# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/67ed57bc-24ef-4442-a01c-eb309c4648e1/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 ZnH4(BrO)2 / Immm (71) / materials id 643060](https://mdr.nims.go.jp/datasets/9116b270-062d-49c6-b18f-f64473a06f68)

## 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: "Immm"  number: 71  Hall_symbol: "-I 2 2"primitive_matrix:- [ -0.500000000000000,  0.500000000000000,  0.500000000000000 ]- [  0.500000000000000, -0.500000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.500000000000000, -0.500000000000000 ]supercell_matrix:- [   2,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [    -3.778077885000000,     5.019778295000000,     5.377532725000000 ] # a  - [     3.778077885000000,    -5.019778295000000,     5.377532725000000 ] # b  - [     3.778077885000000,     5.019778295000000,    -5.377532725000000 ] # c  points:  - symbol: Zn # 1    coordinates: [  0.349789540000000,  0.849789540000000,  0.500000000000000 ]    mass: 65.380000  - symbol: Zn # 2    coordinates: [  0.650210460000000,  0.150210460000000,  0.500000000000000 ]    mass: 65.380000  - symbol: Zn # 3    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 65.380000  - symbol: H  # 4    coordinates: [  0.082512240000000,  0.197624930000000,  0.426292250000000 ]    mass: 1.007940  - symbol: H  # 5    coordinates: [  0.228667320000000,  0.802375070000000,  0.884887310000000 ]    mass: 1.007940  - symbol: H  # 6    coordinates: [  0.771332680000000,  0.656219990000000,  0.573707750000000 ]    mass: 1.007940  - symbol: H  # 7    coordinates: [  0.917487760000000,  0.343780010000000,  0.115112690000000 ]    mass: 1.007940  - symbol: H  # 8    coordinates: [  0.917487760000000,  0.802375070000000,  0.573707750000000 ]    mass: 1.007940  - symbol: H  # 9    coordinates: [  0.771332680000000,  0.197624930000000,  0.115112690000000 ]    mass: 1.007940  - symbol: H  # 10    coordinates: [  0.228667320000000,  0.343780010000000,  0.426292250000000 ]    mass: 1.007940  - symbol: H  # 11    coordinates: [  0.082512240000000,  0.656219990000000,  0.884887310000000 ]    mass: 1.007940  - symbol: H  # 12    coordinates: [  0.836572940000000,  0.755238290000000,  0.081334650000000 ]    mass: 1.007940  - symbol: H  # 13    coordinates: [  0.326096360000000,  0.244761710000000,  0.081334650000000 ]    mass: 1.007940  - symbol: H  # 14    coordinates: [  0.673903640000000,  0.755238290000000,  0.918665350000000 ]    mass: 1.007940  - symbol: H  # 15    coordinates: [  0.163427060000000,  0.244761710000000,  0.918665350000000 ]    mass: 1.007940  - symbol: Br # 16    coordinates: [  0.500000000000000,  0.242864680000000,  0.742864680000000 ]    mass: 79.904000  - symbol: Br # 17    coordinates: [  0.500000000000000,  0.757135320000000,  0.257135320000000 ]    mass: 79.904000  - symbol: Br # 18    coordinates: [  0.024513790000000,  0.713236350000000,  0.311277440000000 ]    mass: 79.904000  - symbol: Br # 19    coordinates: [  0.598041090000000,  0.286763650000000,  0.311277440000000 ]    mass: 79.904000  - symbol: Br # 20    coordinates: [  0.401958910000000,  0.713236350000000,  0.688722560000000 ]    mass: 79.904000  - symbol: Br # 21    coordinates: [  0.975486210000000,  0.286763650000000,  0.688722560000000 ]    mass: 79.904000  - symbol: O  # 22    coordinates: [  0.148941020000000,  0.191492840000000,  0.340433860000000 ]    mass: 15.999400  - symbol: O  # 23    coordinates: [  0.148941020000000,  0.808507160000000,  0.957448180000000 ]    mass: 15.999400  - symbol: O  # 24    coordinates: [  0.851058980000000,  0.808507160000000,  0.659566140000000 ]    mass: 15.999400  - symbol: O  # 25    coordinates: [  0.851058980000000,  0.191492840000000,  0.042551820000000 ]    mass: 15.999400  - symbol: O  # 26    coordinates: [  0.806627940000000,  0.806627940000000,  0.000000000000000 ]    mass: 15.999400  - symbol: O  # 27    coordinates: [  0.193372060000000,  0.193372060000000,  0.000000000000000 ]    mass: 15.999400  reciprocal_lattice: # without 2pi  - [     0.000000000000000,     0.099605992658686,     0.092979443467729 ] # a*  - [     0.132342427874538,     0.000000000000000,     0.092979443467729 ] # b*  - [     0.132342427874538,     0.099605992658686,     0.000000000000000 ] # c*unit_cell:  lattice:  - [     7.556155770000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    10.039556590000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    10.755065450000000 ] # c  points:  - symbol: Zn # 1    coordinates: [  0.500000000000000,  0.000000000000000,  0.349789540000000 ]    mass: 65.380000    reduced_to: 1  - symbol: Zn # 2    coordinates: [  0.500000000000000,  0.000000000000000,  0.650210460000000 ]    mass: 65.380000    reduced_to: 2  - symbol: Zn # 3    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 65.380000    reduced_to: 3  - symbol: Zn # 4    coordinates: [  0.000000000000000,  0.500000000000000,  0.849789540000000 ]    mass: 65.380000    reduced_to: 1  - symbol: Zn # 5    coordinates: [  0.000000000000000,  0.500000000000000,  0.150210460000000 ]    mass: 65.380000    reduced_to: 2  - symbol: Zn # 6    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 65.380000    reduced_to: 3  - symbol: H  # 7    coordinates: [  0.770702470000000,  0.655589780000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.229297530000000,  0.655589780000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 9    coordinates: [  0.229297530000000,  0.344410220000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 10    coordinates: [  0.770702470000000,  0.344410220000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 11    coordinates: [  0.229297530000000,  0.344410220000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 12    coordinates: [  0.770702470000000,  0.344410220000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 13    coordinates: [  0.770702470000000,  0.655589780000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.229297530000000,  0.655589780000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 14  - symbol: H  # 15    coordinates: [  0.000000000000000,  0.081334650000000,  0.755238290000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 16    coordinates: [  0.000000000000000,  0.081334650000000,  0.244761710000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 17    coordinates: [  0.000000000000000,  0.918665350000000,  0.755238290000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 18    coordinates: [  0.000000000000000,  0.918665350000000,  0.244761710000000 ]    mass: 1.007940    reduced_to: 18  - symbol: H  # 19    coordinates: [  0.270702470000000,  0.155589780000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 20    coordinates: [  0.729297530000000,  0.155589780000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 21    coordinates: [  0.729297530000000,  0.844410220000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 22    coordinates: [  0.270702470000000,  0.844410220000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 23    coordinates: [  0.729297530000000,  0.844410220000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 24    coordinates: [  0.270702470000000,  0.844410220000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 25    coordinates: [  0.270702470000000,  0.155589780000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 26    coordinates: [  0.729297530000000,  0.155589780000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 14  - symbol: H  # 27    coordinates: [  0.500000000000000,  0.581334650000000,  0.255238290000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 28    coordinates: [  0.500000000000000,  0.581334650000000,  0.744761710000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 29    coordinates: [  0.500000000000000,  0.418665350000000,  0.255238290000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 30    coordinates: [  0.500000000000000,  0.418665350000000,  0.744761710000000 ]    mass: 1.007940    reduced_to: 18  - symbol: Br # 31    coordinates: [  0.742864680000000,  0.000000000000000,  0.500000000000000 ]    mass: 79.904000    reduced_to: 31  - symbol: Br # 32    coordinates: [  0.257135320000000,  0.000000000000000,  0.500000000000000 ]    mass: 79.904000    reduced_to: 32  - symbol: Br # 33    coordinates: [  0.500000000000000,  0.811277440000000,  0.213236350000000 ]    mass: 79.904000    reduced_to: 33  - symbol: Br # 34    coordinates: [  0.500000000000000,  0.811277440000000,  0.786763650000000 ]    mass: 79.904000    reduced_to: 34  - symbol: Br # 35    coordinates: [  0.500000000000000,  0.188722560000000,  0.213236350000000 ]    mass: 79.904000    reduced_to: 35  - symbol: Br # 36    coordinates: [  0.500000000000000,  0.188722560000000,  0.786763650000000 ]    mass: 79.904000    reduced_to: 36  - symbol: Br # 37    coordinates: [  0.242864680000000,  0.500000000000000,  0.000000000000000 ]    mass: 79.904000    reduced_to: 31  - symbol: Br # 38    coordinates: [  0.757135320000000,  0.500000000000000,  0.000000000000000 ]    mass: 79.904000    reduced_to: 32  - symbol: Br # 39    coordinates: [  0.000000000000000,  0.311277440000000,  0.713236350000000 ]    mass: 79.904000    reduced_to: 33  - symbol: Br # 40    coordinates: [  0.000000000000000,  0.311277440000000,  0.286763650000000 ]    mass: 79.904000    reduced_to: 34  - symbol: Br # 41    coordinates: [  0.000000000000000,  0.688722560000000,  0.713236350000000 ]    mass: 79.904000    reduced_to: 35  - symbol: Br # 42    coordinates: [  0.000000000000000,  0.688722560000000,  0.286763650000000 ]    mass: 79.904000    reduced_to: 36  - symbol: O  # 43    coordinates: [  0.691492840000000,  0.648941020000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.308507160000000,  0.648941020000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 45    coordinates: [  0.308507160000000,  0.351058980000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.691492840000000,  0.351058980000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 47    coordinates: [  0.000000000000000,  0.000000000000000,  0.806627940000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.000000000000000,  0.000000000000000,  0.193372060000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 49    coordinates: [  0.191492840000000,  0.148941020000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 50    coordinates: [  0.808507160000000,  0.148941020000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 51    coordinates: [  0.808507160000000,  0.851058980000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 52    coordinates: [  0.191492840000000,  0.851058980000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 53    coordinates: [  0.500000000000000,  0.500000000000000,  0.306627940000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 54    coordinates: [  0.500000000000000,  0.500000000000000,  0.693372060000000 ]    mass: 15.999400    reduced_to: 48supercell:  lattice:  - [    15.112311540000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    10.039556590000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    10.755065450000000 ] # c  points:  - symbol: Zn # 1    coordinates: [  0.250000000000000,  0.000000000000000,  0.349789540000000 ]    mass: 65.380000    reduced_to: 1  - symbol: Zn # 2    coordinates: [  0.750000000000000,  0.000000000000000,  0.349789540000000 ]    mass: 65.380000    reduced_to: 1  - symbol: Zn # 3    coordinates: [  0.250000000000000,  0.000000000000000,  0.650210460000000 ]    mass: 65.380000    reduced_to: 3  - symbol: Zn # 4    coordinates: [  0.750000000000000,  0.000000000000000,  0.650210460000000 ]    mass: 65.380000    reduced_to: 3  - symbol: Zn # 5    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 65.380000    reduced_to: 5  - symbol: Zn # 6    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 65.380000    reduced_to: 5  - symbol: Zn # 7    coordinates: [  0.000000000000000,  0.500000000000000,  0.849789540000000 ]    mass: 65.380000    reduced_to: 1  - symbol: Zn # 8    coordinates: [  0.500000000000000,  0.500000000000000,  0.849789540000000 ]    mass: 65.380000    reduced_to: 1  - symbol: Zn # 9    coordinates: [  0.000000000000000,  0.500000000000000,  0.150210460000000 ]    mass: 65.380000    reduced_to: 3  - symbol: Zn # 10    coordinates: [  0.500000000000000,  0.500000000000000,  0.150210460000000 ]    mass: 65.380000    reduced_to: 3  - symbol: Zn # 11    coordinates: [  0.250000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 65.380000    reduced_to: 5  - symbol: Zn # 12    coordinates: [  0.750000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 65.380000    reduced_to: 5  - symbol: H  # 13    coordinates: [  0.385351235000000,  0.655589780000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.885351235000000,  0.655589780000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 15    coordinates: [  0.114648765000000,  0.655589780000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 16    coordinates: [  0.614648765000000,  0.655589780000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 17    coordinates: [  0.114648765000000,  0.344410220000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 18    coordinates: [  0.614648765000000,  0.344410220000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 19    coordinates: [  0.385351235000000,  0.344410220000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 20    coordinates: [  0.885351235000000,  0.344410220000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 21    coordinates: [  0.114648765000000,  0.344410220000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 22    coordinates: [  0.614648765000000,  0.344410220000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 23    coordinates: [  0.385351235000000,  0.344410220000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 23  - symbol: H  # 24    coordinates: [  0.885351235000000,  0.344410220000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 23  - symbol: H  # 25    coordinates: [  0.385351235000000,  0.655589780000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 25  - symbol: H  # 26    coordinates: [  0.885351235000000,  0.655589780000000,  0.573077540000000 ]    mass: 1.007940    reduced_to: 25  - symbol: H  # 27    coordinates: [  0.114648765000000,  0.655589780000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 27  - symbol: H  # 28    coordinates: [  0.614648765000000,  0.655589780000000,  0.426922460000000 ]    mass: 1.007940    reduced_to: 27  - symbol: H  # 29    coordinates: [  0.000000000000000,  0.081334650000000,  0.755238290000000 ]    mass: 1.007940    reduced_to: 29  - symbol: H  # 30    coordinates: [  0.500000000000000,  0.081334650000000,  0.755238290000000 ]    mass: 1.007940    reduced_to: 29  - symbol: H  # 31    coordinates: [  0.000000000000000,  0.081334650000000,  0.244761710000000 ]    mass: 1.007940    reduced_to: 31  - symbol: H  # 32    coordinates: [  0.500000000000000,  0.081334650000000,  0.244761710000000 ]    mass: 1.007940    reduced_to: 31  - symbol: H  # 33    coordinates: [  0.000000000000000,  0.918665350000000,  0.755238290000000 ]    mass: 1.007940    reduced_to: 33  - symbol: H  # 34    coordinates: [  0.500000000000000,  0.918665350000000,  0.755238290000000 ]    mass: 1.007940    reduced_to: 33  - symbol: H  # 35    coordinates: [  0.000000000000000,  0.918665350000000,  0.244761710000000 ]    mass: 1.007940    reduced_to: 35  - symbol: H  # 36    coordinates: [  0.500000000000000,  0.918665350000000,  0.244761710000000 ]    mass: 1.007940    reduced_to: 35  - symbol: H  # 37    coordinates: [  0.135351235000000,  0.155589780000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 38    coordinates: [  0.635351235000000,  0.155589780000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 39    coordinates: [  0.364648765000000,  0.155589780000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 40    coordinates: [  0.864648765000000,  0.155589780000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 41    coordinates: [  0.364648765000000,  0.844410220000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 42    coordinates: [  0.864648765000000,  0.844410220000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 43    coordinates: [  0.135351235000000,  0.844410220000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 44    coordinates: [  0.635351235000000,  0.844410220000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 45    coordinates: [  0.364648765000000,  0.844410220000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 46    coordinates: [  0.864648765000000,  0.844410220000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 21  - symbol: H  # 47    coordinates: [  0.135351235000000,  0.844410220000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 23  - symbol: H  # 48    coordinates: [  0.635351235000000,  0.844410220000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 23  - symbol: H  # 49    coordinates: [  0.135351235000000,  0.155589780000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 25  - symbol: H  # 50    coordinates: [  0.635351235000000,  0.155589780000000,  0.073077540000000 ]    mass: 1.007940    reduced_to: 25  - symbol: H  # 51    coordinates: [  0.364648765000000,  0.155589780000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 27  - symbol: H  # 52    coordinates: [  0.864648765000000,  0.155589780000000,  0.926922460000000 ]    mass: 1.007940    reduced_to: 27  - symbol: H  # 53    coordinates: [  0.250000000000000,  0.581334650000000,  0.255238290000000 ]    mass: 1.007940    reduced_to: 29  - symbol: H  # 54    coordinates: [  0.750000000000000,  0.581334650000000,  0.255238290000000 ]    mass: 1.007940    reduced_to: 29  - symbol: H  # 55    coordinates: [  0.250000000000000,  0.581334650000000,  0.744761710000000 ]    mass: 1.007940    reduced_to: 31  - symbol: H  # 56    coordinates: [  0.750000000000000,  0.581334650000000,  0.744761710000000 ]    mass: 1.007940    reduced_to: 31  - symbol: H  # 57    coordinates: [  0.250000000000000,  0.418665350000000,  0.255238290000000 ]    mass: 1.007940    reduced_to: 33  - symbol: H  # 58    coordinates: [  0.750000000000000,  0.418665350000000,  0.255238290000000 ]    mass: 1.007940    reduced_to: 33  - symbol: H  # 59    coordinates: [  0.250000000000000,  0.418665350000000,  0.744761710000000 ]    mass: 1.007940    reduced_to: 35  - symbol: H  # 60    coordinates: [  0.750000000000000,  0.418665350000000,  0.744761710000000 ]    mass: 1.007940    reduced_to: 35  - symbol: Br # 61    coordinates: [  0.371432340000000,  0.000000000000000,  0.500000000000000 ]    mass: 79.904000    reduced_to: 61  - symbol: Br # 62    coordinates: [  0.871432340000000,  0.000000000000000,  0.500000000000000 ]    mass: 79.904000    reduced_to: 61  - symbol: Br # 63    coordinates: [  0.128567660000000,  0.000000000000000,  0.500000000000000 ]    mass: 79.904000    reduced_to: 63  - symbol: Br # 64    coordinates: [  0.628567660000000,  0.000000000000000,  0.500000000000000 ]    mass: 79.904000    reduced_to: 63  - symbol: Br # 65    coordinates: [  0.250000000000000,  0.811277440000000,  0.213236350000000 ]    mass: 79.904000    reduced_to: 65  - symbol: Br # 66    coordinates: [  0.750000000000000,  0.811277440000000,  0.213236350000000 ]    mass: 79.904000    reduced_to: 65  - symbol: Br # 67    coordinates: [  0.250000000000000,  0.811277440000000,  0.786763650000000 ]    mass: 79.904000    reduced_to: 67  - symbol: Br # 68    coordinates: [  0.750000000000000,  0.811277440000000,  0.786763650000000 ]    mass: 79.904000    reduced_to: 67  - symbol: Br # 69    coordinates: [  0.250000000000000,  0.188722560000000,  0.213236350000000 ]    mass: 79.904000    reduced_to: 69  - symbol: Br # 70    coordinates: [  0.750000000000000,  0.188722560000000,  0.213236350000000 ]    mass: 79.904000    reduced_to: 69  - symbol: Br # 71    coordinates: [  0.250000000000000,  0.188722560000000,  0.786763650000000 ]    mass: 79.904000    reduced_to: 71  - symbol: Br # 72    coordinates: [  0.750000000000000,  0.188722560000000,  0.786763650000000 ]    mass: 79.904000    reduced_to: 71  - symbol: Br # 73    coordinates: [  0.121432340000000,  0.500000000000000,  0.000000000000000 ]    mass: 79.904000    reduced_to: 61  - symbol: Br # 74    coordinates: [  0.621432340000000,  0.500000000000000,  0.000000000000000 ]    mass: 79.904000    reduced_to: 61  - symbol: Br # 75    coordinates: [  0.378567660000000,  0.500000000000000,  0.000000000000000 ]    mass: 79.904000    reduced_to: 63  - symbol: Br # 76    coordinates: [  0.878567660000000,  0.500000000000000,  0.000000000000000 ]    mass: 79.904000    reduced_to: 63  - symbol: Br # 77    coordinates: [  0.000000000000000,  0.311277440000000,  0.713236350000000 ]    mass: 79.904000    reduced_to: 65  - symbol: Br # 78    coordinates: [  0.500000000000000,  0.311277440000000,  0.713236350000000 ]    mass: 79.904000    reduced_to: 65  - symbol: Br # 79    coordinates: [  0.000000000000000,  0.311277440000000,  0.286763650000000 ]    mass: 79.904000    reduced_to: 67  - symbol: Br # 80    coordinates: [  0.500000000000000,  0.311277440000000,  0.286763650000000 ]    mass: 79.904000    reduced_to: 67  - symbol: Br # 81    coordinates: [  0.000000000000000,  0.688722560000000,  0.713236350000000 ]    mass: 79.904000    reduced_to: 69  - symbol: Br # 82    coordinates: [  0.500000000000000,  0.688722560000000,  0.713236350000000 ]    mass: 79.904000    reduced_to: 69  - symbol: Br # 83    coordinates: [  0.000000000000000,  0.688722560000000,  0.286763650000000 ]    mass: 79.904000    reduced_to: 71  - symbol: Br # 84    coordinates: [  0.500000000000000,  0.688722560000000,  0.286763650000000 ]    mass: 79.904000    reduced_to: 71  - symbol: O  # 85    coordinates: [  0.345746420000000,  0.648941020000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 85  - symbol: O  # 86    coordinates: [  0.845746420000000,  0.648941020000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 85  - symbol: O  # 87    coordinates: [  0.154253580000000,  0.648941020000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 87  - symbol: O  # 88    coordinates: [  0.654253580000000,  0.648941020000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 87  - symbol: O  # 89    coordinates: [  0.154253580000000,  0.351058980000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 89  - symbol: O  # 90    coordinates: [  0.654253580000000,  0.351058980000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 89  - symbol: O  # 91    coordinates: [  0.345746420000000,  0.351058980000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 91  - symbol: O  # 92    coordinates: [  0.845746420000000,  0.351058980000000,  0.500000000000000 ]    mass: 15.999400    reduced_to: 91  - symbol: O  # 93    coordinates: [  0.000000000000000,  0.000000000000000,  0.806627940000000 ]    mass: 15.999400    reduced_to: 93  - symbol: O  # 94    coordinates: [  0.500000000000000,  0.000000000000000,  0.806627940000000 ]    mass: 15.999400    reduced_to: 93  - symbol: O  # 95    coordinates: [  0.000000000000000,  0.000000000000000,  0.193372060000000 ]    mass: 15.999400    reduced_to: 95  - symbol: O  # 96    coordinates: [  0.500000000000000,  0.000000000000000,  0.193372060000000 ]    mass: 15.999400    reduced_to: 95  - symbol: O  # 97    coordinates: [  0.095746420000000,  0.148941020000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 85  - symbol: O  # 98    coordinates: [  0.595746420000000,  0.148941020000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 85  - symbol: O  # 99    coordinates: [  0.404253580000000,  0.148941020000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 87  - symbol: O  # 100    coordinates: [  0.904253580000000,  0.148941020000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 87  - symbol: O  # 101    coordinates: [  0.404253580000000,  0.851058980000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 89  - symbol: O  # 102    coordinates: [  0.904253580000000,  0.851058980000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 89  - symbol: O  # 103    coordinates: [  0.095746420000000,  0.851058980000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 91  - symbol: O  # 104    coordinates: [  0.595746420000000,  0.851058980000000,  0.000000000000000 ]    mass: 15.999400    reduced_to: 91  - symbol: O  # 105    coordinates: [  0.250000000000000,  0.500000000000000,  0.306627940000000 ]    mass: 15.999400    reduced_to: 93  - symbol: O  # 106    coordinates: [  0.750000000000000,  0.500000000000000,  0.306627940000000 ]    mass: 15.999400    reduced_to: 93  - symbol: O  # 107    coordinates: [  0.250000000000000,  0.500000000000000,  0.693372060000000 ]    mass: 15.999400    reduced_to: 95  - symbol: O  # 108    coordinates: [  0.750000000000000,  0.500000000000000,  0.693372060000000 ]    mass: 15.999400    reduced_to: 95displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0480198600000000,  0.0000000000000000, -0.0000485000000000 ]  - [   0.0012808800000000,  0.0000000000000000,  0.0009888800000000 ]  - [  -0.0147675600000000,  0.0000000000000000, -0.0010009200000000 ]  - [   0.0011944500000000,  0.0000000000000000, -0.0009895700000000 ]  - [  -0.0000685400000000,  0.0000000000000000,  0.0003956800000000 ]  - [  -0.0000686000000000,  0.0000000000000000, -0.0004073600000000 ]  - [  -0.0002298600000000,  0.0000000000000000,  0.0002354100000000 ]  - [  -0.0002315100000000,  0.0000000000000000,  0.0017404600000000 ]  - [  -0.0002672500000000,  0.0000000000000000, -0.0001657800000000 ]  - [  -0.0002697500000000,  0.0000000000000000, -0.0018158000000000 ]  - [  -0.0027713400000000,  0.0000000000000000, -0.0000026700000000 ]  - [   0.0011176700000000,  0.0000000000000000,  0.0000010100000000 ]  - [   0.0000795900000000, -0.0006693900000000,  0.0005684200000000 ]  - [   0.0001831300000000, -0.0000661700000000,  0.0006427200000000 ]  - [   0.0001626200000000,  0.0003477400000000, -0.0010373900000000 ]  - [   0.0002863200000000, -0.0000973700000000, -0.0008983600000000 ]  - [   0.0002049100000000, -0.0005110100000000,  0.0009982800000000 ]  - [   0.0003073800000000,  0.0000907800000000,  0.0009242600000000 ]  - [   0.0000401600000000,  0.0005049700000000, -0.0005266500000000 ]  - [   0.0001636300000000,  0.0000594200000000, -0.0006652600000000 ]  - [   0.0001626200000000, -0.0003477400000000, -0.0010373900000000 ]  - [   0.0002863200000000,  0.0000973700000000, -0.0008983600000000 ]  - [   0.0000795900000000,  0.0006693900000000,  0.0005684200000000 ]  - [   0.0001831300000000,  0.0000661700000000,  0.0006427200000000 ]  - [   0.0000401600000000, -0.0005049700000000, -0.0005266500000000 ]  - [   0.0001636300000000, -0.0000594200000000, -0.0006652600000000 ]  - [   0.0002049100000000,  0.0005110100000000,  0.0009982800000000 ]  - [   0.0003073800000000, -0.0000907800000000,  0.0009242600000000 ]  - [   0.0005930100000000, -0.0003682800000000,  0.0004075300000000 ]  - [   0.0005916800000000,  0.0006511400000000,  0.0013734800000000 ]  - [   0.0008919500000000, -0.0005216300000000, -0.0006829900000000 ]  - [   0.0009001300000000,  0.0008194000000000, -0.0010942500000000 ]  - [   0.0005930100000000,  0.0003682800000000,  0.0004075300000000 ]  - [   0.0005916800000000, -0.0006511400000000,  0.0013734800000000 ]  - [   0.0008919500000000,  0.0005216300000000, -0.0006829900000000 ]  - [   0.0009001300000000, -0.0008194000000000, -0.0010942500000000 ]  - [  -0.0004608300000000, -0.0001960800000000,  0.0009185400000000 ]  - [   0.0002283000000000, -0.0000672200000000,  0.0006253100000000 ]  - [  -0.0006855100000000,  0.0006692700000000, -0.0006009200000000 ]  - [   0.0003780300000000, -0.0001166400000000, -0.0009197100000000 ]  - [  -0.0003364600000000, -0.0000387500000000,  0.0006496600000000 ]  - [   0.0003505200000000,  0.0000899900000000,  0.0009384200000000 ]  - [  -0.0008033800000000,  0.0008249100000000, -0.0009663300000000 ]  - [   0.0002560800000000,  0.0000397400000000, -0.0006444900000000 ]  - [  -0.0006855100000000, -0.0006692700000000, -0.0006009200000000 ]  - [   0.0003780300000000,  0.0001166400000000, -0.0009197100000000 ]  - [  -0.0004608300000000,  0.0001960800000000,  0.0009185400000000 ]  - [   0.0002283000000000,  0.0000672200000000,  0.0006253100000000 ]  - [  -0.0008033800000000, -0.0008249100000000, -0.0009663300000000 ]  - [   0.0002560800000000, -0.0000397400000000, -0.0006444900000000 ]  - [  -0.0003364600000000,  0.0000387500000000,  0.0006496600000000 ]  - [   0.0003505200000000, -0.0000899900000000,  0.0009384200000000 ]  - [   0.0003150700000000,  0.0001485000000000,  0.0008884800000000 ]  - [   0.0001782000000000,  0.0001432500000000,  0.0008912500000000 ]  - [  -0.0001223700000000,  0.0001430800000000, -0.0008904900000000 ]  - [   0.0001725100000000,  0.0001445800000000, -0.0008897300000000 ]  - [   0.0003150700000000, -0.0001485000000000,  0.0008884800000000 ]  - [   0.0001782000000000, -0.0001432500000000,  0.0008912500000000 ]  - [  -0.0001223700000000, -0.0001430800000000, -0.0008904900000000 ]  - [   0.0001725100000000, -0.0001445800000000, -0.0008897300000000 ]  - [   0.0126546800000000,  0.0000000000000000,  0.0138304800000000 ]  - [  -0.0154422000000000,  0.0000000000000000, -0.0000504400000000 ]  - [   0.0405819200000000,  0.0000000000000000, -0.0129482100000000 ]  - [   0.0132869900000000,  0.0000000000000000,  0.0000532700000000 ]  - [   0.0022361700000000,  0.0012629600000000,  0.0001429900000000 ]  - [  -0.0004061100000000,  0.0011478600000000,  0.0000630600000000 ]  - [   0.0017153800000000,  0.0011536900000000, -0.0000687500000000 ]  - [  -0.0003847300000000,  0.0011495700000000, -0.0000640200000000 ]  - [   0.0022361700000000, -0.0012629600000000,  0.0001429900000000 ]  - [  -0.0004061100000000, -0.0011478600000000,  0.0000630600000000 ]  - [   0.0017153800000000, -0.0011536900000000, -0.0000687500000000 ]  - [  -0.0003847300000000, -0.0011495700000000, -0.0000640200000000 ]  - [  -0.0139624800000000,  0.0000000000000000,  0.0000572900000000 ]  - [  -0.0145949200000000,  0.0000000000000000,  0.0000220300000000 ]  - [   0.0147719200000000,  0.0000000000000000, -0.0000635100000000 ]  - [   0.0141361100000000,  0.0000000000000000, -0.0000275600000000 ]  - [  -0.0000653600000000,  0.0014577500000000,  0.0003568700000000 ]  - [  -0.0000656700000000,  0.0008463300000000, -0.0002240000000000 ]  - [  -0.0000573200000000,  0.0015326800000000, -0.0003727100000000 ]  - [  -0.0000580200000000,  0.0007596000000000,  0.0002473100000000 ]  - [  -0.0000653600000000, -0.0014577500000000,  0.0003568700000000 ]  - [  -0.0000656700000000, -0.0008463300000000, -0.0002240000000000 ]  - [  -0.0000573200000000, -0.0015326800000000, -0.0003727100000000 ]  - [  -0.0000580200000000, -0.0007596000000000,  0.0002473100000000 ]  - [   0.0012892700000000,  0.0010425900000000, -0.0001019300000000 ]  - [   0.0002575300000000, -0.0002454900000000,  0.0000143700000000 ]  - [  -0.0001502400000000, -0.0013098400000000,  0.0001028300000000 ]  - [  -0.0011798100000000, -0.0000234600000000, -0.0000154400000000 ]  - [  -0.0001502400000000,  0.0013098400000000,  0.0001028300000000 ]  - [  -0.0011798100000000,  0.0000234600000000, -0.0000154400000000 ]  - [   0.0012892700000000, -0.0010425900000000, -0.0001019300000000 ]  - [   0.0002575300000000,  0.0002454900000000,  0.0000143700000000 ]  - [  -0.0006815200000000,  0.0000000000000000,  0.0010533800000000 ]  - [  -0.0006802200000000,  0.0000000000000000, -0.0010206200000000 ]  - [  -0.0013993400000000,  0.0000000000000000, -0.0010033500000000 ]  - [  -0.0014142300000000,  0.0000000000000000,  0.0009720400000000 ]  - [   0.0016621200000000,  0.0003369600000000,  0.0001561100000000 ]  - [   0.0002535300000000, -0.0002916000000000,  0.0000480500000000 ]  - [   0.0002243300000000, -0.0006070100000000, -0.0001550600000000 ]  - [  -0.0011813500000000,  0.0000212100000000, -0.0000443500000000 ]  - [   0.0002243300000000,  0.0006070100000000, -0.0001550600000000 ]  - [  -0.0011813500000000, -0.0000212100000000, -0.0000443500000000 ]  - [   0.0016621200000000, -0.0003369600000000,  0.0001561100000000 ]  - [   0.0002535300000000,  0.0002916000000000,  0.0000480500000000 ]  - [   0.0002047600000000,  0.0000000000000000,  0.0000207600000000 ]  - [  -0.0003897600000000,  0.0000000000000000,  0.0000160200000000 ]  - [   0.0004765500000000,  0.0000000000000000, -0.0000147600000000 ]  - [  -0.0003757700000000,  0.0000000000000000, -0.0000178500000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000000000000000, -0.0637036400000000,  0.0022357300000000 ]  - [   0.0000000000000000, -0.0002578500000000,  0.0009901600000000 ]  - [   0.0000000000000000, -0.0021291500000000, -0.0010016800000000 ]  - [   0.0000000000000000, -0.0001188300000000, -0.0009894100000000 ]  - [  -0.0000012900000000, -0.0022134400000000,  0.0000008700000000 ]  - [   0.0000012900000000, -0.0022134400000000,  0.0000008700000000 ]  - [   0.0000014000000000,  0.0001751200000000,  0.0009912600000000 ]  - [  -0.0000014000000000,  0.0001751200000000,  0.0009912600000000 ]  - [   0.0000015500000000,  0.0013471500000000, -0.0009912800000000 ]  - [  -0.0000015500000000,  0.0013471500000000, -0.0009912800000000 ]  - [   0.0000000000000000,  0.0031358000000000, -0.0000015100000000 ]  - [   0.0000000000000000,  0.0003999400000000,  0.0000006300000000 ]  - [  -0.0008601900000000,  0.0006178900000000,  0.0004734600000000 ]  - [   0.0001997700000000, -0.0000335100000000,  0.0004699300000000 ]  - [   0.0003519900000000, -0.0003042000000000, -0.0011336800000000 ]  - [   0.0000653100000000, -0.0000795700000000, -0.0008021300000000 ]  - [  -0.0007406000000000,  0.0007794200000000,  0.0010912300000000 ]  - [   0.0003264700000000,  0.0001239800000000,  0.0010988200000000 ]  - [   0.0002293500000000, -0.0001493400000000, -0.0004275000000000 ]  - [  -0.0000607800000000,  0.0000779700000000, -0.0007645100000000 ]  - [  -0.0002293500000000, -0.0001493400000000, -0.0004275000000000 ]  - [   0.0000607800000000,  0.0000779700000000, -0.0007645100000000 ]  - [   0.0007406000000000,  0.0007794200000000,  0.0010912300000000 ]  - [  -0.0003264700000000,  0.0001239800000000,  0.0010988200000000 ]  - [  -0.0003519900000000, -0.0003042000000000, -0.0011336800000000 ]  - [  -0.0000653100000000, -0.0000795700000000, -0.0008021300000000 ]  - [   0.0008601900000000,  0.0006178900000000,  0.0004734600000000 ]  - [  -0.0001997700000000, -0.0000335100000000,  0.0004699300000000 ]  - [  -0.0000226900000000,  0.0000415700000000,  0.0007261200000000 ]  - [   0.0000226900000000,  0.0000415700000000,  0.0007261200000000 ]  - [  -0.0005116100000000, -0.0002289300000000, -0.0008528600000000 ]  - [   0.0005116100000000, -0.0002289300000000, -0.0008528600000000 ]  - [   0.0000239800000000, -0.0002394600000000,  0.0010593200000000 ]  - [  -0.0000239800000000, -0.0002394600000000,  0.0010593200000000 ]  - [   0.0005133200000000, -0.0005144600000000, -0.0009281800000000 ]  - [  -0.0005133200000000, -0.0005144600000000, -0.0009281800000000 ]  - [   0.0001534900000000, -0.0001035400000000,  0.0000502900000000 ]  - [  -0.0000493900000000, -0.0000833300000000,  0.0007314100000000 ]  - [   0.0035984500000000, -0.0011846200000000, -0.0039123200000000 ]  - [   0.0000494200000000, -0.0001243500000000, -0.0007846100000000 ]  - [   0.0002789600000000,  0.0000531300000000,  0.0015172900000000 ]  - [   0.0000748100000000,  0.0000742800000000,  0.0008345100000000 ]  - [   0.0034671800000000, -0.0010288900000000,  0.0023431400000000 ]  - [  -0.0000749200000000,  0.0000334500000000, -0.0007800600000000 ]  - [  -0.0034671800000000, -0.0010288900000000,  0.0023431400000000 ]  - [   0.0000749200000000,  0.0000334500000000, -0.0007800600000000 ]  - [  -0.0002789600000000,  0.0000531300000000,  0.0015172900000000 ]  - [  -0.0000748100000000,  0.0000742800000000,  0.0008345100000000 ]  - [  -0.0035984500000000, -0.0011846200000000, -0.0039123200000000 ]  - [  -0.0000494200000000, -0.0001243500000000, -0.0007846100000000 ]  - [  -0.0001534900000000, -0.0001035400000000,  0.0000502900000000 ]  - [   0.0000493900000000, -0.0000833300000000,  0.0007314100000000 ]  - [   0.0000000000000000,  0.0048632100000000, -0.0006808700000000 ]  - [   0.0000000000000000,  0.0002119800000000,  0.0009042300000000 ]  - [   0.0000000000000000,  0.0004313400000000, -0.0009343900000000 ]  - [   0.0000000000000000,  0.0001782600000000, -0.0009071300000000 ]  - [   0.0000000000000000,  0.0045606000000000,  0.0024455900000000 ]  - [   0.0000000000000000, -0.0000735000000000,  0.0008807100000000 ]  - [   0.0000000000000000,  0.0001452600000000, -0.0008486200000000 ]  - [   0.0000000000000000, -0.0001077300000000, -0.0008762100000000 ]  - [  -0.0144623600000000,  0.0014772100000000, -0.0000710500000000 ]  - [  -0.0143642500000000,  0.0000452200000000, -0.0000008000000000 ]  - [   0.0144623600000000,  0.0014772100000000, -0.0000710500000000 ]  - [   0.0143642500000000,  0.0000452200000000, -0.0000008000000000 ]  - [   0.0000000000000000,  0.0306860600000000,  0.0206838700000000 ]  - [   0.0000000000000000,  0.0012538800000000,  0.0001020100000000 ]  - [   0.0000000000000000,  