# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/6149161b-a206-4b72-9174-a8c27e88a978/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 Sr2Sb2O7 / Imma (74) / materials id 4103](https://mdr.nims.go.jp/datasets/98b3fc27-a950-424a-96ce-5df269cb6ee5)

## 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: "Imma"  number: 74  Hall_symbol: "-I 2b 2"primitive_matrix:- [ -0.500000000000000,  0.500000000000000,  0.500000000000000 ]- [  0.500000000000000, -0.500000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.500000000000000, -0.500000000000000 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   2,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [    -5.202607920000000,     3.747180510000000,     3.857817945000000 ] # a  - [     5.202607920000000,    -3.747180510000000,     3.857817945000000 ] # b  - [     5.202607920000000,     3.747180510000000,    -3.857817945000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.227649680000000,  0.551480960000000,  0.413606300000000 ]    mass: 15.999400  - symbol: O  # 2    coordinates: [  0.362125340000000,  0.448519040000000,  0.176168720000000 ]    mass: 15.999400  - symbol: O  # 3    coordinates: [  0.637874660000000,  0.814043380000000,  0.086393700000000 ]    mass: 15.999400  - symbol: O  # 4    coordinates: [  0.772350320000000,  0.185956620000000,  0.323831280000000 ]    mass: 15.999400  - symbol: O  # 5    coordinates: [  0.772350320000000,  0.448519040000000,  0.586393700000000 ]    mass: 15.999400  - symbol: O  # 6    coordinates: [  0.637874660000000,  0.551480960000000,  0.823831280000000 ]    mass: 15.999400  - symbol: O  # 7    coordinates: [  0.362125340000000,  0.185956620000000,  0.913606300000000 ]    mass: 15.999400  - symbol: O  # 8    coordinates: [  0.227649680000000,  0.814043380000000,  0.676168720000000 ]    mass: 15.999400  - symbol: O  # 9    coordinates: [  0.151234170000000,  0.401234170000000,  0.750000000000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.848765830000000,  0.598765830000000,  0.250000000000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.719504390000000,  0.811557570000000,  0.592053180000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.280495610000000,  0.188442430000000,  0.407946820000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.719504390000000,  0.127451210000000,  0.907946820000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.280495610000000,  0.872548790000000,  0.092053180000000 ]    mass: 15.999400  - symbol: Sr # 15    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 87.620000  - symbol: Sr # 16    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 87.620000  - symbol: Sr # 17    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 87.620000  - symbol: Sr # 18    coordinates: [  0.000000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 87.620000  - symbol: Sb # 19    coordinates: [  0.000000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 121.760000  - symbol: Sb # 20    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 121.760000  - symbol: Sb # 21    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 121.760000  - symbol: Sb # 22    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 121.760000  reciprocal_lattice: # without 2pi  - [    -0.000000000000000,     0.133433657296643,     0.129606945462016 ] # a*  - [     0.096105646954076,     0.000000000000000,     0.129606945462016 ] # b*  - [     0.096105646954076,     0.133433657296643,     0.000000000000000 ] # c*unit_cell:  lattice:  - [    10.405215840000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     7.494361020000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     7.715635890000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.868718790000000,  0.544887510000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.631281210000000,  0.544887510000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 3    coordinates: [  0.631281210000000,  0.455112490000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.368718790000000,  0.955112490000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 5    coordinates: [  0.131281210000000,  0.455112490000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.368718790000000,  0.455112490000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 7    coordinates: [  0.368718790000000,  0.544887510000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.631281210000000,  0.044887510000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 9    coordinates: [  0.500000000000000,  0.250000000000000,  0.901234170000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.500000000000000,  0.750000000000000,  0.098765830000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 11    coordinates: [  0.342053180000000,  0.250000000000000,  0.469504390000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.657946820000000,  0.750000000000000,  0.530495610000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 13    coordinates: [  0.157946820000000,  0.750000000000000,  0.969504390000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.842053180000000,  