000 ]  - [  -0.0001511700000000, -0.0000014600000000,  0.0017498200000000 ]  - [  -0.0001214800000000,  0.0000642300000000,  0.0015803900000000 ]  - [   0.0003856000000000,  0.0000208600000000, -0.0018344700000000 ]  - [  -0.0001489000000000, -0.0001511500000000, -0.0015919700000000 ]  - [   0.0006001600000000,  0.0000597200000000, -0.0002329200000000 ]  - [   0.0010011600000000,  0.0000966100000000, -0.0000857300000000 ]  - [  -0.0017959200000000, -0.0002169100000000, -0.0002723700000000 ]  - [  -0.0012391000000000,  0.0000256900000000, -0.0000143300000000 ]  - [  -0.0034940200000000, -0.0033723800000000,  0.0049980500000000 ]  - [  -0.0015456500000000,  0.0001438200000000,  0.0001226100000000 ]  - [  -0.0013879800000000,  0.0033251000000000,  0.0047995700000000 ]  - [   0.0009657900000000,  0.0000556100000000,  0.0004478300000000 ]  - [  -0.0047084200000000, -0.0065754600000000,  0.0187678000000000 ]  - [  -0.0018812900000000, -0.0030628300000000,  0.0052635600000000 ]  - [   0.0019644100000000,  0.0033343600000000,  0.0055961500000000 ]  - [   0.0018678900000000,  0.0033230900000000,  0.0050949700000000 ]  - [  -0.0365050900000000,  0.0140995400000000, -0.1203141400000000 ]  - [  -0.0033666400000000,  0.0041339500000000,  0.0038272200000000 ]  - [   0.0046537400000000,  0.0037976200000000, -0.0048496000000000 ]  - [   0.0038058300000000,  0.0027684700000000, -0.0048475200000000 ]  - [  -0.0032073600000000, -0.0027807200000000, -0.0007159100000000 ]  - [   0.0036380400000000, -0.0035142500000000,  0.0044690300000000 ]  - [  -0.0040968500000000, -0.0074263700000000, -0.0003380900000000 ]  - [  -0.0041036400000000,  0.0104658300000000, -0.0009224700000000 ]  - [   0.0283708100000000, -0.0072525800000000, -0.0173160200000000 ]  - [   0.0036539100000000, -0.0031923500000000, -0.0048160200000000 ]  - [  -0.0037536800000000, -0.0034585500000000,  0.0047767100000000 ]  - [  -0.0039119700000000, -0.0037171700000000,  0.0049603500000000 ]  - [  -0.0043214600000000,  0.0033248200000000, -0.0042937900000000 ]  - [  -0.0036112500000000,  0.0036564900000000, -0.0046521000000000 ]  - [   0.0029619400000000,  0.0037475000000000,  0.0062951400000000 ]  - [   0.0045108800000000,  0.0037644500000000,  0.0062921600000000 ]- atom:   73  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0006419900000000,  0.0074334500000000,  0.0019915900000000 ]  - [  -0.0034482400000000,  0.0039632000000000, -0.0078141300000000 ]  - [   0.0033549700000000,  0.0054595500000000,  0.0072575000000000 ]  - [   0.0033643700000000,  0.0041960800000000,  0.0079406900000000 ]  - [   0.0044925900000000, -0.0051750400000000, -0.0083533300000000 ]  - [   0.0036237400000000, -0.0044329600000000, -0.0082214800000000 ]  - [  -0.0035577100000000,  0.0021939500000000, -0.0044336500000000 ]  - [  -0.0039882500000000, -0.0042762900000000,  0.0067216900000000 ]  - [   0.0039288500000000, -0.0052025600000000,  0.0090078400000000 ]  - [   0.0032519000000000, -0.0043450700000000,  0.0083147800000000 ]  - [  -0.0034569700000000, -0.0049057500000000, -0.0081091100000000 ]  - [  -0.0034074600000000, -0.0044201100000000, -0.0081990600000000 ]  - [  -0.0034011500000000,  0.0044606400000000,  0.0083080100000000 ]  - [  -0.0034767400000000,  0.0047007200000000,  0.0081939000000000 ]  - [   0.0059564300000000,  0.0062782000000000, -0.0090081400000000 ]  - [   0.0031435000000000,  0.0047815100000000, -0.0083131900000000 ]  - [  -0.0002995000000000, -0.0026231000000000, -0.0043004900000000 ]  - [   0.0012111200000000, -0.0029782000000000, -0.0046625900000000 ]  - [  -0.0026806900000000, -0.0018700600000000,  0.0060061500000000 ]  - [  -0.0015273000000000, -0.0031631000000000,  0.0057951100000000 ]  - [  -0.0247677100000000, -0.0095813600000000, -0.0709818500000000 ]  - [   0.0012001600000000, -0.0026306700000000,  0.0042244800000000 ]  - [  -0.0013127100000000, -0.0031709300000000, -0.0042004900000000 ]  - [  -0.0013839200000000, -0.0029045400000000, -0.0043070400000000 ]  - [  -0.0028085600000000,  0.0027877300000000,  0.0046883000000000 ]  - [  -0.0011470700000000,  0.0031013800000000,  0.0045387200000000 ]  - [   0.0010446100000000,  0.0043594500000000, -0.0011899800000000 ]  - [   0.0007920400000000,  