0.0015908700000000, -0.0006067600000000 ]  - [   0.0000000000000000,  0.0011872400000000, -0.0001098200000000 ]  - [   0.0000000000000000,  0.0295400700000000, -0.0216714100000000 ]  - [   0.0000000000000000, -0.0010430000000000,  0.0000234000000000 ]  - [   0.0000000000000000, -0.0007026200000000,  0.0004869100000000 ]  - [   0.0000000000000000, -0.0011076000000000, -0.0000122200000000 ]  - [  -0.0143653500000000, -0.0001477300000000,  0.0000003400000000 ]  - [  -0.0143632200000000, -0.0000980600000000,  0.0000008900000000 ]  - [   0.0143653500000000, -0.0001477300000000,  0.0000003400000000 ]  - [   0.0143632200000000, -0.0000980600000000,  0.0000008900000000 ]  - [   0.0001312600000000,  0.0011053700000000, -0.0000598300000000 ]  - [  -0.0001312600000000,  0.0011053700000000, -0.0000598300000000 ]  - [   0.0005687200000000,  0.0005318600000000,  0.0000708000000000 ]  - [  -0.0005687200000000,  0.0005318600000000,  0.0000708000000000 ]  - [  -0.0001299100000000, -0.0011907800000000,  0.0001820200000000 ]  - [   0.0001299100000000, -0.0011907800000000,  0.0001820200000000 ]  - [  -0.0005658300000000, -0.0017625600000000, -0.0001921600000000 ]  - [   0.0005658300000000, -0.0017625600000000, -0.0001921600000000 ]  - [   0.0012705100000000, -0.0010960800000000,  0.0008685500000000 ]  - [   0.0005324200000000, -0.0002280500000000,  0.0002189900000000 ]  - [  -0.0012705100000000, -0.0010960800000000,  0.0008685500000000 ]  - [  -0.0005324200000000, -0.0002280500000000,  0.0002189900000000 ]  - [  -0.0001556700000000, -0.0008357300000000, -0.0008732500000000 ]  - [  -0.0009000300000000,  0.0000372800000000, -0.0002187400000000 ]  - [   0.0001556700000000, -0.0008357300000000, -0.0008732500000000 ]  - [   0.0009000300000000,  0.0000372800000000, -0.0002187400000000 ]  - [  -0.0000009000000000,  0.0004172300000000,  0.0000156100000000 ]  - [   0.0000009000000000,  0.0004172300000000,  0.0000156100000000 ]  - [  -0.0000018800000000,  0.0009409100000000, -0.0000191100000000 ]  - [   0.0000018800000000,  0.0009409100000000, -0.0000191100000000 ]  - [   0.0031499500000000,  0.0011483300000000,  0.0025549800000000 ]  - [   0.0005023100000000, -0.0000854000000000,  0.0000374600000000 ]  - [  -0.0031499500000000,  0.0011483300000000,  0.0025549800000000 ]  - [  -0.0005023100000000, -0.0000854000000000,  0.0000374600000000 ]  - [   0.0017137300000000,  0.0014139800000000, -0.0025520800000000 ]  - [  -0.0009252400000000,  0.0001792400000000, -0.0000360600000000 ]  - [  -0.0017137300000000,  0.0014139800000000, -0.0025520800000000 ]  - [   0.0009252400000000,  0.0001792400000000, -0.0000360600000000 ]  - [   0.0000000000000000, -0.0058393900000000,  0.0000295900000000 ]  - [   0.0000000000000000, -0.0001707000000000,  0.0000160500000000 ]  - [   0.0000000000000000, -0.0006083200000000, -0.0000166600000000 ]  - [   0.0000000000000000, -0.0000992900000000, -0.0000163200000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0825027300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001488900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0120931500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001928100000000 ]  - [   0.0017645000000000,  0.0000000000000000,  0.0012228200000000 ]  - [  -0.0017645000000000,  0.0000000000000000,  0.0012228200000000 ]  - [   0.0007526100000000,  0.0000000000000000,  0.0023466900000000 ]  - [  -0.0007526100000000,  0.0000000000000000,  0.0023466900000000 ]  - [   0.0008252900000000,  0.0000000000000000, -0.0010121100000000 ]  - [  -0.0008252900000000,  0.0000000000000000, -0.0010121100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034136500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001848000000000 ]  - [  -0.0002784700000000, -0.0004211500000000, -0.0001686000000000 ]  - [   0.0002095600000000, -0.0001249500000000,  0.0004140800000000 ]  - [  -0.0001013700000000, -0.0005829900000000, -0.0007338600000000 ]  - [   0.0001524100000000, -0.0001468100000000, -0.0008955000000000 ]  - [   0.0002784700000000,  0.0004211500000000, -0.0001686000000000 ]  - [  -0.0002095600000000,  0.0001249500000000,  0.0004140800000000 ]  - [   0.0001013700000000,  0.0005829900000000, -0.0007338600000000 ]  - [  -0.0001524100000000,  0.0001468100000000, -0.0008955000000000 ]  - [  -0.0001013700000000,  0.0005829900000000, -0.0007338600000000 ]  - [   0.0001524100000000,  0.0001468100000000, -0.0008955000000000 ]  - [  -0.0002784700000000,  0.0004211500000000, -0.0001686000000000 ]  - [   0.0002095600000000,  0.0001249500000000,  0.0004140800000000 ]  - [   0.0001013700000000, -0.0005829900000000, -0.0007338600000000 ]  - [  -0.0001524100000000, -0.0001468100000000, -0.0008955000000000 ]  - [   0.0002784700000000, -0.0004211500000000, -0.0001686000000000 ]  - [  -0.0002095600000000, -0.0001249500000000,  0.0004140800000000 ]  - [  -0.0004296700000000,  0.0005276600000000,  0.0013527600000000 ]  - [   0.0004296700000000,  0.0005276600000000,  0.0013527600000000 ]  - [   0.0002702400000000,  0.0002216000000000, -0.0015145900000000 ]  - [  -0.0002702400000000,  0.0002216000000000, -0.0015145900000000 ]  - [  -0.0004296700000000, -0.0005276600000000,  0.0013527600000000 ]  - [   0.0004296700000000, -0.0005276600000000,  0.0013527600000000 ]  - [   0.0002702400000000, -0.0002216000000000, -0.0015145900000000 ]  - [  -0.0002702400000000, -0.0002216000000000, -0.0015145900000000 ]  - [  -0.0009856800000000, -0.0003247700000000,  0.0021926000000000 ]  - [  -0.0001291700000000, -0.0000715300000000,  0.0009979300000000 ]  - [  -0.0021439700000000, -0.0001896500000000,  0.0017646200000000 ]  - [   0.0001737500000000, -0.0001067300000000, -0.0008162100000000 ]  - [   0.0009856800000000,  0.0003247700000000,  0.0021926000000000 ]  - [   0.0001291700000000,  0.0000715300000000,  0.0009979300000000 ]  - [   0.0021439700000000,  0.0001896500000000,  0.0017646200000000 ]  - [  -0.0001737500000000,  0.0001067300000000, -0.0008162100000000 ]  - [  -0.0021439700000000,  0.0001896500000000,  0.0017646200000000 ]  - [   0.0001737500000000,  0.0001067300000000, -0.0008162100000000 ]  - [  -0.0009856800000000,  0.0003247700000000,  0.0021926000000000 ]  - [  -0.0001291700000000,  0.0000715300000000,  0.0009979300000000 ]  - [   0.0021439700000000, -0.0001896500000000,  0.0017646200000000 ]  - [  -0.0001737500000000, -0.0001067300000000, -0.0008162100000000 ]  - [   0.0009856800000000, -0.0003247700000000,  0.0021926000000000 ]  - [   0.0001291700000000, -0.0000715300000000,  0.0009979300000000 ]  - [   0.0000000000000000,  0.0042340000000000, -0.0000106800000000 ]  - [   0.0000000000000000,  0.0000781700000000,  0.0009148400000000 ]  - [   0.0000000000000000, -0.0003532300000000, -0.0008656800000000 ]  - [   0.0000000000000000,  0.0000715700000000, -0.0008637000000000 ]  - [   0.0000000000000000, -0.0042340000000000, -0.0000106800000000 ]  - [   0.0000000000000000, -0.0000781700000000,  0.0009148400000000 ]  - [   0.0000000000000000,  0.0003532300000000, -0.0008656800000000 ]  - [   0.0000000000000000, -0.0000715700000000, -0.0008637000000000 ]  - [   0.0065550800000000,  0.0000000000000000,  0.0168411600000000 ]  - [  -0.0141559700000000,  0.0000000000000000,  0.0001318000000000 ]  - [  -0.0065550800000000,  0.0000000000000000,  0.0168411600000000 ]  - [   0.0141559700000000,  0.0000000000000000,  0.0001318000000000 ]  - [   0.0000000000000000,  0.0236327100000000,  0.0184950600000000 ]  - [   0.0000000000000000,  0.0013319900000000,  0.0003271900000000 ]  - [   0.0000000000000000,  0.0023681200000000, -0.0024773600000000 ]  - [   0.0000000000000000,  0.0012757700000000, -0.0003279300000000 ]  - [   0.0000000000000000, -0.0236327100000000,  0.0184950600000000 ]  - [   0.0000000000000000, -0.0013319900000000,  0.0003271900000000 ]  - [   0.0000000000000000, -0.0023681200000000, -0.0024773600000000 ]  - [   0.0000000000000000, -0.0012757700000000, -0.0003279300000000 ]  - [  -0.0152058100000000,  0.0000000000000000, -0.0006639800000000 ]  - [  -0.0141215400000000,  0.0000000000000000, -0.0002574800000000 ]  - [   0.0152058100000000,  0.0000000000000000, -0.0006639800000000 ]  - [   0.0141215400000000,  0.0000000000000000, -0.0002574800000000 ]  - [  -0.0000264200000000,  0.0007587300000000, -0.0003322100000000 ]  - [   0.0000264200000000,  0.0007587300000000, -0.0003322100000000 ]  - [  -0.0004639700000000,  0.0011259800000000,  0.0003391400000000 ]  - [   0.0004639700000000,  0.0011259800000000,  0.0003391400000000 ]  - [  -0.0000264200000000, -0.0007587300000000, -0.0003322100000000 ]  - [   0.0000264200000000, -0.0007587300000000, -0.0003322100000000 ]  - [  -0.0004639700000000, -0.0011259800000000,  0.0003391400000000 ]  - [   0.0004639700000000, -0.0011259800000000,  0.0003391400000000 ]  - [   0.0010329900000000,  0.0011101000000000,  0.0010585400000000 ]  - [   0.0006017300000000, -0.0000343900000000,  0.0003323200000000 ]  - [  -0.0010329900000000,  0.0011101000000000,  0.0010585400000000 ]  - [  -0.0006017300000000, -0.0000343900000000,  0.0003323200000000 ]  - [  -0.0010329900000000, -0.0011101000000000,  0.0010585400000000 ]  - [  -0.0006017300000000,  0.0000343900000000,  0.0003323200000000 ]  - [   0.0010329900000000, -0.0011101000000000,  0.0010585400000000 ]  - [   0.0006017300000000,  0.0000343900000000,  0.0003323200000000 ]  - [   0.0003736500000000,  0.0000000000000000, -0.0012089000000000 ]  - [  -0.0003736500000000,  0.0000000000000000, -0.0012089000000000 ]  - [  -0.0010304700000000,  0.0000000000000000,  0.0005746300000000 ]  - [   0.0010304700000000,  0.0000000000000000,  0.0005746300000000 ]  - [  -0.0003614300000000, -0.0001696000000000, -0.0025445200000000 ]  - [   0.0010130000000000, -0.0000874900000000, -0.0002332800000000 ]  - [   0.0003614300000000, -0.0001696000000000, -0.0025445200000000 ]  - [  -0.0010130000000000, -0.0000874900000000, -0.0002332800000000 ]  - [   0.0003614300000000,  0.0001696000000000, -0.0025445200000000 ]  - [  -0.0010130000000000,  0.0000874900000000, -0.0002332800000000 ]  - [  -0.0003614300000000,  0.0001696000000000, -0.0025445200000000 ]  - [   0.0010130000000000,  0.0000874900000000, -0.0002332800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0030589200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000647300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000420100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000015100000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0839158300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0021307300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0139946400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017835400000000 ]  - [  -0.0017699400000000,  0.0000000000000000, -0.0012255100000000 ]  - [   0.0017699400000000,  0.0000000000000000, -0.0012255100000000 ]  - [  -0.0007524300000000,  0.0000000000000000, -0.0003666700000000 ]  - [   0.0007524300000000,  0.0000000000000000, -0.0003666700000000 ]  - [  -0.0008252100000000,  0.0000000000000000, -0.0009645300000000 ]  - [   0.0008252100000000,  0.0000000000000000, -0.0009645300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034160600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001875100000000 ]  - [   0.0001548600000000,  0.0002643200000000,  0.0017353500000000 ]  - [  -0.0003340600000000, -0.0000332400000000,  0.0011542700000000 ]  - [   0.0002236300000000,  0.0004246800000000, -0.0008277000000000 ]  - [  -0.0000282700000000, -0.0000111400000000, -0.0006674100000000 ]  - [  -0.0001548600000000, -0.0002643200000000,  0.0017353500000000 ]  - [   0.0003340600000000,  0.0000332400000000,  0.0011542700000000 ]  - [  -0.0002236300000000, -0.0004246800000000, -0.0008277000000000 ]  - [   0.0000282700000000,  0.0000111400000000, -0.0006674100000000 ]  - [   0.0002236300000000, -0.0004246800000000, -0.0008277000000000 ]  - [  -0.0000282700000000,  0.0000111400000000, -0.0006674100000000 ]  - [   0.0001548600000000, -0.0002643200000000,  0.0017353500000000 ]  - [  -0.0003340600000000,  0.0000332400000000,  0.0011542700000000 ]  - [  -0.0002236300000000,  0.0004246800000000, -0.0008277000000000 ]  - [   0.0000282700000000, -0.0000111400000000, -0.0006674100000000 ]  - [  -0.0001548600000000,  0.0002643200000000,  0.0017353500000000 ]  - [   0.0003340600000000, -0.0000332400000000,  0.0011542700000000 ]  - [   0.0004318700000000, -0.0002465300000000,  0.0004338400000000 ]  - [  -0.0004318700000000, -0.0002465300000000,  0.0004338400000000 ]  - [  -0.0002694300000000,  0.0000678500000000, -0.0002636200000000 ]  - [   0.0002694300000000,  0.0000678500000000, -0.0002636200000000 ]  - [   0.0004318700000000,  0.0002465300000000,  0.0004338400000000 ]  - [  -0.0004318700000000,  0.0002465300000000,  0.0004338400000000 ]  - [  -0.0002694300000000, -0.0000678500000000, -0.0002636200000000 ]  - [   0.0002694300000000, -0.0000678500000000, -0.0002636200000000 ]  - [   0.0008607800000000,  0.0001678400000000, -0.0006244100000000 ]  - [   0.0000064900000000, -0.0000865800000000,  0.0005679300000000 ]  - [   0.0022672600000000,  0.0000415000000000, -0.0033298900000000 ]  - [  -0.0000509900000000, -0.0000511700000000, -0.0007451700000000 ]  - [  -0.0008607800000000, -0.0001678400000000, -0.0006244100000000 ]  - [  -0.0000064900000000,  0.0000865800000000,  0.0005679300000000 ]  - [  -0.0022672600000000, -0.0000415000000000, -0.0033298900000000 ]  - [   0.0000509900000000,  0.0000511700000000, -0.0007451700000000 ]  - [   0.0022672600000000, -0.0000415000000000, -0.0033298900000000 ]  - [  -0.0000509900000000,  0.0000511700000000, -0.0007451700000000 ]  - [   0.0008607800000000, -0.0001678400000000, -0.0006244100000000 ]  - [   0.0000064900000000,  0.0000865800000000,  0.0005679300000000 ]  - [  -0.0022672600000000,  0.0000415000000000, -0.0033298900000000 ]  - [   0.0000509900000000, -0.0000511700000000, -0.0007451700000000 ]  - [  -0.0008607800000000,  0.0001678400000000, -0.0006244100000000 ]  - [  -0.0000064900000000, -0.0000865800000000,  0.0005679300000000 ]  - [   0.0000000000000000, -0.0039530900000000,  0.0017905600000000 ]  - [   0.0000000000000000,  0.0002076300000000,  0.0008721900000000 ]  - [   0.0000000000000000,  0.0006372800000000, -0.0009161500000000 ]  - [   0.0000000000000000,  0.0002153700000000, -0.0009174700000000 ]  - [   0.0000000000000000,  0.0039530900000000,  0.0017905600000000 ]  - [   0.0000000000000000, -0.0002076300000000,  0.0008721900000000 ]  - [   0.0000000000000000, -0.0006372800000000, -0.0009161500000000 ]  - [   0.0000000000000000, -0.0002153700000000, -0.0009174700000000 ]  - [  -0.0344923500000000,  0.0000000000000000, -0.0163844800000000 ]  - [  -0.0145747300000000,  0.0000000000000000, -0.0001299800000000 ]  - [   0.0344923500000000,  0.0000000000000000, -0.0163844800000000 ]  - [   0.0145747300000000,  0.0000000000000000, -0.0001299800000000 ]  - [   0.0000000000000000, -0.0221212200000000, -0.0187013100000000 ]  - [   0.0000000000000000,  0.0009644800000000, -0.0002019600000000 ]  - [   0.0000000000000000, -0.0000686500000000,  0.0023503100000000 ]  - [   0.0000000000000000,  0.0010200800000000,  0.0002075900000000 ]  - [   0.0000000000000000,  0.0221212200000000, -0.0187013100000000 ]  - [   0.0000000000000000, -0.0009644800000000, -0.0002019600000000 ]  - [   0.0000000000000000,  0.0000686500000000,  0.0023503100000000 ]  - [   0.0000000000000000, -0.0010200800000000,  0.0002075900000000 ]  - [  -0.0135295700000000,  0.0000000000000000,  0.0006666400000000 ]  - [  -0.0146130800000000,  0.0000000000000000,  0.0002602300000000 ]  - [   0.0135295700000000,  0.0000000000000000,  0.0006666400000000 ]  - [   0.0146130800000000,  0.0000000000000000,  0.0002602300000000 ]  - [   0.0000273600000000,  0.0015388300000000,  0.0004590400000000 ]  - [  -0.0000273600000000,  0.0015388300000000,  0.0004590400000000 ]  - [   0.0004656000000000,  0.0011698200000000, -0.0004613300000000 ]  - [  -0.0004656000000000,  0.0011698200000000, -0.0004613300000000 ]  - [   0.0000273600000000, -0.0015388300000000,  0.0004590400000000 ]  - [  -0.0000273600000000, -0.0015388300000000,  0.0004590400000000 ]  - [   0.0004656000000000, -0.0011698200000000, -0.0004613300000000 ]  - [  -0.0004656000000000, -0.0011698200000000, -0.0004613300000000 ]  - [   0.0004013100000000, -0.0013789400000000, -0.0010551500000000 ]  - [   0.0008350800000000, -0.0002334900000000, -0.0003301700000000 ]  - [  -0.0004013100000000, -0.0013789400000000, -0.0010551500000000 ]  - [  -0.0008350800000000, -0.0002334900000000, -0.0003301700000000 ]  - [  -0.0004013100000000,  0.0013789400000000, -0.0010551500000000 ]  - [  -0.0008350800000000,  0.0002334900000000, -0.0003301700000000 ]  - [   0.0004013100000000,  0.0013789400000000, -0.0010551500000000 ]  - [   0.0008350800000000,  0.0002334900000000, -0.0003301700000000 ]  - [  -0.0003759700000000,  0.0000000000000000,  0.0012459900000000 ]  - [   0.0003759700000000,  0.0000000000000000,  0.0012459900000000 ]  - [   0.0010325400000000,  0.0000000000000000, -0.0006081900000000 ]  - [  -0.0010325400000000,  0.0000000000000000, -0.0006081900000000 ]  - [   0.0017968200000000, -0.0001021300000000,  0.0025474600000000 ]  - [   0.0004202100000000, -0.0001809800000000,  0.0002370900000000 ]  - [  -0.0017968200000000, -0.0001021300000000,  0.0025474600000000 ]  - [  -0.0004202100000000, -0.0001809800000000,  0.0002370900000000 ]  - [  -0.0017968200000000,  0.0001021300000000,  0.0025474600000000 ]  - [  -0.0004202100000000,  0.0001809800000000,  0.0002370900000000 ]  - [   0.0017968200000000,  0.0001021300000000,  0.0025474600000000 ]  - [   0.0004202100000000,  0.0001809800000000,  0.0002370900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0030187900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000313900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000694400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000273700000000 ]- atom:    5  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000725300000000,  0.0000000000000000,  0.0027607300000000 ]  - [  -0.0000665000000000,  0.0000000000000000, -0.0007734000000000 ]  - [  -0.0000725300000000,  0.0000000000000000, -0.0027607300000000 ]  - [  -0.0000665000000000,  0.0000000000000000,  0.0007734000000000 ]  - [  -0.0951405300000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0030207600000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0027736000000000,  0.0000000000000000,  0.0009868800000000 ]  - [   0.0011152100000000,  0.0000000000000000,  0.0009904500000000 ]  - [  -0.0027736000000000,  0.0000000000000000, -0.0009868800000000 ]  - [   0.0011152100000000,  0.0000000000000000, -0.0009904500000000 ]  - [  -0.0001295100000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0001233500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0005005500000000, -0.0001558800000000,  0.0005516500000000 ]  - [  -0.0006302200000000, -0.0000181100000000,  0.0010489100000000 ]  - [  -0.0005081700000000, -0.0001411900000000, -0.0005138600000000 ]  - [   0.0006251700000000, -0.0000031500000000, -0.0010128200000000 ]  - [  -0.0005081700000000,  0.0001411900000000,  0.0005138600000000 ]  - [   0.0006251700000000,  0.0000031500000000,  0.0010128200000000 ]  - [   0.0005005500000000,  0.0001558800000000, -0.0005516500000000 ]  - [  -0.0006302200000000,  0.0000181100000000, -0.0010489100000000 ]  - [  -0.0005081700000000,  0.0001411900000000, -0.0005138600000000 ]  - [   0.0006251700000000,  0.0000031500000000, -0.0010128200000000 ]  - [   0.0005005500000000,  0.0001558800000000,  0.0005516500000000 ]  - [  -0.0006302200000000,  0.0000181100000000,  0.0010489100000000 ]  - [   0.0005005500000000, -0.0001558800000000, -0.0005516500000000 ]  - [  -0.0006302200000000, -0.0000181100000000, -0.0010489100000000 ]  - [  -0.0005081700000000, -0.0001411900000000,  0.0005138600000000 ]  - [   0.0006251700000000, -0.0000031500000000,  0.0010128200000000 ]  - [  -0.0006554700000000,  0.0001348000000000,  0.0008918700000000 ]  - [   0.0004902600000000,  0.0001457500000000,  0.0008907900000000 ]  - [  -0.0006554700000000,  0.0001348000000000, -0.0008918700000000 ]  - [   0.0004902600000000,  0.0001457500000000, -0.0008907900000000 ]  - [  -0.0006554700000000, -0.0001348000000000,  0.0008918700000000 ]  - [   0.0004902600000000, -0.0001457500000000,  0.0008907900000000 ]  - [  -0.0006554700000000, -0.0001348000000000, -0.0008918700000000 ]  - [   0.0004902600000000, -0.0001457500000000, -0.0008907900000000 ]  - [   0.0041680700000000,  0.0036617300000000, -0.0040177400000000 ]  - [   0.0006493100000000, -0.0001710600000000,  0.0003952600000000 ]  - [   0.0007741900000000,  0.0000126300000000, -0.0011683300000000 ]  - [   0.0042345400000000, -0.0037216100000000, -0.0055733300000000 ]  - [   0.0007741900000000, -0.0000126300000000,  0.0011683300000000 ]  - [   0.0042345400000000,  0.0037216100000000,  0.0055733300000000 ]  - [   0.0041680700000000, -0.0036617300000000,  0.0040177400000000 ]  - [   0.0006493100000000,  0.0001710600000000, -0.0003952600000000 ]  - [   0.0007741900000000, -0.0000126300000000, -0.0011683300000000 ]  - [   0.0042345400000000,  0.0037216100000000, -0.0055733300000000 ]  - [   0.0041680700000000, -0.0036617300000000, -0.0040177400000000 ]  - [   0.0006493100000000,  0.0001710600000000,  0.0003952600000000 ]  - [   0.0041680700000000,  0.0036617300000000,  0.0040177400000000 ]  - [   0.0006493100000000, -0.0001710600000000, -0.0003952600000000 ]  - [   0.0007741900000000,  0.0000126300000000,  0.0011683300000000 ]  - [   0.0042345400000000, -0.0037216100000000,  0.0055733300000000 ]  - [   0.0000123900000000, -0.0006704000000000,  0.0009526800000000 ]  - [   0.0000135700000000,  0.0009588400000000,  0.0008296000000000 ]  - [   0.0000123900000000, -0.0006704000000000, -0.0009526800000000 ]  - [   0.0000135700000000,  0.0009588400000000, -0.0008296000000000 ]  - [   0.0000123900000000,  0.0006704000000000,  0.0009526800000000 ]  - [   0.0000135700000000, -0.0009588400000000,  0.0008296000000000 ]  - [   0.0000123900000000,  0.0006704000000000, -0.0009526800000000 ]  - [   0.0000135700000000, -0.0009588400000000, -0.0008296000000000 ]  - [  -0.0150866700000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0137847400000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0149556700000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0136436500000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0015644500000000,  0.0014247900000000, -0.0015232000000000 ]  - [  -0.0015584800000000,  0.0008724900000000,  0.0016390400000000 ]  - [  -0.0015644500000000,  0.0014247900000000,  0.0015232000000000 ]  - [  -0.0015584800000000,  0.0008724900000000, -0.0016390400000000 ]  - [  -0.0015644500000000, -0.0014247900000000, -0.0015232000000000 ]  - [  -0.0015584800000000, -0.0008724900000000,  0.0016390400000000 ]  - [  -0.0015644500000000, -0.0014247900000000,  0.0015232000000000 ]  - [  -0.0015584800000000, -0.0008724900000000, -0.0016390400000000 ]  - [  -0.0125279400000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0153135200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0134158800000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0162035900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0009901700000000,  0.0011504300000000,  0.0000632600000000 ]  - [  -0.0007055400000000,  0.0011451000000000,  0.0000608100000000 ]  - [   0.0009901700000000,  0.0011504300000000, -0.0000632600000000 ]  - [  -0.0007055400000000,  0.0011451000000000, -0.0000608100000000 ]  - [   0.0009901700000000, -0.0011504300000000,  0.0000632600000000 ]  - [  -0.0007055400000000, -0.0011451000000000,  0.0000608100000000 ]  - [   0.0009901700000000, -0.0011504300000000, -0.0000632600000000 ]  - [  -0.0007055400000000, -0.0011451000000000, -0.0000608100000000 ]  - [   0.0000171600000000, -0.0000675900000000,  0.0000000000000000 ]  - [   0.0014849700000000, -0.0001636100000000,  0.0000000000000000 ]  - [   0.0000642500000000, -0.0001110000000000,  0.0000000000000000 ]  - [  -0.0014095000000000, -0.0002057900000000,  0.0000000000000000 ]  - [   0.0000642500000000,  0.0001110000000000,  0.0000000000000000 ]  - [  -0.0014095000000000,  0.0002057900000000,  0.0000000000000000 ]  - [   0.0000171600000000,  0.0000675900000000,  0.0000000000000000 ]  - [   0.0014849700000000,  0.0001636100000000,  0.0000000000000000 ]  - [   0.0029922500000000,  0.0000000000000000,  0.0001447800000000 ]  - [  -0.0010330900000000,  0.0000000000000000,  0.0000219300000000 ]  - [   0.0029922500000000,  0.0000000000000000, -0.0001447800000000 ]  - [  -0.0010330900000000,  0.0000000000000000, -0.0000219300000000 ]  - [   0.0180591400000000,  0.0130240100000000,  0.0000000000000000 ]  - [  -0.0005581100000000, -0.0002360800000000,  0.0000000000000000 ]  - [  -0.0019854400000000, -0.0000378200000000,  0.0000000000000000 ]  - [   0.0159555700000000, -0.0124183700000000,  0.0000000000000000 ]  - [  -0.0019854400000000,  0.0000378200000000,  0.0000000000000000 ]  - [   0.0159555700000000,  0.0124183700000000,  0.0000000000000000 ]  - [   0.0180591400000000, -0.0130240100000000,  0.0000000000000000 ]  - [  -0.0005581100000000,  0.0002360800000000,  0.0000000000000000 ]  - [  -0.0000132200000000,  0.0000000000000000, -0.0003659400000000 ]  - [  -0.0000150200000000,  0.0000000000000000,  0.0004082900000000 ]  - [  -0.0000132200000000,  0.0000000000000000,  0.0003659400000000 ]  - [  -0.0000150200000000,  0.0000000000000000, -0.0004082900000000 ]- atom:    5  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000033000000000, -0.0022120900000000,  0.0009929100000000 ]  - [   0.0000033000000000, -0.0022120900000000,  0.0009929100000000 ]  - [  -0.0000033000000000, -0.0022120900000000, -0.0009929100000000 ]  - [   0.0000033000000000, -0.0022120900000000, -0.0009929100000000 ]  - [   0.0000000000000000, -0.0916879000000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0009760000000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0031345100000000,  0.0009858200000000 ]  - [   0.0000000000000000,  0.0004018900000000,  0.0009902100000000 ]  - [   0.0000000000000000,  0.0031345100000000, -0.0009858200000000 ]  - [   0.0000000000000000,  0.0004018900000000, -0.0009902100000000 ]  - [   0.0000009200000000,  0.0010640400000000,  0.0000000000000000 ]  - [  -0.0000009200000000,  0.0010640400000000,  0.0000000000000000 ]  - [  -0.0001404100000000, -0.0000166400000000,  0.0007143200000000 ]  - [   0.0002690100000000,  0.0000041400000000,  0.0004737000000000 ]  - [  -0.0002690100000000,  0.0000041400000000, -0.0004737000000000 ]  - [   0.0001404100000000, -0.0000166400000000, -0.0007143200000000 ]  - [   0.0003974100000000,  0.0001616100000000,  0.0010946800000000 ]  - [  -0.0000139700000000,  0.0001413300000000,  0.0008532900000000 ]  - [   0.0000139700000000,  0.0001413300000000, -0.0008532900000000 ]  - [  -0.0003974100000000,  0.0001616100000000, -0.0010946800000000 ]  - [   0.0003974100000000,  0.0001616100000000, -0.0010946800000000 ]  - [  -0.0000139700000000,  0.0001413300000000, -0.0008532900000000 ]  - [   0.0000139700000000,  0.0001413300000000,  0.0008532900000000 ]  - [  -0.0003974100000000,  0.0001616100000000,  0.0010946800000000 ]  - [  -0.0001404100000000, -0.0000166400000000, -0.0007143200000000 ]  - [   0.0002690100000000,  0.0000041400000000, -0.0004737000000000 ]  - [  -0.0002690100000000,  0.0000041400000000,  0.0004737000000000 ]  - [   0.0001404100000000, -0.0000166400000000,  0.0007143200000000 ]  - [   0.0000000000000000, -0.0023673600000000, -0.0032653700000000 ]  - [   0.0000000000000000,  0.0000230500000000,  0.0008594200000000 ]  - [   0.0000000000000000, -0.0023673600000000,  0.0032653700000000 ]  - [   0.0000000000000000,  0.0000230500000000, -0.0008594200000000 ]  - [   0.0000000000000000, -0.0026137500000000,  0.0050296700000000 ]  - [   0.0000000000000000, -0.0002641800000000,  0.0009245000000000 ]  - [   0.0000000000000000, -0.0026137500000000, -0.0050296700000000 ]  - [   0.0000000000000000, -0.0002641800000000, -0.0009245000000000 ]  - [   0.0021026900000000,  0.0003367200000000, -0.0040452700000000 ]  - [  -0.0003912900000000, -0.0001617700000000,  0.0010314500000000 ]  - [   0.0003912900000000, -0.0001617700000000, -0.0010314500000000 ]  - [  -0.0021026900000000,  0.0003367200000000,  0.0040452700000000 ]  - [  -0.0002663200000000, -0.0000035700000000,  0.0005342000000000 ]  - [   0.0021976700000000,  0.0004735400000000,  0.0056014400000000 ]  - [  -0.0021976700000000,  0.0004735400000000, -0.0056014400000000 ]  - [   0.0002663200000000, -0.0000035700000000, -0.0005342000000000 ]  - [  -0.0002663200000000, -0.0000035700000000, -0.0005342000000000 ]  - [   0.0021976700000000,  0.0004735400000000, -0.0056014400000000 ]  - [  -0.0021976700000000,  0.0004735400000000,  0.0056014400000000 ]  - [   0.0002663200000000, -0.0000035700000000,  0.0005342000000000 ]  - [   0.0021026900000000,  0.0003367200000000,  0.0040452700000000 ]  - [  -0.0003912900000000, -0.0001617700000000, -0.0010314500000000 ]  - [   0.0003912900000000, -0.0001617700000000,  0.0010314500000000 ]  - [  -0.0021026900000000,  0.0003367200000000, -0.0040452700000000 ]  - [  -0.0000231100000000,  0.0006746200000000,  0.0008293000000000 ]  - [   0.0000231100000000,  0.0006746200000000,  0.0008293000000000 ]  - [  -0.0000231100000000,  0.0006746200000000, -0.0008293000000000 ]  - [   0.0000231100000000,  0.0006746200000000, -0.0008293000000000 ]  - [   0.0000237600000000,  0.0003870700000000,  0.0009555600000000 ]  - [  -0.0000237600000000,  0.0003870700000000,  0.0009555600000000 ]  - [   0.0000237600000000,  0.0003870700000000, -0.0009555600000000 ]  - [  -0.0000237600000000,  0.0003870700000000, -0.0009555600000000 ]  - [  -0.0143665900000000,  0.0004176800000000,  0.0000000000000000 ]  - [  -0.0143703800000000,  0.0002932600000000,  0.0000000000000000 ]  - [   0.0143703800000000,  0.0002932600000000,  0.0000000000000000 ]  - [   0.0143665900000000,  0.0004176800000000,  0.0000000000000000 ]  - [   0.0014921600000000,  0.0017068800000000,  0.0017406400000000 ]  - [  -0.0014921600000000,  0.0017068800000000,  0.0017406400000000 ]  - [   0.0014921600000000,  0.0017068800000000, -0.0017406400000000 ]  - [  -0.0014921600000000,  0.0017068800000000, -0.0017406400000000 ]  - [  -0.0014966900000000, -0.0005839700000000, -0.0016250900000000 ]  - [   0.0014966900000000, -0.0005839700000000, -0.0016250900000000 ]  - [  -0.0014966900000000, -0.0005839700000000,  0.0016250900000000 ]  - [   0.0014966900000000, -0.0005839700000000,  0.0016250900000000 ]  - [  -0.0143682900000000, -0.0008631800000000,  0.0000000000000000 ]  - [  -0.0143657900000000, -0.0000595000000000,  0.0000000000000000 ]  - [   0.0143657900000000, -0.0000595000000000,  0.0000000000000000 ]  - [   0.0143682900000000, -0.0008631800000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0002213300000000,  0.0004892800000000 ]  - [   0.0000000000000000,  0.0009564200000000,  0.0000036900000000 ]  - [   0.0000000000000000,  0.0002213300000000, -0.0004892800000000 ]  - [   0.0000000000000000,  0.0009564200000000, -0.0000036900000000 ]  - [   0.0000000000000000, -0.0020754500000000, -0.0003552300000000 ]  - [   0.0000000000000000, -0.0013340200000000,  0.0001172300000000 ]  - [   0.0000000000000000, -0.0020754500000000,  0.0003552300000000 ]  - [   0.0000000000000000, -0.0013340200000000, -0.0001172300000000 ]  - [   0.0008020600000000, -0.0003053300000000,  0.0000000000000000 ]  - [   0.0001946200000000, -0.0004728700000000,  0.0000000000000000 ]  - [  -0.0001946200000000, -0.0004728700000000,  0.0000000000000000 ]  - [  -0.0008020600000000, -0.0003053300000000,  0.0000000000000000 ]  - [  -0.0012463200000000, -0.0002063500000000,  0.0000000000000000 ]  - [  -0.0006361800000000, -0.0000392900000000,  0.0000000000000000 ]  - [   0.0006361800000000, -0.0000392900000000,  0.0000000000000000 ]  - [   0.0012463200000000, -0.0002063500000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0100963500000000,  0.0001237200000000 ]  - [   0.0000000000000000,  0.0003180300000000,  0.0000160200000000 ]  - [   0.0000000000000000,  0.0100963500000000, -0.0001237200000000 ]  - [   0.0000000000000000,  0.0003180300000000, -0.0000160200000000 ]  - [   0.0174343000000000,  0.0198463700000000,  0.0000000000000000 ]  - [   0.0011161900000000,  0.0001089800000000,  0.0000000000000000 ]  - [  -0.0011161900000000,  0.0001089800000000,  0.0000000000000000 ]  - [  -0.0174343000000000,  0.0198463700000000,  0.0000000000000000 ]  - [  -0.0003176400000000,  0.0003768500000000,  0.0000000000000000 ]  - [   0.0150169400000000,  0.0194210800000000,  0.0000000000000000 ]  - [  -0.0150169400000000,  0.0194210800000000,  0.0000000000000000 ]  - [   0.0003176400000000,  0.0003768500000000,  0.0000000000000000 ]  - [  -0.0000006100000000, -0.0007811900000000,  0.0000140600000000 ]  - [   0.0000006100000000, -0.0007811900000000,  0.0000140600000000 ]  - [  -0.0000006100000000, -0.0007811900000000, -0.0000140600000000 ]  - [   0.0000006100000000, -0.0007811900000000, -0.0000140600000000 ]- atom:    5  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0004075600000000,  0.0000000000000000,  0.0022131200000000 ]  - [  -0.0004075600000000,  0.0000000000000000,  0.0022131200000000 ]  - [  -0.0003952800000000,  0.0000000000000000,  0.0002412900000000 ]  - [   0.0003952800000000,  0.0000000000000000,  0.0002412900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0980113700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002371400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0024063200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0008058900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044174900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011736000000000 ]  - [   0.0000043100000000,  0.0000000000000000,  0.0007001400000000 ]  - [  -0.0000043100000000,  0.0000000000000000,  0.0007001400000000 ]  - [  -0.0000549100000000, -0.0000929200000000,  0.0008910500000000 ]  - [  -0.0009007600000000, -0.0001137900000000,  0.0017977000000000 ]  - [  -0.0007727400000000, -0.0000441400000000,  0.0002308900000000 ]  - [   0.0000702100000000, -0.0000655700000000, -0.0006737700000000 ]  - [   0.0009007600000000,  0.0001137900000000,  0.0017977000000000 ]  - [   0.0000549100000000,  0.0000929200000000,  0.0008910500000000 ]  - [  -0.0000702100000000,  0.0000655700000000, -0.0006737700000000 ]  - [   0.0007727400000000,  0.0000441400000000,  0.0002308900000000 ]  - [  -0.0007727400000000,  0.0000441400000000,  0.0002308900000000 ]  - [   0.0000702100000000,  0.0000655700000000, -0.0006737700000000 ]  - [  -0.0000549100000000,  0.0000929200000000,  0.0008910500000000 ]  - [  -0.0009007600000000,  0.0001137900000000,  0.0017977000000000 ]  - [  -0.0000702100000000, -0.0000655700000000, -0.0006737700000000 ]  - [   0.0007727400000000, -0.0000441400000000,  0.0002308900000000 ]  - [   0.0009007600000000, -0.0001137900000000,  0.0017977000000000 ]  - [   0.0000549100000000, -0.0000929200000000,  0.0008910500000000 ]  - [   0.0000000000000000, -0.0071021700000000,  0.0025609400000000 ]  - [   0.0000000000000000,  0.0001497000000000,  0.0009259300000000 ]  - [   0.0000000000000000,  0.0074331500000000,  0.0008992200000000 ]  - [   0.0000000000000000,  0.0001390800000000, -0.0008580200000000 ]  - [   0.0000000000000000,  0.0071021700000000,  0.0025609400000000 ]  - [   0.0000000000000000, -0.0001497000000000,  0.0009259300000000 ]  - [   0.0000000000000000, -0.0074331500000000,  0.0008992200000000 ]  - [   0.0000000000000000, -0.0001390800000000, -0.0008580200000000 ]  - [  -0.0032127800000000, -0.0042083900000000, -0.0014875700000000 ]  - [   0.0001723100000000, -0.0000423900000000,  0.0004644100000000 ]  - [   0.0002965700000000, -0.0001170400000000, -0.0011010900000000 ]  - [  -0.0031005400000000,  0.0040514100000000, -0.0030941800000000 ]  - [  -0.0001723100000000,  0.0000423900000000,  0.0004644100000000 ]  - [   0.0032127800000000,  0.0042083900000000, -0.0014875700000000 ]  - [   0.0031005400000000, -0.0040514100000000, -0.0030941800000000 ]  - [  -0.0002965700000000,  0.0001170400000000, -0.0011010900000000 ]  - [   0.0002965700000000,  0.0001170400000000, -0.0011010900000000 ]  - [  -0.0031005400000000, -0.0040514100000000, -0.0030941800000000 ]  - [  -0.0032127800000000,  0.0042083900000000, -0.0014875700000000 ]  - [   0.0001723100000000,  0.0000423900000000,  0.0004644100000000 ]  - [   0.0031005400000000,  0.0040514100000000, -0.0030941800000000 ]  - [  -0.0002965700000000, -0.0001170400000000, -0.0011010900000000 ]  - [  -0.0001723100000000, -0.0000423900000000,  0.0004644100000000 ]  - [   0.0032127800000000, -0.0042083900000000, -0.0014875700000000 ]  - [   0.0000817200000000, -0.0000306800000000,  0.0008411200000000 ]  - [  -0.0000817200000000, -0.0000306800000000,  0.0008411200000000 ]  - [  -0.0000809600000000,  0.0003204100000000, -0.0009426900000000 ]  - [   0.0000809600000000,  0.0003204100000000, -0.0009426900000000 ]  - [   0.0000817200000000,  0.0000306800000000,  0.0008411200000000 ]  - [  -0.0000817200000000,  0.0000306800000000,  0.0008411200000000 ]  - [  -0.0000809600000000, -0.0003204100000000, -0.0009426900000000 ]  - [   0.0000809600000000, -0.0003204100000000, -0.0009426900000000 ]  - [  -0.0143660600000000,  