0.250000000000000,  0.030495610000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.368718790000000,  0.044887510000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 16    coordinates: [  0.131281210000000,  0.044887510000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 2  - symbol: O  # 17    coordinates: [  0.131281210000000,  0.955112490000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 18    coordinates: [  0.868718790000000,  0.455112490000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 19    coordinates: [  0.631281210000000,  0.955112490000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 20    coordinates: [  0.868718790000000,  0.955112490000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 6  - symbol: O  # 21    coordinates: [  0.868718790000000,  0.044887510000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 22    coordinates: [  0.131281210000000,  0.544887510000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 8  - symbol: O  # 23    coordinates: [  0.000000000000000,  0.750000000000000,  0.401234170000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 24    coordinates: [  0.000000000000000,  0.250000000000000,  0.598765830000000 ]    mass: 15.999400    reduced_to: 10  - symbol: O  # 25    coordinates: [  0.842053180000000,  0.750000000000000,  0.969504390000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 26    coordinates: [  0.157946820000000,  0.250000000000000,  0.030495610000000 ]    mass: 15.999400    reduced_to: 12  - symbol: O  # 27    coordinates: [  0.657946820000000,  0.250000000000000,  0.469504390000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 28    coordinates: [  0.342053180000000,  0.750000000000000,  0.530495610000000 ]    mass: 15.999400    reduced_to: 14  - symbol: Sr # 29    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 29  - symbol: Sr # 30    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 87.620000    reduced_to: 30  - symbol: Sr # 31    coordinates: [  0.250000000000000,  0.250000000000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 31  - symbol: Sr # 32    coordinates: [  0.250000000000000,  0.750000000000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 32  - symbol: Sr # 33    coordinates: [  0.000000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 87.620000    reduced_to: 29  - symbol: Sr # 34    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 30  - symbol: Sr # 35    coordinates: [  0.750000000000000,  0.750000000000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 31  - symbol: Sr # 36    coordinates: [  0.750000000000000,  0.250000000000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 32  - symbol: Sb # 37    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 121.760000    reduced_to: 37  - symbol: Sb # 38    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 121.760000    reduced_to: 38  - symbol: Sb # 39    coordinates: [  0.750000000000000,  0.750000000000000,  0.750000000000000 ]    mass: 121.760000    reduced_to: 39  - symbol: Sb # 40    coordinates: [  0.250000000000000,  0.750000000000000,  0.750000000000000 ]    mass: 121.760000    reduced_to: 40  - symbol: Sb # 41    coordinates: [  0.000000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 121.760000    reduced_to: 37  - symbol: Sb # 42    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 121.760000    reduced_to: 38  - symbol: Sb # 43    coordinates: [  0.250000000000000,  0.250000000000000,  0.250000000000000 ]    mass: 121.760000    reduced_to: 39  - symbol: Sb # 44    coordinates: [  0.750000000000000,  0.250000000000000,  0.250000000000000 ]    mass: 121.760000    reduced_to: 40supercell:  lattice:  - [    10.405215840000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    14.988722040000001,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     7.715635890000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.868718790000000,  0.272443755000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.868718790000000,  0.772443755000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 3    coordinates: [  0.631281210000000,  0.272443755000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.631281210000000,  0.772443755000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 5    coordinates: [  0.631281210000000,  0.227556245000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 6    coordinates: [  0.631281210000000,  0.727556245000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 7    coordinates: [  0.368718790000000,  0.477556245000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 8    coordinates: [  0.368718790000000,  0.977556245000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 9    coordinates: [  0.131281210000000,  0.227556245000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 10    coordinates: [  0.131281210000000,  0.727556245000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 11    coordinates: [  0.368718790000000,  0.227556245000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 12    coordinates: [  0.368718790000000,  