0.0027226900000000, -0.0016588300000000 ]  - [   0.0010542000000000,  0.0001341000000000,  0.0004438600000000 ]  - [  -0.0001369800000000,  0.0001202900000000,  0.0044806000000000 ]  - [  -0.0001275200000000, -0.0000953900000000, -0.0043913000000000 ]  - [  -0.0004825900000000,  0.0001157900000000, -0.0043997300000000 ]  - [   0.0055467000000000,  0.0028716600000000, -0.0217835400000000 ]  - [   0.0000876200000000,  0.0003004000000000, -0.0050154100000000 ]  - [   0.0012773700000000,  0.0029476800000000,  0.0045847300000000 ]  - [   0.0014725500000000,  0.0029972900000000,  0.0047206500000000 ]  - [   0.0004892300000000, -0.0005605900000000,  0.0060030600000000 ]  - [   0.0010946300000000,  0.0018325200000000,  0.0055602200000000 ]  - [  -0.0090189000000000,  0.0027053200000000, -0.0188642300000000 ]  - [  -0.0012307800000000,  0.0031241200000000, -0.0049260300000000 ]  - [  -0.0018394300000000,  0.0033225100000000,  0.0051351800000000 ]  - [  -0.0017710200000000,  0.0031630500000000,  0.0050865300000000 ]  - [   0.0066500200000000,  0.0046413700000000, -0.0096233700000000 ]  - [   0.0019209200000000,  0.0031715800000000, -0.0049597200000000 ]  - [   0.0018030500000000, -0.0031577500000000,  0.0056062800000000 ]  - [   0.0023997800000000, -0.0046093100000000,  0.0055976900000000 ]  - [  -0.0019016200000000, -0.0032504400000000, -0.0048019900000000 ]  - [  -0.0018737700000000, -0.0032986900000000, -0.0049770300000000 ]  - [  -0.0025953900000000,  0.0101544000000000, -0.0070418400000000 ]  - [  -0.0010666000000000, -0.0034616100000000, -0.0056791100000000 ]  - [   0.0020899700000000, -0.0034580600000000, -0.0051591500000000 ]  - [   0.0019290100000000, -0.0029698200000000, -0.0049444900000000 ]  - [  -0.0065184400000000,  0.0022612900000000, -0.0046852500000000 ]  - [  -0.0001326000000000, -0.0000538300000000, -0.0016364700000000 ]  - [   0.0000580800000000, -0.0008114100000000,  0.0020130400000000 ]  - [   0.0001290400000000,  0.0017600500000000,  0.0022359300000000 ]  - [   0.0001520800000000,  0.0000016300000000,  0.0013934800000000 ]  - [   0.0001213700000000, -0.0000642200000000,  0.0015604100000000 ]  - [  -0.0003826400000000, -0.0000201900000000, -0.0013052800000000 ]  - [   0.0001515000000000,  0.0001496200000000, -0.0015494400000000 ]  - [   0.0017316100000000, -0.0000571300000000,  0.0002287700000000 ]  - [   0.0013325900000000, -0.0000972800000000,  0.0000847900000000 ]  - [  -0.0005292500000000,  0.0002141200000000,  0.0002693400000000 ]  - [  -0.0010907000000000, -0.0000250400000000,  0.0000127800000000 ]  - [   0.0011943500000000,  0.0033866800000000, -0.0050108100000000 ]  - [  -0.0007846300000000, -0.0001488900000000, -0.0001161600000000 ]  - [   0.0037614500000000, -0.0033426200000000, -0.0048255400000000 ]  - [   0.0013662500000000, -0.0000506200000000, -0.0004401200000000 ]  - [   0.0008733700000000,  0.0000226800000000, -0.0088323800000000 ]  - [  -0.0018692300000000, -0.0034419500000000,  0.0047050100000000 ]  - [   0.0017934400000000,  0.0031741400000000,  0.0043763100000000 ]  - [   0.0018832400000000,  0.0031830700000000,  0.0048753900000000 ]  - [   0.0312318400000000, -0.0063398800000000,  0.1338010700000000 ]  - [  -0.0036977900000000,  0.0029144700000000,  0.0053837400000000 ]  - [   0.0024332500000000,  0.0032662900000000, -0.0043673100000000 ]  - [   0.0032769000000000,  0.0042715700000000, -0.0043653700000000 ]  - [   0.0102614300000000, -0.0042727500000000,  0.0098999900000000 ]  - [   0.0034274800000000, -0.0035461100000000,  0.0047322700000000 ]  - [  -0.0029909100000000,  0.0003144200000000, -0.0088597200000000 ]  - [  -0.0029890300000000, -0.0172966200000000, -0.0083163400000000 ]  - [  -0.0214112500000000,  0.0002242400000000,  0.0081836200000000 ]  - [   0.0034073300000000, -0.0038651500000000, -0.0043826300000000 ]  - [  -0.0033075200000000, -0.0035979700000000,  0.0044284100000000 ]  - [  -0.0031514000000000, -0.0033397400000000,  0.0042448800000000 ]  - [  -0.0027374300000000,  0.0037290700000000, -0.0049069700000000 ]  - [  -0.0034542700000000,  0.0033994400000000, -0.0045493100000000 ]  - [   0.0040843500000000,  0.0033072300000000,  0.0029177700000000 ]  - [   0.0025473700000000,  0.0032921900000000,  0.0029148100000000 ]