0.0000000000000000, -0.0003057100000000 ]  - [  -0.0143568600000000,  0.0000000000000000, -0.0012423000000000 ]  - [   0.0143568600000000,  0.0000000000000000, -0.0012423000000000 ]  - [   0.0143660600000000,  0.0000000000000000, -0.0003057100000000 ]  - [  -0.0002811500000000,  0.0012523000000000,  0.0001692600000000 ]  - [   0.0002811500000000,  0.0012523000000000,  0.0001692600000000 ]  - [   0.0002836200000000,  0.0010444800000000,  0.0000355100000000 ]  - [  -0.0002836200000000,  0.0010444800000000,  0.0000355100000000 ]  - [  -0.0002811500000000, -0.0012523000000000,  0.0001692600000000 ]  - [   0.0002811500000000, -0.0012523000000000,  0.0001692600000000 ]  - [   0.0002836200000000, -0.0010444800000000,  0.0000355100000000 ]  - [  -0.0002836200000000, -0.0010444800000000,  0.0000355100000000 ]  - [  -0.0143683800000000,  0.0000000000000000,  0.0014029100000000 ]  - [  -0.0143651500000000,  0.0000000000000000,  0.0001217500000000 ]  - [   0.0143651500000000,  0.0000000000000000,  0.0001217500000000 ]  - [   0.0143683800000000,  0.0000000000000000,  0.0014029100000000 ]  - [   0.0000000000000000,  0.0036088800000000,  0.0000818500000000 ]  - [   0.0000000000000000,  0.0011961500000000,  0.0000513500000000 ]  - [   0.0000000000000000, -0.0013432300000000, -0.0000406100000000 ]  - [   0.0000000000000000,  0.0010994000000000, -0.0000724200000000 ]  - [   0.0000000000000000, -0.0036088800000000,  0.0000818500000000 ]  - [   0.0000000000000000, -0.0011961500000000,  0.0000513500000000 ]  - [   0.0000000000000000,  0.0013432300000000, -0.0000406100000000 ]  - [   0.0000000000000000, -0.0010994000000000, -0.0000724200000000 ]  - [   0.0007194900000000, -0.0001371500000000, -0.0002195000000000 ]  - [   0.0007226600000000, -0.0001362900000000, -0.0013986700000000 ]  - [  -0.0007226600000000, -0.0001362900000000, -0.0013986700000000 ]  - [  -0.0007194900000000, -0.0001371500000000, -0.0002195000000000 ]  - [  -0.0007226600000000,  0.0001362900000000, -0.0013986700000000 ]  - [  -0.0007194900000000,  0.0001371500000000, -0.0002195000000000 ]  - [   0.0007194900000000,  0.0001371500000000, -0.0002195000000000 ]  - [   0.0007226600000000,  0.0001362900000000, -0.0013986700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0328502000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000618200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0352097000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000214200000000 ]  - [   0.0006404800000000, -0.0002000900000000,  0.0102027200000000 ]  - [   0.0007190900000000, -0.0001395000000000,  0.0004303800000000 ]  - [  -0.0007190900000000, -0.0001395000000000,  0.0004303800000000 ]  - [  -0.0006404800000000, -0.0002000900000000,  0.0102027200000000 ]  - [  -0.0007190900000000,  0.0001395000000000,  0.0004303800000000 ]  - [  -0.0006404800000000,  0.0002000900000000,  0.0102027200000000 ]  - [   0.0006404800000000,  0.0002000900000000,  0.0102027200000000 ]  - [   0.0007190900000000,  0.0001395000000000,  0.0004303800000000 ]  - [  -0.0002021800000000,  0.0000000000000000, -0.0001423500000000 ]  - [   0.0002021800000000,  0.0000000000000000, -0.0001423500000000 ]  - [   0.0001998000000000,  0.0000000000000000, -0.0001798100000000 ]  - [  -0.0001998000000000,  0.0000000000000000, -0.0001798100000000 ]- atom:   13  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0001416700000000, -0.0008000000000000,  0.0007788100000000 ]  - [   0.0002434600000000,  0.0002695500000000,  0.0012634000000000 ]  - [   0.0001033500000000, -0.0002955500000000, -0.0011514400000000 ]  - [   0.0002254100000000,  0.0000017700000000, -0.0008986800000000 ]  - [   0.0005646000000000, -0.0000765200000000,  0.0000070700000000 ]  - [  -0.0005726900000000,  0.0003357100000000, -0.0008436600000000 ]  - [   0.0002893100000000,  0.0000186200000000,  0.0009204800000000 ]  - [  -0.0004033000000000,  0.0002196300000000,  0.0000584300000000 ]  - [   0.0003191700000000,  0.0000179300000000, -0.0008773500000000 ]  - [  -0.0007499600000000, -0.0035620800000000, -0.0032095600000000 ]  - [   0.0042416200000000,  0.0021711700000000, -0.0031122900000000 ]  - [   0.0007174800000000, -0.0003293500000000,  0.0002360900000000 ]  - [  -0.1623904100000000, -0.0214891000000000,  0.1662961200000000 ]  - [   0.0001235600000000, -0.0000843400000000,  0.0006696400000000 ]  - [   0.0002993600000000, -0.0001350000000000, -0.0010245400000000 ]  - [  -0.0002300000000000,  0.0000301600000000, -0.0000792500000000 ]  - [   0.0002812100000000,  0.0001516500000000,  0.0009152400000000 ]  - [   0.0001492200000000, -0.0000498300000000,  0.0008622900000000 ]  - [  -0.0004774400000000,  0.0002911500000000, -0.0011530700000000 ]  - [   0.0000694500000000,  0.0000822800000000, -0.0006784600000000 ]  - [   0.0002263400000000,  0.0000934300000000, -0.0009702200000000 ]  - [  -0.0000803000000000,  0.0000230000000000, -0.0005706400000000 ]  - [  -0.0008422200000000,  0.0003728000000000,  0.0013673000000000 ]  - [   0.0000973000000000,  0.0000698300000000,  0.0006841300000000 ]  - [  -0.0134085800000000, -0.0024377900000000,  0.0191046600000000 ]  - [   0.0000778100000000, -0.0000796500000000, -0.0006578600000000 ]  - [   0.0005525400000000, -0.0001153100000000,  0.0008494300000000 ]  - [   0.0013470200000000, -0.0001808700000000,  0.0018548000000000 ]  - [   0.0000687000000000,  0.0001505400000000,  0.0008880200000000 ]  - [  -0.0000861500000000,  0.0001571100000000,  0.0008944200000000 ]  - [   0.0000830800000000,  0.0001600500000000, -0.0008871800000000 ]  - [  -0.0000792200000000, -0.0000015500000000, -0.0007264100000000 ]  - [   0.0000842800000000, -0.0001622000000000,  0.0008947800000000 ]  - [  -0.0000839800000000, -0.0002880100000000,  0.0008497000000000 ]  - [   0.0001309300000000, -0.0001711600000000, -0.0008933400000000 ]  - [  -0.0003457600000000,  0.0017127100000000, -0.0009557300000000 ]  - [  -0.0000231300000000, -0.0001015100000000,  0.0007758300000000 ]  - [  -0.0000314800000000, -0.0000980200000000,  0.0006774900000000 ]  - [  -0.0002380100000000, -0.0000964400000000, -0.0006480000000000 ]  - [   0.0002069000000000, -0.0000685200000000, -0.0008827000000000 ]  - [  -0.0001673900000000,  0.0000395000000000,  0.0005381600000000 ]  - [   0.0001364600000000,  0.0000686200000000,  0.0007944600000000 ]  - [   0.0003488900000000,  0.0000932400000000, -0.0004742500000000 ]  - [   0.0003625600000000,  0.0003461500000000, -0.0010281000000000 ]  - [  -0.0007125400000000,  0.0002032200000000, -0.0005346000000000 ]  - [   0.0003209900000000,  0.0000864100000000, -0.0010244300000000 ]  - [   0.0000237100000000,  0.0000960800000000,  0.0007698800000000 ]  - [   0.0000311300000000, -0.0000280000000000,  0.0005307600000000 ]  - [   0.0000255000000000, -0.0001119700000000, -0.0007231000000000 ]  - [   0.0000183500000000, -0.0000607900000000, -0.0007934100000000 ]  - [  -0.0000916000000000, -0.0001207700000000,  0.0006393500000000 ]  - [   0.0001589400000000, -0.0000730300000000,  0.0008273700000000 ]  - [   0.0008826800000000,  0.0001870600000000,  0.0021070100000000 ]  - [   0.0002806900000000,  0.0000854300000000,  0.0008501900000000 ]  - [   0.0002205000000000,  0.0001138200000000, -0.0011470300000000 ]  - [   0.0000537900000000,  0.0001729200000000, -0.0009010200000000 ]  - [  -0.0004511400000000,  0.0005642900000000,  0.0010785700000000 ]  - [   0.0001042600000000, -0.0002337700000000,  0.0008562600000000 ]  - [  -0.0000772700000000, -0.0000433500000000, -0.0010197400000000 ]  - [   0.0000615100000000, -0.0001851100000000, -0.0009362200000000 ]  - [  -0.0142057000000000,  0.0002414900000000,  0.0000657500000000 ]  - [  -0.0145824100000000, -0.0000177300000000, -0.0000733100000000 ]  - [   0.0142722600000000,  0.0000642900000000,  0.0001064200000000 ]  - [   0.0141866700000000, -0.0000215700000000, -0.0001578300000000 ]  - [  -0.0001224100000000,  0.0017325900000000, -0.0004313800000000 ]  - [  -0.0004151600000000,  0.0009352400000000,  0.0000481300000000 ]  - [   0.0000056500000000,  0.0012604800000000,  0.0000670500000000 ]  - [  -0.0000837200000000,  0.0011715000000000, -0.0000257100000000 ]  - [   0.0000988400000000, -0.0011495800000000, -0.0000596700000000 ]  - [  -0.0001188000000000, -0.0011940700000000,  0.0000808100000000 ]  - [   0.0000539000000000, -0.0011086500000000,  0.0000585200000000 ]  - [  -0.0000850300000000, -0.0011590100000000, -0.0000739500000000 ]  - [  -0.0145845700000000, -0.0000038900000000, -0.0000402400000000 ]  - [  -0.0145210100000000,  0.0003352200000000,  0.0011022600000000 ]  - [   0.0149754100000000,  0.0002133500000000,  0.0006813900000000 ]  - [   0.0141145600000000, -0.0000015000000000,  0.0000045700000000 ]  - [  -0.0001690800000000,  0.0011389100000000,  0.0000942400000000 ]  - [   0.0002848900000000,  0.0011809300000000,  0.0002694100000000 ]  - [  -0.0001961100000000,  0.0011320500000000, -0.0000957800000000 ]  - [   0.0003006400000000,  0.0019338100000000, -0.0003750500000000 ]  - [  -0.0002015000000000, -0.0011526500000000,  0.0001044700000000 ]  - [   0.0015166100000000, -0.0010861200000000,  0.0008214100000000 ]  - [  -0.0002490600000000, -0.0011466100000000, -0.0000957900000000 ]  - [  -0.0016162600000000,  0.0000891100000000,  0.0037046200000000 ]  - [   0.1728055800000000,  0.0235611400000000, -0.1870474200000000 ]  - [   0.0003712300000000, -0.0001846400000000, -0.0000327400000000 ]  - [  -0.0007272000000000, -0.0001340300000000,  0.0005350300000000 ]  - [  -0.0013840800000000,  0.0000124600000000, -0.0011017400000000 ]  - [  -0.0011027900000000, -0.0000726800000000,  0.0001005100000000 ]  - [  -0.0007364900000000,  0.0002948700000000, -0.0002110300000000 ]  - [   0.0014844600000000, -0.0012476400000000,  0.0000239000000000 ]  - [   0.0004490000000000,  0.0001902700000000, -0.0000254400000000 ]  - [  -0.0001651800000000,  0.0000199600000000,  0.0000208500000000 ]  - [   0.0001779800000000,  0.0000586400000000,  0.0001901400000000 ]  - [  -0.0002315100000000,  0.0000181800000000, -0.0000286100000000 ]  - [   0.0003015800000000, -0.0010688800000000,  0.0003321900000000 ]  - [   0.0005646400000000, -0.0001065200000000, -0.0000354200000000 ]  - [   0.0006932300000000, -0.0001603000000000,  0.0001674000000000 ]  - [  -0.0003415900000000, -0.0001684300000000,  0.0000994100000000 ]  - [  -0.0009375800000000, -0.0001114800000000,  0.0000347000000000 ]  - [   0.0000090400000000,  0.0000954300000000,  0.0002240200000000 ]  - [  -0.0010234700000000,  0.0000792900000000,  0.0001507900000000 ]  - [   0.0002843700000000,  0.0002100500000000, -0.0002115500000000 ]  - [   0.0005302200000000, -0.0000782500000000,  0.0006100400000000 ]  - [  -0.0008245900000000, -0.0015590800000000, -0.0009762800000000 ]  - [  -0.0003846900000000,  0.0001618000000000, -0.0000004300000000 ]  - [  -0.0004728100000000, -0.0001475400000000,  0.0004376200000000 ]  - [  -0.0001291200000000,  0.0000435400000000, -0.0000742000000000 ]- atom:   13  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0001398500000000,  0.0008040800000000,  0.0012109600000000 ]  - [  -0.0002429500000000, -0.0002640200000000,  0.0007185700000000 ]  - [  -0.0000964500000000,  0.0002891000000000, -0.0008258800000000 ]  - [  -0.0002205600000000, -0.0000009900000000, -0.0010783000000000 ]  - [  -0.0005603800000000,  0.0000773300000000, -0.0000080800000000 ]  - [   0.0005663800000000, -0.0003322400000000,  0.0008302200000000 ]  - [  -0.0002878800000000, -0.0000174400000000,  0.0010551700000000 ]  - [   0.0003952900000000, -0.0002177200000000,  0.0019033600000000 ]  - [  -0.0003132900000000, -0.0000181900000000, -0.0011006700000000 ]  - [   0.0007400800000000,  0.0034992600000000,  0.0012039700000000 ]  - [  -0.0041706900000000, -0.0021304900000000,  0.0032013500000000 ]  - [  -0.0007074800000000,  0.0003207800000000, -0.0002328900000000 ]  - [   0.1654510400000000,  0.0223622300000000, -0.1742324900000000 ]  - [  -0.0002498900000000, -0.0000738700000000,  0.0009000000000000 ]  - [  -0.0001713400000000, -0.0000221800000000, -0.0005390700000000 ]  - [   0.0003543600000000, -0.0001872800000000, -0.0014834400000000 ]  - [  -0.0001520600000000,  0.0000067200000000,  0.0006568800000000 ]  - [  -0.0000281000000000,  0.0002062900000000,  0.0006994300000000 ]  - [   0.0003482800000000, -0.0001236700000000, -0.0004172800000000 ]  - [  -0.0001829700000000,  0.0000753200000000, -0.0008735100000000 ]  - [  -0.0000961600000000,  0.0000663800000000, -0.0006000200000000 ]  - [   0.0001982100000000,  0.0001344000000000, -0.0009867500000000 ]  - [   0.0007115100000000, -0.0002026900000000,  0.0002082100000000 ]  - [  -0.0002108900000000,  0.0000877100000000,  0.0008689600000000 ]  - [   0.0133634900000000,  0.0023471600000000, -0.0210976900000000 ]  - [  -0.0002040000000000, -0.0000783200000000, -0.0009102500000000 ]  - [  -0.0004315300000000, -0.0000421000000000,  0.0007198200000000 ]  - [  -0.0011965200000000,  0.0000212800000000, -0.0002680900000000 ]  - [  -0.0000675300000000,  0.0001359700000000,  0.0008968400000000 ]  - [   0.0000849900000000,  0.0001311700000000,  0.0008895900000000 ]  - [  -0.0000819200000000,  0.0001318800000000, -0.0008934000000000 ]  - [   0.0000785400000000,  0.0002935700000000, -0.0010507700000000 ]  - [  -0.0000831400000000, -0.0001242600000000,  0.0008898500000000 ]  - [   0.0000823600000000, -0.0000005600000000,  0.0009338800000000 ]  - [  -0.0001300300000000, -0.0001204400000000, -0.0008871400000000 ]  - [   0.0003405000000000, -0.0019749700000000, -0.0008235100000000 ]  - [  -0.0000918500000000, -0.0000558600000000,  0.0007781000000000 ]  - [  -0.0000991000000000, -0.0000603000000000,  0.0008946000000000 ]  - [   0.0003649800000000, -0.0000612800000000, -0.0009231400000000 ]  - [  -0.0000770900000000, -0.0000892300000000, -0.0006884800000000 ]  - [   0.0002777500000000,  0.0001169100000000,  0.0010092400000000 ]  - [  -0.0000197700000000,  0.0000888500000000,  0.0007591900000000 ]  - [  -0.0004838600000000,  0.0000652000000000, -0.0011045600000000 ]  - [  -0.0004705600000000, -0.0001844300000000, -0.0005283000000000 ]  - [   0.0008233700000000, -0.0000434000000000, -0.0010219600000000 ]  - [  -0.0002016500000000,  0.0000713600000000, -0.0005327300000000 ]  - [  -0.0001514500000000,  0.0000622200000000,  0.0008016500000000 ]  - [  -0.0001442600000000,  0.0001836900000000,  0.0010181300000000 ]  - [  -0.0001424400000000, -0.0000452100000000, -0.0008331800000000 ]  - [  -0.0001485600000000, -0.0000968800000000, -0.0007805100000000 ]  - [   0.0002179100000000, -0.0000376700000000,  0.0009284300000000 ]  - [  -0.0000299400000000, -0.0000848100000000,  0.0007425600000000 ]  - [  -0.0008884700000000,  0.0000948900000000, -0.0003330800000000 ]  - [  -0.0002770400000000,  0.0002012900000000,  0.0009329300000000 ]  - [  -0.0002151300000000,  0.0001717200000000, -0.0006484400000000 ]  - [  -0.0000528400000000,  0.0001173000000000, -0.0008811800000000 ]  - [   0.0004546900000000, -0.0008532500000000,  0.0007043500000000 ]  - [  -0.0001029200000000, -0.0000550900000000,  0.0009271900000000 ]  - [   0.0000728600000000, -0.0002350700000000, -0.0007606300000000 ]  - [  -0.0000606800000000, -0.0001053800000000, -0.0008467700000000 ]  - [  -0.0145221500000000, -0.0002411700000000, -0.0000648200000000 ]  - [  -0.0141447200000000,  0.0000178500000000,  0.0000718700000000 ]  - [   0.0144514300000000, -0.0000638200000000, -0.0001066100000000 ]  - [   0.0145364700000000,  0.0000215100000000,  0.0001535000000000 ]  - [   0.0001280500000000,  0.0005568000000000,  0.0005566900000000 ]  - [   0.0004093300000000,  0.0013605700000000,  0.0000753300000000 ]  - [  -0.0000062100000000,  0.0010453500000000, -0.0001877200000000 ]  - [   0.0000823800000000,  0.0011259200000000, -0.0000973600000000 ]  - [  -0.0000988100000000, -0.0011465800000000,  0.0001814200000000 ]  - [   0.0001177100000000, -0.0011055600000000,  0.0000455600000000 ]  - [  -0.0000540600000000, -0.0011926100000000, -0.0001814200000000 ]  - [   0.0000844000000000, -0.0011383500000000, -0.0000500000000000 ]  - [  -0.0141437800000000,  0.0000044600000000,  0.0000390400000000 ]  - [  -0.0142067500000000, -0.0003287400000000, -0.0010876900000000 ]  - [   0.0137580700000000, -0.0002091600000000, -0.0006732900000000 ]  - [   0.0146080400000000,  0.0000014000000000, -0.0000087800000000 ]  - [   0.0001663000000000,  0.0011614000000000,  0.0000314500000000 ]  - [  -0.0002799200000000,  0.0011201400000000, -0.0001391000000000 ]  - [   0.0001933200000000,  0.0011641900000000, -0.0000284000000000 ]  - [  -0.0002953000000000,  0.0003735800000000,  0.0002438400000000 ]  - [   0.0001984100000000, -0.0011477400000000,  0.0000234900000000 ]  - [  -0.0015173300000000, -0.0012172400000000, -0.0006927700000000 ]  - [   0.0002460200000000, -0.0011484000000000, -0.0000290300000000 ]  - [   0.0015519900000000, -0.0023732200000000, -0.0036784100000000 ]  - [  -0.1746020200000000, -0.0249201600000000,  0.1967339500000000 ]  - [   0.0010634200000000, -0.0000845000000000,  0.0000308400000000 ]  - [  -0.0007199300000000, -0.0001253000000000, -0.0005530800000000 ]  - [  -0.0000672900000000, -0.0002787800000000,  0.0010855100000000 ]  - [  -0.0003385900000000,  0.0003386800000000, -0.0001037000000000 ]  - [  -0.0006817800000000, -0.0000237400000000,  0.0002076600000000 ]  - [  -0.0000544900000000,  0.0014773700000000, -0.0000291400000000 ]  - [   0.0009526100000000,  0.0000784200000000,  0.0000245900000000 ]  - [   0.0001636100000000, -0.0000197400000000,  0.0000211200000000 ]  - [  -0.0001755200000000, -0.0000596800000000, -0.0001430600000000 ]  - [   0.0002287600000000, -0.0000180400000000, -0.0000212900000000 ]  - [  -0.0002978100000000,  0.0010494500000000, -0.0003807300000000 ]  - [   0.0008420300000000, -0.0001621900000000,  0.0000375200000000 ]  - [   0.0007513900000000, -0.0001093300000000, -0.0001645200000000 ]  - [  -0.0010948300000000, -0.0001013400000000, -0.0000956400000000 ]  - [  -0.0005038100000000, -0.0001562100000000, -0.0000340000000000 ]  - [  -0.0014081700000000,  0.0001708100000000, -0.0002129300000000 ]  - [  -0.0003837700000000,  0.0001890500000000, -0.0001476400000000 ]  - [   0.0011640300000000,  0.0000587100000000,  0.0002179700000000 ]  - [   0.0008696800000000,  0.0003431200000000, -0.0005991100000000 ]  - [   0.0008195100000000,  0.0015716100000000,  0.0010110600000000 ]  - [   0.0003804900000000, -0.0001598300000000,  0.0000460700000000 ]  - [   0.0004585400000000,  0.0001194700000000, -0.0004457900000000 ]  - [   0.0001276800000000, -0.0000432000000000,  0.0000263200000000 ]- atom:   13  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0005967600000000,  0.0006976700000000,  0.0006420300000000 ]  - [   0.0000110200000000,  0.0000440600000000,  0.0009424500000000 ]  - [  -0.0004299600000000, -0.0002296700000000, -0.0004796200000000 ]  - [   0.0000200200000000, -0.0000020600000000, -0.0009205900000000 ]  - [  -0.0000783700000000,  0.0000616200000000, -0.0000131300000000 ]  - [   0.0000625300000000,  0.0000764400000000, -0.0000344800000000 ]  - [   0.0000099700000000, -0.0000045200000000,  0.0009972800000000 ]  - [  -0.0001185600000000, -0.0000207000000000,  0.0007421500000000 ]  - [   0.0000392300000000, -0.0000458300000000, -0.0009624800000000 ]  - [  -0.0007466100000000, -0.0010999700000000, -0.0008749400000000 ]  - [   0.0036451600000000,  0.0004124900000000, -0.0041079500000000 ]  - [  -0.0000918000000000, -0.0000837700000000,  0.0000378100000000 ]  - [  -0.0231278400000000, -0.0143874800000000,  0.0197410900000000 ]  - [  -0.0000726200000000, -0.0000819200000000,  0.0008007600000000 ]  - [   0.0001198400000000, -0.0000475700000000, -0.0007973300000000 ]  - [  -0.0000422500000000, -0.0001595900000000, -0.0007320900000000 ]  - [   0.0001382200000000,  0.0001379000000000,  0.0008117000000000 ]  - [  -0.0000658500000000,  0.0001039500000000,  0.0007320100000000 ]  - [  -0.0002620500000000,  0.0004267000000000, -0.0013537200000000 ]  - [  -0.0000606500000000,  0.0000824900000000, -0.0007836700000000 ]  - [   0.0000795000000000,  0.0000711300000000, -0.0008843600000000 ]  - [   0.0000059300000000,  0.0001309400000000, -0.0008019400000000 ]  - [  -0.0003425200000000,  0.0015793100000000,  0.0011041500000000 ]  - [  -0.0000482400000000,  0.0000758800000000,  0.0007714800000000 ]  - [  -0.0024242500000000, -0.0007867100000000,  0.0001779500000000 ]  - [  -0.0000680400000000, -0.0000823400000000, -0.0007874400000000 ]  - [   0.0000987900000000, -0.0002719200000000,  0.0007718900000000 ]  - [   0.0001662200000000, -0.0001689100000000,  0.0010892600000000 ]  - [  -0.0000108000000000,  0.0001647700000000,  0.0009030800000000 ]  - [   0.0000423000000000,  0.0002731900000000,  0.0009338200000000 ]  - [  -0.0000109800000000,  0.0001899200000000, -0.0008913200000000 ]  - [   0.0000557300000000,  0.0004230900000000, -0.0009204800000000 ]  - [  -0.0000077500000000, -0.0001600300000000,  0.0008973400000000 ]  - [   0.0000388200000000, -0.0002937000000000,  0.0009394100000000 ]  - [  -0.0000338200000000, -0.0001657000000000, -0.0008885000000000 ]  - [   0.0003186600000000, -0.0003141800000000, -0.0010690600000000 ]  - [  -0.0000767000000000, -0.0000861600000000,  0.0007872500000000 ]  - [  -0.0000914300000000, -0.0000865000000000,  0.0007873300000000 ]  - [   0.0000856100000000, -0.0000503300000000, -0.0007691900000000 ]  - [   0.0000561700000000, -0.0000743700000000, -0.0007717300000000 ]  - [   0.0000185300000000,  0.0000548800000000,  0.0007006200000000 ]  - [   0.0000460600000000,  0.0000782000000000,  0.0007589100000000 ]  - [  -0.0003353500000000,  0.0001119500000000, -0.0010412200000000 ]  - [  -0.0000708400000000,  0.0001104100000000, -0.0007772300000000 ]  - [   0.0001811300000000,  0.0001217300000000, -0.0009648000000000 ]  - [   0.0000636400000000,  0.0000783400000000, -0.0007816000000000 ]  - [   0.0000363700000000,  0.0000725600000000,  0.0006727100000000 ]  - [  -0.0000731500000000,  0.0000718200000000,  0.0007521100000000 ]  - [  -0.0000401400000000, -0.0000650500000000, -0.0007478700000000 ]  - [  -0.0001020100000000, -0.0000654900000000, -0.0007729800000000 ]  - [   0.0001093500000000, -0.0000780500000000,  0.0008098600000000 ]  - [   0.0000604800000000, -0.0000788600000000,  0.0007791000000000 ]  - [   0.0004586500000000, -0.0007356500000000,  0.0013755000000000 ]  - [   0.0000516600000000,  0.0001343200000000,  0.0008887800000000 ]  - [   0.0000229600000000,  0.0003086900000000, -0.0009442800000000 ]  - [  -0.0000054200000000,  0.0001398700000000, -0.0009001300000000 ]  - [  -0.0000754300000000,  0.0004996000000000,  0.0010713600000000 ]  - [  -0.0000070800000000, -0.0001646200000000,  0.0008945000000000 ]  - [   0.0001989500000000, -0.0002815900000000, -0.0011456100000000 ]  - [  -0.0000039100000000, -0.0001433800000000, -0.0009107900000000 ]  - [  -0.0138005700000000, -0.0002009300000000, -0.0002934200000000 ]  - [  -0.0143770200000000, -0.0000018400000000, -0.0000030200000000 ]  - [   0.0145731800000000, -0.0000169900000000, -0.0000636000000000 ]  - [   0.0143219900000000, -0.0000019900000000, -0.0000084300000000 ]  - [   0.0003070900000000,  0.0011713800000000,  0.0004028700000000 ]  - [   0.0000016700000000,  0.0011206300000000,  0.0000613500000000 ]  - [  -0.0000807300000000,  0.0013109500000000,  0.0000443400000000 ]  - [   0.0000184800000000,  0.0011636100000000, -0.0000654400000000 ]  - [   0.0000059500000000, -0.0015148200000000,  0.0001791000000000 ]  - [   0.0000291400000000, -0.0011785100000000,  0.0000716900000000 ]  - [   0.0000319000000000, -0.0011956800000000, -0.0001724500000000 ]  - [   0.0000150100000000, -0.0011624800000000, -0.0000728800000000 ]  - [  -0.0143753500000000,  0.0000054200000000, -0.0000263900000000 ]  - [  -0.0144285000000000,  0.0001609600000000,  0.0003511700000000 ]  - [   0.0144439000000000,  0.0000679500000000,  0.0000313200000000 ]  - [   0.0143538100000000,  0.0000044900000000, -0.0000000500000000 ]  - [  -0.0000165700000000,  0.0011377100000000,  0.0000836400000000 ]  - [   0.0001182100000000,  0.0010895000000000,  0.0002447700000000 ]  - [  -0.0000379200000000,  0.0011386700000000, -0.0000850800000000 ]  - [   0.0002959600000000,  0.0011188100000000, -0.0003645500000000 ]  - [  -0.0000088900000000, -0.0011362300000000,  0.0000645200000000 ]  - [   0.0003367200000000, -0.0009810000000000,  0.0003494400000000 ]  - [  -0.0000015900000000, -0.0010997300000000, -0.0000701600000000 ]  - [   0.0004935800000000,  0.0022641500000000,  0.0001782500000000 ]  - [   0.0234510800000000,  0.0113267700000000, -0.0159663000000000 ]  - [   0.0007352100000000, -0.0001220400000000, -0.0000126500000000 ]  - [  -0.0006063000000000, -0.0002150800000000,  0.0000886000000000 ]  - [  -0.0007274200000000, -0.0000256100000000, -0.0002092500000000 ]  - [  -0.0009916600000000, -0.0000418600000000,  0.0001300500000000 ]  - [  -0.0005767100000000,  0.0001167600000000,  0.0000401000000000 ]  - [   0.0001047500000000, -0.0009201500000000,  0.0009133400000000 ]  - [   0.0007158800000000,  0.0001274100000000,  0.0000049500000000 ]  - [   0.0000175400000000, -0.0000101300000000,  0.0000166600000000 ]  - [  -0.0000479200000000,  0.0000102100000000,  0.0000022300000000 ]  - [   0.0000422400000000, -0.0000280300000000, -0.0000207600000000 ]  - [  -0.0001580300000000, -0.0000185000000000,  0.0000226100000000 ]  - [   0.0007055200000000, -0.0001520900000000, -0.0000245300000000 ]  - [   0.0007530800000000, -0.0001459000000000, -0.0000125500000000 ]  - [  -0.0007603300000000, -0.0001656100000000, -0.0000288500000000 ]  - [  -0.0007054400000000, -0.0001429000000000, -0.0000043700000000 ]  - [  -0.0007736100000000,  0.0001015200000000,  0.0001650400000000 ]  - [  -0.0006813700000000,  0.0001349800000000,  0.0000153500000000 ]  - [   0.0008595600000000,  0.0000981200000000,  0.0002663900000000 ]  - [   0.0007074000000000,  0.0001083900000000,  0.0000291300000000 ]  - [  -0.0014162800000000, -0.0005694900000000, -0.0006898400000000 ]  - [  -0.0000337300000000,  0.0000460200000000, -0.0000149800000000 ]  - [   0.0004251000000000,  0.0007938400000000, -0.0010365500000000 ]  - [   0.0000216600000000,  0.0000120500000000,  0.0000061000000000 ]- atom:   13  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0005837300000000, -0.0006972400000000,  0.0013274800000000 ]  - [  -0.0000133900000000, -0.0000447000000000,  0.0010342500000000 ]  - [   0.0004227800000000,  0.0002262400000000, -0.0014875900000000 ]  - [  -0.0000177500000000,  0.0000012300000000, -0.0010564500000000 ]  - [   0.0000742200000000, -0.0000620900000000,  0.0000142400000000 ]  - [  -0.0000604500000000, -0.0000878800000000,  0.0000353200000000 ]  - [  -0.0000129500000000,  0.0000061500000000,  0.0009819900000000 ]  - [   0.0001163000000000,  0.0000316100000000,  0.0012348900000000 ]  - [  -0.0000376700000000,  0.0000467000000000, -0.0010176600000000 ]  - [   0.0007474600000000,  0.0011155100000000, -0.0011057800000000 ]  - [  -0.0037396400000000, -0.0003956700000000,  0.0041516400000000 ]  - [   0.0000919400000000,  0.0000824900000000, -0.0000373200000000 ]  - [   0.0206942900000000,  0.0134895100000000, -0.0150029100000000 ]  - [  -0.0000620300000000, -0.0000757000000000,  0.0007769500000000 ]  - [   0.0000056200000000, -0.0001101500000000, -0.0007680500000000 ]  - [   0.0001741400000000,  0.0000020000000000, -0.0008448300000000 ]  - [  -0.0000070100000000,  0.0000198500000000,  0.0007622500000000 ]  - [   0.0001909000000000,  0.0000543700000000,  0.0008333300000000 ]  - [   0.0001477900000000, -0.0002719500000000, -0.0001954800000000 ]  - [  -0.0000528400000000,  0.0000749000000000, -0.0007679400000000 ]  - [   0.0000521700000000,  0.0000874800000000, -0.0006888400000000 ]  - [   0.0001179300000000,  0.0000271400000000, -0.0007620200000000 ]  - [   0.0002280300000000, -0.0014375100000000,  0.0004482800000000 ]  - [  -0.0000653400000000,  0.0000815000000000,  0.0007805900000000 ]  - [   0.0023609300000000,  0.0005649100000000, -0.0017358800000000 ]  - [  -0.0000665100000000, -0.0000753600000000, -0.0007899800000000 ]  - [   0.0000241600000000,  0.0001152800000000,  0.0007950200000000 ]  - [  -0.0000369500000000,  0.0000123500000000,  0.0004848800000000 ]  - [   0.0000106800000000,  0.0001176300000000,  0.0008835200000000 ]  - [  -0.0000413700000000,  0.0000101900000000,  0.0008522700000000 ]  - [   0.0000108800000000,  0.0000985000000000, -0.0008906800000000 ]  - [  -0.0000550500000000, -0.0001354800000000, -0.0008614800000000 ]  - [   0.0000072600000000, -0.0001224900000000,  0.0008891700000000 ]  - [  -0.0000375200000000,  0.0000058400000000,  0.0008467000000000 ]  - [   0.0000332400000000, -0.0001228800000000, -0.0008935000000000 ]  - [  -0.0003150400000000,  0.0000186500000000, -0.0007139600000000 ]  - [  -0.0000397800000000, -0.0000710500000000,  0.0007678200000000 ]  - [  -0.0000454700000000, -0.0000713000000000,  0.0007938200000000 ]  - [   0.0000502000000000, -0.0001076200000000, -0.0008100800000000 ]  - [   0.0000763700000000, -0.0000833300000000, -0.0008042000000000 ]  - [   0.0000963700000000,  0.0001020800000000,  0.0008526100000000 ]  - [   0.0000668800000000,  0.0000790200000000,  0.0007924500000000 ]  - [   0.0001957500000000,  0.0000469200000000, -0.0005422200000000 ]  - [  -0.0000432200000000,  0.0000455000000000, -0.0007720400000000 ]  - [  -0.0000650000000000,  0.0000348300000000, -0.0005892200000000 ]  - [   0.0000490200000000,  0.0000789000000000, -0.0007694400000000 ]  - [  -0.0001747500000000,  0.0000859200000000,  0.0009098000000000 ]  - [  -0.0000398400000000,  0.0000852500000000,  0.0007983700000000 ]  - [  -0.0000770000000000, -0.0000922600000000, -0.0008078600000000 ]  - [  -0.0000348400000000, -0.0000926500000000, -0.0008085100000000 ]  - [   0.0000260000000000, -0.0000796600000000,  0.0007683900000000 ]  - [   0.0000718900000000, -0.0000787700000000,  0.0007964900000000 ]  - [  -0.0004497300000000,  0.0010290300000000,  0.0004154200000000 ]  - [  -0.0000527600000000,  0.0001511700000000,  0.0008959500000000 ]  - [  -0.0000164900000000, -0.0000214600000000, -0.0008493600000000 ]  - [   0.0000047200000000,  0.0001473500000000, -0.0008832300000000 ]  - [   0.0000737900000000, -0.0007869200000000,  0.0007119800000000 ]  - [   0.0000071900000000, -0.0001196100000000,  0.0008903900000000 ]  - [  -0.0002010300000000, -0.0000007000000000, -0.0006361900000000 ]  - [   0.0000039100000000, -0.0001430100000000, -0.0008726500000000 ]  - [  -0.0149158100000000,  0.0001966600000000,  0.0002907300000000 ]  - [  -0.0143483300000000,  0.0000034900000000,  0.0000032500000000 ]  - [   0.0141568400000000,  0.0000178800000000,  0.0000626800000000 ]  - [   0.0144036200000000,  0.0000033400000000,  0.0000069400000000 ]  - [  -0.0003051200000000,  0.0011272800000000, -0.0002767000000000 ]  - [   0.0000001600000000,  0.0011766300000000,  0.0000605200000000 ]  - [   0.0000811200000000,  0.0009890700000000, -0.0001692300000000 ]  - [  -0.0000174000000000,  0.0011327700000000, -0.0000570400000000 ]  - [  -0.0000054300000000, -0.0007791600000000, -0.0000535100000000 ]  - [  -0.0000291600000000, -0.0011160700000000,  0.0000525100000000 ]  - [  -0.0000312800000000, -0.0011007000000000,  0.0000475600000000 ]  - [  -0.0000147900000000, -0.0011317700000000, -0.0000495500000000 ]  - [  -0.0143500200000000, -0.0000054800000000,  0.0000274600000000 ]  - [  -0.0142965500000000, -0.0001617800000000, -0.0003508100000000 ]  - [   0.0142806200000000, -0.0000686200000000, -0.0000325000000000 ]  - [   0.0143727800000000, -0.0000040200000000, -0.0000011800000000 ]  - [   0.0000169500000000,  0.0011572000000000,  0.0000370600000000 ]  - [  -0.0001218100000000,  0.0012035300000000, -0.0001279800000000 ]  - [   0.0000382400000000,  0.0011557600000000, -0.0000369600000000 ]  - [  -0.0003010900000000,  0.0011752400000000,  0.0002479500000000 ]  - [   0.0000091200000000, -0.0011589200000000,  0.0000589600000000 ]  - [  -0.0003289800000000, -0.0013147900000000, -0.0002169300000000 ]  - [   0.0000018900000000, -0.0011945200000000, -0.0000525100000000 ]  - [  -0.0005093800000000, -0.0045565500000000, -0.0002826500000000 ]  - [  -0.0196763100000000, -0.0108168200000000,  0.0127154900000000 ]  - [   0.0007175100000000, -0.0001423500000000,  0.0000122200000000 ]  - [  -0.0008313200000000, -0.0000470000000000, -0.0000958900000000 ]  - [  -0.0007193700000000, -0.0002414000000000,  0.0002106500000000 ]  - [  -0.0004523000000000,  0.0003068100000000, -0.0001315500000000 ]  - [  -0.0008505200000000,  0.0001449000000000, -0.0000408200000000 ]  - [   0.0013159600000000,  0.0012157200000000, -0.0009202500000000 ]  - [   0.0006856800000000,  0.0001334300000000, -0.0000047100000000 ]  - [  -0.0000165000000000,  0.0000107700000000,  0.0000103500000000 ]  - [   0.0000466800000000, -0.0000064500000000,  0.0000272500000000 ]  - [  -0.0000417500000000,  0.0000289200000000, -0.0000171900000000 ]  - [   0.0001556800000000,  0.0000248000000000, -0.0000624000000000 ]  - [   0.0007023600000000, -0.0001099600000000,  0.0000250300000000 ]  - [   0.0007048100000000, -0.0001179300000000,  0.0000132100000000 ]  - [  -0.0006937800000000, -0.0000971000000000,  0.0000294000000000 ]  - [  -0.0007442200000000, -0.0001193900000000,  0.0000043700000000 ]  - [  -0.0006338400000000,  0.0001598400000000, -0.0001641700000000 ]  - [  -0.0007186500000000,  0.0001269800000000, -0.0000149800000000 ]  - [   0.0006059400000000,  0.0001677900000000, -0.0002647800000000 ]  - [   0.0006933300000000,  0.0001542000000000, -0.0000297400000000 ]  - [   0.0014262300000000,  0.0005627300000000,  0.0007328000000000 ]  - [   0.0000350900000000, -0.0000469800000000,  0.0000472300000000 ]  - [  -0.0004310800000000, -0.0008137800000000,  0.0010117400000000 ]  - [  -0.0000208900000000, -0.0000127500000000, -0.0000422400000000 ]- atom:   13  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0002130700000000, -0.0003087100000000,  0.0000425600000000 ]  - [  -0.0001384500000000, -0.0003146600000000,  0.0006234400000000 ]  - [  -0.0002515300000000,  0.0003506300000000, -0.0009410300000000 ]  - [  -0.0001120500000000,  0.0000146600000000, -0.0011014300000000 ]  - [  -0.0002260300000000, -0.0000695000000000,  0.0001063500000000 ]  - [   0.0002636500000000, -0.0003098600000000,  0.0010051600000000 ]  - [  -0.0001555200000000, -0.0000572700000000,  0.0012017300000000 ]  - [   0.0001293700000000, -0.0007364300000000,  0.0023888900000000 ]  - [  -0.0001340300000000, -0.0000042200000000, -0.0010209900000000 ]  - [   0.0001800300000000,  0.0030936500000000,  0.0015381800000000 ]  - [  -0.0047377200000000, -0.0047716100000000, -0.0022966400000000 ]  - [  -0.0003797000000000,  0.0002392300000000, -0.0003173100000000 ]  - [   0.1774015200000000,  0.0180957200000000, -0.2968384500000000 ]  - [  -0.0001792100000000, -0.0000674900000000,  0.0008048800000000 ]  - [  -0.0001777800000000, -0.0000657900000000, -0.0003928900000000 ]  - [   0.0007632600000000, -0.0001353000000000, -0.0013453800000000 ]  - [  -0.0000654500000000,  0.0000551400000000,  0.0005173100000000 ]  - [  -0.0000201200000000,  0.0001284900000000,  0.0005967700000000 ]  - [   0.0003024700000000, -0.0004996800000000, -0.0002389100000000 ]  - [  -0.0001524600000000,  0.0000715600000000, -0.0008605800000000 ]  - [  -0.0001211800000000, -0.0000176400000000, -0.0006234100000000 ]  - [   0.0002675600000000,  0.0000584200000000, -0.0009832600000000 ]  - [   0.0005125000000000, -0.0002460100000000, -0.0002447500000000 ]  - [  -0.0001472500000000,  0.0000839100000000,  0.0007995900000000 ]  - [  -0.0203484500000000, -0.0010600500000000,  0.0270145000000000 ]  - [  -0.0001903700000000, -0.0000804800000000, -0.0009095800000000 ]  - [  -0.0000001700000000, -0.0000917100000000,  0.0001775200000000 ]  - [  -0.0009858400000000,  0.0002189600000000, -0.0010680500000000 ]  - [  -0.0000502200000000,  0.0001049000000000,  0.0008858700000000 ]  - [   0.0000665800000000,  0.0000199600000000,  0.0008651000000000 ]  - [  -0.0000417700000000,  0.0000989500000000, -0.0009133600000000 ]  - [   0.0000452600000000,  0.0001969300000000, -0.0010631800000000 ]  - [  -0.0000561000000000, -0.0000806700000000,  0.0008988200000000 ]  - [   0.0000671700000000,  0.0003027200000000,  0.0009530200000000 ]  - [  -0.0000346400000000, -0.0001027600000000, -0.0009238500000000 ]  - [   0.0002248900000000, -0.0018134900000000, -0.0007605500000000 ]  - [  -0.0001668400000000, -0.0000822700000000,  0.0008961500000000 ]  - [  -0.0000669300000000, -0.0000689700000000,  0.0009053400000000 ]  - [   0.0002012400000000, -0.0000996900000000, -0.0007823100000000 ]  - [  -0.0000307900000000, -0.0000954500000000, -0.0007093000000000 ]  - [   0.0002897100000000,  0.0001542400000000,  0.0011761000000000 ]  - [   0.0000403900000000,  0.0000952000000000,  0.0008345400000000 ]  - [   0.0001828500000000,  0.0000765500000000, -0.0004758700000000 ]  - [  -0.0003694200000000, -0.0001679200000000, -0.0004653100000000 ]  - [   0.0002970700000000, -0.0001075200000000, -0.0004989200000000 ]  - [  -0.0001853800000000,  0.0000726400000000, -0.0005249800000000 ]  - [  -0.0003080000000000,  0.0001021600000000,  0.0010472400000000 ]  - [  -0.0000719700000000,  0.0001970500000000,  0.0010347700000000 ]  - [  -0.0000525500000000, -0.0000967500000000, -0.0007416000000000 ]  - [  -0.0001207400000000, -0.0001083300000000, -0.0007511200000000 ]  - [   0.0002082500000000, -0.0000588700000000,  0.0010011300000000 ]  - [   0.0000233300000000, -0.0000879500000000,  0.0007969200000000 ]  - [   0.0009260400000000,  0.0004460800000000,  0.0012315300000000 ]  - [  -0.0002888900000000,  0.0002348600000000,  0.0009438900000000 ]  - [  -0.0001437200000000,  0.0003412900000000, -0.0004708700000000 ]  - [  -0.0000054700000000,  0.0001318000000000, -0.0008692500000000 ]  - [  -0.0000026000000000, -0.0001336900000000,  0.0011342300000000 ]  - [  -0.0000733900000000, -0.0000634900000000,  0.0009422800000000 ]  - [   0.0000575500000000, -0.0005539800000000, -0.0009722100000000 ]  - [  -0.0000217100000000, -0.0001315600000000, -0.0008407200000000 ]  - [  -0.0141768700000000, -0.0002083200000000,  0.0003093100000000 ]  - [  -0.0142324700000000,  0.0000206900000000,  0.0001004200000000 ]  - [   0.0144342800000000, -0.0000123200000000,  0.0001948900000000 ]  - [   0.0144230200000000,  0.0000191900000000,  0.0001942600000000 ]  - [  -0.0004534500000000,  0.0016086500000000,  0.0001286400000000 ]  - [   0.0004417100000000,  0.0014156900000000,  0.0000584400000000 ]  - [   0.0000268100000000,  0.0009562100000000, -0.0002903600000000 ]  - [   0.0000184300000000,  0.0011025300000000, -0.0001048500000000 ]  - [  -0.0000294000000000, -0.0010841700000000,  0.0001938200000000 ]  - [   0.0000716200000000, -0.0010971400000000,  0.0000575400000000 ]  - [   0.0000018800000000, -0.0010763700000000, -0.0001968200000000 ]  - [   0.0000328200000000, -0.0011273200000000, -0.0000628000000000 ]  - [  -0.0142773600000000,  0.0000028300000000, -0.0000755000000000 ]  - [  -0.0143279100000000, -0.0001788000000000, -0.0011074600000000 ]  - [   0.0141377900000000, -0.0001228000000000, -0.0008954400000000 ]  - [   0.0145207600000000,  0.0000066000000000, -0.0000457500000000 ]  - [   0.0001413400000000,  0.0011671500000000,  0.0000015700000000 ]  - [  -0.0002807700000000,  0.0012677100000000, -0.0002429200000000 ]  - [   0.0001227300000000,  0.0011638500000000,  0.0000013800000000 ]  - [  -0.0002106500000000,  0.0003987300000000,  0.0003716900000000 ]  - [   0.0002322600000000, -0.0011361300000000, -0.0000806500000000 ]  - [  -0.0008091100000000, -0.0008247900000000, -0.0013519600000000 ]  - [   0.0002052200000000, -0.0011838600000000,  0.0001038800000000 ]  - [   0.0045936200000000, -0.0016565300000000, -0.0018063200000000 ]  - [  -0.1580971900000000, -0.0151291600000000,  0.2736506900000000 ]  - [   0.0009482700000000, -0.0001084900000000,  0.0001014800000000 ]  - [   0.0011312700000000, -0.0005702200000000,  0.0004929900000000 ]  - [  -0.0003139600000000, -0.0003282200000000,  0.0014678300000000 ]  - [  -0.0004031700000000,  0.0003519100000000,  0.0001807500000000 ]  - [  -0.0007726000000000,  0.0000629900000000,  0.0002777700000000 ]  - [   0.0001061200000000,  0.0023422800000000,  0.0004583000000000 ]  - [   0.0008541500000000,  0.0001012200000000,  0.0000686500000000 ]  - [   0.0001065900000000, -0.0000060600000000, -0.0000377400000000 ]  - [  -0.0001260800000000, -0.0001722400000000, -0.0002485400000000 ]  - [   0.0000724300000000,  0.0000241700000000, -0.0000038100000000 ]  - [  -0.0001489600000000,  0.0009898600000000, -0.0003918700000000 ]  - [   0.0008057900000000, -0.0000958000000000, -0.0001101100000000 ]  - [   0.0007423600000000, -0.0000941500000000, -0.0002107900000000 ]  - [  -0.0009485200000000, -0.0000769200000000, -0.0002531400000000 ]  - [  -0.0006005300000000, -0.0001288400000000, -0.0000669300000000 ]  - [  -0.0010161800000000,  0.0002006300000000, -0.0006410500000000 ]  - [  -0.0004941100000000,  0.0001626900000000, -0.0002127900000000 ]  - [   0.0007482800000000,  0.0001266700000000, -0.0003949700000000 ]  - [   0.0008109300000000,  0.0002656500000000, -0.0006303800000000 ]  - [  -0.0005597200000000, -0.0002660800000000,  0.0011595100000000 ]  - [   0.0003465700000000, -0.0001793600000000,  0.0000927400000000 ]  - [   0.0005478500000000,  0.0008363400000000, -0.0016308600000000 ]  - [   0.0000309300000000, -0.0000260400000000,  0.0000095000000000 ]- atom:   13  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0002156300000000,  0.0003049300000000,  0.0019466800000000 ]  - [   0.0001405800000000,  0.0003234300000000,  0.0013615100000000 ]  - [   0.0002579900000000, -0.0003597100000000, -0.0010374400000000 ]  - [   0.0001183700000000, -0.0000138100000000, -0.0008744200000000 ]  - [   0.0002334900000000,  0.0000701700000000, -0.0001072400000000 ]  - [  -0.0002729900000000,  0.0003126800000000, -0.0010199900000000 ]  - [   0.0001583700000000,  0.0000588800000000,  0.0007723600000000 ]  - [  -0.0001382800000000,  0.0007364400000000, -0.0004282600000000 ]  - [   0.0001416600000000,  0.0000042300000000, -0.0009550600000000 ]  - [  -0.0001841800000000, -0.0031564600000000, -0.0035614500000000 ]  - [   0.0048640300000000,  0.0048767800000000,  0.0022889400000000 ]  - [   0.0003943500000000, -0.0002498000000000,  0.0003231300000000 ]  - [  -0.1633086200000000, -0.0167008300000000,  0.2846093300000000 ]  - [   0.0000539400000000, -0.0000909300000000,  0.0007640800000000 ]  - [   0.0003064200000000, -0.0000932300000000, -0.0011766600000000 ]  - [  -0.0006419800000000, -0.0000212600000000, -0.0002155900000000 ]  - [   0.0001948100000000,  0.0001039800000000,  0.0010541400000000 ]  - [   0.0001407200000000,  0.0000277500000000,  0.0009645900000000 ]  - [  -0.0004337600000000,  0.0006644600000000, -0.0013321600000000 ]  - [   0.0000409700000000,  0.0000863300000000, -0.0006890000000000 ]  - [   0.0002509800000000,  0.0001773800000000, -0.0009467700000000 ]  - [  -0.0001504600000000,  0.0000990200000000, -0.0005726500000000 ]  - [  -0.0006469000000000,  0.0004156400000000,  0.0018211700000000 ]  - [   0.0000360000000000,  0.0000737500000000,  0.0007512900000000 ]  - [   0.0198591400000000,  0.0008560400000000, -0.0277130300000000 ]  - [   0.0000647800000000, -0.0000776500000000, -0.0006575000000000 ]  - [   0.0001281400000000, -0.0000666600000000,  0.0013937200000000 ]  - [   0.0011359500000000, -0.0003841100000000,  0.0026755700000000 ]  - [   0.0000517600000000,  0.0001826900000000,  0.0008986300000000 ]  - [  -0.0000683100000000,  0.0002688700000000,  0.0009185200000000 ]  - [   0.0000434400000000,  0.0001942500000000, -0.0008666000000000 ]  - [  -0.0000467300000000,  0.0000956100000000, -0.0007131500000000 ]  - [   0.0000576900000000, -0.0002070500000000,  0.0008854400000000 ]  - [  -0.0000693300000000, -0.0005912700000000,  0.0008302200000000 ]  - [   0.0000363300000000, -0.0001902200000000, -0.0008559700000000 ]  - [  -0.0002320800000000,  0.0015543200000000, -0.0010222100000000 ]  - [   0.0000524300000000, -0.0000753300000000,  0.0006571500000000 ]  - [  -0.0000636400000000, -0.0000893900000000,  0.0006661100000000 ]  - [  -0.0000757700000000, -0.0000583800000000, -0.0007875800000000 ]  - [   0.0001614500000000, -0.0000622900000000, -0.0008619100000000 ]  - [  -0.0001811000000000,  0.0000027200000000,  0.0003706500000000 ]  - [   0.0000759800000000,  0.0000623000000000,  0.0007182500000000 ]  - [  -0.0003157800000000,  0.0000820800000000, -0.0011016800000000 ]  - [   0.0002611200000000,  0.0003303300000000, -0.0010925100000000 ]  - [  -0.0001902300000000,  0.0002685900000000, -0.0010565300000000 ]  - [   0.0003066500000000,  0.0000853500000000, -0.0010339300000000 ]  - [   0.0001804500000000,  0.0000563500000000,  0.0005242100000000 ]  - [  -0.0000401100000000, -0.0000408600000000,  0.0005130400000000 ]  - [  -0.0000632100000000, -0.0000607000000000, -0.0008132100000000 ]  - [  -0.0000095600000000, -0.0000493100000000, -0.0008225900000000 ]  - [  -0.0000825700000000, -0.0000999200000000,  0.0005660800000000 ]  - [   0.0001061700000000, -0.0000699400000000,  0.0007727800000000 ]  - [  -0.0009303600000000, -0.0001600900000000,  0.0005599500000000 ]  - [   0.0002954000000000,  0.0000520600000000,  0.0008381300000000 ]  - [   0.0001507100000000, -0.0000536900000000, -0.0013238000000000 ]  - [   0.0000067100000000,  0.0001595300000000, -0.0009122300000000 ]  - [  -0.0000000600000000, -0.0001495800000000,  0.0006467600000000 ]  - [   0.0000751600000000, -0.0002274500000000,  0.0008402200000000 ]  - [  -0.0000617100000000,  0.0002732900000000, -0.0008107600000000 ]  - [   0.0000226800000000, -0.0001601800000000, -0.0009417100000000 ]  - [  -0.0145476700000000,  0.0002101500000000, -0.0003080000000000 ]  - [  -0.0144968800000000, -0.0000207100000000, -0.0001039100000000 ]  - [   0.0142884800000000,  0.0000134500000000, -0.0001952800000000 ]  - [   0.0142997300000000, -0.0000194200000000, -0.0002010600000000 ]  - [   0.0004624700000000,  0.0006826600000000, -0.0000077700000000 ]  - [  -0.0004531400000000,  0.0008773300000000,  0.0000669600000000 ]  - [  -0.0000276500000000,  0.0013488000000000,  0.0001712300000000 ]  - [  -0.0000202200000000,  0.0011942300000000, -0.0000177700000000 ]  - [   0.0000299600000000, -0.0012132100000000, -0.0000725400000000 ]  - [  -0.0000733800000000, -0.0012036300000000,  0.0000696700000000 ]  - [  -0.0000016400000000, -0.0012227300000000,  0.0000755300000000 ]  - [  -0.0000340700000000, -0.0011693600000000, -0.0000606600000000 ]  - [  -0.0144517300000000, -0.0000023800000000,  0.0000738800000000 ]  - [  -0.0143969800000000,  0.0001840000000000,  0.0011209600000000 ]  - [   0.0145959200000000,  0.0001271300000000,  0.0009063500000000 ]  - [   0.0141998600000000, -0.0000065600000000,  0.0000417200000000 ]  - [  -0.0001451500000000,  0.0011327800000000,  0.0001244600000000 ]  - [   0.0002863700000000,  0.0010340800000000,  0.0003733400000000 ]  - [  -0.0001268100000000,  0.0011321400000000, -0.0001257300000000 ]  - [   0.0002164400000000,  0.0019127600000000, -0.0005036500000000 ]  - [  -0.0002372600000000, -0.0011639700000000,  0.0002096600000000 ]  - [   0.0008188300000000, -0.0014748700000000,  0.0014737700000000 ]  - [  -0.0002103700000000, -0.0011108900000000, -0.0002290300000000 ]  - [  -0.0048351900000000, -0.0006592400000000,  0.0017887300000000 ]  - [   0.1458125200000000,  0.0133446200000000, -0.2608158500000000 ]  - [   0.0004843200000000, -0.0001624600000000, -0.0001036700000000 ]  - [  -0.0025724600000000,  0.0003047900000000, -0.0004962100000000 ]  - [  -0.0011366800000000,  0.0000626800000000, -0.0014951900000000 ]  - [  -0.0010396700000000, -0.0000889500000000, -0.0001821600000000 ]  - [  -0.0006446300000000,  0.0002096300000000, -0.0002818200000000 ]  - [   0.0013285100000000, -0.0021068100000000, -0.0004598300000000 ]  - [   0.0005423300000000,  0.0001685500000000, -0.0000696400000000 ]  - [  -0.0001091700000000,  0.0000064500000000,  0.0000827000000000 ]  - [   0.0001294000000000,  0.0001711600000000,  0.0003001200000000 ]  - [  -0.0000766600000000, -0.0000239900000000, -0.0000499500000000 ]  - [   0.0001544600000000, -0.0010102000000000,  0.0003412700000000 ]  - [   0.0005988700000000, -0.0001733700000000,  0.0001118500000000 ]  - [   0.0007029300000000, -0.0001766400000000,  0.0002142300000000 ]  - [  -0.0004860400000000, -0.0001939800000000,  0.0002568100000000 ]  - [  -0.0008420900000000, -0.0001400100000000,  0.0000678800000000 ]  - [  -0.0003783300000000,  0.0000666300000000,  0.0006507400000000 ]  - [  -0.0009139500000000,  0.0001057500000000,  0.0002176700000000 ]  - [   0.0006983200000000,  0.0001440700000000,  0.0004005900000000 ]  - [   0.0005876500000000, -0.0000003800000000,  0.0006414400000000 ]  - [   0.0005560500000000,  0.0002553900000000, -0.0011325600000000 ]  - [  -0.0003541700000000,  0.0001836400000000, -0.0000428400000000 ]  - [  -0.0005608600000000, -0.0008562900000000,  0.0016069900000000 ]  - [  -0.0000332900000000,  0.0000270500000000, -0.0000625200000000 ]- atom:   29  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0005895300000000, -0.0000233800000000,  0.0005586500000000 ]  - [   0.0005907700000000,  0.0000236900000000,  0.0014201400000000 ]  - [   0.0008988400000000, -0.0005155600000000, -0.0012635800000000 ]  - [   0.0008934600000000,  0.0005097800000000, -0.0007237900000000 ]  - [  -0.0006562400000000, -0.0000115100000000, -0.0000084600000000 ]  - [   0.0004906900000000, -0.0000039700000000,  0.0000010600000000 ]  - [   0.0003128500000000, -0.0000018400000000,  0.0009800500000000 ]  - [   0.0001760500000000,  0.0000008700000000,  0.0009899600000000 ]  - [  -0.0001222900000000,  0.0000000800000000, -0.0009905300000000 ]  - [   0.0001727300000000,  0.0000001300000000, -0.0009892400000000 ]  - [   0.0000121200000000,  0.0000244400000000, -0.0000819200000000 ]  - [   0.0000168900000000, -0.0000252800000000,  0.0000809800000000 ]  - [   0.0000062400000000, -0.0000893800000000,  0.0007311600000000 ]  - [  -0.0001521000000000, -0.0000372900000000,  0.0008558900000000 ]  - [  -0.0000186400000000, -0.0001344100000000, -0.0007352000000000 ]  - [   0.0001495000000000, -0.0000679800000000, -0.0008310800000000 ]  - [  -0.0000178400000000,  0.0001171800000000,  0.0007188300000000 ]  - [   0.0001453600000000,  0.0000712700000000,  0.0008386700000000 ]  - [   0.0000688400000000,  0.0001126600000000, -0.0007468200000000 ]  - [  -0.0003971700000000, -0.0002374900000000, -0.0010035300000000 ]  - [  -0.0002799400000000,  0.0003966000000000, -0.0005576200000000 ]  - [   0.0001920900000000,  0.0000454500000000, -0.0008178000000000 ]  - [   0.0000220500000000,  0.0000863100000000,  0.0007249700000000 ]  - [  -0.0001393700000000,  0.0000405500000000,  0.0008444500000000 ]  - [   0.0000206200000000, -0.0000897300000000, -0.0007397600000000 ]  - [  -0.0001435200000000, -0.0000238700000000, -0.0008326500000000 ]  - [  -0.0000234300000000, -0.0001206300000000,  0.0007154000000000 ]  - [   0.0001351400000000, -0.0000681400000000,  0.0008391600000000 ]  - [  -0.0057508700000000, -0.0016612300000000,  0.0021134600000000 ]  - [   0.0001356800000000,  0.0001420100000000,  0.0008924100000000 ]  - [  -0.0001633000000000,  0.0001445200000000, -0.0008909300000000 ]  - [   0.0000799300000000,  0.0001447400000000, -0.0008905600000000 ]  - [   0.0032801900000000, -0.0001934300000000,  0.0008915800000000 ]  - [   0.0000810900000000, -0.0001422400000000,  0.0008926800000000 ]  - [  -0.0000978400000000, -0.0001446100000000, -0.0008911700000000 ]  - [   0.0000660500000000, -0.0001448400000000, -0.0008908300000000 ]  - [   0.0008284800000000,  0.0003801100000000,  0.0017109600000000 ]  - [   0.0002095400000000, -0.0000270900000000,  0.0004993400000000 ]  - [   0.0001202000000000, -0.0000737800000000, -0.0007942300000000 ]  - [   0.0002826700000000, -0.0000993700000000, -0.0009345600000000 ]  - [   0.0001612100000000,  0.0000714200000000,  0.0008514000000000 ]  - [  -0.0003942400000000,  0.0000012200000000,  0.0007793500000000 ]  - [  -0.0001430900000000, -0.0001212600000000, -0.0008515400000000 ]  - [   0.0000050900000000,  0.0000824400000000, -0.0007529000000000 ]  - [   0.0001183000000000,  0.0000746500000000, -0.0007987100000000 ]  - [  -0.0000191700000000,  0.0002781800000000, -0.0007173000000000 ]  - [  -0.0005235700000000,  0.0001509800000000,  0.0007919100000000 ]  - [   0.0000471300000000,  0.0000856700000000,  0.0007015900000000 ]  - [   0.0001607500000000, -0.0000595500000000, -0.0006305600000000 ]  - [  -0.0000145200000000, -0.0000840000000000, -0.0007833600000000 ]  - [   0.0003471900000000, -0.0001314400000000,  0.0010821800000000 ]  - [   0.0009505100000000, -0.0005287100000000, -0.0001359100000000 ]  - [  -0.0000033500000000,  0.0000831400000000,  0.0008958500000000 ]  - [  -0.0000028000000000,  0.0002023000000000,  0.0008884300000000 ]  - [  -0.0000120100000000,  0.0000287100000000, -0.0008875100000000 ]  - [  -0.0000108200000000,  0.0002552700000000, -0.0008968300000000 ]  - [  -0.0000062100000000, -0.0000511600000000,  0.0009024000000000 ]  - [  -0.0000056800000000, -0.0002337000000000,  0.0008820200000000 ]  - [  -0.0000385900000000,  0.0001813300000000, -0.0009408600000000 ]  - [  -0.0000373300000000, -0.0004627500000000, -0.0008440900000000 ]  - [  -0.0146434900000000,  0.0000307200000000,  0.0000889100000000 ]  - [  -0.0149778600000000, -0.0000014700000000, -0.0004593300000000 ]  - [   0.0137477100000000,  0.0000038600000000,  0.0004623600000000 ]  - [   0.0140809800000000, -0.0000299400000000, -0.0000883800000000 ]  - [  -0.0000320600000000,  0.0013038700000000,  0.0002767300000000 ]  - [  -0.0000337300000000,  0.0009927100000000, -0.0001527200000000 ]  - [  -0.0000499600000000,  0.0013801300000000, -0.0002193200000000 ]  - [  -0.0000496300000000,  0.0009178500000000,  0.0000961700000000 ]  - [  -0.0001300300000000, -0.0012423300000000,  0.0001011300000000 ]  - [  -0.0001302100000000, -0.0010534400000000,  0.0000231300000000 ]  - [  -0.0005786400000000, -0.0012713600000000, -0.0001274500000000 ]  - [  -0.0005709500000000, -0.0010249700000000,  0.0000051100000000 ]  - [  -0.0141986100000000,  0.0000064800000000,  0.0000730100000000 ]  - [  -0.0145114000000000,  0.0000020500000000,  0.0000123400000000 ]  - [   0.0142151300000000, -0.0000011500000000, -0.0000141600000000 ]  - [   0.0145256400000000, -0.0000059300000000, -0.0000704100000000 ]  - [   0.0015477500000000,  0.0011261100000000,  0.0000733000000000 ]  - [  -0.0001816500000000,  0.0011476800000000,  0.0000611900000000 ]  - [   0.0001002600000000,  0.0011470900000000, -0.0000613300000000 ]  - [  -0.0001006700000000,  0.0011472600000000, -0.0000613000000000 ]  - [  -0.0001618100000000, -0.0011504400000000,  0.0000603700000000 ]  - [  -0.0000974000000000, -0.0011475900000000,  0.0000620600000000 ]  - [   0.0000825500000000, -0.0011467200000000, -0.0000610400000000 ]  - [  -0.0000820600000000, -0.0011468300000000, -0.0000611900000000 ]  - [   0.0006111300000000, -0.0001206600000000,  0.0000165700000000 ]  - [   0.0008052500000000, -0.0002204200000000, -0.0000265900000000 ]  - [  -0.0006312400000000, -0.0000449600000000,  0.0000241200000000 ]  - [  -0.0008295100000000, -0.0001444300000000, -0.0000162800000000 ]  - [  -0.0004559500000000, -0.0000196400000000, -0.0001241200000000 ]  - [  -0.0008419200000000,  0.0001672600000000, -0.0000343600000000 ]  - [   0.0005851800000000,  0.0000967400000000,  0.0000355700000000 ]  - [   0.0009633000000000,  0.0002837300000000,  0.0001230500000000 ]  - [  -0.0007721300000000,  0.0018988500000000, -0.0012155100000000 ]  - [  -0.0002170300000000,  0.0000005000000000,  0.0000157200000000 ]  - [   0.0002439400000000,  0.0000006800000000, -0.0000203300000000 ]  - [  -0.0001500000000000,  0.0000003600000000, -0.0000211700000000 ]  - [   0.0006715700000000,  0.0001093300000000, -0.0006629300000000 ]  - [   0.0004266100000000, -0.0002064600000000,  0.0001791100000000 ]  - [  -0.0010298000000000, -0.0000588400000000, -0.0001815900000000 ]  - [  -0.0007580000000000, -0.0003749000000000,  0.0006591200000000 ]  - [  -0.0008664500000000,  0.0001251700000000, -0.0000321000000000 ]  - [  -0.0000976900000000,  0.0003504700000000, -0.0007807500000000 ]  - [   0.0013487800000000, -0.0000892100000000,  0.0007898800000000 ]  - [   0.0005366200000000,  0.0001381400000000,  0.0000318700000000 ]  - [   0.0000031300000000, -0.0000190500000000,  0.0000071600000000 ]  - [   0.0000020300000000,  0.0000189000000000,  0.0000259500000000 ]  - [   0.0000453300000000, -0.0001137800000000,  0.0000640500000000 ]  - [   0.0000431200000000,  0.0001124700000000, -0.0000967300000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0005122400000000, -0.0001009600000000,  0.0013781100000000 ]  - [   0.0005122400000000, -0.0001009600000000,  0.0013781100000000 ]  - [  -0.0006762100000000, -0.0003747800000000, -0.0010653300000000 ]  - [   0.0006762100000000, -0.0003747800000000, -0.0010653300000000 ]  - [   0.0000000000000000, -0.0024886800000000, -0.0073689900000000 ]  - [   0.0000000000000000, -0.0001236700000000,  0.0000070200000000 ]  - [   0.0000000000000000,  0.0047714300000000,  0.0051356300000000 ]  - [   0.0000000000000000,  0.0000690400000000,  0.0009244300000000 ]  - [   0.0000000000000000,  0.0002902200000000, -0.0004881900000000 ]  - [   0.0000000000000000,  0.0000345100000000, -0.0009164100000000 ]  - [   0.0008250300000000,  0.0005362800000000, -0.0001774800000000 ]  - [  -0.0008250300000000,  0.0005362800000000, -0.0001774800000000 ]  - [  -0.0000560800000000, -0.0000547400000000,  0.0007447200000000 ]  - [  -0.0000513800000000,  0.0000539900000000,  0.0006591000000000 ]  - [   0.0002124900000000,  0.0002028800000000, -0.0008354800000000 ]  - [   0.0000494600000000, -0.0000328200000000, -0.0007362400000000 ]  - [  -0.0000843100000000, -0.0000726300000000,  0.0003284000000000 ]  - [   0.0000421700000000,  0.0000596400000000,  0.0007175400000000 ]  - [  -0.0000359600000000,  0.0000573100000000, -0.0007373200000000 ]  - [  -0.0019287400000000, -0.0000906100000000, -0.0024855400000000 ]  - [   0.0019287400000000, -0.0000906100000000, -0.0024855400000000 ]  - [   0.0000359600000000,  0.0000573100000000, -0.0007373200000000 ]  - [  -0.0000421700000000,  0.0000596400000000,  0.0007175400000000 ]  - [   0.0000843100000000, -0.0000726300000000,  0.0003284000000000 ]  - [  -0.0000494600000000, -0.0000328200000000, -0.0007362400000000 ]  - [  -0.0002124900000000,  0.0002028800000000, -0.0008354800000000 ]  - [   0.0000513800000000,  0.0000539900000000,  0.0006591000000000 ]  - [   0.0000560800000000, -0.0000547400000000,  0.0007447200000000 ]  - [   0.0000000000000000, -0.2950659300000000,  0.1711450000000000 ]  - [   0.0000000000000000,  0.0000782900000000,  0.0008788000000000 ]  - [   0.0000000000000000, -0.0003016500000000, -0.0008938700000000 ]  - [   0.0000000000000000,  0.0000910600000000, -0.0008776500000000 ]  - [   0.0000000000000000,  0.0186060900000000, -0.0172300800000000 ]  - [   0.0000000000000000, -0.0001172200000000,  0.0008866800000000 ]  - [   0.0000000000000000,  0.0001552700000000, -0.0009387000000000 ]  - [   0.0000000000000000, -0.0001122900000000, -0.0008872900000000 ]  - [  -0.0000240800000000, -0.0009732300000000,  0.0010847400000000 ]  - [  -0.0001245400000000, -0.0000870700000000,  0.0008795700000000 ]  - [   0.0000389700000000, -0.0000837400000000, -0.0007740500000000 ]  - [   0.0000930500000000,  0.0000873300000000, -0.0009848300000000 ]  - [  -0.0000329600000000,  0.0000556800000000,  0.0006940800000000 ]  - [   0.0007804900000000,  0.0007297200000000,  0.0007744000000000 ]  - [  -0.0001604400000000, -0.0000616900000000, -0.0012019500000000 ]  - [  -0.0000174300000000,  0.0000793600000000, -0.0007623700000000 ]  - [   0.0000174300000000,  0.0000793600000000, -0.0007623700000000 ]  - [   0.0001604400000000, -0.0000616900000000, -0.0012019500000000 ]  - [  -0.0007804900000000,  0.0007297200000000,  0.0007744000000000 ]  - [   0.0000329600000000,  0.0000556800000000,  0.0006940800000000 ]  - [  -0.0000930500000000,  0.0000873300000000, -0.0009848300000000 ]  - [  -0.0000389700000000, -0.0000837400000000, -0.0007740500000000 ]  - [   0.0001245400000000, -0.0000870700000000,  0.0008795700000000 ]  - [   0.0000240800000000, -0.0009732300000000,  0.0010847400000000 ]  - [   0.0000603000000000,  0.0003808500000000,  0.0009132900000000 ]  - [  -0.0000603000000000,  0.0003808500000000,  0.0009132900000000 ]  - [   0.0001141700000000,  0.0005485600000000, -0.0008280800000000 ]  - [  -0.0001141700000000,  0.0005485600000000, -0.0008280800000000 ]  - [   0.0000923000000000, -0.0003109000000000,  0.0008676200000000 ]  - [  -0.0000923000000000, -0.0003109000000000,  0.0008676200000000 ]  - [   0.0003255200000000, -0.0003445100000000, -0.0008042600000000 ]  - [  -0.0003255200000000, -0.0003445100000000, -0.0008042600000000 ]  - [  -0.0141532500000000,  0.0000342100000000,  0.0000259800000000 ]  - [  -0.0148838900000000,  0.0000566200000000, -0.0003123600000000 ]  - [   0.0148838900000000,  0.0000566200000000, -0.0003123600000000 ]  - [   0.0141532500000000,  0.0000342100000000,  0.0000259800000000 ]  - [   0.0001953900000000,  0.0010091800000000,  0.0001058500000000 ]  - [  -0.0001953900000000,  0.0010091800000000,  0.0001058500000000 ]  - [   0.0003121700000000,  0.0009827400000000, -0.0001402200000000 ]  - [  -0.0003121700000000,  0.0009827400000000, -0.0001402200000000 ]  - [   0.0000879300000000, -0.0009389400000000, -0.0000182900000000 ]  - [  -0.0000879300000000, -0.0009389400000000, -0.0000182900000000 ]  - [  -0.0000300500000000, -0.0006804900000000, -0.0000542700000000 ]  - [   0.0000300500000000, -0.0006804900000000, -0.0000542700000000 ]  - [  -0.0147262600000000, -0.0003451000000000, -0.0008120500000000 ]  - [  -0.0143493500000000, -0.0000086200000000, -0.0000028800000000 ]  - [   0.0143493500000000, -0.0000086200000000, -0.0000028800000000 ]  - [   0.0147262600000000, -0.0003451000000000, -0.0008120500000000 ]  - [   0.0000000000000000, -0.0068626700000000, -0.0020971700000000 ]  - [   0.0000000000000000,  0.0011650600000000,  0.0000392900000000 ]  - [   0.0000000000000000,  0.0013036500000000,  0.0001172300000000 ]  - [   0.0000000000000000,  0.0011751500000000, -0.0000377700000000 ]  - [   0.0000000000000000, -0.0042401500000000,  0.0009246400000000 ]  - [   0.0000000000000000, -0.0012256000000000,  0.0000609500000000 ]  - [   0.0000000000000000, -0.0014950400000000, -0.0001475400000000 ]  - [   0.0000000000000000, -0.0012009500000000, -0.0000639900000000 ]  - [   0.0006253000000000, -0.0002531500000000,  0.0000038300000000 ]  - [   0.0008179200000000, -0.0005094500000000,  0.0001222900000000 ]  - [  -0.0008179200000000, -0.0005094500000000,  0.0001222900000000 ]  - [  -0.0006253000000000, -0.0002531500000000,  0.0000038300000000 ]  - [  -0.0019525300000000,  0.0000746100000000,  0.0014102600000000 ]  - [  -0.0005147500000000,  0.0002217100000000,  0.0000244400000000 ]  - [   0.0005147500000000,  0.0002217100000000,  0.0000244400000000 ]  - [   0.0019525300000000,  0.0000746100000000,  0.0014102600000000 ]  - [   0.0000000000000000,  0.2859109000000000, -0.1477541700000000 ]  - [   0.0000000000000000,  0.0000496400000000,  0.0000247500000000 ]  - [   0.0000000000000000,  0.0001949800000000,  0.0001970300000000 ]  - [   0.0000000000000000,  0.0000315200000000, -0.0000319600000000 ]  - [   0.0013405600000000,  0.0011406900000000,  0.0003208700000000 ]  - [   0.0007622300000000, -0.0000956500000000, -0.0000732800000000 ]  - [  -0.0007622300000000, -0.0000956500000000, -0.0000732800000000 ]  - [  -0.0013405600000000,  0.0011406900000000,  0.0003208700000000 ]  - [  -0.0006255500000000,  0.0001545800000000,  0.0000411100000000 ]  - [  -0.0021087800000000, -0.0010380000000000,  0.0013835700000000 ]  - [   0.0021087800000000, -0.0010380000000000,  0.0013835700000000 ]  - [   0.0006255500000000,  0.0001545800000000,  0.0000411100000000 ]  - [  -0.0001671900000000, -0.0001150900000000,  0.0001465300000000 ]  - [   0.0001671900000000, -0.0001150900000000,  0.0001465300000000 ]  - [  -0.0004579800000000, -0.0002402600000000, -0.0001238000000000 ]  - [   0.0004579800000000, -0.0002402600000000, -0.0001238000000000 ]- atom:   29  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0005070400000000,  0.0000994800000000,  0.0006039800000000 ]  - [  -0.0005070400000000,  0.0000994800000000,  0.0006039800000000 ]  - [   0.0006649700000000,  0.0003711100000000, -0.0009101500000000 ]  - [  -0.0006649700000000,  0.0003711100000000, -0.0009101500000000 ]  - [   0.0000000000000000,  0.0024936900000000,  0.0071653400000000 ]  - [   0.0000000000000000,  0.0001185400000000, -0.0000068900000000 ]  - [   0.0000000000000000, -0.0046512700000000, -0.0030504500000000 ]  - [   0.0000000000000000, -0.0000673800000000,  0.0010537700000000 ]  - [   0.0000000000000000, -0.0002844100000000, -0.0014796700000000 ]  - [   0.0000000000000000, -0.0000339300000000, -0.0010619800000000 ]  - [  -0.0008046400000000, -0.0005244400000000,  0.0001740100000000 ]  - [   0.0008046400000000, -0.0005244400000000,  0.0001740100000000 ]  - [  -0.0000710100000000, -0.0001024500000000,  0.0008232900000000 ]  - [  -0.0000769900000000, -0.0002089400000000,  0.0009086000000000 ]  - [  -0.0000821000000000, -0.0003552800000000, -0.0007351700000000 ]  - [   0.0000775300000000, -0.0001240000000000, -0.0008317200000000 ]  - [   0.0002015100000000,  0.0002268600000000,  0.0012211600000000 ]  - [   0.0000806400000000,  0.0000978900000000,  0.0008447400000000 ]  - [  -0.0000867400000000,  0.0001000400000000, -0.0008250000000000 ]  - [   0.0017598400000000,  0.0002418400000000,  0.0008832600000000 ]  - [  -0.0017598400000000,  0.0002418400000000,  0.0008832600000000 ]  - [   0.0000867400000000,  0.0001000400000000, -0.0008250000000000 ]  - [  -0.0000806400000000,  0.0000978900000000,  0.0008447400000000 ]  - [  -0.0002015100000000,  0.0002268600000000,  0.0012211600000000 ]  - [  -0.0000775300000000, -0.0001240000000000, -0.0008317200000000 ]  - [   0.0000821000000000, -0.0003552800000000, -0.0007351700000000 ]  - [   0.0000769900000000, -0.0002089400000000,  0.0009086000000000 ]  - [   0.0000710100000000, -0.0001024500000000,  0.0008232900000000 ]  - [   0.0000000000000000,  0.3124689600000000, -0.1841763000000000 ]  - [   0.0000000000000000,  0.0002069700000000,  0.0009048400000000 ]  - [   0.0000000000000000,  0.0005839200000000, -0.0008858200000000 ]  - [   0.0000000000000000,  0.0001996300000000, -0.0009019600000000 ]  - [   0.0000000000000000, -0.0195272300000000,  0.0195155100000000 ]  - [   0.0000000000000000, -0.0001681800000000,  0.0008974700000000 ]  - [   0.0000000000000000, -0.0004397700000000, -0.0008410300000000 ]  - [   0.0000000000000000, -0.0001784300000000, -0.0008928100000000 ]  - [  -0.0001163800000000,  0.0007920500000000,  0.0004790100000000 ]  - [  -0.0000086700000000, -0.0000709700000000,  0.0006964800000000 ]  - [   0.0000940500000000, -0.0000747800000000, -0.0008021400000000 ]  - [   0.0000353900000000, -0.0002425300000000, -0.0005901900000000 ]  - [   0.0001451900000000,  0.0001015700000000,  0.0008568100000000 ]  - [  -0.0006360300000000, -0.0005571300000000,  0.0007916000000000 ]  - [   0.0000301600000000,  0.0002191500000000, -0.0003758700000000 ]  - [  -0.0000960900000000,  0.0000783800000000, -0.0007904300000000 ]  - [   0.0000960900000000,  0.0000783800000000, -0.0007904300000000 ]  - [  -0.0000301600000000,  0.0002191500000000, -0.0003758700000000 ]  - [   0.0006360300000000, -0.0005571300000000,  0.0007916000000000 ]  - [  -0.0001451900000000,  0.0001015700000000,  0.0008568100000000 ]  - [  -0.0000353900000000, -0.0002425300000000, -0.0005901900000000 ]  - [  -0.0000940500000000, -0.0000747800000000, -0.0008021400000000 ]  - [   0.0000086700000000, -0.0000709700000000,  0.0006964800000000 ]  - [   0.0001163800000000,  0.0007920500000000,  0.0004790100000000 ]  - [  -0.0000589500000000, -0.0000877400000000,  0.0008701300000000 ]  - [   0.0000589500000000, -0.0000877400000000,  0.0008701300000000 ]  - [  -0.0001117300000000, -0.0002515400000000, -0.0009536900000000 ]  - [   0.0001117300000000, -0.0002515400000000, -0.0009536900000000 ]  - [  -0.0000901200000000,  0.0000193900000000,  0.0009147700000000 ]  - [   0.0000901200000000,  0.0000193900000000,  0.0009147700000000 ]  - [  -0.0003177600000000,  0.0000506500000000, -0.0009765400000000 ]  - [   0.0003177600000000,  0.0000506500000000, -0.0009765400000000 ]  - [  -0.0145731200000000, -0.0000332200000000, -0.0000255800000000 ]  - [  -0.0138489600000000, -0.0000544200000000,  0.0003112200000000 ]  - [   0.0138489600000000, -0.0000544200000000,  0.0003112200000000 ]  - [   0.0145731200000000, -0.0000332200000000, -0.0000255800000000 ]  - [  -0.0001908000000000,  0.0012851300000000,  0.0000191900000000 ]  - [   0.0001908000000000,  0.0012851300000000,  0.0000191900000000 ]  - [  -0.0003052200000000,  0.0013118700000000,  0.0000124000000000 ]  - [   0.0003052200000000,  0.0013118700000000,  0.0000124000000000 ]  - [  -0.0000860400000000, -0.0013542100000000,  0.0001457700000000 ]  - [   0.0000860400000000, -0.0013542100000000,  0.0001457700000000 ]  - [   0.0000323900000000, -0.0016073200000000, -0.0000730800000000 ]  - [  -0.0000323900000000, -0.0016073200000000, -0.0000730800000000 ]  - [  -0.0140127000000000,  0.0003378700000000,  0.0007926900000000 ]  - [  -0.0143796800000000,  0.0000096300000000,  0.0000007100000000 ]  - [   0.0143796800000000,  0.0000096300000000,  0.0000007100000000 ]  - [   0.0140127000000000,  0.0003378700000000,  0.0007926900000000 ]  - [   0.0000000000000000,  0.0087689400000000,  0.0022242200000000 ]  - [   0.0000000000000000,  0.0011352800000000,  0.0000840500000000 ]  - [   0.0000000000000000,  0.0009984200000000, -0.0002371500000000 ]  - [   0.0000000000000000,  0.0011218500000000, -0.0000852900000000 ]  - [   0.0000000000000000,  0.0018293800000000, -0.0007965700000000 ]  - [   0.0000000000000000, -0.0010740800000000,  0.0000648000000000 ]  - [   0.0000000000000000, -0.0008097400000000,  0.0000205200000000 ]  - [   0.0000000000000000, -0.0010950300000000, -0.0000593200000000 ]  - [   0.0008119100000000, -0.0000182500000000, -0.0000043800000000 ]  - [   0.0006268500000000,  0.0002323200000000, -0.0001210900000000 ]  - [  -0.0006268500000000,  0.0002323200000000, -0.0001210900000000 ]  - [  -0.0008119100000000, -0.0000182500000000, -0.0000043800000000 ]  - [   0.0004975200000000,  0.0001921400000000, -0.0013761900000000 ]  - [  -0.0009099600000000,  0.0000489600000000, -0.0000244400000000 ]  - [   0.0009099600000000,  0.0000489600000000, -0.0000244400000000 ]  - [  -0.0004975200000000,  0.0001921400000000, -0.0013761900000000 ]  - [   0.0000000000000000, -0.3019989500000000,  0.1622006600000000 ]  - [   0.0000000000000000, -0.0000490100000000,  0.0000126100000000 ]  - [   0.0000000000000000, -0.0001919800000000, -0.0002288800000000 ]  - [   0.0000000000000000, -0.0000310600000000, -0.0000136500000000 ]  - [   0.0001094200000000, -0.0013853000000000, -0.0003007300000000 ]  - [   0.0006889800000000, -0.0001745800000000,  0.0000731100000000 ]  - [  -0.0006889800000000, -0.0001745800000000,  0.0000731100000000 ]  - [  -0.0001094200000000, -0.0013853000000000, -0.0003007300000000 ]  - [  -0.0007792800000000,  0.0001124200000000, -0.0000393200000000 ]  - [   0.0006494200000000,  0.0012873500000000, -0.0013563500000000 ]  - [  -0.0006494200000000,  0.0012873500000000, -0.0013563500000000 ]  - [   0.0007792800000000,  0.0001124200000000, -0.0000393200000000 ]  - [   0.0001629500000000,  0.0001127200000000, -0.0001047600000000 ]  - [  -0.0001629500000000,  0.0001127200000000, -0.0001047600000000 ]  - [   0.0004471800000000,  0.0002357300000000,  0.0000808400000000 ]  - [  -0.0004471800000000,  0.0002357300000000,  0.0000808400000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0004813700000000, -0.0001663700000000,  0.0014488200000000 ]  - [   0.0004813700000000, -0.0001663700000000,  0.0014488200000000 ]  - [  -0.0002074100000000, -0.0000372400000000, -0.0016099300000000 ]  - [   0.0002074100000000, -0.0000372400000000, -0.0016099300000000 ]  - [   0.0000000000000000, -0.0042062500000000,  0.0017533200000000 ]  - [   0.0000000000000000, -0.0000335200000000,  0.0000304800000000 ]  - [   0.0000000000000000, -0.0015576800000000,  0.0000924000000000 ]  - [   0.0000000000000000,  0.0000121000000000,  0.0010108400000000 ]  - [   0.0000000000000000,  0.0000436800000000, -0.0009627400000000 ]  - [   0.0000000000000000,  0.0000155500000000, -0.0009621400000000 ]  - [  -0.0000614800000000, -0.0000636300000000, -0.0000516100000000 ]  - [   0.0000614800000000, -0.0000636300000000, -0.0000516100000000 ]  - [  -0.0000681200000000, -0.0000695300000000,  0.0007778300000000 ]  - [  -0.0000614900000000, -0.0000384700000000,  0.0007578200000000 ]  - [   0.0002265700000000, -0.0000496200000000, -0.0009597000000000 ]  - [   0.0000666900000000, -0.0000787700000000, -0.0008072700000000 ]  - [   0.0001031600000000,  0.0000329600000000,  0.0008424200000000 ]  - [   0.0000591400000000,  0.0000752300000000,  0.0007884700000000 ]  - [  -0.0000583600000000,  0.0000815300000000, -0.0008152300000000 ]  - [   0.0000059200000000, -0.0000980100000000, -0.0006485100000000 ]  - [  -0.0000059200000000, -0.0000980100000000, -0.0006485100000000 ]  - [   0.0000583600000000,  0.0000815300000000, -0.0008152300000000 ]  - [  -0.0000591400000000,  0.0000752300000000,  0.0007884700000000 ]  - [  -0.0001031600000000,  0.0000329600000000,  0.0008424200000000 ]  - [  -0.0000666900000000, -0.0000787700000000, -0.0008072700000000 ]  - [  -0.0002265700000000, -0.0000496200000000, -0.0009597000000000 ]  - [   0.0000614900000000, -0.0000384700000000,  0.0007578200000000 ]  - [   0.0000681200000000, -0.0000695300000000,  0.0007778300000000 ]  - [   0.0000000000000000,  0.1817864000000000, -0.1624382600000000 ]  - [   0.0000000000000000,  0.0001313700000000,  0.0008709400000000 ]  - [   0.0000000000000000,  0.0001511600000000, -0.0007863300000000 ]  - [   0.0000000000000000,  0.0001340200000000, -0.0008812900000000 ]  - [   0.0000000000000000,  0.0183477200000000, -0.0120858500000000 ]  - [   0.0000000000000000, -0.0001389400000000,  0.0008738400000000 ]  - [   0.0000000000000000, -0.0001965400000000, -0.0008539900000000 ]  - [   0.0000000000000000, -0.0001434300000000, -0.0008836100000000 ]  - [   0.0011627600000000,  0.0004009600000000,  0.0011145000000000 ]  - [  -0.0001069900000000, -0.0000830200000000,  0.0008392100000000 ]  - [   0.0000566200000000, -0.0000704600000000, -0.0007666300000000 ]  - [  -0.0001874100000000, -0.0000323700000000, -0.0003525600000000 ]  - [   0.0000925400000000,  0.0000769300000000,  0.0008270300000000 ]  - [  -0.0001203900000000, -0.0000979800000000,  0.0010248400000000 ]  - [   0.0000671300000000, -0.0001763000000000, -0.0008643500000000 ]  - [  -0.0000128500000000,  0.0000592700000000, -0.0007267000000000 ]  - [   0.0000128500000000,  0.0000592700000000, -0.0007267000000000 ]  - [  -0.0000671300000000, -0.0001763000000000, -0.0008643500000000 ]  - [   0.0001203900000000, -0.0000979800000000,  0.0010248400000000 ]  - [  -0.0000925400000000,  0.0000769300000000,  0.0008270300000000 ]  - [   0.0001874100000000, -0.0000323700000000, -0.0003525600000000 ]  - [  -0.0000566200000000, -0.0000704600000000, -0.0007666300000000 ]  - [   0.0001069900000000, -0.0000830200000000,  0.0008392100000000 ]  - [  -0.0011627600000000,  0.0004009600000000,  0.0011145000000000 ]  - [  -0.0000035800000000,  0.0001660700000000,  0.0008756200000000 ]  - [   0.0000035800000000,  0.0001660700000000,  0.0008756200000000 ]  - [   0.0000051400000000,  0.0000821600000000, -0.0008872800000000 ]  - [  -0.0000051400000000,  0.0000821600000000, -0.0008872800000000 ]  - [  -0.0000101900000000, -0.0001205800000000,  0.0008954900000000 ]  - [   0.0000101900000000, -0.0001205800000000,  0.0008954900000000 ]  - [  -0.0000481400000000, -0.0000588800000000, -0.0009032900000000 ]  - [   0.0000481400000000, -0.0000588800000000, -0.0009032900000000 ]  - [  -0.0141714100000000,  0.0000250600000000,  0.0000792200000000 ]  - [  -0.0149770700000000,  0.0000487100000000, -0.0002458700000000 ]  - [   0.0149770700000000,  0.0000487100000000, -0.0002458700000000 ]  - [   0.0141714100000000,  0.0000250600000000,  0.0000792200000000 ]  - [   0.0000720500000000,  0.0010993100000000, -0.0000599700000000 ]  - [  -0.0000720500000000,  0.0010993100000000, -0.0000599700000000 ]  - [  -0.0000816500000000,  0.0011591400000000,  0.0000093500000000 ]  - [   0.0000816500000000,  0.0011591400000000,  0.0000093500000000 ]  - [  -0.0000964400000000, -0.0010754500000000, -0.0001872100000000 ]  - [   0.0000964400000000, -0.0010754500000000, -0.0001872100000000 ]  - [  -0.0002004500000000, -0.0011641100000000,  0.0001598400000000 ]  - [   0.0002004500000000, -0.0011641100000000,  0.0001598400000000 ]  - [  -0.0142768000000000,  0.0000988500000000,  0.0001493300000000 ]  - [  -0.0143623300000000, -0.0000011900000000, -0.0000190700000000 ]  - [   0.0143623300000000, -0.0000011900000000, -0.0000190700000000 ]  - [   0.0142768000000000,  0.0000988500000000,  0.0001493300000000 ]  - [   0.0000000000000000,  0.0038141900000000,  0.0031583400000000 ]  - [   0.0000000000000000,  0.0011364000000000,  0.0000738500000000 ]  - [   0.0000000000000000,  0.0011456400000000, -0.0001401400000000 ]  - [   0.0000000000000000,  0.0011456300000000, -0.0000692100000000 ]  - [   0.0000000000000000,  0.0016184200000000,  0.0000103900000000 ]  - [   0.0000000000000000, -0.0011479900000000,  0.0000765900000000 ]  - [   0.0000000000000000, -0.0011458200000000, -0.0000554200000000 ]  - [   0.0000000000000000, -0.0011604400000000, -0.0000702300000000 ]  - [   0.0007212100000000, -0.0001528600000000,  0.0000284200000000 ]  - [   0.0008190500000000, -0.0001773400000000,  0.0001496100000000 ]  - [  -0.0008190500000000, -0.0001773400000000,  0.0001496100000000 ]  - [  -0.0007212100000000, -0.0001528600000000,  0.0000284200000000 ]  - [  -0.0006746600000000,  0.0002842400000000, -0.0000746200000000 ]  - [  -0.0007304800000000,  0.0001378700000000,  0.0000260300000000 ]  - [   0.0007304800000000,  0.0001378700000000,  0.0000260300000000 ]  - [   0.0006746600000000,  0.0002842400000000, -0.0000746200000000 ]  - [   0.0000000000000000, -0.1999621300000000,  0.1722094900000000 ]  - [   0.0000000000000000,  0.0000093900000000,  0.0000401000000000 ]  - [   0.0000000000000000,  0.0000998300000000, -0.0002974300000000 ]  - [   0.0000000000000000,  0.0000114900000000, -0.0000494300000000 ]  - [   0.0002195900000000, -0.0000052000000000, -0.0010287300000000 ]  - [   0.0007408500000000, -0.0001351800000000, -0.0000466400000000 ]  - [  -0.0007408500000000, -0.0001351800000000, -0.0000466400000000 ]  - [  -0.0002195900000000, -0.0000052000000000, -0.0010287300000000 ]  - [  -0.0006979800000000,  0.0001509600000000, -0.0000670600000000 ]  - [  -0.0012299800000000,  0.0000289400000000,  0.0004548200000000 ]  - [   0.0012299800000000,  0.0000289400000000,  0.0004548200000000 ]  - [   0.0006979800000000,  0.0001509600000000, -0.0000670600000000 ]  - [   0.0000147400000000, -0.0000181400000000,  0.0000246900000000 ]  - [  -0.0000147400000000, -0.0000181400000000,  0.0000246900000000 ]  - [   0.0000353900000000,  0.0000073700000000,  0.0000166000000000 ]  - [  -0.0000353900000000,  0.0000073700000000,  0.0000166000000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0004849400000000,  0.0001668000000000,  0.0005290700000000 ]  - [  -0.0004849400000000,  0.0001668000000000,  0.0005290700000000 ]  - [   0.0002037500000000,  0.0000380700000000, -0.0003625200000000 ]  - [  -0.0002037500000000,  0.0000380700000000, -0.0003625200000000 ]  - [   0.0000000000000000,  0.0040899600000000, -0.0017018200000000 ]  - [   0.0000000000000000,  0.0000302900000000, -0.0000309300000000 ]  - [   0.0000000000000000,  0.0015690800000000,  0.0018906600000000 ]  - [   0.0000000000000000, -0.0000114300000000,  0.0009663600000000 ]  - [   0.0000000000000000, -0.0000420500000000, -0.0010154100000000 ]  - [   0.0000000000000000, -0.0000153900000000, -0.0010167400000000 ]  - [   0.0000619100000000,  0.0000623300000000,  0.0000534400000000 ]  - [  -0.0000619100000000,  0.0000623300000000,  0.0000534400000000 ]  - [  -0.0000597600000000, -0.0000888000000000,  0.0007911500000000 ]  - [  -0.0000673800000000, -0.0001201400000000,  0.0008122800000000 ]  - [  -0.0000972200000000, -0.0001090000000000, -0.0006103300000000 ]  - [   0.0000612200000000, -0.0000795800000000, -0.0007611600000000 ]  - [   0.0000196600000000,  0.0001259400000000,  0.0007201800000000 ]  - [   0.0000643000000000,  0.0000832800000000,  0.0007753700000000 ]  - [  -0.0000650700000000,  0.0000768600000000, -0.0007477100000000 ]  - [  -0.0001264800000000,  0.0002576000000000, -0.0009103100000000 ]  - [   0.0001264800000000,  0.0002576000000000, -0.0009103100000000 ]  - [   0.0000650700000000,  0.0000768600000000, -0.0007477100000000 ]  - [  -0.0000643000000000,  0.0000832800000000,  0.0007753700000000 ]  - [  -0.0000196600000000,  0.0001259400000000,  0.0007201800000000 ]  - [  -0.0000612200000000, -0.0000795800000000, -0.0007611600000000 ]  - [   0.0000972200000000, -0.0001090000000000, -0.0006103300000000 ]  - [   0.0000673800000000, -0.0001201400000000,  0.0008122800000000 ]  - [   0.0000597600000000, -0.0000888000000000,  0.0007911500000000 ]  - [   0.0000000000000000, -0.1732501600000000,  0.1626780800000000 ]  - [   0.0000000000000000,  0.0001561000000000,  0.0009131400000000 ]  - [   0.0000000000000000,  0.0001414300000000, -0.0009933300000000 ]  - [   0.0000000000000000,  0.0001573200000000, -0.0008993400000000 ]  - [   0.0000000000000000, -0.0183965400000000,  0.0138186300000000 ]  - [   0.0000000000000000, -0.0001483700000000,  0.0009106100000000 ]  - [   0.0000000000000000, -0.0000971400000000, -0.0009269600000000 ]  - [   0.0000000000000000, -0.0001479100000000, -0.0008973500000000 ]  - [  -0.0012770400000000, -0.0005594700000000,  0.0004425200000000 ]  - [  -0.0000252700000000, -0.0000753200000000,  0.0007349200000000 ]  - [   0.0000778100000000, -0.0000883900000000, -0.0008104500000000 ]  - [   0.0003108000000000, -0.0001273500000000, -0.0012052900000000 ]  - [   0.0000217600000000,  0.0000805800000000,  0.0007254100000000 ]  - [   0.0002548200000000,  0.0002618000000000,  0.0005386100000000 ]  - [  -0.0001928600000000,  0.0003333500000000, -0.0007042700000000 ]  - [  -0.0001028000000000,  0.0000985300000000, -0.0008275300000000 ]  - [   0.0001028000000000,  0.0000985300000000, -0.0008275300000000 ]  - [   0.0001928600000000,  0.0003333500000000, -0.0007042700000000 ]  - [  -0.0002548200000000,  0.0002618000000000,  0.0005386100000000 ]  - [  -0.0000217600000000,  0.0000805800000000,  0.0007254100000000 ]  - [  -0.0003108000000000, -0.0001273500000000, -0.0012052900000000 ]  - [  -0.0000778100000000, -0.0000883900000000, -0.0008104500000000 ]  - [   0.0000252700000000, -0.0000753200000000,  0.0007349200000000 ]  - [   0.0012770400000000, -0.0005594700000000,  0.0004425200000000 ]  - [   0.0000038100000000,  0.0001222000000000,  0.0009076900000000 ]  - [  -0.0000038100000000,  0.0001222000000000,  0.0009076900000000 ]  - [  -0.0000047700000000,  0.0002072900000000, -0.0008960600000000 ]  - [   0.0000047700000000,  0.0002072900000000, -0.0008960600000000 ]  - [   0.0000103700000000, -0.0001668200000000,  0.0008880700000000 ]  - [  -0.0000103700000000, -0.0001668200000000,  0.0008880700000000 ]  - [   0.0000482500000000, -0.0002304900000000, -0.0008801800000000 ]  - [  -0.0000482500000000, -0.0002304900000000, -0.0008801800000000 ]  - [  -0.0145591000000000, -0.0000247400000000, -0.0000788000000000 ]  - [  -0.0137423800000000, -0.0000467500000000,  0.0002534800000000 ]  - [   0.0137423800000000, -0.0000467500000000,  0.0002534800000000 ]  - [   0.0145591000000000, -0.0000247400000000, -0.0000788000000000 ]  - [  -0.0000714100000000,  0.0011962900000000,  0.0001846600000000 ]  - [   0.0000714100000000,  0.0011962900000000,  0.0001846600000000 ]  - [   0.0000839700000000,  0.0011378600000000, -0.0001359200000000 ]  - [  -0.0000839700000000,  0.0011378600000000, -0.0001359200000000 ]  - [   0.0000932700000000, -0.0012189700000000,  0.0003105300000000 ]  - [  -0.0000932700000000, -0.0012189700000000,  0.0003105300000000 ]  - [   0.0002011100000000, -0.0011323600000000, -0.0002838400000000 ]  - [  -0.0002011100000000, -0.0011323600000000, -0.0002838400000000 ]  - [  -0.0144525700000000, -0.0000999300000000, -0.0001532200000000 ]  - [  -0.0143663600000000,  0.0000018200000000,  0.0000145700000000 ]  - [   0.0143663600000000,  0.0000018200000000,  0.0000145700000000 ]  - [   0.0144525700000000, -0.0000999300000000, -0.0001532200000000 ]  - [   0.0000000000000000, -0.0015900000000000, -0.0030554900000000 ]  - [   0.0000000000000000,  0.0011646500000000,  0.0000521900000000 ]  - [   0.0000000000000000,  0.0011489600000000,  0.0000152400000000 ]  - [   0.0000000000000000,  0.0011487900000000, -0.0000543500000000 ]  - [   0.0000000000000000, -0.0038967900000000,  0.0001175600000000 ]  - [   0.0000000000000000, -0.0011519400000000,  0.0000512400000000 ]  - [   0.0000000000000000, -0.0011490400000000, -0.0000686400000000 ]  - [   0.0000000000000000, -0.0011331700000000, -0.0000529700000000 ]  - [   0.0007186400000000, -0.0001217900000000, -0.0000294900000000 ]  - [   0.0006241300000000, -0.0000967900000000, -0.0001506800000000 ]  - [  -0.0006241300000000, -0.0000967900000000, -0.0001506800000000 ]  - [  -0.0007186400000000, -0.0001217900000000, -0.0000294900000000 ]  - [  -0.0007488100000000, -0.0000113900000000,  0.0000718600000000 ]  - [  -0.0006976800000000,  0.0001361500000000, -0.0000267800000000 ]  - [   0.0006976800000000,  0.0001361500000000, -0.0000267800000000 ]  - [   0.0007488100000000, -0.0000113900000000,  0.0000718600000000 ]  - [   0.0000000000000000,  0.1916328600000000, -0.1706105100000000 ]  - [   0.0000000000000000, -0.0000097800000000,  0.0000000500000000 ]  - [   0.0000000000000000, -0.0000962300000000,  0.0002446400000000 ]  - [   0.0000000000000000, -0.0000117400000000,  0.0000024700000000 ]  - [   0.0011990900000000, -0.0002659200000000,  0.0010142900000000 ]  - [   0.0007110700000000, -0.0001391600000000,  0.0000485800000000 ]  - [  -0.0007110700000000, -0.0001391600000000,  0.0000485800000000 ]  - [  -0.0011990900000000, -0.0002659200000000,  0.0010142900000000 ]  - [  -0.0007096600000000,  0.0001206800000000,  0.0000690500000000 ]  - [  -0.0002175900000000,  0.0002391400000000, -0.0004366400000000 ]  - [   0.0002175900000000,  0.0002391400000000, -0.0004366400000000 ]  - [   0.0007096600000000,  0.0001206800000000,  0.0000690500000000 ]  - [  -0.0000151600000000,  0.0000178600000000,  0.0000158200000000 ]  - [   0.0000151600000000,  0.0000178600000000,  0.0000158200000000 ]  - [  -0.0000357200000000, -0.0000071500000000, -0.0000588700000000 ]  - [   0.0000357200000000, -0.0000071500000000, -0.0000588700000000 ]- atom:   61  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0262118200000000,  0.0000000000000000,  0.0210414400000000 ]  - [  -0.0010823300000000,  0.0000000000000000,  0.0012035200000000 ]  - [   0.0262118200000000,  0.0000000000000000, -0.0210414400000000 ]  - [  -0.0010823300000000,  0.0000000000000000, -0.0012035200000000 ]  - [  -0.0007306500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0005948000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0002359400000000,  0.0000000000000000,  0.0012345600000000 ]  - [   0.0004104900000000,  0.0000000000000000,  0.0001465600000000 ]  - [  -0.0002359400000000,  0.0000000000000000, -0.0012345600000000 ]  - [   0.0004104900000000,  0.0000000000000000, -0.0001465600000000 ]  - [   0.0018399400000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0009506800000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0001027600000000,  0.0004800600000000,  0.0009644300000000 ]  - [  -0.0002808800000000, -0.0000917300000000,  0.0009150500000000 ]  - [  -0.0000287400000000, -0.0002861900000000, -0.0007091200000000 ]  - [  -0.0001127300000000, -0.0000365600000000, -0.0007213100000000 ]  - [  -0.0000287400000000,  0.0002861900000000,  0.0007091200000000 ]  - [  -0.0001127300000000,  0.0000365600000000,  0.0007213100000000 ]  - [   0.0001027600000000, -0.0004800600000000, -0.0009644300000000 ]  - [  -0.0002808800000000,  0.0000917300000000, -0.0009150500000000 ]  - [  -0.0000287400000000,  0.0002861900000000, -0.0007091200000000 ]  - [  -0.0001127300000000,  0.0000365600000000, -0.0007213100000000 ]  - [   0.0001027600000000, -0.0004800600000000,  0.0009644300000000 ]  - [  -0.0002808800000000,  0.0000917300000000,  0.0009150500000000 ]  - [   0.0001027600000000,  0.0004800600000000, -0.0009644300000000 ]  - [  -0.0002808800000000, -0.0000917300000000, -0.0009150500000000 ]  - [  -0.0000287400000000, -0.0002861900000000,  0.0007091200000000 ]  - [  -0.0001127300000000, -0.0000365600000000,  0.0007213100000000 ]  - [  -0.0002825800000000,  0.0003476200000000,  0.0010858200000000 ]  - [  -0.0006174500000000, -0.0003833800000000,  0.0002693300000000 ]  - [  -0.0002825800000000,  0.0003476200000000, -0.0010858200000000 ]  - [  -0.0006174500000000, -0.0003833800000000, -0.0002693300000000 ]  - [  -0.0002825800000000, -0.0003476200000000,  0.0010858200000000 ]  - [  -0.0006174500000000,  0.0003833800000000,  0.0002693300000000 ]  - [  -0.0002825800000000, -0.0003476200000000, -0.0010858200000000 ]  - [  -0.0006174500000000,  0.0003833800000000, -0.0002693300000000 ]  - [  -0.0002212100000000, -0.0001446200000000,  0.0008187600000000 ]  - [  -0.0002830200000000, -0.0000913500000000,  0.0008700300000000 ]  - [   0.0006735700000000, -0.0001597900000000, -0.0010131200000000 ]  - [  -0.0001861600000000, -0.0000689000000000, -0.0006208600000000 ]  - [   0.0006735700000000,  0.0001597900000000,  0.0010131200000000 ]  - [  -0.0001861600000000,  0.0000689000000000,  0.0006208600000000 ]  - [  -0.0002212100000000,  0.0001446200000000, -0.0008187600000000 ]  - [  -0.0002830200000000,  0.0000913500000000, -0.0008700300000000 ]  - [   0.0006735700000000,  0.0001597900000000, -0.0010131200000000 ]  - [  -0.0001861600000000,  0.0000689000000000, -0.0006208600000000 ]  - [  -0.0002212100000000,  0.0001446200000000,  0.0008187600000000 ]  - [  -0.0002830200000000,  0.0000913500000000,  0.0008700300000000 ]  - [  -0.0002212100000000, -0.0001446200000000, -0.0008187600000000 ]  - [  -0.0002830200000000, -0.0000913500000000, -0.0008700300000000 ]  - [   0.0006735700000000, -0.0001597900000000,  0.0010131200000000 ]  - [  -0.0001861600000000, -0.0000689000000000,  0.0006208600000000 ]  - [   0.0001642900000000, -0.0002214600000000,  0.0009817200000000 ]  - [  -0.0001484400000000,  0.0001550600000000,  0.0008950700000000 ]  - [   0.0001642900000000, -0.0002214600000000, -0.0009817200000000 ]  - [  -0.0001484400000000,  0.0001550600000000, -0.0008950700000000 ]  - [   0.0001642900000000,  0.0002214600000000,  0.0009817200000000 ]  - [  -0.0001484400000000, -0.0001550600000000,  0.0008950700000000 ]  - [   0.0001642900000000,  0.0002214600000000, -0.0009817200000000 ]  - [  -0.0001484400000000, -0.0001550600000000, -0.0008950700000000 ]  - [  -0.0830640000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0132592300000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0282992300000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0166290900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0004031700000000,  0.0020798400000000,  0.0021805200000000 ]  - [   0.0003271000000000,  0.0011079100000000,  0.0000009400000000 ]  - [   0.0004031700000000,  0.0020798400000000, -0.0021805200000000 ]  - [   0.0003271000000000,  0.0011079100000000, -0.0000009400000000 ]  - [   0.0004031700000000, -0.0020798400000000,  0.0021805200000000 ]  - [   0.0003271000000000, -0.0011079100000000,  0.0000009400000000 ]  - [   0.0004031700000000, -0.0020798400000000, -0.0021805200000000 ]  - [   0.0003271000000000, -0.0011079100000000, -0.0000009400000000 ]  - [  -0.0141984200000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0142007600000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0138231300000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0146897900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0001470800000000,  0.0010225000000000, -0.0000011500000000 ]  - [  -0.0000558800000000,  0.0015449500000000,  0.0004029200000000 ]  - [   0.0001470800000000,  0.0010225000000000,  0.0000011500000000 ]  - [  -0.0000558800000000,  0.0015449500000000, -0.0004029200000000 ]  - [   0.0001470800000000, -0.0010225000000000, -0.0000011500000000 ]  - [  -0.0000558800000000, -0.0015449500000000,  0.0004029200000000 ]  - [   0.0001470800000000, -0.0010225000000000,  0.0000011500000000 ]  - [  -0.0000558800000000, -0.0015449500000000, -0.0004029200000000 ]  - [  -0.0002601900000000, -0.0008588500000000,  0.0000000000000000 ]  - [   0.0011413500000000, -0.0000426700000000,  0.0000000000000000 ]  - [  -0.0009807300000000,  0.0003543100000000,  0.0000000000000000 ]  - [  -0.0003621700000000, -0.0002604900000000,  0.0000000000000000 ]  - [  -0.0009807300000000, -0.0003543100000000,  0.0000000000000000 ]  - [  -0.0003621700000000,  0.0002604900000000,  0.0000000000000000 ]  - [  -0.0002601900000000,  0.0008588500000000,  0.0000000000000000 ]  - [   0.0011413500000000,  0.0000426700000000,  0.0000000000000000 ]  - [   0.0004313100000000,  0.0000000000000000, -0.0002951800000000 ]  - [   0.0007546200000000,  0.0000000000000000,  0.0015673800000000 ]  - [   0.0004313100000000,  0.0000000000000000,  0.0002951800000000 ]  - [   0.0007546200000000,  0.0000000000000000, -0.0015673800000000 ]  - [   0.0009996200000000, -0.0000497300000000,  0.0000000000000000 ]  - [   0.0010223500000000, -0.0000187000000000,  0.0000000000000000 ]  - [  -0.0016501600000000,  0.0000971800000000,  0.0000000000000000 ]  - [  -0.0002588800000000, -0.0002311400000000,  0.0000000000000000 ]  - [  -0.0016501600000000, -0.0000971800000000,  0.0000000000000000 ]  - [  -0.0002588800000000,  0.0002311400000000,  0.0000000000000000 ]  - [   0.0009996200000000,  0.0000497300000000,  0.0000000000000000 ]  - [   0.0010223500000000,  0.0000187000000000,  0.0000000000000000 ]  - [  -0.0004044700000000,  0.0000000000000000, -0.0002644600000000 ]  - [   0.0003254000000000,  0.0000000000000000,  0.0000025600000000 ]  - [  -0.0004044700000000,  0.0000000000000000,  0.0002644600000000 ]  - [   0.0003254000000000,  0.0000000000000000, -0.0000025600000000 ]- atom:   61  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0270220600000000,  0.0000000000000000, -0.0200105200000000 ]  - [   0.0010743200000000,  0.0000000000000000,  0.0007835200000000 ]  - [  -0.0270220600000000,  0.0000000000000000,  0.0200105200000000 ]  - [   0.0010743200000000,  0.0000000000000000, -0.0007835200000000 ]  - [   0.0007153000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0005806400000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0002300600000000,  0.0000000000000000,  0.0007420600000000 ]  - [  -0.0004033400000000,  0.0000000000000000,  0.0018214200000000 ]  - [   0.0002300600000000,  0.0000000000000000, -0.0007420600000000 ]  - [  -0.0004033400000000,  0.0000000000000000, -0.0018214200000000 ]  - [  -0.0018370500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0009450800000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0002148400000000, -0.0006357200000000,  0.0005946800000000 ]  - [   0.0001558100000000, -0.0000642800000000,  0.0006513200000000 ]  - [   0.0001503500000000,  0.0001295100000000, -0.0008554300000000 ]  - [   0.0002379200000000, -0.0001197100000000, -0.0008452500000000 ]  - [   0.0001503500000000, -0.0001295100000000,  0.0008554300000000 ]  - [   0.0002379200000000,  0.0001197100000000,  0.0008452500000000 ]  - [  -0.0002148400000000,  0.0006357200000000, -0.0005946800000000 ]  - [   0.0001558100000000,  0.0000642800000000, -0.0006513200000000 ]  - [   0.0001503500000000, -0.0001295100000000, -0.0008554300000000 ]  - [   0.0002379200000000,  0.0001197100000000, -0.0008452500000000 ]  - [  -0.0002148400000000,  0.0006357200000000,  0.0005946800000000 ]  - [   0.0001558100000000,  0.0000642800000000,  0.0006513200000000 ]  - [  -0.0002148400000000, -0.0006357200000000, -0.0005946800000000 ]  - [   0.0001558100000000, -0.0000642800000000, -0.0006513200000000 ]  - [   0.0001503500000000,  0.0001295100000000,  0.0008554300000000 ]  - [   0.0002379200000000, -0.0001197100000000,  0.0008452500000000 ]  - [   0.0002808100000000, -0.0000699000000000,  0.0006981100000000 ]  - [   0.0006122400000000,  0.0006536500000000,  0.0015038100000000 ]  - [   0.0002808100000000, -0.0000699000000000, -0.0006981100000000 ]  - [   0.0006122400000000,  0.0006536500000000, -0.0015038100000000 ]  - [   0.0002808100000000,  0.0000699000000000,  0.0006981100000000 ]  - [   0.0006122400000000, -0.0006536500000000,  0.0015038100000000 ]  - [   0.0002808100000000,  0.0000699000000000, -0.0006981100000000 ]  - [   0.0006122400000000, -0.0006536500000000, -0.0015038100000000 ]  - [   0.0000917100000000, -0.0000132200000000,  0.0007501800000000 ]  - [   0.0001587400000000, -0.0000658000000000,  0.0006947500000000 ]  - [  -0.0005421200000000,  0.0000027300000000, -0.0005561000000000 ]  - [   0.0003058900000000, -0.0000876500000000, -0.0009409000000000 ]  - [  -0.0005421200000000, -0.0000027300000000,  0.0005561000000000 ]  - [   0.0003058900000000,  0.0000876500000000,  0.0009409000000000 ]  - [   0.0000917100000000,  0.0000132200000000, -0.0007501800000000 ]  - [   0.0001587400000000,  0.0000658000000000, -0.0006947500000000 ]  - [  -0.0005421200000000, -0.0000027300000000, -0.0005561000000000 ]  - [   0.0003058900000000,  0.0000876500000000, -0.0009409000000000 ]  - [   0.0000917100000000,  0.0000132200000000,  0.0007501800000000 ]  - [   0.0001587400000000,  0.0000658000000000,  0.0006947500000000 ]  - [   0.0000917100000000, -0.0000132200000000, -0.0007501800000000 ]  - [   0.0001587400000000, -0.0000658000000000, -0.0006947500000000 ]  - [  -0.0005421200000000,  0.0000027300000000,  0.0005561000000000 ]  - [   0.0003058900000000, -0.0000876500000000,  0.0009409000000000 ]  - [  -0.0001627300000000,  0.0004935500000000,  0.0008047200000000 ]  - [   0.0001475400000000,  0.0001255800000000,  0.0008900800000000 ]  - [  -0.0001627300000000,  0.0004935500000000, -0.0008047200000000 ]  - [   0.0001475400000000,  0.0001255800000000, -0.0008900800000000 ]  - [  -0.0001627300000000, -0.0004935500000000,  0.0008047200000000 ]  - [   0.0001475400000000, -0.0001255800000000,  0.0008900800000000 ]  - [  -0.0001627300000000, -0.0004935500000000, -0.0008047200000000 ]  - [   0.0001475400000000, -0.0001255800000000, -0.0008900800000000 ]  - [   0.0561332000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0154561600000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0001596900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0121481500000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0003978100000000,  0.0002271300000000, -0.0020519600000000 ]  - [  -0.0003239900000000,  0.0011840100000000,  0.0001193100000000 ]  - [  -0.0003978100000000,  0.0002271300000000,  0.0020519600000000 ]  - [  -0.0003239900000000,  0.0011840100000000, -0.0001193100000000 ]  - [  -0.0003978100000000, -0.0002271300000000, -0.0020519600000000 ]  - [  -0.0003239900000000, -0.0011840100000000,  0.0001193100000000 ]  - [  -0.0003978100000000, -0.0002271300000000,  0.0020519600000000 ]  - [  -0.0003239900000000, -0.0011840100000000, -0.0001193100000000 ]  - [  -0.0145213800000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0145223200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0148913600000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0140402300000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0001434500000000,  0.0012728000000000,  0.0001262400000000 ]  - [   0.0000515600000000,  0.0007534600000000, -0.0002775900000000 ]  - [  -0.0001434500000000,  0.0012728000000000, -0.0001262400000000 ]  - [   0.0000515600000000,  0.0007534600000000,  0.0002775900000000 ]  - [  -0.0001434500000000, -0.0012728000000000,  0.0001262400000000 ]  - [   0.0000515600000000, -0.0007534600000000, -0.0002775900000000 ]  - [  -0.0001434500000000, -0.0012728000000000, -0.0001262400000000 ]  - [   0.0000515600000000, -0.0007534600000000,  0.0002775900000000 ]  - [   0.0016840600000000,  0.0006157600000000,  0.0000000000000000 ]  - [   0.0003002400000000, -0.0002140800000000,  0.0000000000000000 ]  - [  -0.0004594800000000, -0.0006140900000000,  0.0000000000000000 ]  - [  -0.0010812000000000, -0.0000035200000000,  0.0000000000000000 ]  - [  -0.0004594800000000,  0.0006140900000000,  0.0000000000000000 ]  - [  -0.0010812000000000,  0.0000035200000000,  0.0000000000000000 ]  - [   0.0016840600000000, -0.0006157600000000,  0.0000000000000000 ]  - [   0.0003002400000000,  0.0002140800000000,  0.0000000000000000 ]  - [  -0.0004261200000000,  0.0000000000000000,  0.0003111100000000 ]  - [  -0.0007484400000000,  0.0000000000000000, -0.0015213200000000 ]  - [  -0.0004261200000000,  0.0000000000000000, -0.0003111100000000 ]  - [  -0.0007484400000000,  0.0000000000000000,  0.0015213200000000 ]  - [   0.0004527500000000, -0.0002086100000000,  0.0000000000000000 ]  - [   0.0004179400000000, -0.0002378500000000,  0.0000000000000000 ]  - [   0.0001986300000000, -0.0003516900000000,  0.0000000000000000 ]  - [  -0.0011705100000000, -0.0000253300000000,  0.0000000000000000 ]  - [   0.0001986300000000,  0.0003516900000000,  0.0000000000000000 ]  - [  -0.0011705100000000,  0.0000253300000000,  0.0000000000000000 ]  - [   0.0004527500000000,  0.0002086100000000,  0.0000000000000000 ]  - [   0.0004179400000000,  0.0002378500000000,  0.0000000000000000 ]  - [   0.0004026300000000,  0.0000000000000000,  0.0002770200000000 ]  - [  -0.0003224900000000,  0.0000000000000000,  0.0000139900000000 ]  - [   0.0004026300000000,  0.0000000000000000, -0.0002770200000000 ]  - [  -0.0003224900000000,  0.0000000000000000, -0.0000139900000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000685600000000,  0.0014768200000000,  0.0010445500000000 ]  - [  -0.0000035300000000,  0.0000446100000000,  0.0009902400000000 ]  - [   0.0000685600000000,  0.0014768200000000, -0.0010445500000000 ]  - [  -0.0000035300000000,  0.0000446100000000, -0.0009902400000000 ]  - [  -0.0000022500000000,  0.0004178700000000,  0.0000000000000000 ]  - [   0.0000017600000000,  0.0002914200000000,  0.0000000000000000 ]  - [  -0.0000005600000000, -0.0000993400000000,  0.0009899500000000 ]  - [   0.0000008600000000, -0.0001495900000000,  0.0009883000000000 ]  - [  -0.0000005600000000, -0.0000993400000000, -0.0009899500000000 ]  - [   0.0000008600000000, -0.0001495900000000, -0.0009883000000000 ]  - [   0.0000051400000000, -0.0008641400000000,  0.0000000000000000 ]  - [  -0.0000005300000000, -0.0000626700000000,  0.0000000000000000 ]  - [   0.0001796300000000, -0.0002801800000000,  0.0005728700000000 ]  - [  -0.0000832200000000, -0.0000818900000000,  0.0008064200000000 ]  - [  -0.0000015600000000, -0.0000968500000000, -0.0007696300000000 ]  - [   0.0000865300000000, -0.0000817400000000, -0.0008047900000000 ]  - [   0.0001279200000000,  0.0000619500000000,  0.0007972500000000 ]  - [   0.0000404000000000,  0.0000761300000000,  0.0007624500000000 ]  - [  -0.0003030000000000, -0.0001175800000000, -0.0009912600000000 ]  - [  -0.0000412000000000,  0.0000761700000000, -0.0007573700000000 ]  - [   0.0001279200000000,  0.0000619500000000, -0.0007972500000000 ]  - [   0.0000404000000000,  0.0000761300000000, -0.0007624500000000 ]  - [  -0.0003030000000000, -0.0001175800000000,  0.0009912600000000 ]  - [  -0.0000412000000000,  0.0000761700000000,  0.0007573700000000 ]  - [   0.0001796300000000, -0.0002801800000000, -0.0005728700000000 ]  - [  -0.0000832200000000, -0.0000818900000000, -0.0008064200000000 ]  - [  -0.0000015600000000, -0.0000968500000000,  0.0007696300000000 ]  - [   0.0000865300000000, -0.0000817400000000,  0.0008047900000000 ]  - [   0.0000300700000000,  0.0001780900000000,  0.0009174000000000 ]  - [  -0.0000047700000000,  0.0001962900000000,  0.0009369700000000 ]  - [   0.0000300700000000,  0.0001780900000000, -0.0009174000000000 ]  - [  -0.0000047700000000,  0.0001962900000000, -0.0009369700000000 ]  - [  -0.0000312700000000, -0.0001104000000000,  0.0008675200000000 ]  - [   0.0000011200000000, -0.0000850000000000,  0.0008417000000000 ]  - [  -0.0000312700000000, -0.0001104000000000, -0.0008675200000000 ]  - [   0.0000011200000000, -0.0000850000000000, -0.0008417000000000 ]  - [   0.0002729000000000,  0.0000823800000000,  0.0005969800000000 ]  - [  -0.0000707100000000, -0.0000738700000000,  0.0007894800000000 ]  - [  -0.0001452100000000, -0.0000111400000000, -0.0006609500000000 ]  - [   0.0000656100000000, -0.0000749900000000, -0.0007914900000000 ]  - [   0.0002720400000000,  0.0001474800000000,  0.0009046900000000 ]  - [   0.0000564900000000,  0.0000830900000000,  0.0007706900000000 ]  - [  -0.0003984600000000,  0.0002405200000000, -0.0009688200000000 ]  - [  -0.0000539300000000,  0.0000845500000000, -0.0007745500000000 ]  - [   0.0002720400000000,  0.0001474800000000, -0.0009046900000000 ]  - [   0.0000564900000000,  0.0000830900000000, -0.0007706900000000 ]  - [  -0.0003984600000000,  0.0002405200000000,  0.0009688200000000 ]  - [  -0.0000539300000000,  0.0000845500000000,  0.0007745500000000 ]  - [   0.0002729000000000,  0.0000823800000000, -0.0005969800000000 ]  - [  -0.0000707100000000, -0.0000738700000000, -0.0007894800000000 ]  - [  -0.0001452100000000, -0.0000111400000000,  0.0006609500000000 ]  - [   0.0000656100000000, -0.0000749900000000,  0.0007914900000000 ]  - [   0.0000064600000000, -0.0001982800000000,  0.0009913100000000 ]  - [   0.0000014100000000,  0.0001350900000000,  0.0008902600000000 ]  - [   0.0000064600000000, -0.0001982800000000, -0.0009913100000000 ]  - [   0.0000014100000000,  0.0001350900000000, -0.0008902600000000 ]  - [  -0.0000060000000000, -0.0004845600000000,  0.0007926200000000 ]  - [  -0.0000017900000000, -0.0001533600000000,  0.0008935600000000 ]  - [  -0.0000060000000000, -0.0004845600000000, -0.0007926200000000 ]  - [  -0.0000017900000000, -0.0001533600000000, -0.0008935600000000 ]  - [  -0.0145102500000000, -0.0108348000000000,  0.0000000000000000 ]  - [  -0.0143584300000000,  0.0000366800000000,  0.0000000000000000 ]  - [   0.0143857300000000, -0.0018477400000000,  0.0000000000000000 ]  - [   0.0143646100000000, -0.0001978000000000,  0.0000000000000000 ]  - [   0.0009821400000000,  0.0023136900000000,  0.0022497200000000 ]  - [  -0.0000010700000000,  0.0011358600000000,  0.0000570200000000 ]  - [   0.0009821400000000,  0.0023136900000000, -0.0022497200000000 ]  - [  -0.0000010700000000,  0.0011358600000000, -0.0000570200000000 ]  - [  -0.0009843700000000,  0.0000225200000000, -0.0021320500000000 ]  - [   0.0000027300000000, -0.0011543400000000,  0.0000636400000000 ]  - [  -0.0009843700000000,  0.0000225200000000,  0.0021320500000000 ]  - [   0.0000027300000000, -0.0011543400000000, -0.0000636400000000 ]  - [  -0.0143642400000000,  0.0000360800000000,  0.0000000000000000 ]  - [  -0.0143632800000000,  0.0000366900000000,  0.0000000000000000 ]  - [   0.0143621900000000,  0.0000270500000000,  0.0000000000000000 ]  - [   0.0143656300000000,  0.0000121100000000,  0.0000000000000000 ]  - [  -0.0000468000000000,  0.0011803900000000,  0.0000716100000000 ]  - [   0.0001223800000000,  0.0012625500000000,  0.0001884200000000 ]  - [  -0.0000468000000000,  0.0011803900000000, -0.0000716100000000 ]  - [   0.0001223800000000,  0.0012625500000000, -0.0001884200000000 ]  - [   0.0000476700000000, -0.0011116700000000,  0.0000504000000000 ]  - [  -0.0001213400000000, -0.0010307300000000, -0.0000649500000000 ]  - [   0.0000476700000000, -0.0011116700000000, -0.0000504000000000 ]  - [  -0.0001213400000000, -0.0010307300000000,  0.0000649500000000 ]  - [   0.0010716900000000,  0.0030097300000000,  0.0000000000000000 ]  - [   0.0007478500000000, -0.0001217200000000,  0.0000000000000000 ]  - [  -0.0005966600000000, -0.0000450600000000,  0.0000000000000000 ]  - [  -0.0007513300000000, -0.0001196000000000,  0.0000000000000000 ]  - [  -0.0008389100000000,  0.0002233700000000,  0.0000000000000000 ]  - [  -0.0006825500000000,  0.0001514100000000,  0.0000000000000000 ]  - [   0.0003421500000000,  0.0033537400000000,  0.0000000000000000 ]  - [   0.0006794600000000,  0.0001473600000000,  0.0000000000000000 ]  - [   0.0000009600000000, -0.0001062600000000,  0.0000169100000000 ]  - [   0.0000022200000000, -0.0001476500000000,  0.0000241200000000 ]  - [   0.0000009600000000, -0.0001062600000000, -0.0000169100000000 ]  - [   0.0000022200000000, -0.0001476500000000, -0.0000241200000000 ]  - [   0.0001921300000000, -0.0004248300000000,  0.0000000000000000 ]  - [   0.0007532600000000, -0.0001464000000000,  0.0000000000000000 ]  - [  -0.0004319100000000, -0.0002920300000000,  0.0000000000000000 ]  - [  -0.0007623600000000, -0.0001417800000000,  0.0000000000000000 ]  - [  -0.0010001000000000, -0.0000239400000000,  0.0000000000000000 ]  - [  -0.0006598300000000,  0.0001278500000000,  0.0000000000000000 ]  - [   0.0012390100000000, -0.0001545500000000,  0.0000000000000000 ]  - [   0.0006737100000000,  0.0001225000000000,  0.0000000000000000 ]  - [  -0.0000008400000000,  0.0004704300000000,  0.0000171900000000 ]  - [   0.0000007000000000,  0.0000224000000000,  0.0000185800000000 ]  - [  -0.0000008400000000,  0.0004704300000000, -0.0000171900000000 ]  - [   0.0000007000000000,  0.0000224000000000, -0.0000185800000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0129974500000000,  0.0000000000000000,  0.0173622200000000 ]  - [  -0.0000557100000000,  0.0000000000000000,  0.0011199500000000 ]  - [  -0.0137761000000000,  0.0000000000000000,  0.0158704300000000 ]  - [   0.0000514900000000,  0.0000000000000000, -0.0008553200000000 ]  - [   0.0000006900000000,  0.0000000000000000, -0.0003105100000000 ]  - [  -0.0000002000000000,  0.0000000000000000, -0.0012458500000000 ]  - [   0.0000236000000000,  0.0000000000000000,  0.0007335300000000 ]  - [   0.0000596200000000,  0.0000000000000000,  0.0003245400000000 ]  - [  -0.0000219800000000,  0.0000000000000000, -0.0012502300000000 ]  - [  -0.0000587200000000,  0.0000000000000000, -0.0016549400000000 ]  - [   0.0000015900000000,  0.0000000000000000,  0.0014041800000000 ]  - [  -0.0000015600000000,  0.0000000000000000,  0.0001212000000000 ]  - [   0.0000069900000000, -0.0003712300000000,  0.0010867800000000 ]  - [  -0.0001329900000000, -0.0000837300000000,  0.0008828700000000 ]  - [   0.0001684800000000, -0.0000170700000000, -0.0005870600000000 ]  - [  -0.0000946400000000, -0.0000703000000000, -0.0005835100000000 ]  - [  -0.0000458100000000,  0.0001427700000000,  0.0009760300000000 ]  - [   0.0002170100000000,  0.0000883700000000,  0.0009800100000000 ]  - [  -0.0001248000000000, -0.0002124300000000, -0.0004705200000000 ]  - [   0.0000125600000000,  0.0000748000000000, -0.0006773500000000 ]  - [   0.0001684800000000,  0.0000170700000000, -0.0005870600000000 ]  - [  -0.0000946400000000,  0.0000703000000000, -0.0005835100000000 ]  - [   0.0000069900000000,  0.0003712300000000,  0.0010867800000000 ]  - [  -0.0001329900000000,  0.0000837300000000,  0.0008828700000000 ]  - [  -0.0001248000000000,  0.0002124300000000, -0.0004705200000000 ]  - [   0.0000125600000000, -0.0000748000000000, -0.0006773500000000 ]  - [  -0.0000458100000000, -0.0001427700000000,  0.0009760300000000 ]  - [   0.0002170100000000, -0.0000883700000000,  0.0009800100000000 ]  - [   0.0000877700000000,  0.0001684800000000,  0.0009725000000000 ]  - [  -0.0004641100000000, -0.0001729900000000,  0.0006409000000000 ]  - [  -0.0000894000000000,  