0.727556245000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 13    coordinates: [  0.368718790000000,  0.272443755000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.368718790000000,  0.772443755000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 15    coordinates: [  0.631281210000000,  0.022443755000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.631281210000000,  0.522443755000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 17    coordinates: [  0.500000000000000,  0.125000000000000,  0.901234170000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.500000000000000,  0.625000000000000,  0.901234170000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 19    coordinates: [  0.500000000000000,  0.375000000000000,  0.098765830000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.500000000000000,  0.875000000000000,  0.098765830000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 21    coordinates: [  0.342053180000000,  0.125000000000000,  0.469504390000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.342053180000000,  0.625000000000000,  0.469504390000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 23    coordinates: [  0.657946820000000,  0.375000000000000,  0.530495610000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.657946820000000,  0.875000000000000,  0.530495610000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 25    coordinates: [  0.157946820000000,  0.375000000000000,  0.969504390000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.157946820000000,  0.875000000000000,  0.969504390000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 27    coordinates: [  0.842053180000000,  0.125000000000000,  0.030495610000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.842053180000000,  0.625000000000000,  0.030495610000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 29    coordinates: [  0.368718790000000,  0.022443755000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 30    coordinates: [  0.368718790000000,  0.522443755000000,  0.182762170000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 31    coordinates: [  0.131281210000000,  0.022443755000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 32    coordinates: [  0.131281210000000,  0.522443755000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 33    coordinates: [  0.131281210000000,  0.477556245000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 34    coordinates: [  0.131281210000000,  0.977556245000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 5  - symbol: O  # 35    coordinates: [  0.868718790000000,  0.227556245000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 36    coordinates: [  0.868718790000000,  0.727556245000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 7  - symbol: O  # 37    coordinates: [  0.631281210000000,  0.477556245000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 38    coordinates: [  0.631281210000000,  0.977556245000000,  0.817237830000000 ]    mass: 15.999400    reduced_to: 9  - symbol: O  # 39    coordinates: [  0.868718790000000,  0.477556245000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 40    coordinates: [  0.868718790000000,  0.977556245000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 11  - symbol: O  # 41    coordinates: [  0.868718790000000,  0.022443755000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 42    coordinates: [  0.868718790000000,  0.522443755000000,  0.317237830000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 43    coordinates: [  0.131281210000000,  0.272443755000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 44    coordinates: [  0.131281210000000,  0.772443755000000,  0.682762170000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 45    coordinates: [  0.000000000000000,  0.375000000000000,  0.401234170000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 46    coordinates: [  0.000000000000000,  0.875000000000000,  0.401234170000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 47    coordinates: [  0.000000000000000,  0.125000000000000,  0.598765830000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 48    coordinates: [  0.000000000000000,  0.625000000000000,  0.598765830000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 49    coordinates: [  0.842053180000000,  0.375000000000000,  0.969504390000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 50    coordinates: [  0.842053180000000,  0.875000000000000,  0.969504390000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 51    coordinates: [  0.157946820000000,  0.125000000000000,  0.030495610000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 52    coordinates: [  0.157946820000000,  0.625000000000000,  0.030495610000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 53    coordinates: [  0.657946820000000,  0.125000000000000,  0.469504390000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 54    coordinates: [  0.657946820000000,  0.625000000000000,  0.469504390000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 55    coordinates: [  0.342053180000000,  0.375000000000000,  