0.0001212500000000, -0.0008124300000000 ]  - [   0.0004593300000000,  0.0004550500000000, -0.0011379400000000 ]  - [   0.0000877700000000, -0.0001684800000000,  0.0009725000000000 ]  - [  -0.0004641100000000,  0.0001729900000000,  0.0006409000000000 ]  - [  -0.0000894000000000, -0.0001212500000000, -0.0008124300000000 ]  - [   0.0004593300000000, -0.0004550500000000, -0.0011379400000000 ]  - [   0.0010347600000000,  0.0002726300000000, -0.0003327300000000 ]  - [  -0.0001021200000000, -0.0001065800000000,  0.0007072200000000 ]  - [   0.0007387500000000, -0.0001109400000000, -0.0016825900000000 ]  - [   0.0000658000000000, -0.0000795000000000, -0.0008239000000000 ]  - [  -0.0006160200000000,  0.0000478300000000, -0.0001198000000000 ]  - [   0.0000536200000000,  0.0000787500000000,  0.0007364100000000 ]  - [  -0.0011552800000000,  0.0004286000000000, -0.0018959200000000 ]  - [  -0.0000215600000000,  0.0000520000000000, -0.0008565300000000 ]  - [   0.0007387500000000,  0.0001109400000000, -0.0016825900000000 ]  - [   0.0000658000000000,  0.0000795000000000, -0.0008239000000000 ]  - [   0.0010347600000000, -0.0002726300000000, -0.0003327300000000 ]  - [  -0.0001021200000000,  0.0001065800000000,  0.0007072200000000 ]  - [  -0.0011552800000000, -0.0004286000000000, -0.0018959200000000 ]  - [  -0.0000215600000000, -0.0000520000000000, -0.0008565300000000 ]  - [  -0.0006160200000000, -0.0000478300000000, -0.0001198000000000 ]  - [   0.0000536200000000, -0.0000787500000000,  0.0007364100000000 ]  - [   0.0000710300000000, -0.0006580100000000,  0.0010416600000000 ]  - [   0.0000125000000000,  0.0001426900000000,  0.0008741400000000 ]  - [  -0.0000715300000000,  0.0009473000000000, -0.0007397900000000 ]  - [  -0.0000131500000000,  0.0001459500000000, -0.0009089600000000 ]  - [   0.0000710300000000,  0.0006580100000000,  0.0010416600000000 ]  - [   0.0000125000000000, -0.0001426900000000,  0.0008741400000000 ]  - [  -0.0000715300000000, -0.0009473000000000, -0.0007397900000000 ]  - [  -0.0000131500000000, -0.0001459500000000, -0.0009089600000000 ]  - [  -0.0135637500000000,  0.0000000000000000, -0.0447139100000000 ]  - [  -0.0143637100000000,  0.0000000000000000,  0.0000798500000000 ]  - [   0.0143988200000000,  0.0000000000000000, -0.0030547000000000 ]  - [   0.0143644900000000,  0.0000000000000000, -0.0004632900000000 ]  - [   0.0027568900000000,  0.0038780200000000,  0.0041355600000000 ]  - [  -0.0000113900000000,  0.0011295500000000,  0.0000600200000000 ]  - [  -0.0027857500000000, -0.0016173800000000,  0.0040465100000000 ]  - [   0.0000131900000000,  0.0011675400000000, -0.0000636600000000 ]  - [   0.0027568900000000, -0.0038780200000000,  0.0041355600000000 ]  - [  -0.0000113900000000, -0.0011295500000000,  0.0000600200000000 ]  - [  -0.0027857500000000,  0.0016173800000000,  0.0040465100000000 ]  - [   0.0000131900000000, -0.0011675400000000, -0.0000636600000000 ]  - [  -0.0143707200000000,  0.0000000000000000,  0.0003555300000000 ]  - [  -0.0143677400000000,  0.0000000000000000,  0.0003551400000000 ]  - [   0.0143681400000000,  0.0000000000000000,  0.0004413300000000 ]  - [   0.0143697300000000,  0.0000000000000000,  0.0000903800000000 ]  - [  -0.0000995800000000,  0.0012017300000000,  0.0000413600000000 ]  - [   0.0001055700000000,  0.0014512200000000,  0.0002053500000000 ]  - [   0.0000988100000000,  0.0010960600000000, -0.0000823400000000 ]  - [  -0.0001056600000000,  0.0008505300000000,  0.0000792000000000 ]  - [  -0.0000995800000000, -0.0012017300000000,  0.0000413600000000 ]  - [   0.0001055700000000, -0.0014512200000000,  0.0002053500000000 ]  - [   0.0000988100000000, -0.0010960600000000, -0.0000823400000000 ]  - [  -0.0001056600000000, -0.0008505300000000,  0.0000792000000000 ]  - [   0.0007147800000000, -0.0001315600000000, -0.0008907700000000 ]  - [   0.0007156700000000, -0.0001376300000000, -0.0001471500000000 ]  - [  -0.0007210000000000, -0.0001348600000000, -0.0004899900000000 ]  - [  -0.0007192900000000, -0.0001375700000000, -0.0002660500000000 ]  - [  -0.0007210000000000,  0.0001348600000000, -0.0004899900000000 ]  - [  -0.0007192900000000,  0.0001375700000000, -0.0002660500000000 ]  - [   0.0007147800000000,  0.0001315600000000, -0.0008907700000000 ]  - [   0.0007156700000000,  0.0001376300000000, -0.0001471500000000 ]  - [  -0.0001854000000000,  0.0000000000000000,  0.0000549200000000 ]  - [   0.0008775800000000,  0.0000000000000000,  0.0011906000000000 ]  - [   0.0001862800000000,  0.0000000000000000,  0.0000198200000000 ]  - [  -0.0008624500000000,  0.0000000000000000,  0.0011285500000000 ]  - [   0.0007180100000000, -0.0001383000000000,  0.0015632300000000 ]  - [   0.0007198000000000, -0.0001362100000000,  0.0002423700000000 ]  - [  -0.0007181700000000, -0.0001362800000000,  0.0012366100000000 ]  - [  -0.0007156700000000, -0.0001375900000000,  0.0000811300000000 ]  - [  -0.0007181700000000,  0.0001362800000000,  0.0012366100000000 ]  - [  -0.0007156700000000,  0.0001375900000000,  0.0000811300000000 ]  - [   0.0007180100000000,  0.0001383000000000,  0.0015632300000000 ]  - [   0.0007198000000000,  0.0001362100000000,  0.0002423700000000 ]  - [  -0.0000342300000000,  0.0000000000000000, -0.0005337800000000 ]  - [  -0.0000266100000000,  0.0000000000000000,  0.0000002800000000 ]  - [   0.0000340700000000,  0.0000000000000000, -0.0005719400000000 ]  - [   0.0000285300000000,  0.0000000000000000, -0.0000396900000000 ]- atom:   65  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0022340800000000, -0.0000674900000000,  0.0009213700000000 ]  - [  -0.0004089600000000,  0.0000002200000000,  0.0009886900000000 ]  - [   0.0017155800000000, -0.0000012700000000, -0.0009848400000000 ]  - [  -0.0003850200000000, -0.0000000700000000, -0.0009888900000000 ]  - [  -0.0015597100000000,  0.0014889200000000, -0.0002829100000000 ]  - [  -0.0015649400000000, -0.0015024900000000,  0.0002822700000000 ]  - [  -0.0000681700000000, -0.0001299000000000,  0.0010163300000000 ]  - [  -0.0000672400000000,  0.0001317900000000,  0.0009623500000000 ]  - [  -0.0000590900000000, -0.0005664800000000, -0.0014541200000000 ]  - [  -0.0000562400000000,  0.0005683400000000, -0.0005237600000000 ]  - [   0.0009932400000000,  0.0000000100000000,  0.0000045000000000 ]  - [  -0.0007043200000000, -0.0000012700000000, -0.0000002300000000 ]  - [  -0.0001847400000000,  0.0002275300000000,  0.0003224900000000 ]  - [  -0.0004787300000000, -0.0000783900000000,  0.0012344200000000 ]  - [   0.0000684800000000,  0.0000021100000000, -0.0007551600000000 ]  - [  -0.0000159300000000, -0.0000968100000000, -0.0007693500000000 ]  - [   0.0001642400000000,  0.0000847600000000,  0.0008169500000000 ]  - [  -0.0000564400000000,  0.0001081200000000,  0.0007096100000000 ]  - [  -0.0000068300000000,  0.0000473900000000, -0.0007829200000000 ]  - [  -0.0001415600000000,  0.0000637800000000, -0.0008092900000000 ]  - [   0.0001200100000000,  0.0001108500000000, -0.0007850800000000 ]  - [  -0.0000229200000000,  0.0000936600000000, -0.0007486400000000 ]  - [   0.0000383800000000,  0.0000732000000000,  0.0007519600000000 ]  - [  -0.0001752100000000,  0.0000496400000000,  0.0008484800000000 ]  - [  -0.0000546100000000, -0.0001599200000000, -0.0008071500000000 ]  - [  -0.0001505800000000, -0.0000611300000000, -0.0008081700000000 ]  - [  -0.0000637300000000, -0.0003845800000000,  0.0012407900000000 ]  - [  -0.0003462300000000, -0.0000798300000000,  0.0003394000000000 ]  - [  -0.0000336000000000,  0.0003343500000000,  0.0009646500000000 ]  - [  -0.0000326500000000, -0.0000520700000000,  0.0008212400000000 ]  - [  -0.0000504400000000,  0.0004530100000000, -0.0008078800000000 ]  - [  -0.0000496200000000, -0.0001644100000000, -0.0009735100000000 ]  - [  -0.0001301000000000, -0.0002284100000000,  0.0007988400000000 ]  - [  -0.0001301200000000, -0.0000547200000000,  0.0009885200000000 ]  - [  -0.0005740800000000, -0.0001133200000000, -0.0006905300000000 ]  - [  -0.0005753600000000, -0.0001762800000000, -0.0010919800000000 ]  - [   0.0002233300000000,  0.0000412000000000,  0.0004950100000000 ]  - [  -0.0002368000000000, -0.0000958000000000,  0.0009345700000000 ]  - [   0.0003670700000000, -0.0003778100000000, -0.0010038300000000 ]  - [  -0.0001285600000000, -0.0000408300000000, -0.0006631200000000 ]  - [   0.0015806500000000,  0.0004123400000000,  0.0015882300000000 ]  - [  -0.0001432200000000,  0.0000695800000000,  0.0005417000000000 ]  - [  -0.0016823100000000, -0.0004080700000000, -0.0055172700000000 ]  - [  -0.0003039200000000,  0.0000802800000000, -0.0009835100000000 ]  - [  -0.0014963100000000,  0.0005949000000000,  0.0039224800000000 ]  - [  -0.0001906700000000,  0.0000767900000000, -0.0005686100000000 ]  - [   0.0014415800000000, -0.0002529700000000, -0.0000253300000000 ]  - [  -0.0002565300000000,  0.0000875600000000,  0.0010103400000000 ]  - [   0.0002373700000000,  0.0002196700000000, -0.0005667700000000 ]  - [  -0.0002640100000000, -0.0001171500000000, -0.0009162300000000 ]  - [   0.0003498500000000, -0.0001992200000000,  0.0010720900000000 ]  - [  -0.0001015300000000, -0.0000621700000000,  0.0006444300000000 ]  - [   0.0015479500000000,  0.0001364200000000,  0.0008843000000000 ]  - [  -0.0001816500000000,  0.0001424000000000,  0.0008924800000000 ]  - [   0.0001004200000000,  0.0001432900000000, -0.0008921500000000 ]  - [  -0.0001005900000000,  0.0001437500000000, -0.0008915400000000 ]  - [  -0.0001618000000000, -0.0001389300000000,  0.0008897100000000 ]  - [  -0.0000971100000000, -0.0001421700000000,  0.0008925600000000 ]  - [   0.0000826100000000, -0.0001425100000000, -0.0008922900000000 ]  - [  -0.0000818500000000, -0.0001436400000000, -0.0008916300000000 ]  - [  -0.0139654400000000,  0.0009817000000000,  0.0027718000000000 ]  - [  -0.0140358600000000, -0.0000012100000000, -0.0000109500000000 ]  - [   0.0147655000000000, -0.0009842200000000, -0.0027717100000000 ]  - [   0.0146875500000000,  0.0000022500000000,  0.0000128600000000 ]  - [  -0.0169030400000000,  0.0011851200000000,  0.0003166400000000 ]  - [   0.0003547000000000,  0.0011475000000000,  0.0000602100000000 ]  - [  -0.0009455600000000,  0.0011491200000000, -0.0000647700000000 ]  - [   0.0002618600000000,  0.0011483700000000, -0.0000619300000000 ]  - [  -0.0012551400000000, -0.0011590100000000,  0.0000621900000000 ]  - [   0.0002136900000000, -0.0011469400000000,  0.0000615000000000 ]  - [  -0.0004346800000000, -0.0011477700000000, -0.0000617900000000 ]  - [   0.0001962900000000, -0.0011479700000000, -0.0000619700000000 ]  - [  -0.0144170000000000,  0.0001217400000000,  0.0001054000000000 ]  - [  -0.0142167200000000, -0.0000469000000000, -0.0000997400000000 ]  - [   0.0143076300000000, -0.0001215500000000, -0.0001063700000000 ]  - [   0.0145091700000000,  0.0000471600000000,  0.0000973900000000 ]  - [   0.0000159000000000,  0.0011208700000000,  0.0000820400000000 ]  - [   0.0000149900000000,  0.0011756600000000,  0.0000395500000000 ]  - [  -0.0000023400000000,  0.0012116100000000, -0.0001006600000000 ]  - [  -0.0000036300000000,  0.0010823900000000, -0.0000215100000000 ]  - [   0.0000554200000000, -0.0010567400000000,  0.0000773700000000 ]  - [   0.0000543300000000, -0.0012402800000000,  0.0000460800000000 ]  - [   0.0015035300000000, -0.0002886800000000, -0.0003655200000000 ]  - [   0.0015379400000000, -0.0020212500000000,  0.0002512900000000 ]  - [   0.0005476400000000, -0.0004691300000000,  0.0006008500000000 ]  - [   0.0011927800000000, -0.0000469700000000, -0.0002858900000000 ]  - [  -0.0008771000000000,  0.0002040200000000, -0.0006010300000000 ]  - [  -0.0002559000000000, -0.0002185300000000,  0.0002879700000000 ]  - [  -0.0009441100000000,  0.0000706900000000, -0.0000105200000000 ]  - [  -0.0005053200000000,  0.0001275300000000,  0.0000256900000000 ]  - [   0.0004901300000000,  0.0001941200000000,  0.0000089800000000 ]  - [   0.0009085900000000,  0.0001349200000000, -0.0000256800000000 ]  - [   0.0002456500000000, -0.0003024700000000,  0.0003077500000000 ]  - [   0.0002457900000000,  0.0003052500000000, -0.0002807700000000 ]  - [   0.0007582900000000, -0.0005441200000000, -0.0001806900000000 ]  - [   0.0007632600000000,  0.0005485900000000,  0.0001411200000000 ]  - [   0.0003196300000000, -0.0007606900000000,  0.0000928400000000 ]  - [   0.0010475200000000,  0.0000086000000000, -0.0000407200000000 ]  - [  -0.0011137900000000,  0.0005001200000000, -0.0000907000000000 ]  - [  -0.0004060100000000, -0.0002721200000000,  0.0000407000000000 ]  - [   0.0059168300000000,  0.0015266500000000, -0.0098607900000000 ]  - [  -0.0000196000000000,  0.0002603400000000,  0.0000302600000000 ]  - [   0.0072690700000000, -0.0012452000000000,  0.0097149200000000 ]  - [   0.0013840800000000,  0.0000013600000000, -0.0000294400000000 ]  - [  -0.0012353100000000,  0.0000212700000000,  0.0000119900000000 ]  - [   0.0003039400000000, -0.0000003800000000,  0.0000167200000000 ]  - [  -0.0002282000000000, -0.0000003500000000, -0.0000169400000000 ]  - [   0.0002022300000000, -0.0000002300000000, -0.0000180600000000 ]- atom:   65  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000000000000000,  0.0306919200000000,  0.0244700400000000 ]  - [   0.0000000000000000,  0.0001047600000000,  0.0011721300000000 ]  - [   0.0000000000000000,  0.0004447300000000, -0.0022037400000000 ]  - [   0.0000000000000000,  0.0000391000000000, -0.0011162200000000 ]  - [   0.0002693600000000,  0.0005665600000000,  0.0001053200000000 ]  - [  -0.0002693600000000,  0.0005665600000000,  0.0001053200000000 ]  - [  -0.0003006000000000, -0.0000447400000000,  0.0006030600000000 ]  - [   0.0003006000000000, -0.0000447400000000,  0.0006030600000000 ]  - [  -0.0003813400000000, -0.0006171200000000, -0.0009688600000000 ]  - [   0.0003813400000000, -0.0006171200000000, -0.0009688600000000 ]  - [   0.0000000000000000, -0.0009292100000000,  0.0024493200000000 ]  - [   0.0000000000000000, -0.0001915400000000,  0.0000470900000000 ]  - [   0.0005219400000000, -0.0000585800000000,  0.0012456000000000 ]  - [  -0.0002803200000000, -0.0001062700000000,  0.0010578100000000 ]  - [  -0.0000441300000000,  0.0000820100000000, -0.0005885400000000 ]  - [   0.0000456900000000, -0.0000644400000000, -0.0007445800000000 ]  - [   0.0000654500000000, -0.0002869100000000,  0.0007197100000000 ]  - [   0.0000143000000000,  0.0000466900000000,  0.0007248800000000 ]  - [  -0.0001062500000000,  0.0000313300000000, -0.0007129900000000 ]  - [  -0.0000486500000000,  0.0000641700000000, -0.0007583800000000 ]  - [   0.0001062500000000,  0.0000313300000000, -0.0007129900000000 ]  - [   0.0000486500000000,  0.0000641700000000, -0.0007583800000000 ]  - [  -0.0000654500000000, -0.0002869100000000,  0.0007197100000000 ]  - [  -0.0000143000000000,  0.0000466900000000,  0.0007248800000000 ]  - [   0.0000441300000000,  0.0000820100000000, -0.0005885400000000 ]  - [  -0.0000456900000000, -0.0000644400000000, -0.0007445800000000 ]  - [  -0.0005219400000000, -0.0000585800000000,  0.0012456000000000 ]  - [   0.0002803200000000, -0.0001062700000000,  0.0010578100000000 ]  - [   0.0001554800000000,  0.0000054600000000,  0.0008448200000000 ]  - [  -0.0001554800000000,  0.0000054600000000,  0.0008448200000000 ]  - [   0.0002312700000000, -0.0000183700000000, -0.0009016500000000 ]  - [  -0.0002312700000000, -0.0000183700000000, -0.0009016500000000 ]  - [   0.0000934600000000,  0.0000648100000000,  0.0008208600000000 ]  - [  -0.0000934600000000,  0.0000648100000000,  0.0008208600000000 ]  - [   0.0001214000000000,  0.0003178800000000, -0.0009062500000000 ]  - [  -0.0001214000000000,  0.0003178800000000, -0.0009062500000000 ]  - [  -0.0000316400000000, -0.0001346800000000,  0.0008984000000000 ]  - [  -0.0000792800000000, -0.0000883400000000,  0.0008069500000000 ]  - [  -0.0007200100000000, -0.0001049700000000, -0.0000225400000000 ]  - [   0.0000845300000000, -0.0000872300000000, -0.0008056900000000 ]  - [   0.0001282500000000,  0.0002431700000000,  0.0004576400000000 ]  - [   0.0000526100000000,  0.0000896000000000,  0.0007599300000000 ]  - [  -0.0013268500000000,  0.0034818900000000, -0.0013094800000000 ]  - [  -0.0000564300000000,  0.0001258700000000, -0.0008101900000000 ]  - [   0.0013268500000000,  0.0034818900000000, -0.0013094800000000 ]  - [   0.0000564300000000,  0.0001258700000000, -0.0008101900000000 ]  - [  -0.0001282500000000,  0.0002431700000000,  0.0004576400000000 ]  - [  -0.0000526100000000,  0.0000896000000000,  0.0007599300000000 ]  - [   0.0007200100000000, -0.0001049700000000, -0.0000225400000000 ]  - [  -0.0000845300000000, -0.0000872300000000, -0.0008056900000000 ]  - [   0.0000316400000000, -0.0001346800000000,  0.0008984000000000 ]  - [   0.0000792800000000, -0.0000883400000000,  0.0008069500000000 ]  - [   0.0000000000000000, -0.0076692800000000,  0.0035706200000000 ]  - [   0.0000000000000000,  0.0001570000000000,  0.0008779600000000 ]  - [   0.0000000000000000,  0.0002919700000000, -0.0008907600000000 ]  - [   0.0000000000000000,  0.0001693500000000, -0.0008901500000000 ]  - [   0.0000000000000000, -0.0031893600000000, -0.0018546400000000 ]  - [   0.0000000000000000, -0.0002179100000000,  0.0008902300000000 ]  - [   0.0000000000000000, -0.0004827600000000, -0.0008909000000000 ]  - [   0.0000000000000000, -0.0001957200000000, -0.0009056600000000 ]  - [  -0.0134373000000000,  0.0011676300000000,  0.0027491900000000 ]  - [  -0.0144007700000000, -0.0000085100000000, -0.0000201200000000 ]  - [   0.0134373000000000,  0.0011676300000000,  0.0027491900000000 ]  - [   0.0144007700000000, -0.0000085100000000, -0.0000201200000000 ]  - [   0.0000000000000000, -0.0534877200000000, -0.0215889500000000 ]  - [   0.0000000000000000,  0.0010211300000000,  0.0000302400000000 ]  - [   0.0000000000000000,  0.0006134100000000,  0.0004142600000000 ]  - [   0.0000000000000000,  0.0010933800000000, -0.0000221100000000 ]  - [   0.0000000000000000,  0.0109163900000000, -0.0011019500000000 ]  - [   0.0000000000000000, -0.0011331100000000,  0.0000533100000000 ]  - [   0.0000000000000000, -0.0009013200000000,  0.0001557200000000 ]  - [   0.0000000000000000, -0.0011245400000000, -0.0000549000000000 ]  - [  -0.0139722900000000,  0.0001148300000000,  0.0002956900000000 ]  - [  -0.0144865700000000,  0.0000348300000000,  0.0000515800000000 ]  - [   0.0139722900000000,  0.0001148300000000,  0.0002956900000000 ]  - [   0.0144865700000000,  0.0000348300000000,  0.0000515800000000 ]  - [   0.0000269600000000,  0.0013626000000000,  0.0002008400000000 ]  - [  -0.0000269600000000,  0.0013626000000000,  0.0002008400000000 ]  - [  -0.0000658600000000,  0.0014869900000000, -0.0001360800000000 ]  - [   0.0000658600000000,  0.0014869900000000, -0.0001360800000000 ]  - [   0.0000922300000000, -0.0012289100000000,  0.0000302500000000 ]  - [  -0.0000922300000000, -0.0012289100000000,  0.0000302500000000 ]  - [   0.0008643200000000, -0.0009889400000000, -0.0002091800000000 ]  - [  -0.0008643200000000, -0.0009889400000000, -0.0002091800000000 ]  - [   0.0001390000000000, -0.0002792500000000, -0.0010303800000000 ]  - [   0.0008564300000000, -0.0001042300000000, -0.0002134100000000 ]  - [  -0.0001390000000000, -0.0002792500000000, -0.0010303800000000 ]  - [  -0.0008564300000000, -0.0001042300000000, -0.0002134100000000 ]  - [  -0.0004693300000000,  0.0007517600000000, -0.0002404100000000 ]  - [  -0.0006575500000000,  0.0001999000000000,  0.0000200700000000 ]  - [   0.0004693300000000,  0.0007517600000000, -0.0002404100000000 ]  - [   0.0006575500000000,  0.0001999000000000,  0.0000200700000000 ]  - [  -0.0001616700000000, -0.0001345300000000,  0.0001742500000000 ]  - [   0.0001616700000000, -0.0001345300000000,  0.0001742500000000 ]  - [  -0.0004551300000000, -0.0002045100000000, -0.0000781100000000 ]  - [   0.0004551300000000, -0.0002045100000000, -0.0000781100000000 ]  - [   0.0001086500000000, -0.0002329900000000, -0.0005548600000000 ]  - [   0.0008373000000000, -0.0000880200000000, -0.0000018200000000 ]  - [  -0.0001086500000000, -0.0002329900000000, -0.0005548600000000 ]  - [  -0.0008373000000000, -0.0000880200000000, -0.0000018200000000 ]  - [  -0.0004479900000000, -0.0019374400000000, -0.0005619300000000 ]  - [  -0.0006951500000000,  0.0000536200000000,  0.0000397300000000 ]  - [   0.0004479900000000, -0.0019374400000000, -0.0005619300000000 ]  - [   0.0006951500000000,  0.0000536200000000,  0.0000397300000000 ]  - [   0.0000000000000000,  0.0167205800000000, -0.0044948000000000 ]  - [   0.0000000000000000,  0.0000832500000000,  0.0000143600000000 ]  - [   0.0000000000000000,  0.0001866300000000, -0.0001635300000000 ]  - [   0.0000000000000000,  0.0000436100000000, -0.0000292700000000 ]- atom:   65  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000000000000000, -0.0295320000000000, -0.0212885700000000 ]  - [   0.0000000000000000, -0.0001032700000000,  0.0008054700000000 ]  - [   0.0000000000000000, -0.0004415600000000,  0.0002335400000000 ]  - [   0.0000000000000000, -0.0000384600000000, -0.0008620700000000 ]  - [  -0.0002848900000000, -0.0005543300000000, -0.0001042600000000 ]  - [   0.0002848900000000, -0.0005543300000000, -0.0001042600000000 ]  - [   0.0003067600000000,  0.0000431100000000,  0.0013831500000000 ]  - [  -0.0003067600000000,  0.0000431100000000,  0.0013831500000000 ]  - [   0.0003885600000000,  0.0006164000000000, -0.0010127400000000 ]  - [  -0.0003885600000000,  0.0006164000000000, -0.0010127400000000 ]  - [   0.0000000000000000,  0.0009257500000000, -0.0024998100000000 ]  - [   0.0000000000000000,  0.0001875400000000, -0.0000473400000000 ]  - [  -0.0006516400000000, -0.0001023700000000,  0.0003181100000000 ]  - [   0.0001474600000000, -0.0000514600000000,  0.0005177000000000 ]  - [   0.0001697000000000, -0.0002401500000000, -0.0009798200000000 ]  - [   0.0000883600000000, -0.0000937100000000, -0.0008326300000000 ]  - [   0.0000674600000000,  0.0004484500000000,  0.0008485000000000 ]  - [   0.0001030400000000,  0.0001104700000000,  0.0008321600000000 ]  - [  -0.0000222600000000,  0.0001263500000000, -0.0008594500000000 ]  - [  -0.0000694200000000,  0.0000931100000000, -0.0007995300000000 ]  - [   0.0000222600000000,  0.0001263500000000, -0.0008594500000000 ]  - [   0.0000694200000000,  0.0000931100000000, -0.0007995300000000 ]  - [  -0.0000674600000000,  0.0004484500000000,  0.0008485000000000 ]  - [  -0.0001030400000000,  0.0001104700000000,  0.0008321600000000 ]  - [  -0.0001697000000000, -0.0002401500000000, -0.0009798200000000 ]  - [  -0.0000883600000000, -0.0000937100000000, -0.0008326300000000 ]  - [   0.0006516400000000, -0.0001023700000000,  0.0003181100000000 ]  - [  -0.0001474600000000, -0.0000514600000000,  0.0005177000000000 ]  - [  -0.0001558000000000,  0.0002804300000000,  0.0009417600000000 ]  - [   0.0001558000000000,  0.0002804300000000,  0.0009417600000000 ]  - [  -0.0002317200000000,  0.0003122400000000, -0.0008795700000000 ]  - [   0.0002317200000000,  0.0003122400000000, -0.0008795700000000 ]  - [  -0.0000952000000000, -0.0003496700000000,  0.0009644700000000 ]  - [   0.0000952000000000, -0.0003496700000000,  0.0009644700000000 ]  - [  -0.0001253800000000, -0.0006108400000000, -0.0008738100000000 ]  - [   0.0001253800000000, -0.0006108400000000, -0.0008738100000000 ]  - [  -0.0000940100000000, -0.0000208000000000,  0.0006677700000000 ]  - [  -0.0000555600000000, -0.0000692700000000,  0.0007710600000000 ]  - [   0.0008424200000000, -0.0000480300000000, -0.0015395100000000 ]  - [   0.0000502900000000, -0.0000702600000000, -0.0007720900000000 ]  - [  -0.0000070400000000, -0.0000908100000000,  0.0011033600000000 ]  - [   0.0000596200000000,  0.0000672100000000,  0.0007898000000000 ]  - [   0.0011390500000000, -0.0033393300000000, -0.0003075400000000 ]  - [  -0.0000559300000000,  0.0000308100000000, -0.0007390700000000 ]  - [  -0.0011390500000000, -0.0033393300000000, -0.0003075400000000 ]  - [   0.0000559300000000,  0.0000308100000000, -0.0007390700000000 ]  - [   0.0000070400000000, -0.0000908100000000,  0.0011033600000000 ]  - [  -0.0000596200000000,  0.0000672100000000,  0.0007898000000000 ]  - [  -0.0008424200000000, -0.0000480300000000, -0.0015395100000000 ]  - [  -0.0000502900000000, -0.0000702600000000, -0.0007720900000000 ]  - [   0.0000940100000000, -0.0000208000000000,  0.0006677700000000 ]  - [   0.0000555600000000, -0.0000692700000000,  0.0007710600000000 ]  - [   0.0000000000000000,  0.0079562400000000, -0.0018325800000000 ]  - [   0.0000000000000000,  0.0001269100000000,  0.0009064500000000 ]  - [   0.0000000000000000, -0.0000126300000000, -0.0008938800000000 ]  - [   0.0000000000000000,  0.0001165300000000, -0.0008928400000000 ]  - [   0.0000000000000000,  0.0028792500000000,  0.0036602000000000 ]  - [   0.0000000000000000, -0.0000664500000000,  0.0008945000000000 ]  - [   0.0000000000000000,  0.0002016200000000, -0.0008935800000000 ]  - [   0.0000000000000000, -0.0000906800000000, -0.0008776400000000 ]  - [  -0.0152910000000000, -0.0011690400000000, -0.0027452500000000 ]  - [  -0.0143258600000000,  0.0000095300000000,  0.0000183300000000 ]  - [   0.0152910000000000, -0.0011690400000000, -0.0027452500000000 ]  - [   0.0143258600000000,  0.0000095300000000,  0.0000183300000000 ]  - [   0.0000000000000000,  0.0548978300000000,  0.0203813800000000 ]  - [   0.0000000000000000,  0.0012767200000000,  0.0000913300000000 ]  - [   0.0000000000000000,  0.0016855600000000, -0.0005338000000000 ]  - [   0.0000000000000000,  0.0012027400000000, -0.0000996600000000 ]  - [   0.0000000000000000, -0.0130436200000000,  0.0012091000000000 ]  - [   0.0000000000000000, -0.0011642600000000,  0.0000731800000000 ]  - [   0.0000000000000000, -0.0013986800000000, -0.0002805000000000 ]  - [   0.0000000000000000, -0.0011710200000000, -0.0000693100000000 ]  - [  -0.0147639100000000, -0.0001162500000000, -0.0003037100000000 ]  - [  -0.0142369400000000, -0.0000335900000000, -0.0000531100000000 ]  - [   0.0147639100000000, -0.0001162500000000, -0.0003037100000000 ]  - [   0.0142369400000000, -0.0000335900000000, -0.0000531100000000 ]  - [  -0.0000287000000000,  0.0009315200000000, -0.0000794500000000 ]  - [   0.0000287000000000,  0.0009315200000000, -0.0000794500000000 ]  - [   0.0000629100000000,  0.0008055000000000,  0.0000134100000000 ]  - [  -0.0000629100000000,  0.0008055000000000,  0.0000134100000000 ]  - [  -0.0000924700000000, -0.0010643200000000,  0.0000942500000000 ]  - [   0.0000924700000000, -0.0010643200000000,  0.0000942500000000 ]  - [  -0.0008682900000000, -0.0013006500000000,  0.0000870200000000 ]  - [   0.0008682900000000, -0.0013006500000000,  0.0000870200000000 ]  - [   0.0012997300000000,  0.0000213400000000,  0.0010417100000000 ]  - [   0.0005932500000000, -0.0001616500000000,  0.0002143800000000 ]  - [  -0.0012997300000000,  0.0000213400000000,  0.0010417100000000 ]  - [  -0.0005932500000000, -0.0001616500000000,  0.0002143800000000 ]  - [  -0.0009755700000000, -0.0004938900000000,  0.0002503100000000 ]  - [  -0.0007557100000000,  0.0000631200000000, -0.0000191800000000 ]  - [   0.0009755700000000, -0.0004938900000000,  0.0002503100000000 ]  - [   0.0007557100000000,  0.0000631200000000, -0.0000191800000000 ]  - [   0.0001644800000000,  0.0001312900000000, -0.0001446300000000 ]  - [  -0.0001644800000000,  0.0001312900000000, -0.0001446300000000 ]  - [   0.0004592400000000,  0.0002015300000000,  0.0000380700000000 ]  - [  -0.0004592400000000,  0.0002015300000000,  0.0000380700000000 ]  - [   0.0013188500000000, -0.0000385300000000,  0.0005524700000000 ]  - [   0.0006142800000000, -0.0001794300000000,  0.0000017300000000 ]  - [  -0.0013188500000000, -0.0000385300000000,  0.0005524700000000 ]  - [  -0.0006142800000000, -0.0001794300000000,  0.0000017300000000 ]  - [  -0.0010483800000000,  0.0021876700000000,  0.0006240300000000 ]  - [  -0.0007001700000000,  0.0002108100000000, -0.0000395900000000 ]  - [   0.0010483800000000,  0.0021876700000000,  0.0006240300000000 ]  - [   0.0007001700000000,  0.0002108100000000, -0.0000395900000000 ]  - [   0.0000000000000000, -0.0170669100000000,  0.0046903600000000 ]  - [   0.0000000000000000, -0.0000833200000000,  0.0000156200000000 ]  - [   0.0000000000000000, -0.0001852400000000,  0.0001368500000000 ]  - [   0.0000000000000000, -0.0000435900000000, -0.0000035700000000 ]- atom:   65  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0215958900000000,  0.0197638000000000 ]  - [   0.0000000000000000,  0.0000406100000000,  0.0012552500000000 ]  - [   0.0000000000000000,  0.0005453100000000, -0.0034036600000000 ]  - [   0.0000000000000000,  0.0000494200000000, -0.0012563400000000 ]  - [  -0.0015787200000000,  0.0016750600000000,  0.0000987500000000 ]  - [   0.0015787200000000,  0.0016750600000000,  0.0000987500000000 ]  - [  -0.0002886100000000, -0.0001198900000000,  0.0005946400000000 ]  - [   0.0002886100000000, -0.0001198900000000,  0.0005946400000000 ]  - [  -0.0003092000000000, -0.0001317800000000, -0.0005901900000000 ]  - [   0.0003092000000000, -0.0001317800000000, -0.0005901900000000 ]  - [   0.0000000000000000,  0.0004233000000000,  0.0000278600000000 ]  - [   0.0000000000000000, -0.0000590100000000, -0.0000125500000000 ]  - [  -0.0005555900000000,  0.0002614000000000,  0.0008526700000000 ]  - [  -0.0000813400000000, -0.0000779400000000,  0.0007851600000000 ]  - [   0.0001888600000000, -0.0001868400000000, -0.0010118700000000 ]  - [   0.0001027200000000, -0.0000755600000000, -0.0008322600000000 ]  - [   0.0001838600000000, -0.0000374400000000,  0.0009191000000000 ]  - [   0.0000425900000000,  0.0000687100000000,  0.0007739700000000 ]  - [  -0.0001837100000000, -0.0000310600000000, -0.0009202600000000 ]  - [  -0.0000478800000000,  0.0000679900000000, -0.0007808200000000 ]  - [   0.0001837100000000, -0.0000310600000000, -0.0009202600000000 ]  - [   0.0000478800000000,  0.0000679900000000, -0.0007808200000000 ]  - [  -0.0001838600000000, -0.0000374400000000,  0.0009191000000000 ]  - [  -0.0000425900000000,  0.0000687100000000,  0.0007739700000000 ]  - [  -0.0001888600000000, -0.0001868400000000, -0.0010118700000000 ]  - [  -0.0001027200000000, -0.0000755600000000, -0.0008322600000000 ]  - [   0.0005555900000000,  0.0002614000000000,  0.0008526700000000 ]  - [   0.0000813400000000, -0.0000779400000000,  0.0007851600000000 ]  - [   0.0002145900000000,  0.0001854400000000,  0.0007701500000000 ]  - [  -0.0002145900000000,  0.0001854400000000,  0.0007701500000000 ]  - [   0.0001573500000000,  0.0002208400000000, -0.0008177700000000 ]  - [  -0.0001573500000000,  0.0002208400000000, -0.0008177700000000 ]  - [   0.0000395100000000, -0.0000605300000000,  0.0006444400000000 ]  - [  -0.0000395100000000, -0.0000605300000000,  0.0006444400000000 ]  - [   0.0000656800000000, -0.0001352800000000, -0.0006686100000000 ]  - [  -0.0000656800000000, -0.0001352800000000, -0.0006686100000000 ]  - [   0.0001407600000000,  0.0001072600000000,  0.0004751900000000 ]  - [  -0.0000354600000000, -0.0000556100000000,  0.0007269500000000 ]  - [  -0.0002436800000000,  0.0002267700000000, -0.0003484700000000 ]  - [   0.0000334500000000, -0.0000551600000000, -0.0007250000000000 ]  - [  -0.0006919500000000, -0.0002035900000000, -0.0006230800000000 ]  - [   0.0000162600000000,  0.0000757300000000,  0.0006308000000000 ]  - [  -0.0037718500000000,  0.0003113700000000, -0.0026072800000000 ]  - [  -0.0000235500000000,  0.0000699300000000, -0.0006097100000000 ]  - [   0.0037718500000000,  0.0003113700000000, -0.0026072800000000 ]  - [   0.0000235500000000,  0.0000699300000000, -0.0006097100000000 ]  - [   0.0006919500000000, -0.0002035900000000, -0.0006230800000000 ]  - [  -0.0000162600000000,  0.0000757300000000,  0.0006308000000000 ]  - [   0.0002436800000000,  0.0002267700000000, -0.0003484700000000 ]  - [  -0.0000334500000000, -0.0000551600000000, -0.0007250000000000 ]  - [  -0.0001407600000000,  0.0001072600000000,  0.0004751900000000 ]  - [   0.0000354600000000, -0.0000556100000000,  0.0007269500000000 ]  - [   0.0000000000000000, -0.0020608700000000,  0.0039902000000000 ]  - [   0.0000000000000000,  0.0001207600000000,  0.0009032900000000 ]  - [   0.0000000000000000, -0.0000334300000000, -0.0009697000000000 ]  - [   0.0000000000000000,  0.0001200300000000, -0.0008990000000000 ]  - [   0.0000000000000000, -0.0010016400000000,  0.0008326600000000 ]  - [   0.0000000000000000, -0.0001410700000000,  0.0009052700000000 ]  - [   0.0000000000000000, -0.0002270500000000, -0.0008854700000000 ]  - [   0.0000000000000000, -0.0001461000000000, -0.0009003300000000 ]  - [  -0.0122317400000000,  0.0022029500000000,  0.0041106300000000 ]  - [  -0.0144240100000000, -0.0000025500000000, -0.0000032000000000 ]  - [   0.0122317400000000,  0.0022029500000000,  0.0041106300000000 ]  - [   0.0144240100000000, -0.0000025500000000, -0.0000032000000000 ]  - [   0.0000000000000000, -0.0202719200000000, -0.0388309400000000 ]  - [   0.0000000000000000,  0.0011188800000000, -0.0001007000000000 ]  - [   0.0000000000000000,  0.0006749500000000,  0.0013828600000000 ]  - [   0.0000000000000000,  0.0011094800000000,  0.0000803800000000 ]  - [   0.0000000000000000, -0.0000060100000000, -0.0006883200000000 ]  - [   0.0000000000000000, -0.0011390200000000, -0.0000169600000000 ]  - [   0.0000000000000000, -0.0009300800000000,  0.0005854400000000 ]  - [   0.0000000000000000, -0.0011402000000000,  0.0000155700000000 ]  - [  -0.0140247600000000,  0.0001260800000000,  0.0001393100000000 ]  - [  -0.0144274100000000,  0.0000108900000000, -0.0000223300000000 ]  - [   0.0140247600000000,  0.0001260800000000,  0.0001393100000000 ]  - [   0.0144274100000000,  0.0000108900000000, -0.0000223300000000 ]  - [  -0.0000204700000000,  0.0012895900000000,  0.0002675700000000 ]  - [   0.0000204700000000,  0.0012895900000000,  0.0002675700000000 ]  - [  -0.0000386300000000,  0.0012210600000000, -0.0002042900000000 ]  - [   0.0000386300000000,  0.0012210600000000, -0.0002042900000000 ]  - [  -0.0000148300000000, -0.0011173600000000,  0.0002921000000000 ]  - [   0.0000148300000000, -0.0011173600000000,  0.0002921000000000 ]  - [  -0.0003059300000000, -0.0012936100000000, -0.0003327800000000 ]  - [   0.0003059300000000, -0.0012936100000000, -0.0003327800000000 ]  - [   0.0012063100000000, -0.0006444100000000,  0.0008072500000000 ]  - [   0.0007653400000000, -0.0001358800000000,  0.0000309100000000 ]  - [  -0.0012063100000000, -0.0006444100000000,  0.0008072500000000 ]  - [  -0.0007653400000000, -0.0001358800000000,  0.0000309100000000 ]  - [  -0.0007675200000000,  0.0003678400000000, -0.0000328100000000 ]  - [  -0.0006868800000000,  0.0001640600000000,  0.0000069700000000 ]  - [   0.0007675200000000,  0.0003678400000000, -0.0000328100000000 ]  - [   0.0006868800000000,  0.0001640600000000,  0.0000069700000000 ]  - [  -0.0000012600000000, -0.0003562700000000,  0.0006978900000000 ]  - [   0.0000012600000000, -0.0003562700000000,  0.0006978900000000 ]  - [   0.0000213700000000, -0.0002519300000000, -0.0005601800000000 ]  - [  -0.0000213700000000, -0.0002519300000000, -0.0005601800000000 ]  - [   0.0004040100000000, -0.0008225200000000, -0.0000570300000000 ]  - [   0.0006552800000000, -0.0002118300000000, -0.0000003500000000 ]  - [  -0.0004040100000000, -0.0008225200000000, -0.0000570300000000 ]  - [  -0.0006552800000000, -0.0002118300000000, -0.0000003500000000 ]  - [  -0.0093797700000000, -0.0017111300000000,  0.0079600300000000 ]  - [  -0.0002253600000000,  0.0002187000000000, -0.0000441800000000 ]  - [   0.0093797700000000, -0.0017111300000000,  0.0079600300000000 ]  - [   0.0002253600000000,  0.0002187000000000, -0.0000441800000000 ]  - [   0.0000000000000000, -0.0011272800000000, -0.0015574000000000 ]  - [   0.0000000000000000,  0.0000151000000000, -0.0000047400000000 ]  - [   0.0000000000000000,  0.0001373700000000,  0.0001921300000000 ]  - [   0.0000000000000000,  0.0000255800000000,  0.0000073400000000 ]- atom:   65  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000, -0.0207542600000000, -0.0174345000000000 ]  - [   0.0000000000000000, -0.0000397200000000,  0.0007257000000000 ]  - [   0.0000000000000000, -0.0005487200000000,  0.0014252000000000 ]  - [   0.0000000000000000, -0.0000496000000000, -0.0007230900000000 ]  - [   0.0015842100000000, -0.0016899800000000, -0.0001041200000000 ]  - [  -0.0015842100000000, -0.0016899800000000, -0.0001041200000000 ]  - [   0.0002892900000000,  0.0001206800000000,  0.0013870800000000 ]  - [  -0.0002892900000000,  0.0001206800000000,  0.0013870800000000 ]  - [   0.0003087200000000,  0.0001312800000000, -0.0013955000000000 ]  - [  -0.0003087200000000,  0.0001312800000000, -0.0013955000000000 ]  - [   0.0000000000000000, -0.0004215800000000, -0.0000069700000000 ]  - [   0.0000000000000000,  0.0000551200000000,  0.0000137300000000 ]  - [   0.0004349000000000, -0.0004177400000000,  0.0007133700000000 ]  - [  -0.0000507500000000, -0.0000803100000000,  0.0007892400000000 ]  - [  -0.0000674900000000,  0.0000268400000000, -0.0005476000000000 ]  - [   0.0000275000000000, -0.0000826100000000, -0.0007393500000000 ]  - [  -0.0000598500000000,  0.0001948000000000,  0.0006494900000000 ]  - [   0.0000766700000000,  0.0000890100000000,  0.0007847900000000 ]  - [   0.0000582700000000,  0.0001890900000000, -0.0006449700000000 ]  - [  -0.0000703700000000,  0.0000897700000000, -0.0007760600000000 ]  - [  -0.0000582700000000,  0.0001890900000000, -0.0006449700000000 ]  - [   0.0000703700000000,  0.0000897700000000, -0.0007760600000000 ]  - [   0.0000598500000000,  0.0001948000000000,  0.0006494900000000 ]  - [  -0.0000766700000000,  0.0000890100000000,  0.0007847900000000 ]  - [   0.0000674900000000,  0.0000268400000000, -0.0005476000000000 ]  - [  -0.0000275000000000, -0.0000826100000000, -0.0007393500000000 ]  - [  -0.0004349000000000, -0.0004177400000000,  0.0007133700000000 ]  - [   0.0000507500000000, -0.0000803100000000,  0.0007892400000000 ]  - [  -0.0002142700000000,  0.0000986600000000,  0.0010139700000000 ]  - [   0.0002142700000000,  0.0000986600000000,  0.0010139700000000 ]  - [  -0.0001581200000000,  0.0000689700000000, -0.0009623600000000 ]  - [   0.0001581200000000,  0.0000689700000000, -0.0009623600000000 ]  - [  -0.0000386500000000, -0.0002240300000000,  0.0011417200000000 ]  - [   0.0000386500000000, -0.0002240300000000,  0.0011417200000000 ]  - [  -0.0000675200000000, -0.0001540700000000, -0.0011121200000000 ]  - [   0.0000675200000000, -0.0001540700000000, -0.0011121200000000 ]  - [  -0.0002654200000000, -0.0002658900000000,  0.0010894000000000 ]  - [  -0.0000966100000000, -0.0001029600000000,  0.0008472400000000 ]  - [   0.0003733600000000, -0.0003856900000000, -0.0012222400000000 ]  - [   0.0000984900000000, -0.0001033100000000, -0.0008495100000000 ]  - [   0.0008185600000000,  0.0003631600000000,  0.0021994400000000 ]  - [   0.0000984300000000,  0.0000820100000000,  0.0009225900000000 ]  - [   0.0036119800000000, -0.0001492900000000,  0.0009895300000000 ]  - [  -0.0000908200000000,  0.0000878100000000, -0.0009441400000000 ]  - [  -0.0036119800000000, -0.0001492900000000,  0.0009895300000000 ]  - [   0.0000908200000000,  0.0000878100000000, -0.0009441400000000 ]  - [  -0.0008185600000000,  0.0003631600000000,  0.0021994400000000 ]  - [  -0.0000984300000000,  0.0000820100000000,  0.0009225900000000 ]  - [  -0.0003733600000000, -0.0003856900000000, -0.0012222400000000 ]  - [  -0.0000984900000000, -0.0001033100000000, -0.0008495100000000 ]  - [   0.0002654200000000, -0.0002658900000000,  0.0010894000000000 ]  - [   0.0000966100000000, -0.0001029600000000,  0.0008472400000000 ]  - [   0.0000000000000000,  0.0022623100000000, -0.0022235800000000 ]  - [   0.0000000000000000,  0.0001673400000000,  0.0008802800000000 ]  - [   0.0000000000000000,  0.0003235300000000, -0.0008134100000000 ]  - [   0.0000000000000000,  0.0001690100000000, -0.0008835700000000 ]  - [   0.0000000000000000,  0.0007182100000000,  0.0009391400000000 ]  - [   0.0000000000000000, -0.0001467900000000,  0.0008786200000000 ]  - [   0.0000000000000000, -0.0000613100000000, -0.0008979000000000 ]  - [   0.0000000000000000, -0.0001426100000000, -0.0008825600000000 ]  - [  -0.0164619000000000, -0.0021789400000000, -0.0040731100000000 ]  - [  -0.0143049600000000,  0.0000032600000000,  0.0000026100000000 ]  - [   0.0164619000000000, -0.0021789400000000, -0.0040731100000000 ]  - [   0.0143049600000000,  0.0000032600000000,  0.0000026100000000 ]  - [   0.0000000000000000,  0.0216878900000000,  0.0387913300000000 ]  - [   0.0000000000000000,  0.0011772900000000,  0.0002246700000000 ]  - [   0.0000000000000000,  0.0016217100000000, -0.0015146400000000 ]  - [   0.0000000000000000,  0.0011872000000000, -0.0002050400000000 ]  - [   0.0000000000000000, -0.0023160200000000,  0.0008238500000000 ]  - [   0.0000000000000000, -0.0011565500000000,  0.0001436700000000 ]  - [   0.0000000000000000, -0.0013642000000000, -0.0007086600000000 ]  - [   0.0000000000000000, -0.0011553600000000, -0.0001406500000000 ]  - [  -0.0147058800000000, -0.0001273400000000, -0.0001429300000000 ]  - [  -0.0143006900000000, -0.0000104700000000,  0.0000204700000000 ]  - [   0.0147058800000000, -0.0001273400000000, -0.0001429300000000 ]  - [   0.0143006900000000, -0.0000104700000000,  0.0000204700000000 ]  - [   0.0000209700000000,  0.0010081300000000, -0.0001445400000000 ]  - [  -0.0000209700000000,  0.0010081300000000, -0.0001445400000000 ]  - [   0.0000400200000000,  0.0010724300000000,  0.0000825900000000 ]  - [  -0.0000400200000000,  0.0010724300000000,  0.0000825900000000 ]  - [   0.0000153300000000, -0.0011800800000000, -0.0001670000000000 ]  - [  -0.0000153300000000, -0.0011800800000000, -0.0001670000000000 ]  - [   0.0003103400000000, -0.0009979400000000,  0.0002093400000000 ]  - [  -0.0003103400000000, -0.0009979400000000,  0.0002093400000000 ]  - [   0.0002252500000000,  0.0003660200000000, -0.0007992900000000 ]  - [   0.0006830400000000, -0.0001359000000000, -0.0000329800000000 ]  - [  -0.0002252500000000,  0.0003660200000000, -0.0007992900000000 ]  - [  -0.0006830400000000, -0.0001359000000000, -0.0000329800000000 ]  - [  -0.0006654300000000, -0.0000941300000000,  0.0000284600000000 ]  - [  -0.0007278500000000,  0.0001069700000000, -0.0000077200000000 ]  - [   0.0006654300000000, -0.0000941300000000,  0.0000284600000000 ]  - [   0.0007278500000000,  0.0001069700000000, -0.0000077200000000 ]  - [  -0.0000006600000000,  0.0003588100000000, -0.0006643800000000 ]  - [   0.0000006600000000,  0.0003588100000000, -0.0006643800000000 ]  - [  -0.0000187000000000,  0.0002519800000000,  0.0005180400000000 ]  - [   0.0000187000000000,  0.0002519800000000,  0.0005180400000000 ]  - [   0.0010319000000000,  0.0005545700000000,  0.0000618700000000 ]  - [   0.0007970400000000, -0.0000595900000000,  0.0000016200000000 ]  - [  -0.0010319000000000,  0.0005545700000000,  0.0000618700000000 ]  - [  -0.0007970400000000, -0.0000595900000000,  0.0000016200000000 ]  - [   0.0080813400000000,  0.0020119500000000, -0.0080407500000000 ]  - [  -0.0011815500000000,  0.0000506000000000,  0.0000469300000000 ]  - [  -0.0080813400000000,  0.0020119500000000, -0.0080407500000000 ]  - [   0.0011815500000000,  0.0000506000000000,  0.0000469300000000 ]  - [   0.0000000000000000,  0.0011934000000000,  0.0015689600000000 ]  - [   0.0000000000000000, -0.0000153700000000,  0.0000448000000000 ]  - [   0.0000000000000000, -0.0001380000000000, -0.0002338100000000 ]  - [   0.0000000000000000, -0.0000259700000000, -0.0000497600000000 ]- atom:   85  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0005685500000000,  0.0005591900000000,  0.0013015500000000 ]  - [  -0.0004572500000000, -0.0001908900000000,  0.0008729000000000 ]  - [   0.0005685500000000,  0.0005591900000000, -0.0013015500000000 ]  - [  -0.0004572500000000, -0.0001908900000000, -0.0008729000000000 ]  - [  -0.0006927900000000,  0.0000825600000000,  0.0000000000000000 ]  - [   0.0007738300000000, -0.0005299600000000,  0.0000000000000000 ]  - [  -0.0004635100000000, -0.0002225900000000,  0.0012840700000000 ]  - [   0.0009361900000000,  0.0024182500000000, -0.0000868700000000 ]  - [  -0.0004635100000000, -0.0002225900000000, -0.0012840700000000 ]  - [   0.0009361900000000,  0.0024182500000000,  0.0000868700000000 ]  - [   0.0166747700000000,  0.0157115900000000,  0.0000000000000000 ]  - [  -0.0012692600000000,  0.0003868700000000,  0.0000000000000000 ]  - [   0.1753016200000000,  0.0220499100000000, -0.1555232200000000 ]  - [  -0.0004076400000000, -0.0000700400000000,  0.0010124600000000 ]  - [   0.0000553500000000, -0.0001907100000000,  0.0010672800000000 ]  - [  -0.0005930200000000, -0.0000771600000000, -0.0003795600000000 ]  - [  -0.0003113400000000, -0.0001890600000000,  0.0004754800000000 ]  - [   0.0000334600000000,  0.0002151100000000,  0.0008431400000000 ]  - [   0.0007163100000000,  0.0006817100000000, -0.0001614000000000 ]  - [  -0.0003092000000000,  0.0000648500000000, -0.0009347500000000 ]  - [  -0.0003113400000000, -0.0001890600000000, -0.0004754800000000 ]  - [   0.0000334600000000,  0.0002151100000000, -0.0008431400000000 ]  - [   0.0007163100000000,  0.0006817100000000,  0.0001614000000000 ]  - [  -0.0003092000000000,  0.0000648500000000,  0.0009347500000000 ]  - [   0.1753016200000000,  0.0220499100000000,  0.1555232200000000 ]  - [  -0.0004076400000000, -0.0000700400000000, -0.0010124600000000 ]  - [   0.0000553500000000, -0.0001907100000000, -0.0010672800000000 ]  - [  -0.0005930200000000, -0.0000771600000000,  0.0003795600000000 ]  - [  -0.0001028200000000,  0.0000513000000000,  0.0008937200000000 ]  - [   0.0000814000000000,  0.0002418800000000,  0.0009889300000000 ]  - [  -0.0001028200000000,  0.0000513000000000, -0.0008937200000000 ]  - [   0.0000814000000000,  0.0002418800000000, -0.0009889300000000 ]  - [  -0.0001278400000000,  0.0000522200000000,  0.0009083700000000 ]  - [   0.0002636300000000, -0.0013656500000000,  0.0008543200000000 ]  - [  -0.0001278400000000,  0.0000522200000000, -0.0009083700000000 ]  - [   0.0002636300000000, -0.0013656500000000, -0.0008543200000000 ]  - [  -0.0000873500000000, -0.0000548300000000,  0.0007969300000000 ]  - [  -0.0002051200000000, -0.0000763500000000,  0.0008900000000000 ]  - [   0.0004411100000000, -0.0000458900000000, -0.0010162000000000 ]  - [  -0.0001519300000000, -0.0000984600000000, -0.0006635300000000 ]  - [   0.0007644400000000,  0.0000086000000000,  0.0010947300000000 ]  - [  -0.0002606900000000,  0.0000969300000000,  0.0005675100000000 ]  - [  -0.0002367800000000,  0.0000717100000000, -0.0009003100000000 ]  - [  -0.0004943500000000, -0.0000472200000000, -0.0008004400000000 ]  - [   0.0007644400000000,  0.0000086000000000, -0.0010947300000000 ]  - [  -0.0002606900000000,  0.0000969300000000, -0.0005675100000000 ]  - [  -0.0002367800000000,  0.0000717100000000,  0.0009003100000000 ]  - [  -0.0004943500000000, -0.0000472200000000,  0.0008004400000000 ]  - [  -0.0000873500000000, -0.0000548300000000, -0.0007969300000000 ]  - [  -0.0002051200000000, -0.0000763500000000, -0.0008900000000000 ]  - [   0.0004411100000000, -0.0000458900000000,  0.0010162000000000 ]  - [  -0.0001519300000000, -0.0000984600000000,  0.0006635300000000 ]  - [  -0.0000291300000000,  0.0007610600000000,  0.0004055600000000 ]  - [  -0.0003018500000000,  0.0001804400000000,  0.0009080000000000 ]  - [  -0.0000291300000000,  0.0007610600000000, -0.0004055600000000 ]  - [  -0.0003018500000000,  0.0001804400000000, -0.0009080000000000 ]  - [   0.0006074800000000, -0.0015226400000000,  0.0013933700000000 ]  - [  -0.0001630800000000, -0.0000683000000000,  0.0008855600000000 ]  - [   0.0006074800000000, -0.0015226400000000, -0.0013933700000000 ]  - [  -0.0001630800000000, -0.0000683000000000, -0.0008855600000000 ]  - [  -0.0153301300000000,  0.0003562200000000,  0.0000000000000000 ]  - [  -0.0139429300000000,  0.0000253800000000,  0.0000000000000000 ]  - [   0.0141008400000000, -0.0001187500000000,  0.0000000000000000 ]  - [   0.0147214400000000,  0.0000301600000000,  0.0000000000000000 ]  - [  -0.0001620300000000,  0.0005671300000000,  0.0005459700000000 ]  - [   0.0004659500000000,  0.0012771100000000,  0.0000978900000000 ]  - [  -0.0001620300000000,  0.0005671300000000, -0.0005459700000000 ]  - [   0.0004659500000000,  0.0012771100000000, -0.0000978900000000 ]  - [  -0.0002214000000000, -0.0008934100000000,  0.0001079800000000 ]  - [   0.0002072900000000, -0.0011001300000000,  0.0000408400000000 ]  - [  -0.0002214000000000, -0.0008934100000000, -0.0001079800000000 ]  - [   0.0002072900000000, -0.0011001300000000, -0.0000408400000000 ]  - [  -0.0140622500000000,  0.0000289800000000,  0.0000000000000000 ]  - [  -0.0140871500000000, -0.0005107100000000,  0.0000000000000000 ]  - [   0.0134392000000000, -0.0002896300000000,  0.0000000000000000 ]  - [   0.0148171800000000,  0.0000424400000000,  0.0000000000000000 ]  - [   0.0003166200000000,  0.0012566600000000, -0.0000139000000000 ]  - [  -0.0003865500000000,  0.0005463500000000, -0.0002555500000000 ]  - [   0.0003166200000000,  0.0012566600000000,  0.0000139000000000 ]  - [  -0.0003865500000000,  0.0005463500000000,  0.0002555500000000 ]  - [   0.0006810900000000, -0.0011473500000000, -0.0004127200000000 ]  - [   0.0065456100000000, -0.0008430400000000,  0.0087714200000000 ]  - [   0.0006810900000000, -0.0011473500000000,  0.0004127200000000 ]  - [   0.0065456100000000, -0.0008430400000000, -0.0087714200000000 ]  - [  -0.3901823500000000, -0.0703941800000000,  0.0000000000000000 ]  - [   0.0013701500000000, -0.0000315600000000,  0.0000000000000000 ]  - [   0.0090035200000000, -0.0018350900000000,  0.0000000000000000 ]  - [   0.0002597700000000, -0.0003480200000000,  0.0000000000000000 ]  - [  -0.0006430600000000,  0.0005222900000000,  0.0000000000000000 ]  - [  -0.0005599500000000, -0.0000728000000000,  0.0000000000000000 ]  - [  -0.0036402800000000,  0.0027884500000000,  0.0000000000000000 ]  - [   0.0011646000000000,  0.0000613000000000,  0.0000000000000000 ]  - [   0.0002490400000000, -0.0000698400000000, -0.0000345100000000 ]  - [  -0.0002844000000000,  0.0007257800000000,  0.0002134900000000 ]  - [   0.0002490400000000, -0.0000698400000000,  0.0000345100000000 ]  - [  -0.0002844000000000,  0.0007257800000000, -0.0002134900000000 ]  - [   0.0008254700000000, -0.0001350200000000,  0.0000000000000000 ]  - [   0.0008369400000000, -0.0000784200000000,  0.0000000000000000 ]  - [  -0.0013235600000000, -0.0000493600000000,  0.0000000000000000 ]  - [  -0.0003504100000000, -0.0001493800000000,  0.0000000000000000 ]  - [  -0.0017220100000000,  0.0001883800000000,  0.0000000000000000 ]  - [  -0.0001798600000000,  0.0001725500000000,  0.0000000000000000 ]  - [   0.0010653900000000,  0.0000351000000000,  0.0000000000000000 ]  - [   0.0010521800000000,  0.0004321100000000,  0.0000000000000000 ]  - [   0.0009891600000000,  0.0034215500000000,  0.0052263600000000 ]  - [   0.0004733100000000, -0.0001349300000000,  0.0000227100000000 ]  - [   0.0009891600000000,  0.0034215500000000, -0.0052263600000000 ]  - [   0.0004733100000000, -0.0001349300000000, -0.0000227100000000 ]- atom:   85  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0005733400000000, -0.0005625400000000,  0.0006694300000000 ]  - [   0.0004599300000000,  0.0001938700000000,  0.0011056500000000 ]  - [  -0.0005733400000000, -0.0005625400000000, -0.0006694300000000 ]  - [   0.0004599300000000,  0.0001938700000000, -0.0011056500000000 ]  - [   0.0006963100000000, -0.0000819900000000,  0.0000000000000000 ]  - [  -0.0007797100000000,  0.0005277800000000,  0.0000000000000000 ]  - [   0.0004675200000000,  0.0002247900000000,  0.0006918900000000 ]  - [  -0.0009441900000000, -0.0024362300000000,  0.0020710400000000 ]  - [   0.0004675200000000,  0.0002247900000000, -0.0006918900000000 ]  - [  -0.0009441900000000, -0.0024362300000000, -0.0020710400000000 ]  - [  -0.0173282700000000, -0.0167369800000000,  0.0000000000000000 ]  - [   0.0012772000000000, -0.0003941500000000,  0.0000000000000000 ]  - [  -0.1720896200000000, -0.0211034800000000,  0.1482014900000000 ]  - [   0.0002812400000000, -0.0000879600000000,  0.0005558300000000 ]  - [   0.0000615900000000,  0.0000372200000000, -0.0026373800000000 ]  - [   0.0007240500000000, -0.0000829100000000, -0.0011997000000000 ]  - [   0.0004437200000000,  0.0003498300000000,  0.0010940300000000 ]  - [   0.0000876100000000, -0.0000566300000000,  0.0007185500000000 ]  - [  -0.0008378600000000, -0.0005170100000000, -0.0014013400000000 ]  - [   0.0001959200000000,  0.0000932400000000, -0.0006174100000000 ]  - [   0.0004437200000000,  0.0003498300000000, -0.0010940300000000 ]  - [   0.0000876100000000, -0.0000566300000000, -0.0007185500000000 ]  - [  -0.0008378600000000, -0.0005170100000000,  0.0014013400000000 ]  - [   0.0001959200000000,  0.0000932400000000,  0.0006174100000000 ]  - [  -0.1720896200000000, -0.0211034800000000, -0.1482014900000000 ]  - [   0.0002812400000000, -0.0000879600000000, -0.0005558300000000 ]  - [   0.0000615900000000,  0.0000372200000000,  0.0026373800000000 ]  - [   0.0007240500000000, -0.0000829100000000,  0.0011997000000000 ]  - [   0.0001038200000000,  0.0002397100000000,  0.0008899700000000 ]  - [  -0.0000816800000000,  0.0000508100000000,  0.0007928700000000 ]  - [   0.0001038200000000,  0.0002397100000000, -0.0008899700000000 ]  - [  -0.0000816800000000,  0.0000508100000000, -0.0007928700000000 ]  - [   0.0001288700000000, -0.0003434900000000,  0.0008751300000000 ]  - [  -0.0002663300000000,  0.0010830900000000,  0.0009288000000000 ]  - [   0.0001288700000000, -0.0003434900000000, -0.0008751300000000 ]  - [  -0.0002663300000000,  0.0010830900000000, -0.0009288000000000 ]  - [  -0.0000291400000000, -0.0001026700000000,  0.0007584700000000 ]  - [   0.0000736700000000, -0.0000816300000000,  0.0006831500000000 ]  - [  -0.0003132100000000, -0.0001122500000000, -0.0005534900000000 ]  - [   0.0002819700000000, -0.0000593200000000, -0.0009067400000000 ]  - [  -0.0006530600000000,  0.0001498500000000,  0.0004577400000000 ]  - [   0.0003784600000000,  0.0000610100000000,  0.0009874900000000 ]  - [   0.0001046200000000,  0.0000871800000000, -0.0006750000000000 ]  - [   0.0003832700000000,  0.0002062000000000, -0.0007521300000000 ]  - [  -0.0006530600000000,  0.0001498500000000, -0.0004577400000000 ]  - [   0.0003784600000000,  0.0000610100000000, -0.0009874900000000 ]  - [   0.0001046200000000,  0.0000871800000000,  0.0006750000000000 ]  - [   0.0003832700000000,  0.0002062000000000,  0.0007521300000000 ]  - [  -0.0000291400000000, -0.0001026700000000, -0.0007584700000000 ]  - [   0.0000736700000000, -0.0000816300000000, -0.0006831500000000 ]  - [  -0.0003132100000000, -0.0001122500000000,  0.0005534900000000 ]  - [   0.0002819700000000, -0.0000593200000000,  0.0009067400000000 ]  - [   0.0000363700000000, -0.0004699700000000,  0.0013869000000000 ]  - [   0.0003042600000000,  0.0001102600000000,  0.0008747900000000 ]  - [   0.0000363700000000, -0.0004699700000000, -0.0013869000000000 ]  - [   0.0003042600000000,  0.0001102600000000, -0.0008747900000000 ]  - [  -0.0006126400000000,  0.0012368900000000,  0.0003786300000000 ]  - [   0.0001640900000000, -0.0002232600000000,  0.0008974000000000 ]  - [  -0.0006126400000000,  0.0012368900000000, -0.0003786300000000 ]  - [   0.0001640900000000, -0.0002232600000000, -0.0008974000000000 ]  - [  -0.0133895100000000, -0.0003706800000000,  0.0000000000000000 ]  - [  -0.0147833400000000, -0.0000247900000000,  0.0000000000000000 ]  - [   0.0146235200000000,  0.0001192500000000,  0.0000000000000000 ]  - [   0.0140006400000000, -0.0000298200000000,  0.0000000000000000 ]  - [   0.0001628000000000,  0.0017301800000000, -0.0004287200000000 ]  - [  -0.0004704800000000,  0.0010148500000000,  0.0000247400000000 ]  - [   0.0001628000000000,  0.0017301800000000,  0.0004287200000000 ]  - [  -0.0004704800000000,  0.0010148500000000, -0.0000247400000000 ]  - [   0.0002225000000000, -0.0013991400000000,  0.0000133800000000 ]  - [  -0.0002082000000000, -0.0011932200000000,  0.0000822200000000 ]  - [   0.0002225000000000, -0.0013991400000000, -0.0000133800000000 ]  - [  -0.0002082000000000, -0.0011932200000000, -0.0000822200000000 ]  - [  -0.0146657700000000, -0.0000292200000000,  0.0000000000000000 ]  - [  -0.0146339500000000,  0.0005151500000000,  0.0000000000000000 ]  - [   0.0152878400000000,  0.0002924700000000,  0.0000000000000000 ]  - [   0.0139053700000000, -0.0000421100000000,  0.0000000000000000 ]  - [  -0.0003183500000000,  0.0010368800000000,  0.0001362300000000 ]  - [   0.0003883700000000,  0.0017486300000000,  0.0003783200000000 ]  - [  -0.0003183500000000,  0.0010368800000000, -0.0001362300000000 ]  - [   0.0003883700000000,  0.0017486300000000, -0.0003783200000000 ]  - [  -0.0006852900000000, -0.0011463700000000,  0.0005385600000000 ]  - [  -0.0066150000000000, -0.0014491800000000, -0.0086852800000000 ]  - [  -0.0006852900000000, -0.0011463700000000, -0.0005385600000000 ]  - [  -0.0066150000000000, -0.0014491800000000,  0.0086852800000000 ]  - [   0.3859625900000000,  0.0689827100000000,  0.0000000000000000 ]  - [   0.0000578100000000, -0.0002319200000000,  0.0000000000000000 ]  - [  -0.0106315000000000,  0.0016013600000000,  0.0000000000000000 ]  - [  -0.0016989600000000,  0.0000878300000000,  0.0000000000000000 ]  - [  -0.0007642400000000, -0.0002467100000000,  0.0000000000000000 ]  - [  -0.0008601200000000,  0.0003369700000000,  0.0000000000000000 ]  - [   0.0050643700000000, -0.0025195500000000,  0.0000000000000000 ]  - [   0.0002384100000000,  0.0002012500000000,  0.0000000000000000 ]  - [  -0.0002511500000000,  0.0000706200000000,  0.0000799300000000 ]  - [   0.0002869400000000, -0.0007314400000000, -0.0001657300000000 ]  - [  -0.0002511500000000,  0.0000706200000000, -0.0000799300000000 ]  - [   0.0002869400000000, -0.0007314400000000,  0.0001657300000000 ]  - [   0.0005835500000000, -0.0001275600000000,  0.0000000000000000 ]  - [   0.0005997500000000, -0.0001865000000000,  0.0000000000000000 ]  - [  -0.0001063300000000, -0.0002151700000000,  0.0000000000000000 ]  - [  -0.0010842700000000, -0.0001137100000000,  0.0000000000000000 ]  - [   0.0003207900000000,  0.0000748800000000,  0.0000000000000000 ]  - [  -0.0012284100000000,  0.0000897900000000,  0.0000000000000000 ]  - [   0.0003736300000000,  0.0002297500000000,  0.0000000000000000 ]  - [   0.0003506900000000, -0.0001711000000000,  0.0000000000000000 ]  - [  -0.0010101800000000, -0.0034719500000000, -0.0052491800000000 ]  - [  -0.0004759200000000,  0.0001369400000000,  0.0000256400000000 ]  - [  -0.0010101800000000, -0.0034719500000000,  0.0052491800000000 ]  - [  -0.0004759200000000,  0.0001369400000000, -0.0000256400000000 ]- atom:   85  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0011818600000000, -0.0009644800000000,  0.0022373900000000 ]  - [  -0.0001119200000000, -0.0000957700000000,  0.0010896300000000 ]  - [   0.0011818600000000, -0.0009644800000000, -0.0022373900000000 ]  - [  -0.0001119200000000, -0.0000957700000000, -0.0010896300000000 ]  - [   0.0000693800000000, -0.0001724100000000,  0.0000000000000000 ]  - [  -0.0000274600000000, -0.0003396700000000,  0.0000000000000000 ]  - [  -0.0001558900000000,  0.0000467000000000,  0.0010354300000000 ]  - [   0.0004700400000000,  0.0012745900000000,  0.0009549800000000 ]  - [  -0.0001558900000000,  0.0000467000000000, -0.0010354300000000 ]  - [   0.0004700400000000,  0.0012745900000000, -0.0009549800000000 ]  - [   0.0121699600000000,  0.0192681000000000,  0.0000000000000000 ]  - [  -0.0000989800000000,  0.0002416400000000,  0.0000000000000000 ]  - [   0.0228415600000000,  0.0105493300000000, -0.0122276900000000 ]  - [  -0.0001145600000000, -0.0000690700000000,  0.0008116600000000 ]  - [   0.0000637500000000, -0.0001624600000000, -0.0003399200000000 ]  - [  -0.0000809300000000,  0.0000284500000000, -0.0005909200000000 ]  - [  -0.0001398500000000, -0.0000945100000000,  0.0005647000000000 ]  - [   0.0002204200000000,  0.0000653800000000,  0.0008545400000000 ]  - [   0.0012984500000000, -0.0009849800000000,  0.0014379400000000 ]  - [  -0.0001158600000000,  0.0000763600000000, -0.0008123900000000 ]  - [  -0.0001398500000000, -0.0000945100000000, -0.0005647000000000 ]  - [   0.0002204200000000,  0.0000653800000000, -0.0008545400000000 ]  - [   0.0012984500000000, -0.0009849800000000, -0.0014379400000000 ]  - [  -0.0001158600000000,  0.0000763600000000,  0.0008123900000000 ]  - [   0.0228415600000000,  0.0105493300000000,  0.0122276900000000 ]  - [  -0.0001145600000000, -0.0000690700000000, -0.0008116600000000 ]  - [   0.0000637500000000, -0.0001624600000000,  0.0003399200000000 ]  - [  -0.0000809300000000,  0.0000284500000000,  0.0005909200000000 ]  - [   0.0000115300000000,  0.0000275200000000,  0.0008762500000000 ]  - [  -0.0000882900000000, -0.0002247600000000,  0.0008504500000000 ]  - [   0.0000115300000000,  0.0000275200000000, -0.0008762500000000 ]  - [  -0.0000882900000000, -0.0002247600000000, -0.0008504500000000 ]  - [   0.0000353700000000, -0.0000582300000000,  0.0008908100000000 ]  - [  -0.0001540700000000, -0.0002012200000000,  0.0007430600000000 ]  - [   0.0000353700000000, -0.0000582300000000, -0.0008908100000000 ]  - [  -0.0001540700000000, -0.0002012200000000, -0.0007430600000000 ]  - [  -0.0000856800000000, -0.0000930700000000,  0.0008210300000000 ]  - [  -0.0000381000000000, -0.0001008000000000,  0.0008244300000000 ]  - [   0.0000980600000000, -0.0001138000000000, -0.0008432900000000 ]  - [   0.0000417000000000, -0.0000914300000000, -0.0007898200000000 ]  - [   0.0000220800000000,  0.0000506800000000,  0.0007122600000000 ]  - [   0.0000054800000000,  0.0000838000000000,  0.0007507500000000 ]  - [   0.0001450700000000,  0.0000570700000000, -0.0006528000000000 ]  - [  -0.0001342100000000,  0.0000449100000000, -0.0007874800000000 ]  - [   0.0000220800000000,  0.0000506800000000, -0.0007122600000000 ]  - [   0.0000054800000000,  0.0000838000000000, -0.0007507500000000 ]  - [   0.0001450700000000,  0.0000570700000000,  0.0006528000000000 ]  - [  -0.0001342100000000,  0.0000449100000000,  0.0007874800000000 ]  - [  -0.0000856800000000, -0.0000930700000000, -0.0008210300000000 ]  - [  -0.0000381000000000, -0.0001008000000000, -0.0008244300000000 ]  - [   0.0000980600000000, -0.0001138000000000,  0.0008432900000000 ]  - [   0.0000417000000000, -0.0000914300000000,  0.0007898200000000 ]  - [   0.0002448300000000,  0.0014113600000000,  0.0010259700000000 ]  - [  -0.0000734400000000,  0.0001846200000000,  0.0008942900000000 ]  - [   0.0002448300000000,  0.0014113600000000, -0.0010259700000000 ]  - [  -0.0000734400000000,  0.0001846200000000, -0.0008942900000000 ]  - [   0.0002212200000000, -0.0013111900000000,  0.0009953100000000 ]  - [  -0.0000065000000000, -0.0001240400000000,  0.0008770300000000 ]  - [   0.0002212200000000, -0.0013111900000000, -0.0009953100000000 ]  - [  -0.0000065000000000, -0.0001240400000000, -0.0008770300000000 ]  - [  -0.0151057400000000,  0.0032114700000000,  0.0000000000000000 ]  - [  -0.0142814100000000,  0.0000136600000000,  0.0000000000000000 ]  - [   0.0138789800000000,  0.0000887300000000,  0.0000000000000000 ]  - [   0.0144963200000000,  0.0000165900000000,  0.0000000000000000 ]  - [  -0.0003371600000000,  0.0009941700000000, -0.0004448000000000 ]  - [   0.0000846100000000,  0.0011752500000000,  0.0000609200000000 ]  - [  -0.0003371600000000,  0.0009941700000000,  0.0004448000000000 ]  - [   0.0000846100000000,  0.0011752500000000, -0.0000609200000000 ]  - [  -0.0000636300000000, -0.0005214500000000, -0.0001716600000000 ]  - [  -0.0000041000000000, -0.0010781500000000,  0.0000328200000000 ]  - [  -0.0000636300000000, -0.0005214500000000,  0.0001716600000000 ]  - [  -0.0000041000000000, -0.0010781500000000, -0.0000328200000000 ]  - [  -0.0142567600000000, -0.0000108000000000,  0.0000000000000000 ]  - [  -0.0142852500000000, -0.0002884100000000,  0.0000000000000000 ]  - [   0.0141409200000000, -0.0001565000000000,  0.0000000000000000 ]  - [   0.0144687900000000, -0.0000059500000000,  0.0000000000000000 ]  - [   0.0001408000000000,  0.0011919700000000, -0.0000148800000000 ]  - [  -0.0006292700000000,  0.0010490500000000, -0.0006262100000000 ]  - [   0.0001408000000000,  0.0011919700000000,  0.0000148800000000 ]  - [  -0.0006292700000000,  0.0010490500000000,  0.0006262100000000 ]  - [   0.0001299300000000, -0.0012247200000000, -0.0000223800000000 ]  - [   0.0013572600000000, -0.0032123300000000,  0.0018919200000000 ]  - [   0.0001299300000000, -0.0012247200000000,  0.0000223800000000 ]  - [   0.0013572600000000, -0.0032123300000000, -0.0018919200000000 ]  - [  -0.0656761900000000, -0.0515688900000000,  0.0000000000000000 ]  - [   0.0008143100000000, -0.0001489400000000,  0.0000000000000000 ]  - [   0.0010079400000000, -0.0017867800000000,  0.0000000000000000 ]  - [  -0.0004956100000000, -0.0003309400000000,  0.0000000000000000 ]  - [  -0.0003269400000000,  0.0002837000000000,  0.0000000000000000 ]  - [  -0.0009110200000000,  0.0000939100000000,  0.0000000000000000 ]  - [  -0.0019494900000000,  0.0132111400000000,  0.0000000000000000 ]  - [   0.0007714700000000,  0.0001302000000000,  0.0000000000000000 ]  - [  -0.0000349600000000,  0.0000485800000000,  0.0000088600000000 ]  - [   0.0001196600000000,  0.0002785700000000,  0.0001278100000000 ]  - [  -0.0000349600000000,  0.0000485800000000, -0.0000088600000000 ]  - [   0.0001196600000000,  0.0002785700000000, -0.0001278100000000 ]  - [   0.0007571700000000, -0.0000609200000000,  0.0000000000000000 ]  - [   0.0007141500000000, -0.0000620100000000,  0.0000000000000000 ]  - [  -0.0007978100000000, -0.0000208000000000,  0.0000000000000000 ]  - [  -0.0006961700000000, -0.0001056100000000,  0.0000000000000000 ]  - [  -0.0006473200000000,  0.0002180400000000,  0.0000000000000000 ]  - [  -0.0006616000000000,  0.0001316600000000,  0.0000000000000000 ]  - [   0.0004166000000000,  0.0002098900000000,  0.0000000000000000 ]  - [   0.0007974200000000,  0.0002080500000000,  0.0000000000000000 ]  - [   0.0014213500000000,  0.0010355500000000,  0.0041230300000000 ]  - [   0.0000705600000000, -0.0000815200000000,  0.0000492300000000 ]  - [   0.0014213500000000,  0.0010355500000000, -0.0041230300000000 ]  - [   0.0000705600000000, -0.0000815200000000, -0.0000492300000000 ]- atom:   85  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0011709900000000,  0.0009703100000000, -0.0002521100000000 ]  - [   0.0001111700000000,  0.0000979800000000,  0.0008901600000000 ]  - [  -0.0011709900000000,  0.0009703100000000,  0.0002521100000000 ]  - [   0.0001111700000000,  0.0000979800000000, -0.0008901600000000 ]  - [  -0.0000684500000000,  0.0001740800000000,  0.0000000000000000 ]  - [   0.0000251200000000,  0.0003401400000000,  0.0000000000000000 ]  - [   0.0001565900000000, -0.0000463400000000,  0.0009437600000000 ]  - [  -0.0004735600000000, -0.0012867000000000,  0.0010236800000000 ]  - [   0.0001565900000000, -0.0000463400000000, -0.0009437600000000 ]  - [  -0.0004735600000000, -0.0012867000000000, -0.0010236800000000 ]  - [  -0.0132762600000000, -0.0199995600000000,  0.0000000000000000 ]  - [   0.0000992800000000, -0.0002465900000000,  0.0000000000000000 ]  - [  -0.0256014000000000, -0.0115970100000000,  0.0161886400000000 ]  - [  -0.0000151100000000, -0.0000892400000000,  0.0007587400000000 ]  - [   0.0000584200000000,  0.0000058300000000, -0.0012198400000000 ]  - [   0.0002107200000000, -0.0001873500000000, -0.0009824800000000 ]  - [   0.0002670300000000,  0.0002537500000000,  0.0010005400000000 ]  - [  -0.0000995300000000,  0.0000933800000000,  0.0007066800000000 ]  - [  -0.0014256700000000,  0.0011487700000000, -0.0030101600000000 ]  - [  -0.0000020500000000,  0.0000821800000000, -0.0007437500000000 ]  - [   0.0002670300000000,  0.0002537500000000, -0.0010005400000000 ]  - [  -0.0000995300000000,  0.0000933800000000, -0.0007066800000000 ]  - [  -0.0014256700000000,  0.0011487700000000,  0.0030101600000000 ]  - [  -0.0000020500000000,  0.0000821800000000,  0.0007437500000000 ]  - [  -0.0256014000000000, -0.0115970100000000, -0.0161886400000000 ]  - [  -0.0000151100000000, -0.0000892400000000, -0.0007587400000000 ]  - [   0.0000584200000000,  0.0000058300000000,  0.0012198400000000 ]  - [   0.0002107200000000, -0.0001873500000000,  0.0009824800000000 ]  - [  -0.0000111300000000,  0.0002606900000000,  0.0009082200000000 ]  - [   0.0000872800000000,  0.0005155400000000,  0.0009315300000000 ]  - [  -0.0000111300000000,  0.0002606900000000, -0.0009082200000000 ]  - [   0.0000872800000000,  0.0005155400000000, -0.0009315300000000 ]  - [  -0.0000351400000000, -0.0002291500000000,  0.0008934800000000 ]  - [   0.0001514600000000, -0.0000817300000000,  0.0010392500000000 ]  - [  -0.0000351400000000, -0.0002291500000000, -0.0008934800000000 ]  - [   0.0001514600000000, -0.0000817300000000, -0.0010392500000000 ]  - [  -0.0000323500000000, -0.0000646100000000,  0.0007360500000000 ]  - [  -0.0000932400000000, -0.0000575000000000,  0.0007471900000000 ]  - [   0.0000308500000000, -0.0000444700000000, -0.0007263000000000 ]  - [   0.0000867800000000, -0.0000668600000000, -0.0007794700000000 ]  - [   0.0000954100000000,  0.0001082100000000,  0.0008444400000000 ]  - [   0.0001128600000000,  0.0000749100000000,  0.0008060700000000 ]  - [  -0.0002763300000000,  0.0001022300000000, -0.0009196300000000 ]  - [   0.0000188300000000,  0.0001142700000000, -0.0007678100000000 ]  - [   0.0000954100000000,  0.0001082100000000, -0.0008444400000000 ]  - [   0.0001128600000000,  0.0000749100000000, -0.0008060700000000 ]  - [  -0.0002763300000000,  0.0001022300000000,  0.0009196300000000 ]  - [   0.0000188300000000,  0.0001142700000000,  0.0007678100000000 ]  - [  -0.0000323500000000, -0.0000646100000000, -0.0007360500000000 ]  - [  -0.0000932400000000, -0.0000575000000000, -0.0007471900000000 ]  - [   0.0000308500000000, -0.0000444700000000,  0.0007263000000000 ]  - [   0.0000867800000000, -0.0000668600000000,  0.0007794700000000 ]  - [  -0.0002392500000000, -0.0011168900000000,  0.0007652100000000 ]  - [   0.0000739500000000,  0.0001039200000000,  0.0008896900000000 ]  - [  -0.0002392500000000, -0.0011168900000000, -0.0007652100000000 ]  - [   0.0000739500000000,  0.0001039200000000, -0.0008896900000000 ]  - [  -0.0002199900000000,  0.0010165500000000,  0.0007854900000000 ]  - [   0.0000063000000000, -0.0001645900000000,  0.0009072000000000 ]  - [  -0.0002199900000000,  0.0010165500000000, -0.0007854900000000 ]  - [   0.0000063000000000, -0.0001645900000000, -0.0009072000000000 ]  - [  -0.0136277600000000, -0.0031507300000000,  0.0000000000000000 ]  - [  -0.0144484200000000, -0.0000129100000000,  0.0000000000000000 ]  - [   0.0148457200000000, -0.0000889700000000,  0.0000000000000000 ]  - [   0.0142343000000000, -0.0000159800000000,  0.0000000000000000 ]  - [   0.0003374800000000,  0.0012962900000000,  0.0005672000000000 ]  - [  -0.0000861300000000,  0.0011173500000000,  0.0000617100000000 ]  - [   0.0003374800000000,  0.0012962900000000, -0.0005672000000000 ]  - [  -0.0000861300000000,  0.0011173500000000, -0.0000617100000000 ]  - [   0.0000614900000000, -0.0017685200000000,  0.0002920200000000 ]  - [   0.0000047300000000, -0.0012151600000000,  0.0000912500000000 ]  - [   0.0000614900000000, -0.0017685200000000, -0.0002920200000000 ]  - [   0.0000047300000000, -0.0012151600000000, -0.0000912500000000 ]  - [  -0.0144744600000000,  0.0000110400000000,  0.0000000000000000 ]  - [  -0.0144419000000000,  0.0002919900000000,  0.0000000000000000 ]  - [   0.0145874300000000,  0.0001588600000000,  0.0000000000000000 ]  - [   0.0142613100000000,  0.0000067800000000,  0.0000000000000000 ]  - [  -0.0001410000000000,  0.0011025100000000,  0.0001381000000000 ]  - [   0.0006315600000000,  0.0012452900000000,  0.0007518900000000 ]  - [  -0.0001410000000000,  0.0011025100000000, -0.0001381000000000 ]  - [   0.0006315600000000,  0.0012452900000000, -0.0007518900000000 ]  - [  -0.0001297700000000, -0.0010684400000000,  0.0001461600000000 ]  - [  -0.0014170400000000,  0.0009131600000000, -0.0018301800000000 ]  - [  -0.0001297700000000, -0.0010684400000000, -0.0001461600000000 ]  - [  -0.0014170400000000,  0.0009131600000000,  0.0018301800000000 ]  - [   0.0736435100000000,  0.0539269800000000,  0.0000000000000000 ]  - [   0.0006276200000000, -0.0001237800000000,  0.0000000000000000 ]  - [  -0.0024484300000000,  0.0015220500000000,  0.0000000000000000 ]  - [  -0.0009456100000000,  0.0000592800000000,  0.0000000000000000 ]  - [  -0.0010956100000000,  0.0000072700000000,  0.0000000000000000 ]  - [  -0.0005091800000000,  0.0001795500000000,  0.0000000000000000 ]  - [   0.0033711600000000, -0.0131378900000000,  0.0000000000000000 ]  - [   0.0006377500000000,  0.0001417300000000,  0.0000000000000000 ]  - [   0.0000339200000000, -0.0000483800000000,  0.0000298000000000 ]  - [  -0.0001178000000000, -0.0002833400000000, -0.0000845500000000 ]  - [   0.0000339200000000, -0.0000483800000000, -0.0000298000000000 ]  - [  -0.0001178000000000, -0.0002833400000000,  0.0000845500000000 ]  - [   0.0006539000000000, -0.0002102900000000,  0.0000000000000000 ]  - [   0.0007302200000000, -0.0002115400000000,  0.0000000000000000 ]  - [  -0.0006427400000000, -0.0002524700000000,  0.0000000000000000 ]  - [  -0.0007436100000000, -0.0001664100000000,  0.0000000000000000 ]  - [  -0.0007638900000000,  0.0000523500000000,  0.0000000000000000 ]  - [  -0.0007482700000000,  0.0001389000000000,  0.0000000000000000 ]  - [   0.0010304400000000,  0.0000634500000000,  0.0000000000000000 ]  - [   0.0006085300000000,  0.0000613300000000,  0.0000000000000000 ]  - [  -0.0014396100000000, -0.0010488800000000, -0.0041043000000000 ]  - [  -0.0000706000000000,  0.0000827200000000, -0.0000081300000000 ]  - [  -0.0014396100000000, -0.0010488800000000,  0.0041043000000000 ]  - [  -0.0000706000000000,  0.0000827200000000,  0.0000081300000000 ]- atom:   85  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0001003900000000,  0.0008642500000000,  0.0020479100000000 ]  - [   0.0000149300000000,  0.0002213600000000,  0.0013239200000000 ]  - [   0.0001067800000000, -0.0008783000000000,  0.0000705000000000 ]  - [  -0.0000125600000000, -0.0002172700000000, -0.0006581200000000 ]  - [   0.0000056200000000, -0.0000009000000000, -0.0002216900000000 ]  - [  -0.0000061200000000,  0.0000008000000000, -0.0014017000000000 ]  - [   0.0000483100000000,  0.0000366800000000,  0.0007555200000000 ]  - [   0.0001475500000000,  0.0025413900000000, -0.0015520200000000 ]  - [  -0.0000418000000000, -0.0000377900000000, -0.0012253100000000 ]  - [  -0.0001610900000000, -0.0025667100000000, -0.0035408900000000 ]  - [   0.0000769400000000,  0.0000411700000000,  0.0102017700000000 ]  - [   0.0000043500000000, -0.0000036700000000,  0.0004295700000000 ]  - [  -0.1848572800000000, -0.0136894400000000,  0.2616876700000000 ]  - [  -0.0000948500000000, -0.0000913200000000,  0.0008877200000000 ]  - [   0.0006118900000000, -0.0001728300000000, -0.0002785600000000 ]  - [  -0.0010272500000000,  0.0001306000000000,  0.0006928700000000 ]  - [  -0.0000373600000000, -0.0000525000000000,  0.0009672500000000 ]  - [   0.0002693800000000,  0.0000380000000000,  0.0010605300000000 ]  - [  -0.0000884700000000,  0.0010008700000000, -0.0003173900000000 ]  - [  -0.0000312700000000,  0.0000833400000000, -0.0007064000000000 ]  - [   0.0001670300000000,  0.0002091200000000, -0.0006035500000000 ]  - [  -0.0001494900000000,  0.0001188900000000, -0.0005000500000000 ]  - [  -0.0000354900000000, -0.0008327100000000,  0.0012366100000000 ]  - [  -0.0000812700000000,  0.0000736800000000,  0.0008454900000000 ]  - [   0.1991146900000000,  0.0150495100000000,  0.2727744100000000 ]  - [  -0.0000313100000000, -0.0000664100000000, -0.0006818300000000 ]  - [  -0.0004762300000000,  0.0000116100000000,  0.0012685600000000 ]  - [   0.0011601000000000, -0.0002893700000000,  0.0022708800000000 ]  - [   0.0000171400000000,  0.0001464700000000,  0.0009212600000000 ]  - [  -0.0000260300000000,  0.0002648900000000,  0.0010410700000000 ]  - [  -0.0000155300000000,  0.0001406500000000, -0.0008610500000000 ]  - [   0.0000246300000000,  0.0000235000000000, -0.0007388400000000 ]  - [   0.0000360200000000, -0.0001662800000000,  0.0009188600000000 ]  - [   0.0001208300000000, -0.0015297600000000,  0.0008182200000000 ]  - [  -0.0000337800000000, -0.0001198200000000, -0.0008637800000000 ]  - [  -0.0001264000000000,  0.0012544500000000, -0.0009627500000000 ]  - [   0.0001083500000000, -0.0000918300000000,  0.0005652400000000 ]  - [  -0.0001013200000000, -0.0001037700000000,  0.0006757200000000 ]  - [   0.0001602100000000, -0.0000501100000000, -0.0010399700000000 ]  - [   0.0000990400000000, -0.0000743500000000, -0.0008531400000000 ]  - [  -0.0001653100000000, -0.0000856100000000,  0.0001288700000000 ]  - [  -0.0000905500000000,  0.0000636100000000,  0.0005628100000000 ]  - [  -0.0006662500000000,  0.0001088800000000, -0.0014210600000000 ]  - [   0.0001594700000000,  0.0003449600000000, -0.0011745800000000 ]  - [   0.0002715200000000,  0.0002435500000000, -0.0014206900000000 ]  - [   0.0002081600000000,  0.0000938800000000, -0.0009933600000000 ]  - [   0.0005429700000000,  0.0000500900000000,  0.0001493300000000 ]  - [  -0.0002700100000000, -0.0001862000000000,  0.0003790900000000 ]  - [  -0.0002236000000000, -0.0000659600000000, -0.0009901600000000 ]  - [  -0.0000284600000000, -0.0000541700000000, -0.0008977300000000 ]  - [  -0.0000347200000000, -0.0001084300000000,  0.0005299700000000 ]  - [   0.0000301200000000, -0.0000831500000000,  0.0007182200000000 ]  - [  -0.0006522500000000,  0.0004599700000000, -0.0001165800000000 ]  - [   0.0001815100000000,  0.0000705200000000,  0.0008435500000000 ]  - [   0.0006699700000000, -0.0001612400000000, -0.0019259000000000 ]  - [  -0.0001790400000000,  0.0002168100000000, -0.0009385600000000 ]  - [   0.0007785800000000, -0.0015137400000000,  0.0013352500000000 ]  - [   0.0000325600000000, -0.0001846300000000,  0.0008233500000000 ]  - [  -0.0007921600000000,  0.0012256800000000, -0.0004433700000000 ]  - [  -0.0000313900000000, -0.0001041000000000, -0.0009592100000000 ]  - [  -0.0143648500000000, -0.0000015300000000, -0.0008896200000000 ]  - [  -0.0143650200000000,  0.0000003700000000, -0.0001470500000000 ]  - [   0.0143617500000000,  0.0000005100000000, -0.0004892400000000 ]  - [   0.0143632500000000,  0.0000001700000000, -0.0002663000000000 ]  - [   0.0005981400000000,  0.0001175500000000,  0.0008582200000000 ]  - [  -0.0002895800000000,  0.0009338400000000,  0.0000933700000000 ]  - [  -0.0006036200000000,  0.0021918400000000,  0.0007471200000000 ]  - [   0.0002843500000000,  0.0013613600000000, -0.0000290200000000 ]  - [   0.0000097200000000, -0.0009015100000000,  0.0000306300000000 ]  - [  -0.0000259700000000, -0.0011686500000000,  0.0000705300000000 ]  - [  -0.0000099200000000, -0.0013939300000000, -0.0000922300000000 ]  - [   0.0000252300000000, -0.0011292200000000, -0.0000552300000000 ]  - [  -0.0143665100000000,  0.0000000800000000,  0.0002421800000000 ]  - [  -0.0143646200000000,  0.0000036200000000,  0.0015629100000000 ]  - [   0.0143695100000000,  0.0000019900000000,  0.0012359200000000 ]  - [   0.0143619900000000,  0.0000005600000000,  0.0000795500000000 ]  - [  -0.0000423600000000,  0.0011482800000000,  0.0000611500000000 ]  - [   0.0000928100000000,  0.0005992600000000,  0.0000039300000000 ]  - [   0.0000391200000000,  0.0011499600000000, -0.0000618900000000 ]  - [  -0.0000905400000000,  0.0017045900000000, -0.0001221600000000 ]  - [  -0.0000293800000000, -0.0011892500000000,  0.0000158500000000 ]  - [   0.0097466600000000, -0.0005595200000000,  0.0080164700000000 ]  - [   0.0000295900000000, -0.0011076100000000, -0.0001044400000000 ]  - [  -0.0098285700000000, -0.0017434300000000,  0.0079861100000000 ]  - [  -0.0136422000000000, -0.0016317500000000, -0.5649845600000000 ]  - [   0.0007172800000000, -0.0001336100000000, -0.0001789800000000 ]  - [  -0.0006594500000000, -0.0001472200000000, -0.0034055300000000 ]  - [  -0.0007226100000000, -0.0001323500000000, -0.0017900800000000 ]  - [  -0.0007247500000000,  0.0001322600000000, -0.0005993200000000 ]  - [  -0.0007112700000000,  0.0001340700000000, -0.0003991200000000 ]  - [   0.0006976900000000,  0.0001650300000000, -0.0028924200000000 ]  - [   0.0007031100000000,  0.0001327800000000, -0.0001282000000000 ]  - [  -0.0000586400000000,  0.0000220500000000,  0.0000578000000000 ]  - [   0.0000112100000000,  0.0007706900000000,  0.0004314000000000 ]  - [   0.0000544200000000, -0.0000216300000000,  0.0000214200000000 ]  - [  -0.0000059800000000, -0.0007795000000000,  0.0003893400000000 ]  - [   0.0007038800000000, -0.0001318800000000,  0.0002984400000000 ]  - [   0.0007202900000000, -0.0001338400000000,  0.0002985600000000 ]  - [  -0.0007158100000000, -0.0001334900000000,  0.0004858800000000 ]  - [  -0.0007208000000000, -0.0001320000000000,  0.0001101300000000 ]  - [  -0.0006989300000000,  0.0001324300000000,  0.0011457400000000 ]  - [  -0.0007066700000000,  0.0001314800000000,  0.0003021800000000 ]  - [   0.0007160000000000,  0.0001339500000000,  0.0009049800000000 ]  - [   0.0007035800000000,  0.0001307300000000,  0.0009048900000000 ]  - [   0.0027114500000000,  0.0046501600000000,  0.0048904900000000 ]  - [  -0.0001992400000000,  0.0001007700000000, -0.0000510300000000 ]  - [  -0.0027697000000000, -0.0047258600000000,  0.0048857200000000 ]  - [   0.0001963300000000, -0.0000994400000000, -0.0000882200000000 ]- atom:   93  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0006852200000000,  0.0000000000000000,  0.0013681900000000 ]  - [  -0.0006803000000000,  0.0000000000000000,  0.0006191000000000 ]  - [  -0.0014128700000000,  0.0000000000000000,  0.0000432000000000 ]  - [  -0.0013988000000000,  0.0000000000000000, -0.0020202700000000 ]  - [   0.0029940000000000,  0.0000000000000000, -0.0000321700000000 ]  - [  -0.0010332400000000,  0.0000000000000000, -0.0000006000000000 ]  - [   0.0002032800000000,  0.0000000000000000,  0.0009985100000000 ]  - [  -0.0003921900000000,  0.0000000000000000,  0.0009905100000000 ]  - [   0.0004774600000000,  0.0000000000000000, -0.0009897600000000 ]  - [  -0.0003755800000000,  0.0000000000000000, -0.0009912900000000 ]  - [  -0.0000113400000000,  0.0000000000000000,  0.0002012700000000 ]  - [  -0.0000149700000000,  0.0000000000000000, -0.0002007200000000 ]  - [  -0.0002260100000000, -0.0000620300000000,  0.0008902100000000 ]  - [   0.0001151900000000, -0.0001258100000000,  0.0006543200000000 ]  - [   0.0003668600000000,  0.0000788000000000, -0.0009386200000000 ]  - [  -0.0001655500000000, -0.0001210600000000, -0.0007103100000000 ]  - [   0.0002418600000000,  0.0000314600000000,  0.0009125100000000 ]  - [  -0.0000997600000000,  0.0000959900000000,  0.0006769500000000 ]  - [  -0.0002918000000000,  0.0000367400000000, -0.0008567700000000 ]  - [   0.0002361400000000,  0.0002350900000000, -0.0006323800000000 ]  - [   0.0003668600000000, -0.0000788000000000, -0.0009386200000000 ]  - [  -0.0001655500000000,  0.0001210600000000, -0.0007103100000000 ]  - [  -0.0002260100000000,  0.0000620300000000,  0.0008902100000000 ]  - [   0.0001151900000000,  0.0001258100000000,  0.0006543200000000 ]  - [  -0.0002918000000000, -0.0000367400000000, -0.0008567700000000 ]  - [   0.0002361400000000, -0.0002350900000000, -0.0006323800000000 ]  - [   0.0002418600000000, -0.0000314600000000,  0.0009125100000000 ]  - [  -0.0000997600000000, -0.0000959900000000,  0.0006769500000000 ]  - [  -0.0007671700000000, -0.0013053000000000,  0.0022986700000000 ]  - [  -0.0002167500000000,  0.0001424200000000,  0.0008928500000000 ]  - [   0.0002445600000000,  0.0001450500000000, -0.0008909700000000 ]  - [  -0.0001495400000000,  0.0001452100000000, -0.0008909300000000 ]  - [  -0.0007671700000000,  0.0013053000000000,  0.0022986700000000 ]  - [  -0.0002167500000000, -0.0001424200000000,  0.0008928500000000 ]  - [   0.0002445600000000, -0.0001450500000000, -0.0008909700000000 ]  - [  -0.0001495400000000, -0.0001452100000000, -0.0008909300000000 ]  - [  -0.0008797700000000, -0.0014981600000000,  0.0002252900000000 ]  - [  -0.0004447600000000, -0.0001132200000000,  0.0011328800000000 ]  - [  -0.0000645900000000, -0.0001003400000000, -0.0007522300000000 ]  - [  -0.0004051800000000, -0.0005086200000000, -0.0002250200000000 ]  - [  -0.0003196100000000,  0.0000444100000000,  0.0004324400000000 ]  - [  -0.0007645000000000, -0.0013442900000000,  0.0013390500000000 ]  - [  -0.0005262800000000, -0.0003475500000000, -0.0013354600000000 ]  - [  -0.0001914900000000,  0.0000577800000000, -0.0008161100000000 ]  - [  -0.0000645900000000,  0.0001003400000000, -0.0007522300000000 ]  - [  -0.0004051800000000,  0.0005086200000000, -0.0002250200000000 ]  - [  -0.0008797700000000,  0.0014981600000000,  0.0002252900000000 ]  - [  -0.0004447600000000,  0.0001132200000000,  0.0011328800000000 ]  - [  -0.0005262800000000,  0.0003475500000000, -0.0013354600000000 ]  - [  -0.0001914900000000, -0.0000577800000000, -0.0008161100000000 ]  - [  -0.0003196100000000, -0.0000444100000000,  0.0004324400000000 ]  - [  -0.0007645000000000,  0.0013442900000000,  0.0013390500000000 ]  - [   0.0000031100000000,  0.0003091100000000,  0.0008769300000000 ]  - [   0.0000025700000000, -0.0000216500000000,  0.0009072900000000 ]  - [   0.0000453800000000,  0.0005972400000000, -0.0008569500000000 ]  - [   0.0000440700000000, -0.0003070000000000, -0.0009271200000000 ]  - [   0.0000031100000000, -0.0003091100000000,  0.0008769300000000 ]  - [   0.0000025700000000,  0.0000216500000000,  0.0009072900000000 ]  - [   0.0000453800000000, -0.0005972400000000, -0.0008569500000000 ]  - [   0.0000440700000000,  0.0003070000000000, -0.0009271200000000 ]  - [  -0.0139364100000000,  0.0000000000000000, -0.0001851500000000 ]  - [  -0.0136156100000000,  0.0000000000000000,  0.0008683100000000 ]  - [   0.0151208900000000,  0.0000000000000000, -0.0008711000000000 ]  - [   0.0147943400000000,  0.0000000000000000,  0.0001844700000000 ]  - [   0.0002455400000000,  0.0009831500000000,  0.0000597300000000 ]  - [   0.0002469900000000,  0.0013099400000000,  0.0000596400000000 ]  - [   0.0007624600000000,  0.0006890500000000, -0.0000809300000000 ]  - [   0.0007602100000000,  0.0016027100000000, -0.0000403100000000 ]  - [   0.0002455400000000, -0.0009831500000000,  0.0000597300000000 ]  - [   0.0002469900000000, -0.0013099400000000,  0.0000596400000000 ]  - [   0.0007624600000000, -0.0006890500000000, -0.0000809300000000 ]  - [   0.0007602100000000, -0.0016027100000000, -0.0000403100000000 ]  - [  -0.0147701400000000,  0.0000000000000000, -0.0000363200000000 ]  - [  -0.0140422900000000,  0.0000000000000000, -0.0000291600000000 ]  - [   0.0146907300000000,  0.0000000000000000,  0.0000261300000000 ]  - [   0.0139640900000000,  0.0000000000000000,  0.0000312200000000 ]  - [  -0.0012348400000000,  0.0011218100000000,  0.0000633700000000 ]  - [   0.0003036600000000,  0.0011485000000000,  0.0000617400000000 ]  - [  -0.0002280700000000,  0.0011468300000000, -0.0000616600000000 ]  - [   0.0002017100000000,  0.0011464600000000, -0.0000611600000000 ]  - [  -0.0012348400000000, -0.0011218100000000,  0.0000633700000000 ]  - [   0.0003036600000000, -0.0011485000000000,  0.0000617400000000 ]  - [  -0.0002280700000000, -0.0011468300000000, -0.0000616600000000 ]  - [   0.0002017100000000, -0.0011464600000000, -0.0000611600000000 ]  - [   0.0009682100000000, -0.0001683600000000, -0.0000573500000000 ]  - [   0.0004341300000000, -0.0000152800000000,  0.0000094700000000 ]  - [  -0.0010097200000000, -0.0002538600000000, -0.0000079400000000 ]  - [  -0.0004716100000000, -0.0001004300000000,  0.0000562300000000 ]  - [  -0.0010097200000000,  0.0002538600000000, -0.0000079400000000 ]  - [  -0.0004716100000000,  0.0001004300000000,  0.0000562300000000 ]  - [   0.0009682100000000,  0.0001683600000000, -0.0000573500000000 ]  - [   0.0004341300000000,  0.0000152800000000,  0.0000094700000000 ]  - [   0.0005867800000000,  0.0000000000000000, -0.0027635000000000 ]  - [   0.0004514300000000,  0.0000000000000000,  0.0000161800000000 ]  - [  -0.0005795600000000,  0.0000000000000000, -0.0000244400000000 ]  - [   0.0003147600000000,  0.0000000000000000, -0.0000204600000000 ]  - [   0.0017204000000000,  0.0012997200000000,  0.0027410000000000 ]  - [   0.0011943300000000, -0.0000640900000000, -0.0001970000000000 ]  - [  -0.0002455500000000, -0.0002052200000000,  0.0001985000000000 ]  - [   0.0002832600000000, -0.0015606600000000, -0.0027397900000000 ]  - [  -0.0002455500000000,  0.0002052200000000,  0.0001985000000000 ]  - [   0.0002832600000000,  0.0015606600000000, -0.0027397900000000 ]  - [   0.0017204000000000, -0.0012997200000000,  0.0027410000000000 ]  - [   0.0011943300000000,  0.0000640900000000, -0.0001970000000000 ]  - [   0.0000007800000000,  0.0000000000000000,  0.0000559000000000 ]  - [   0.0000019300000000,  0.0000000000000000, -0.0000210700000000 ]  - [  -0.0000452900000000,  0.0000000000000000, -0.0002093500000000 ]  - [  -0.0000428600000000,  0.0000000000000000,  0.0001722300000000 ]- atom:   93  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000020200000000,  0.0004174000000000,  0.0009926900000000 ]  - [   0.0000020200000000,  0.0004174000000000,  0.0009926900000000 ]  - [  -0.0000041500000000,  0.0009404500000000, -0.0009890300000000 ]  - [   0.0000041500000000,  0.0009404500000000, -0.0009890300000000 ]  - [   0.0000000000000000,  0.0100956600000000, -0.0000574300000000 ]  - [   0.0000000000000000,  0.0003165500000000, -0.0000001200000000 ]  - [   0.0000000000000000, -0.0058405700000000,  0.0010148100000000 ]  - [   0.0000000000000000, -0.0001712900000000,  0.0009895800000000 ]  - [   0.0000000000000000, -0.0006098900000000, -0.0009878200000000 ]  - [   0.0000000000000000, -0.0001008200000000, -0.0009901600000000 ]  - [   0.0000045000000000, -0.0007832100000000, -0.0000001300000000 ]  - [  -0.0000045000000000, -0.0007832100000000, -0.0000001300000000 ]  - [  -0.0000444200000000, -0.0000894000000000,  0.0007784400000000 ]  - [  -0.0000055400000000, -0.0000700400000000,  0.0006126000000000 ]  - [   0.0011294600000000, -0.0000992400000000, -0.0017895100000000 ]  - [   0.0000461600000000, -0.0001073600000000, -0.0008085800000000 ]  - [   0.0001196300000000,  0.0000868300000000,  0.0009508800000000 ]  - [   0.0000815600000000,  0.0000687900000000,  0.0007879300000000 ]  - [  -0.0000797200000000,  0.0000506400000000, -0.0007571900000000 ]  - [   0.0009929600000000,  0.0000560200000000,  0.0002156400000000 ]  - [  -0.0009929600000000,  0.0000560200000000,  0.0002156400000000 ]  - [   0.0000797200000000,  0.0000506400000000, -0.0007571900000000 ]  - [  -0.0000815600000000,  0.0000687900000000,  0.0007879300000000 ]  - [  -0.0001196300000000,  0.0000868300000000,  0.0009508800000000 ]  - [  -0.0000461600000000, -0.0001073600000000, -0.0008085800000000 ]  - [  -0.0011294600000000, -0.0000992400000000, -0.0017895100000000 ]  - [   0.0000055400000000, -0.0000700400000000,  0.0006126000000000 ]  - [   0.0000444200000000, -0.0000894000000000,  0.0007784400000000 ]  - [   0.0000000000000000,  0.3019209900000000, -0.2025978300000000 ]  - [   0.0000000000000000,  0.0001930200000000,  0.0009018300000000 ]  - [   0.0000000000000000,  0.0003370500000000, -0.0009886800000000 ]  - [   0.0000000000000000,  0.0001770200000000, -0.0009020400000000 ]  - [   0.0000000000000000,  0.2859854600000000,  0.1892906800000000 ]  - [   0.0000000000000000, -0.0000937900000000,  0.0008827100000000 ]  - [   0.0000000000000000,  0.0000505500000000, -0.0007924100000000 ]  - [   0.0000000000000000, -0.0001139900000000, -0.0008787600000000 ]  - [  -0.0016376300000000, -0.0006493000000000,  0.0005112800000000 ]  - [   0.0000943900000000, -0.0000325200000000,  0.0006058500000000 ]  - [   0.0000238000000000, -0.0000668400000000, -0.0007619500000000 ]  - [   0.0001936600000000,  0.0007217600000000, -0.0016237200000000 ]  - [   0.0002179500000000,  0.0001254000000000,  0.0009576700000000 ]  - [  -0.0014896500000000, -0.0004823400000000,  0.0010367900000000 ]  - [   0.0000699800000000,  0.0008864400000000,  0.0000650300000000 ]  - [  -0.0001012200000000,  0.0000915000000000, -0.0008037700000000 ]  - [   0.0001012200000000,  0.0000915000000000, -0.0008037700000000 ]  - [  -0.0000699800000000,  0.0008864400000000,  0.0000650300000000 ]  - [   0.0014896500000000, -0.0004823400000000,  0.0010367900000000 ]  - [  -0.0002179500000000,  0.0001254000000000,  0.0009576700000000 ]  - [  -0.0001936600000000,  0.0007217600000000, -0.0016237200000000 ]  - [  -0.0000238000000000, -0.0000668400000000, -0.0007619500000000 ]  - [  -0.0000943900000000, -0.0000325200000000,  0.0006058500000000 ]  - [   0.0016376300000000, -0.0006493000000000,  0.0005112800000000 ]  - [   0.0000194000000000,  0.0000311600000000,  0.0008738200000000 ]  - [  -0.0000194000000000,  0.0000311600000000,  0.0008738200000000 ]  - [   0.0001142300000000, -0.0000917000000000, -0.0008986700000000 ]  - [  -0.0001142300000000, -0.0000917000000000, -0.0008986700000000 ]  - [  -0.0000184500000000, -0.0002586800000000,  0.0009099200000000 ]  - [   0.0000184500000000, -0.0002586800000000,  0.0009099200000000 ]  - [  -0.0001119700000000, -0.0003839600000000, -0.0008843000000000 ]  - [   0.0001119700000000, -0.0003839600000000, -0.0008843000000000 ]  - [  -0.0143630800000000, -0.0001061700000000,  0.0000006000000000 ]  - [  -0.0143647900000000, -0.0001472400000000,  0.0000012500000000 ]  - [   0.0143647900000000, -0.0001472400000000,  0.0000012500000000 ]  - [   0.0143630800000000, -0.0001061700000000,  0.0000006000000000 ]  - [  -0.0003031800000000,  0.0010129200000000, -0.0002973000000000 ]  - [   0.0003031800000000,  0.0010129200000000, -0.0002973000000000 ]  - [  -0.0005447300000000,  0.0009435300000000,  0.0001903300000000 ]  - [   0.0005447300000000,  0.0009435300000000,  0.0001903300000000 ]  - [   0.0003038800000000, -0.0012787700000000,  0.0004196100000000 ]  - [  -0.0003038800000000, -0.0012787700000000,  0.0004196100000000 ]  - [   0.0005477300000000, -0.0013498700000000, -0.0003141800000000 ]  - [  -0.0005477300000000, -0.0013498700000000, -0.0003141800000000 ]  - [  -0.0143664200000000,  0.0004709100000000, -0.0000047100000000 ]  - [  -0.0143640500000000,  0.0000230300000000, -0.0000016100000000 ]  - [   0.0143640500000000,  0.0000230300000000, -0.0000016100000000 ]  - [   0.0143664200000000,  0.0004709100000000, -0.0000047100000000 ]  - [   0.0000000000000000,  0.0180046400000000, -0.0010993500000000 ]  - [   0.0000000000000000,  0.0012330200000000,  0.0000772800000000 ]  - [   0.0000000000000000,  0.0013342600000000, -0.0001995400000000 ]  - [   0.0000000000000000,  0.0011903700000000, -0.0000868500000000 ]  - [   0.0000000000000000,  0.0157806600000000,  0.0012222000000000 ]  - [   0.0000000000000000, -0.0010650600000000,  0.0000472700000000 ]  - [   0.0000000000000000, -0.0009622800000000,  0.0000764700000000 ]  - [   0.0000000000000000, -0.0011026500000000, -0.0000350800000000 ]  - [   0.0006501500000000, -0.0000889100000000,  0.0000214600000000 ]  - [   0.0014549000000000,  0.0001433000000000,  0.0007779600000000 ]  - [  -0.0014549000000000,  0.0001433000000000,  0.0007779600000000 ]  - [  -0.0006501500000000, -0.0000889100000000,  0.0000214600000000 ]  - [   0.0000143700000000,  0.0004186700000000, -0.0007719100000000 ]  - [  -0.0007833800000000,  0.0001861700000000, -0.0000220500000000 ]  - [   0.0007833800000000,  0.0001861700000000, -0.0000220500000000 ]  - [  -0.0000143700000000,  0.0004186700000000, -0.0007719100000000 ]  - [   0.0000000000000000, -0.6321617300000000,  0.0151123700000000 ]  - [   0.0000000000000000, -0.0001243600000000,  0.0000186600000000 ]  - [   0.0000000000000000, -0.0005711800000000, -0.0000158600000000 ]  - [   0.0000000000000000, -0.0000889800000000, -0.0000230300000000 ]  - [   0.0041565200000000,  0.0008908700000000,  0.0047019600000000 ]  - [   0.0005908300000000, -0.0002188400000000,  0.0001007600000000 ]  - [  -0.0005908300000000, -0.0002188400000000,  0.0001007600000000 ]  - [  -0.0041565200000000,  0.0008908700000000,  0.0047019600000000 ]  - [  -0.0008393900000000,  0.0000536300000000, -0.0000990500000000 ]  - [   0.0027296200000000,  0.0011936200000000, -0.0046735900000000 ]  - [  -0.0027296200000000,  0.0011936200000000, -0.0046735900000000 ]  - [   0.0008393900000000,  0.0000536300000000, -0.0000990500000000 ]  - [  -0.0000010400000000,  0.0002425000000000,  0.0000195000000000 ]  - [   0.0000010400000000,  0.0002425000000000,  0.0000195000000000 ]  - [  -0.0000024300000000,  0.0004425300000000, -0.0000201400000000 ]  - [   0.0000024300000000,  0.0004425300000000, -0.0000201400000000 ]- atom:   93  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0010337200000000,  0.0000000000000000, -0.0002334100000000 ]  - [  -0.0010337200000000,  0.0000000000000000, -0.0002334100000000 ]  - [   0.0009835800000000,  0.0000000000000000, -0.0004033000000000 ]  - [  -0.0009835800000000,  0.0000000000000000, -0.0004033000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0352989200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000429600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040599200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010395700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0009320100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0009749000000000 ]  - [   0.0003923600000000,  0.0000000000000000, -0.0001654100000000 ]  - [  -0.0003923600000000,  0.0000000000000000, -0.0001654100000000 ]  - [  -0.0000624700000000, -0.0000752600000000,  0.0007220700000000 ]  - [   0.0001042800000000, -0.0000905400000000,  0.0005065000000000 ]  - [   0.0004238600000000, -0.0001199000000000, -0.0011544200000000 ]  - [   0.0000585300000000, -0.0000770800000000, -0.0007602000000000 ]  - [  -0.0001042800000000,  0.0000905400000000,  0.0005065000000000 ]  - [   0.0000624700000000,  0.0000752600000000,  0.0007220700000000 ]  - [  -0.0000585300000000,  0.0000770800000000, -0.0007602000000000 ]  - [  -0.0004238600000000,  0.0001199000000000, -0.0011544200000000 ]  - [   0.0004238600000000,  0.0001199000000000, -0.0011544200000000 ]  - [   0.0000585300000000,  0.0000770800000000, -0.0007602000000000 ]  - [  -0.0000624700000000,  0.0000752600000000,  0.0007220700000000 ]  - [   0.0001042800000000,  0.0000905400000000,  0.0005065000000000 ]  - [  -0.0000585300000000, -0.0000770800000000, -0.0007602000000000 ]  - [  -0.0004238600000000, -0.0001199000000000, -0.0011544200000000 ]  - [  -0.0001042800000000, -0.0000905400000000,  0.0005065000000000 ]  - [   0.0000624700000000, -0.0000752600000000,  0.0007220700000000 ]  - [   0.0000000000000000, -0.1505651100000000,  0.1714758100000000 ]  - [   0.0000000000000000,  0.0001467000000000,  0.0009111100000000 ]  - [   0.0000000000000000, -0.0000653100000000, -0.0011617900000000 ]  - [   0.0000000000000000,  0.0001512500000000, -0.0009174500000000 ]  - [   0.0000000000000000,  0.1505651100000000,  0.1714758100000000 ]  - [   0.0000000000000000, -0.0001467000000000,  0.0009111100000000 ]  - [   0.0000000000000000,  0.0000653100000000, -0.0011617900000000 ]  - [   0.0000000000000000, -0.0001512500000000, -0.0009174500000000 ]  - [  -0.0010596000000000, -0.0007941300000000,  0.0019277500000000 ]  - [  -0.0000856200000000, -0.0001098300000000,  0.0008509400000000 ]  - [   0.0000121400000000, -0.0001044400000000, -0.0007463700000000 ]  - [   0.0004990000000000,  0.0009506100000000, -0.0024021400000000 ]  - [   0.0000856200000000,  0.0001098300000000,  0.0008509400000000 ]  - [   0.0010596000000000,  0.0007941300000000,  0.0019277500000000 ]  - [  -0.0004990000000000, -0.0009506100000000, -0.0024021400000000 ]  - [  -0.0000121400000000,  0.0001044400000000, -0.0007463700000000 ]  - [   0.0000121400000000,  0.0001044400000000, -0.0007463700000000 ]  - [   0.0004990000000000, -0.0009506100000000, -0.0024021400000000 ]  - [  -0.0010596000000000,  0.0007941300000000,  0.0019277500000000 ]  - [  -0.0000856200000000,  0.0001098300000000,  0.0008509400000000 ]  - [  -0.0004990000000000,  0.0009506100000000, -0.0024021400000000 ]  - [  -0.0000121400000000, -0.0001044400000000, -0.0007463700000000 ]  - [   0.0000856200000000, -0.0001098300000000,  0.0008509400000000 ]  - [   0.0010596000000000, -0.0007941300000000,  0.0019277500000000 ]  - [   0.0000100300000000,  0.0002682900000000,  0.0008961200000000 ]  - [  -0.0000100300000000,  0.0002682900000000,  0.0008961200000000 ]  - [   0.0000809700000000,  0.0002451700000000, -0.0008540300000000 ]  - [  -0.0000809700000000,  0.0002451700000000, -0.0008540300000000 ]  - [   0.0000100300000000, -0.0002682900000000,  0.0008961200000000 ]  - [  -0.0000100300000000, -0.0002682900000000,  0.0008961200000000 ]  - [   0.0000809700000000, -0.0002451700000000, -0.0008540300000000 ]  - [  -0.0000809700000000, -0.0002451700000000, -0.0008540300000000 ]  - [  -0.0146660400000000,  0.0000000000000000,  0.0000413100000000 ]  - [  -0.0128239900000000,  0.0000000000000000,  0.0011616800000000 ]  - [   0.0128239900000000,  0.0000000000000000,  0.0011616800000000 ]  - [   0.0146660400000000,  0.0000000000000000,  0.0000413100000000 ]  - [   0.0002956200000000,  0.0013082300000000,  0.0007472400000000 ]  - [  -0.0002956200000000,  0.0013082300000000,  0.0007472400000000 ]  - [   0.0001613000000000,  0.0012095900000000, -0.0006064100000000 ]  - [  -0.0001613000000000,  0.0012095900000000, -0.0006064100000000 ]  - [   0.0002956200000000, -0.0013082300000000,  0.0007472400000000 ]  - [  -0.0002956200000000, -0.0013082300000000,  0.0007472400000000 ]  - [   0.0001613000000000, -0.0012095900000000, -0.0006064100000000 ]  - [  -0.0001613000000000, -0.0012095900000000, -0.0006064100000000 ]  - [  -0.0146385200000000,  0.0000000000000000, -0.0005616200000000 ]  - [  -0.0143689200000000,  0.0000000000000000, -0.0000246700000000 ]  - [   0.0143689200000000,  0.0000000000000000, -0.0000246700000000 ]  - [   0.0146385200000000,  0.0000000000000000, -0.0005616200000000 ]  - [   0.0000000000000000, -0.0035032100000000, -0.0014944400000000 ]  - [   0.0000000000000000,  0.0011515200000000,  0.0000438700000000 ]  - [   0.0000000000000000,  0.0012989900000000,  0.0001467000000000 ]  - [   0.0000000000000000,  0.0011612000000000, -0.0000366300000000 ]  - [   0.0000000000000000,  0.0035032100000000, -0.0014944400000000 ]  - [   0.0000000000000000, -0.0011515200000000,  0.0000438700000000 ]  - [   0.0000000000000000, -0.0012989900000000,  0.0001467000000000 ]  - [   0.0000000000000000, -0.0011612000000000, -0.0000366300000000 ]  - [   0.0006586400000000, -0.0001493700000000,  0.0000409600000000 ]  - [   0.0009095300000000, -0.0000329500000000,  0.0004152900000000 ]  - [  -0.0009095300000000, -0.0000329500000000,  0.0004152900000000 ]  - [  -0.0006586400000000, -0.0001493700000000,  0.0000409600000000 ]  - [  -0.0009095300000000,  0.0000329500000000,  0.0004152900000000 ]  - [  -0.0006586400000000,  0.0001493700000000,  0.0000409600000000 ]  - [   0.0006586400000000,  0.0001493700000000,  0.0000409600000000 ]  - [   0.0009095300000000,  0.0000329500000000,  0.0004152900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.3944948000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000302800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0005560900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000061000000000 ]  - [   0.0059894500000000,  0.0040152100000000,  0.0049259400000000 ]  - [   0.0007146300000000, -0.0001093800000000, -0.0000705700000000 ]  - [  -0.0007146300000000, -0.0001093800000000, -0.0000705700000000 ]  - [  -0.0059894500000000,  0.0040152100000000,  0.0049259400000000 ]  - [  -0.0007146300000000,  0.0001093800000000, -0.0000705700000000 ]  - [  -0.0059894500000000, -0.0040152100000000,  0.0049259400000000 ]  - [   0.0059894500000000, -0.0040152100000000,  0.0049259400000000 ]  - [   0.0007146300000000,  0.0001093800000000, -0.0000705700000000 ]  - [  -0.0000397900000000,  0.0000000000000000,  0.0001341800000000 ]  - [   0.0000397900000000,  0.0000000000000000,  0.0001341800000000 ]  - [  -0.0001947600000000,  0.0000000000000000, -0.0000790600000000 ]  - [   0.0001947600000000,  0.0000000000000000, -0.0000790600000000 ]- atom:   93  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0010422000000000,  0.0000000000000000,  0.0022211600000000 ]  - [   0.0010422000000000,  0.0000000000000000,  0.0022211600000000 ]  - [  -0.0009919000000000,  0.0000000000000000, -0.0015847800000000 ]  - [   0.0009919000000000,  0.0000000000000000, -0.0015847800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0327567800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000427200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020231700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0009379100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0010451000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0010030300000000 ]  - [  -0.0003833400000000,  0.0000000000000000,  0.0001625600000000 ]  - [   0.0003833400000000,  0.0000000000000000,  0.0001625600000000 ]  - [  -0.0000622800000000, -0.0000825600000000,  0.0008423000000000 ]  - [  -0.0002286400000000, -0.0000656100000000,  0.0010556500000000 ]  - [  -0.0002879000000000, -0.0000344600000000, -0.0004213200000000 ]  - [   0.0000661700000000, -0.0000808100000000, -0.0008055400000000 ]  - [   0.0002286400000000,  0.0000656100000000,  0.0010556500000000 ]  - [   0.0000622800000000,  0.0000825600000000,  0.0008423000000000 ]  - [  -0.0000661700000000,  0.0000808100000000, -0.0008055400000000 ]  - [   0.0002879000000000,  0.0000344600000000, -0.0004213200000000 ]  - [  -0.0002879000000000,  0.0000344600000000, -0.0004213200000000 ]  - [   0.0000661700000000,  0.0000808100000000, -0.0008055400000000 ]  - [  -0.0000622800000000,  0.0000825600000000,  0.0008423000000000 ]  - [  -0.0002286400000000,  0.0000656100000000,  0.0010556500000000 ]  - [  -0.0000661700000000, -0.0000808100000000, -0.0008055400000000 ]  - [   0.0002879000000000, -0.0000344600000000, -0.0004213200000000 ]  - [   0.0002286400000000, -0.0000656100000000,  0.0010556500000000 ]  - [   0.0000622800000000, -0.0000825600000000,  0.0008423000000000 ]  - [   0.0000000000000000,  0.1591141700000000, -0.1713285500000000 ]  - [   0.0000000000000000,  0.0001387900000000,  0.0008722200000000 ]  - [   0.0000000000000000,  0.0003636100000000, -0.0006188700000000 ]  - [   0.0000000000000000,  0.0001391200000000, -0.0008631100000000 ]  - [   0.0000000000000000, -0.1591141700000000, -0.1713285500000000 ]  - [   0.0000000000000000, -0.0001387900000000,  0.0008722200000000 ]  - [   0.0000000000000000, -0.0003636100000000, -0.0006188700000000 ]  - [   0.0000000000000000, -0.0001391200000000, -0.0008631100000000 ]  - [   0.0009279300000000,  0.0006294500000000, -0.0003645800000000 ]  - [  -0.0000391900000000, -0.0000483600000000,  0.0007141000000000 ]  - [   0.0001120200000000, -0.0000536900000000, -0.0008189900000000 ]  - [  -0.0003844200000000, -0.0010978900000000,  0.0008355400000000 ]  - [   0.0000391900000000,  0.0000483600000000,  0.0007141000000000 ]  - [  -0.0009279300000000, -0.0006294500000000, -0.0003645800000000 ]  - [   0.0003844200000000,  0.0010978900000000,  0.0008355400000000 ]  - [  -0.0001120200000000,  0.0000536900000000, -0.0008189900000000 ]  - [   0.0001120200000000,  0.0000536900000000, -0.0008189900000000 ]  - [  -0.0003844200000000,  0.0010978900000000,  0.0008355400000000 ]  - [   0.0009279300000000, -0.0006294500000000, -0.0003645800000000 ]  - [  -0.0000391900000000,  0.0000483600000000,  0.0007141000000000 ]  - [   0.0003844200000000, -0.0010978900000000,  0.0008355400000000 ]  - [  -0.0001120200000000, -0.0000536900000000, -0.0008189900000000 ]  - [   0.0000391900000000, -0.0000483600000000,  0.0007141000000000 ]  - [  -0.0009279300000000,  0.0006294500000000, -0.0003645800000000 ]  - [  -0.0000091100000000,  0.0000215300000000,  0.0008864600000000 ]  - [   0.0000091100000000,  0.0000215300000000,  0.0008864600000000 ]  - [  -0.0000786700000000,  0.0000451300000000, -0.0009289100000000 ]  - [   0.0000786700000000,  0.0000451300000000, -0.0009289100000000 ]  - [  -0.0000091100000000, -0.0000215300000000,  0.0008864600000000 ]  - [   0.0000091100000000, -0.0000215300000000,  0.0008864600000000 ]  - [  -0.0000786700000000, -0.0000451300000000, -0.0009289100000000 ]  - [   0.0000786700000000, -0.0000451300000000, -0.0009289100000000 ]  - [  -0.0140600900000000,  0.0000000000000000, -0.0000369900000000 ]  - [  -0.0159131600000000,  0.0000000000000000, -0.0011616000000000 ]  - [   0.0159131600000000,  0.0000000000000000, -0.0011616000000000 ]  - [   0.0140600900000000,  0.0000000000000000, -0.0000369900000000 ]  - [  -0.0002936600000000,  0.0009862400000000, -0.0006231100000000 ]  - [   0.0002936600000000,  0.0009862400000000, -0.0006231100000000 ]  - [  -0.0001615500000000,  0.0010892000000000,  0.0004779200000000 ]  - [   0.0001615500000000,  0.0010892000000000,  0.0004779200000000 ]  - [  -0.0002936600000000, -0.0009862400000000, -0.0006231100000000 ]  - [   0.0002936600000000, -0.0009862400000000, -0.0006231100000000 ]  - [  -0.0001615500000000, -0.0010892000000000,  0.0004779200000000 ]  - [   0.0001615500000000, -0.0010892000000000,  0.0004779200000000 ]  - [  -0.0140978000000000,  0.0000000000000000,  0.0005462600000000 ]  - [  -0.0143597000000000,  0.0000000000000000,  0.0000178200000000 ]  - [   0.0143597000000000,  0.0000000000000000,  0.0000178200000000 ]  - [   0.0140978000000000,  0.0000000000000000,  0.0005462600000000 ]  - [   0.0000000000000000,  0.0056801500000000,  0.0016254700000000 ]  - [   0.0000000000000000,  0.0011516300000000,  0.0000845900000000 ]  - [   0.0000000000000000,  0.0009986300000000, -0.0002724800000000 ]  - [   0.0000000000000000,  0.0011344600000000, -0.0000881400000000 ]  - [   0.0000000000000000, -0.0056801500000000,  0.0016254700000000 ]  - [   0.0000000000000000, -0.0011516300000000,  0.0000845900000000 ]  - [   0.0000000000000000, -0.0009986300000000, -0.0002724800000000 ]  - [   0.0000000000000000, -0.0011344600000000, -0.0000881400000000 ]  - [   0.0007762900000000, -0.0001255700000000, -0.0000411500000000 ]  - [   0.0005345100000000, -0.0002430700000000, -0.0004077100000000 ]  - [  -0.0005345100000000, -0.0002430700000000, -0.0004077100000000 ]  - [  -0.0007762900000000, -0.0001255700000000, -0.0000411500000000 ]  - [  -0.0005345100000000,  0.0002430700000000, -0.0004077100000000 ]  - [  -0.0007762900000000,  0.0001255700000000, -0.0000411500000000 ]  - [   0.0007762900000000,  0.0001255700000000, -0.0000411500000000 ]  - [   0.0005345100000000,  0.0002430700000000, -0.0004077100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.3950506100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000701200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0006489000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000536200000000 ]  - [  -0.0044830000000000, -0.0042092400000000, -0.0048516300000000 ]  - [   0.0007210800000000, -0.0001638000000000,  0.0000700300000000 ]  - [  -0.0007210800000000, -0.0001638000000000,  0.0000700300000000 ]  - [   0.0044830000000000, -0.0042092400000000, -0.0048516300000000 ]  - [  -0.0007210800000000,  0.0001638000000000,  0.0000700300000000 ]  - [   0.0044830000000000,  0.0042092400000000, -0.0048516300000000 ]  - [  -0.0044830000000000,  0.0042092400000000, -0.0048516300000000 ]  - [   0.0007210800000000,  0.0001638000000000,  0.0000700300000000 ]  - [   0.0000377300000000,  0.0000000000000000, -0.0000917500000000 ]  - [  -0.0000377300000000,  0.0000000000000000, -0.0000917500000000 ]  - [   0.0001895100000000,  0.0000000000000000,  0.0000354300000000 ]  - [  -0.0001895100000000,  0.0000000000000000,  0.0000354300000000 ]