0.530495610000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 56    coordinates: [  0.342053180000000,  0.875000000000000,  0.530495610000000 ]    mass: 15.999400    reduced_to: 27  - symbol: Sr # 57    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 57  - symbol: Sr # 58    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 57  - symbol: Sr # 59    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 87.620000    reduced_to: 59  - symbol: Sr # 60    coordinates: [  0.000000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 87.620000    reduced_to: 59  - symbol: Sr # 61    coordinates: [  0.250000000000000,  0.125000000000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 61  - symbol: Sr # 62    coordinates: [  0.250000000000000,  0.625000000000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 61  - symbol: Sr # 63    coordinates: [  0.250000000000000,  0.375000000000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 63  - symbol: Sr # 64    coordinates: [  0.250000000000000,  0.875000000000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 63  - symbol: Sr # 65    coordinates: [  0.000000000000000,  0.250000000000000,  0.000000000000000 ]    mass: 87.620000    reduced_to: 57  - symbol: Sr # 66    coordinates: [  0.000000000000000,  0.750000000000000,  0.000000000000000 ]    mass: 87.620000    reduced_to: 57  - symbol: Sr # 67    coordinates: [  0.500000000000000,  0.250000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 59  - symbol: Sr # 68    coordinates: [  0.500000000000000,  0.750000000000000,  0.500000000000000 ]    mass: 87.620000    reduced_to: 59  - symbol: Sr # 69    coordinates: [  0.750000000000000,  0.375000000000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 61  - symbol: Sr # 70    coordinates: [  0.750000000000000,  0.875000000000000,  0.250000000000000 ]    mass: 87.620000    reduced_to: 61  - symbol: Sr # 71    coordinates: [  0.750000000000000,  0.125000000000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 63  - symbol: Sr # 72    coordinates: [  0.750000000000000,  0.625000000000000,  0.750000000000000 ]    mass: 87.620000    reduced_to: 63  - symbol: Sb # 73    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 121.760000    reduced_to: 73  - symbol: Sb # 74    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 121.760000    reduced_to: 73  - symbol: Sb # 75    coordinates: [  0.500000000000000,  0.250000000000000,  0.000000000000000 ]    mass: 121.760000    reduced_to: 75  - symbol: Sb # 76    coordinates: [  0.500000000000000,  0.750000000000000,  0.000000000000000 ]    mass: 121.760000    reduced_to: 75  - symbol: Sb # 77    coordinates: [  0.750000000000000,  0.375000000000000,  0.750000000000000 ]    mass: 121.760000    reduced_to: 77  - symbol: Sb # 78    coordinates: [  0.750000000000000,  0.875000000000000,  0.750000000000000 ]    mass: 121.760000    reduced_to: 77  - symbol: Sb # 79    coordinates: [  0.250000000000000,  0.375000000000000,  0.750000000000000 ]    mass: 121.760000    reduced_to: 79  - symbol: Sb # 80    coordinates: [  0.250000000000000,  0.875000000000000,  0.750000000000000 ]    mass: 121.760000    reduced_to: 79  - symbol: Sb # 81    coordinates: [  0.000000000000000,  0.250000000000000,  0.500000000000000 ]    mass: 121.760000    reduced_to: 73  - symbol: Sb # 82    coordinates: [  0.000000000000000,  0.750000000000000,  0.500000000000000 ]    mass: 121.760000    reduced_to: 73  - symbol: Sb # 83    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 121.760000    reduced_to: 75  - symbol: Sb # 84    coordinates: [  0.000000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 121.760000    reduced_to: 75  - symbol: Sb # 85    coordinates: [  0.250000000000000,  0.125000000000000,  0.250000000000000 ]    mass: 121.760000    reduced_to: 77  - symbol: Sb # 86    coordinates: [  0.250000000000000,  0.625000000000000,  0.250000000000000 ]    mass: 121.760000    reduced_to: 77  - symbol: Sb # 87    coordinates: [  0.750000000000000,  0.125000000000000,  0.250000000000000 ]    mass: 121.760000    reduced_to: 79  - symbol: Sb # 88    coordinates: [  0.750000000000000,  0.625000000000000,  0.250000000000000 ]    mass: 121.760000    reduced_to: 79displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.1536018700000000,  0.0594388000000000,  0.0842224100000000 ]  - [  -0.0006263000000000,  0.0000006800000000,  0.0007075800000000 ]  - [   0.0202972700000000,  0.0026570800000000, -0.0142382800000000 ]  - [   0.0003251300000000,  0.0001730000000000, -0.0005979600000000 ]  - [  -0.0005655000000000,  0.0011494500000000, -0.0010206700000000 ]  - [   0.0005151700000000, -0.0009790900000000,  0.0006979700000000 ]  - [   0.0016411200000000,  0.0002476300000000, -0.0001504200000000 ]  - [   0.0008340300000000, -0.0004243600000000, -0.0001395400000000 ]  - [   0.0032977700000000, -0.0013064100000000, -0.0039489000000000 ]  - [   0.0004873300000000, -0.0006462400000000, -0.0006251400000000 ]  - [   0.0014557500000000,  0.0001340600000000,  0.0002286500000000 ]  - [  -0.0001818100000000, -0.0007315800000000,  0.0005538500000000 ]  - [   0.0071637700000000, -0.0006171500000000,  0.0025065400000000 ]  - [   0.0000469000000000,  0.0000496100000000, -0.0004564200000000 ]  - [   0.0003281100000000,  0.0010239300000000,  0.0007321100000000 ]  - [   0.0003280300000000, -0.0006493700000000,  0.0004186300000000 ]  - [   0.0017772000000000,  0.0025357700000000,  0.0029794400000000 ]  - [   0.0005578600000000, -0.0010925000000000,  0.0035680800000000 ]  - [   0.0018928600000000, -0.0008027100000000, -0.0045909200000000 ]  - [   0.0002836500000000, -0.0001946400000000, -0.0037261300000000 ]  - [   0.0009853100000000,  0.0000530900000000, -0.0010173900000000 ]  - [  -0.0000586900000000, -0.0004897300000000, -0.0005167200000000 ]  - [   0.0111550600000000, -0.0087307000000000,  0.0077633700000000 ]  - [   0.0007919200000000, -0.0001140600000000,  0.0008819500000000 ]  - [   0.0017789200000000,  0.0020294000000000,  0.0009375700000000 ]  - [   0.0011898400000000, -0.0005692900000000, -0.0005328200000000 ]  - [  -0.0031695500000000, -0.0000415400000000, -0.0011546000000000 ]  - [  -0.0014622900000000, -0.0004832800000000,  0.0005488900000000 ]  - [   0.0007360600000000,  0.0001825500000000,  0.0000978600000000 ]  - [   0.0007336900000000,  0.0002252800000000,  0.0004543000000000 ]  - [   0.0013145400000000, -0.0006522900000000, -0.0018497100000000 ]  - [   0.0013098200000000,  0.0023147600000000, -0.0012412600000000 ]  - [  -0.0000455500000000,  0.0020437100000000,  0.0008226400000000 ]  - [   0.0020978000000000, -0.0031612700000000,  0.0015425500000000 ]  - [  -0.0070832000000000, -0.0010703600000000, -0.0025059900000000 ]  - [  -0.0008198400000000, -0.0009087600000000, -0.0008047000000000 ]  - [   0.0037045300000000, -0.0048331400000000, -0.0027262000000000 ]  - [   0.0008511200000000,  0.0013118900000000, -0.0007812700000000 ]  - [  -0.0056339600000000, -0.0018017700000000,  0.0027250600000000 ]  - [  -0.0028149000000000, -0.0015186600000000,  0.0016701000000000 ]  - [  -0.0022434800000000,  0.0002328600000000, -0.0018419200000000 ]  - [  -0.0022377200000000,  0.0010330700000000, -0.0009761700000000 ]  - [   0.0282273600000000,  0.0051405000000000,  0.0022994700000000 ]  - [   0.0002456900000000, -0.0001564200000000,  0.0005684000000000 ]  - [  -0.0001814300000000,  0.0071590600000000, -0.0012784400000000 ]  - [  -0.0002651100000000, -0.0009000100000000,  0.0035916000000000 ]  - [   0.0029032800000000, -0.0166626700000000, -0.0092960100000000 ]  - [  -0.0006850900000000, -0.0005675700000000, -0.0034325300000000 ]  - [  -0.0073970300000000, -0.0044022400000000, -0.0083096400000000 ]  - [  -0.0014871900000000, -0.0003467600000000, -0.0007378100000000 ]  - [   0.0018590100000000, -0.0006818600000000,  0.0013132400000000 ]  - [   0.0009572400000000, -0.0000852000000000,  0.0005382800000000 ]  - [   0.0009210100000000,  0.0023040200000000,  0.0015521000000000 ]  - [   0.0007846900000000, -0.0007956100000000, -0.0005731200000000 ]  - [   0.0032458900000000,  0.0015526600000000, -0.0006204400000000 ]  - [  -0.0004698300000000, -0.0003108900000000,  0.0007088600000000 ]  - [  -0.0010364200000000, -0.0004628900000000, -0.0001207100000000 ]  - [  -0.0031078400000000,  0.0022652900000000, -0.0004707300000000 ]  - [   0.0008060800000000,  0.0007725100000000, -0.0002323200000000 ]  - [   0.0026848400000000,  0.0000846700000000,  0.0004098200000000 ]  - [  -0.0033892800000000,  0.0025217100000000, -0.0010707400000000 ]  - [  -0.0004854900000000, -0.0001568500000000, -0.0000642100000000 ]  - [  -0.0024120500000000, -0.0009444100000000,  0.0006967400000000 ]  - [  -0.0004250000000000,  0.0006790000000000,  0.0000830600000000 ]  - [   0.0053302400000000, -0.0006588100000000, -0.0027953200000000 ]  - [   0.0003077700000000,  0.0004912500000000, -0.0000705200000000 ]  - [  -0.0058854600000000, -0.0025478500000000, -0.0016232000000000 ]  - [  -0.0002915800000000,  0.0005153100000000,  0.0000572200000000 ]  - [   0.0031145500000000, -0.0003390500000000, -0.0014117000000000 ]  - [   0.0004224100000000,  0.0003429800000000,  0.0000773400000000 ]  - [   0.0075075900000000,  0.0002843500000000, -0.0012309400000000 ]  - [   0.0003168600000000,  0.0013768100000000,  0.0000117400000000 ]  - [  -0.0015833400000000, -0.0013820000000000,  0.0008034700000000 ]  - [  -0.0034133600000000,  0.0018449400000000,  0.0007855500000000 ]  - [  -0.0096528400000000, -0.0027700600000000,  0.0062848100000000 ]  - [  -0.0004509500000000,  0.0009326200000000,  0.0000064200000000 ]  - [   0.0354323300000000, -0.0221313200000000, -0.0069035000000000 ]  - [   0.0016492900000000,  0.0004845600000000, -0.0004287800000000 ]  - [  -0.0111031000000000, -0.0106501700000000, -0.0040258400000000 ]  - [  -0.0016685500000000,  0.0017776100000000, -0.0004004800000000 ]  - [   0.0623796500000000, -0.0126910200000000, -0.0440378000000000 ]  - [   0.0004203400000000,  0.0011142000000000,  0.0000289400000000 ]  - [   0.0022333700000000,  0.0082504200000000,  0.0027311800000000 ]  - [   0.0046220200000000, -0.0067753900000000, -0.0029817400000000 ]  - [  -0.0040540900000000,  0.0008383300000000,  0.0008547300000000 ]  - [  -0.0014140800000000, -0.0004764100000000,  0.0002311500000000 ]  - [   0.0058903200000000, -0.0002593300000000, -0.0003333200000000 ]  - [   0.0012614000000000,  0.0014042900000000,  0.0001992900000000 ]- atom:    1  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.1514625000000000, -0.0592913300000000, -0.0807929600000000 ]  - [  -0.0002043800000000,  0.0009219600000000,  0.0005868000000000 ]  - [  -0.0198237000000000, -0.0017709100000000,  0.0131587500000000 ]  - [   0.0005096000000000,  0.0007512000000000, -0.0006974700000000 ]  - [   0.0014234600000000, -0.0020876100000000,  0.0023356900000000 ]  - [   0.0003183700000000,  0.0000511800000000,  0.0005961000000000 ]  - [  -0.0024697200000000, -0.0011655700000000, -0.0011421000000000 ]  - [  -0.0016637300000000, -0.0005072900000000, -0.0011553400000000 ]  - [  -0.0024988000000000,  0.0003937900000000,  0.0026627000000000 ]  - [   0.0003406800000000, -0.0002810900000000, -0.0006666200000000 ]  - [  -0.0022856400000000, -0.0010611000000000,  0.0010674900000000 ]  - [  -0.0006491200000000, -0.0001951500000000,  0.0007393900000000 ]  - [  -0.0079951800000000,  0.0015433800000000, -0.0037963500000000 ]  - [  -0.0008774500000000,  0.0008741700000000, -0.0008379700000000 ]  - [   0.0005116700000000, -0.0000929700000000,  0.0005635400000000 ]  - [   0.0005118800000000,  0.0015783800000000,  0.0008759600000000 ]  - [  -0.0017739100000000, -0.0025702500000000,  0.0043307600000000 ]  - [  -0.0005549300000000,  0.0010944800000000,  0.0037370800000000 ]  - [  -0.0018919900000000,  0.0008289900000000, -0.0027000600000000 ]  - [  -0.0002814700000000,  0.0001931900000000, -0.0035788000000000 ]  - [  -0.0031114800000000, -0.0000575100000000, -0.0006139300000000 ]  - [  -0.0020718200000000,  0.0004917500000000, -0.0011111100000000 ]  - [  -0.0091215700000000,  0.0088496400000000, -0.0062590600000000 ]  - [   0.0013362400000000,  0.0001134400000000,  0.0007441700000000 ]  - [   0.0003308100000000, -0.0020179700000000, -0.0025394500000000 ]  - [   0.0009342000000000,  0.0005671500000000, -0.0010881000000000 ]  - [   0.0010523000000000,  0.0000641200000000,  0.0027750600000000 ]  - [  -0.0006645700000000,  0.0004799700000000,  0.0010751200000000 ]  - [  -0.0015654400000000,  0.0007391500000000,  0.0011970700000000 ]  - [  -0.0015675300000000,  0.0007061500000000,  0.0008421300000000 ]  - [  -0.0004802800000000,  0.0015724200000000,  0.0005459300000000 ]  - [  -0.0004847200000000, -0.0013906100000000, -0.0000521600000000 ]  - [   0.0008566400000000, -0.0029522500000000,  0.0004662900000000 ]  - [  -0.0012590200000000,  0.0022209000000000, -0.0002437100000000 ]  - [   0.0062115300000000,  0.0001659300000000,  0.0012761500000000 ]  - [  -0.0000109300000000, -0.0000202300000000, -0.0004885500000000 ]  - [  -0.0028492800000000,  0.0038883700000000,  0.0014261000000000 ]  - [  -0.0000121700000000, -0.0022328200000000, -0.0005149900000000 ]  - [   0.0048070900000000,  0.0008222400000000, -0.0014265700000000 ]  - [   0.0019726700000000,  0.0005844100000000, -0.0003726300000000 ]  - [   0.0014006900000000,  0.0007033800000000,  0.0005344200000000 ]  - [   0.0014062200000000, -0.0001098100000000, -0.0003137300000000 ]  - [  -0.0268114300000000, -0.0041684300000000, -0.0009411000000000 ]  - [   0.0005816400000000,  0.0010769000000000,  0.0007241700000000 ]  - [   0.0001473200000000, -0.0070968100000000,  0.0085484000000000 ]  - [   0.0002628400000000,  0.0009001300000000,  0.0037152100000000 ]  - [  -0.0029098700000000,  0.0164549900000000,  0.0019542100000000 ]  - [   0.0006774100000000,  0.0005557900000000, -0.0038674900000000 ]  - [   0.0053671900000000,  0.0043548900000000,  0.0066383000000000 ]  - [  -0.0006421600000000,  0.0003459800000000, -0.0008917600000000 ]  - [   0.0002592900000000,  0.0006842000000000,  0.0003165100000000 ]  - [   0.0011679800000000,  0.0000842200000000,  0.0010895500000000 ]  - [   0.0012233000000000, -0.0023132000000000, -0.0031814000000000 ]  - [   0.0013486100000000,  0.0007956300000000, -0.0010519900000000 ]  - [  -0.0053555900000000, -0.0015355600000000,  0.0022262000000000 ]  - [  -0.0016585900000000,  0.0003087800000000,  0.0009185700000000 ]  - [   0.0010312600000000,  0.0004646600000000,  0.0001214600000000 ]  - [   0.0031041400000000, -0.0022754500000000,  0.0004708000000000 ]  - [  -0.0007964600000000, -0.0007786700000000,  0.0002295000000000 ]  - [  -0.0026622400000000, -0.0000769600000000, -0.0004031800000000 ]  - [   0.0033854200000000, -0.0025001400000000,  0.0010648100000000 ]  - [   0.0004886800000000,  0.0001545600000000,  0.0000646500000000 ]  - [   0.0024220800000000,  0.0009387100000000, -0.0006944400000000 ]  - [   0.0004255300000000, -0.0006757000000000, -0.0000825200000000 ]  - [  -0.0052296400000000,  0.0006380900000000,  0.0028699000000000 ]  - [  -0.0003054400000000, -0.0004883400000000,  0.0000707200000000 ]  - [   0.0058874300000000,  0.0025592600000000,  0.0016366900000000 ]  - [   0.0002898200000000, -0.0005136600000000, -0.0000576400000000 ]  - [  -0.0031427100000000,  0.0003509000000000,  0.0014199100000000 ]  - [  -0.0004234000000000, -0.0003426800000000, -0.0000766100000000 ]  - [  -0.0075813000000000, -0.0004598100000000,  0.0012793700000000 ]  - [  -0.0003261600000000, -0.0013657300000000, -0.0000095800000000 ]  - [   0.0015703900000000,  0.0013965100000000, -0.0008090800000000 ]  - [   0.0033983800000000, -0.0018619800000000, -0.0007773600000000 ]  - [   0.0096427400000000,  0.0027779800000000, -0.0063138300000000 ]  - [   0.0004475700000000, -0.0009317000000000, -0.0000064500000000 ]  - [  -0.0366494300000000,  0.0240640100000000,  0.0076186700000000 ]  - [  -0.0016481700000000, -0.0004812200000000,  0.0004268600000000 ]  - [   0.0110820400000000,  0.0105579800000000,  0.0040013000000000 ]  - [   0.0016702500000000, -0.0017666000000000,  0.0004003100000000 ]  - [  -0.0600094400000000,  0.0118714500000000,  0.0409549500000000 ]  - [  -0.0004184500000000, -0.0011037300000000, -0.0000299600000000 ]  - [  -0.0022168600000000, -0.0082407600000000, -0.0027189400000000 ]  - [  -0.0045728200000000,  0.0067889800000000,  0.0029548300000000 ]  - [   0.0040586400000000, -0.0008358700000000, -0.0008488600000000 ]  - [   0.0014228900000000,  0.0004739000000000, -0.0002320500000000 ]  - [  -0.0059492600000000,  0.0002187200000000,  0.0003318500000000 ]  - [  -0.0012711300000000, -0.0013994400000000, -0.0001985400000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0604307200000000, -0.1181805100000000, -0.0330563100000000 ]  - [  -0.0008773500000000,  0.0026301000000000,  0.0009254300000000 ]  - [  -0.0018115200000000, -0.0049484000000000,  0.0012409400000000 ]  - [   0.0007052300000000,  0.0024067000000000, -0.0008116400000000 ]  - [   0.0020412200000000, -0.0034653500000000,  0.0017543600000000 ]  - [  -0.0000988000000000,  0.0010956400000000,  0.0003786400000000 ]  - [  -0.0011280800000000, -0.0008361700000000, -0.0005103000000000 ]  - [  -0.0004590200000000, -0.0001553300000000, -0.0009033000000000 ]  - [  -0.0004492000000000, -0.0025838500000000,  0.0001404900000000 ]  - [   0.0002354200000000,  0.0010366200000000, -0.0006791400000000 ]  - [  -0.0010163800000000, -0.0019245500000000,  0.0008250300000000 ]  - [  -0.0001490100000000,  0.0007649600000000,  0.0005273900000000 ]  - [  -0.0015158400000000, -0.0007022500000000, -0.0010671200000000 ]  - [  -0.0008295700000000,  0.0017881700000000, -0.0008328100000000 ]  - [   0.0015325400000000,  0.0012224500000000,  0.0011108000000000 ]  - [  -0.0001425400000000,  0.0012177600000000,  0.0006533200000000 ]  - [   0.0007171600000000, -0.0021706800000000,  0.0034379000000000 ]  - [  -0.0004663400000000,  0.0020812000000000,  0.0037557700000000 ]  - [  -0.0007366600000000, -0.0020897700000000, -0.0036114200000000 ]  - [   0.0001780800000000,  0.0019607600000000, -0.0038562200000000 ]  - [  -0.0018672900000000, -0.0009462100000000, -0.0006664800000000 ]  - [  -0.0013078400000000,  0.0011283600000000, -0.0010442000000000 ]  - [  -0.0082388300000000,  0.0015756400000000, -0.0031541100000000 ]  - [   0.0014610800000000,  0.0013828100000000,  0.0010821200000000 ]  - [   0.0018008800000000, -0.0019465200000000, -0.0012949400000000 ]  - [   0.0008924400000000,  0.0013895700000000, -0.0011425500000000 ]  - [  -0.0005288000000000,  0.0002003400000000, -0.0023789500000000 ]  - [  -0.0011326300000000,  0.0016179400000000,  0.0012220200000000 ]  - [  -0.0006590400000000,  0.0006043700000000,  0.0008681100000000 ]  - [  -0.0006969700000000,  0.0005987500000000,  0.0005340500000000 ]  - [  -0.0014293300000000,  0.0013360500000000,  0.0013320000000000 ]  - [   0.0015261300000000,  0.0013240900000000, -0.0009668200000000 ]  - [   0.0029251800000000, -0.0011895900000000,  0.0011785200000000 ]  - [  -0.0022679600000000,  0.0030163700000000, -0.0005770200000000 ]  - [   0.0002135700000000, -0.0042094800000000,  0.0058983300000000 ]  - [   0.0000276100000000,  0.0013530400000000, -0.0004549300000000 ]  - [  -0.0039462400000000,  0.0035656600000000,  0.0016073100000000 ]  - [   0.0021827300000000,  0.0027340200000000, -0.0015735300000000 ]  - [   0.0009145200000000,  0.0103206100000000, -0.0003869200000000 ]  - [   0.0006356000000000,  0.0033256300000000,  0.0001646100000000 ]  - [   0.0001506100000000,  0.0020096300000000,  0.0002750500000000 ]  - [  -0.0006479100000000,  0.0019982100000000, -0.0017764100000000 ]  - [  -0.0043361700000000, -0.0084156600000000, -0.0012482600000000 ]  - [   0.0010350400000000,  0.0023976400000000,  0.0009670900000000 ]  - [   0.0050883700000000, -0.0021109000000000, -0.0022139400000000 ]  - [  -0.0001284700000000,  0.0026908400000000,  0.0039243600000000 ]  - [  -0.0108637300000000,  0.0201278500000000,  0.0047073700000000 ]  - [   0.0011210200000000,  0.0038564900000000, -0.0042229000000000 ]  - [  -0.0027601600000000,  0.0034197400000000,  0.0121899300000000 ]  - [  -0.0011135400000000,  0.0015692600000000, -0.0011561800000000 ]  - [   0.0003717600000000, -0.0007072300000000,  0.0003891500000000 ]  - [   0.0015179500000000,  0.0011389400000000,  0.0009724500000000 ]  - [   0.0037303900000000,  0.0000328000000000,  0.0019653000000000 ]  - [   0.0006734700000000,  0.0015067800000000, -0.0012429000000000 ]  - [  -0.0023374300000000, -0.0015400600000000,  0.0014869000000000 ]  - [  -0.0013800300000000,  0.0011635600000000,  0.0009215500000000 ]  - [  -0.0008539700000000, -0.0007905800000000, -0.0001530300000000 ]  - [   0.0022797200000000, -0.0017938200000000,  0.0005150200000000 ]  - [   0.0007990800000000, -0.0015968300000000,  0.0005371800000000 ]  - [  -0.0029662800000000, -0.0021620800000000, -0.0013873400000000 ]  - [   0.0021939200000000,  0.0009499900000000,  0.0007286800000000 ]  - [  -0.0002850500000000, -0.0013201000000000, -0.0001307700000000 ]  - [  -0.0005153900000000,  0.0017549900000000,  0.0002224300000000 ]  - [   0.0002749400000000, -0.0016229500000000, -0.0000772900000000 ]  - [  -0.0000825900000000,  0.0075703600000000,  0.0007019100000000 ]  - [  -0.0001561400000000, -0.0020622900000000,  0.0002695000000000 ]  - [   0.0008301800000000,  0.0045674400000000,  0.0006233700000000 ]  - [   0.0001281500000000, -0.0018080900000000, -0.0002641900000000 ]  - [   0.0000416800000000,  0.0030454800000000,  0.0011706600000000 ]  - [  -0.0002563600000000, -0.0020360300000000, -0.0000580600000000 ]  - [   0.0011948200000000,  0.0095246200000000, -0.0003742500000000 ]  - [   0.0010663900000000, -0.0036332000000000, -0.0004334000000000 ]  - [  -0.0017561400000000, -0.0004549700000000,  0.0006161600000000 ]  - [   0.0027538800000000, -0.0005566400000000, -0.0013175000000000 ]  - [   0.0015193800000000,  0.0045509300000000, -0.0020230700000000 ]  - [   0.0001739700000000, -0.0033420000000000,  0.0002579200000000 ]  - [  -0.0269140000000000,  0.0553901900000000,  0.0083826800000000 ]  - [  -0.0007273500000000, -0.0055338600000000,  0.0001558700000000 ]  - [   0.0004237900000000,  0.0059768900000000,  0.0003883500000000 ]  - [   0.0013618300000000, -0.0039489100000000,  0.0003956500000000 ]  - [  -0.0081506400000000,  0.0280675200000000,  0.0059364700000000 ]  - [  -0.0001202400000000, -0.0050373900000000, -0.0000848900000000 ]  - [   0.0002079300000000, -0.0110034800000000, -0.0038546700000000 ]  - [  -0.0075152800000000, -0.0045459800000000,  0.0055235200000000 ]  - [   0.0023782100000000,  0.0021548700000000, -0.0006670200000000 ]  - [  -0.0005643000000000, -0.0022401100000000,  0.0002813300000000 ]  - [  -0.0043713200000000,  0.0004721500000000, -0.0018006600000000 ]  - [   0.0008211500000000, -0.0040029800000000,  0.0003124100000000 ]- atom:    1  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0582933200000000,  0.1173872600000000,  0.0329712200000000 ]  - [   0.0000455400000000, -0.0017014100000000,  0.0003694600000000 ]  - [   0.0026141800000000,  0.0058282700000000, -0.0025196200000000 ]  - [   0.0001253500000000, -0.0014799700000000, -0.0004816300000000 ]  - [  -0.0011983700000000,  0.0025368800000000, -0.0004508500000000 ]  - [   0.0009292700000000, -0.0020216100000000,  0.0009150300000000 ]  - [   0.0002859300000000, -0.0000997200000000, -0.0007861900000000 ]  - [  -0.0003752200000000, -0.0007640300000000, -0.0003915000000000 ]  - [   0.0012494800000000,  0.0016740500000000, -0.0014107500000000 ]  - [   0.0005995100000000, -0.0019647400000000, -0.0006176900000000 ]  - [   0.0001802200000000,  0.0010017700000000,  0.0004696300000000 ]  - [  -0.0006844900000000, -0.0016932700000000,  0.0007675200000000 ]  - [   0.0006449500000000,  0.0016359600000000, -0.0002493800000000 ]  - [  -0.0000039000000000, -0.0008625800000000, -0.0004621800000000 ]  - [  -0.0006983300000000, -0.0002899200000000,  0.0001856700000000 ]  - [   0.0009719000000000, -0.0002934800000000,  0.0006423100000000 ]  - [  -0.0007295400000000,  0.0021760300000000,  0.0038736100000000 ]  - [   0.0004624900000000, -0.0020819500000000,  0.0035512700000000 ]  - [   0.0007304700000000,  0.0020805400000000, -0.0036942600000000 ]  - [  -0.0001799600000000, -0.0019587200000000, -0.0034461400000000 ]  - [  -0.0002680100000000,  0.0009546000000000, -0.0009576800000000 ]  - [  -0.0008232800000000, -0.0011316900000000, -0.0005843900000000 ]  - [   0.0102490000000000, -0.0015841900000000,  0.0046783600000000 ]  - [   0.0006640100000000, -0.0013822000000000,  0.0005405400000000 ]  - [   0.0003257900000000,  0.0019260500000000, -0.0003400700000000 ]  - [   0.0012336600000000, -0.0013881500000000, -0.0004774300000000 ]  - [  -0.0015863500000000, -0.0001747700000000,  0.0040414800000000 ]  - [  -0.0009951900000000, -0.0016165900000000,  0.0004103500000000 ]  - [  -0.0001764500000000,  0.0003270500000000,  0.0004287200000000 ]  - [  -0.0001391700000000,  0.0003222100000000,  0.0007627400000000 ]  - [   0.0022755800000000, -0.0004061800000000, -0.0026460800000000 ]  - [  -0.0007001900000000, -0.0004179700000000, -0.0003248500000000 ]  - [  -0.0020721900000000,  0.0002396400000000,  0.0001163100000000 ]  - [   0.0031134300000000, -0.0039509600000000,  0.0018805400000000 ]  - [  -0.0010197400000000,  0.0033547100000000, -0.0071349100000000 ]  - [  -0.0008590600000000, -0.0022784900000000, -0.0008394900000000 ]  - [   0.0047745100000000, -0.0044885800000000, -0.0028995500000000 ]  - [  -0.0013638500000000, -0.0036859800000000,  0.0002862900000000 ]  - [  -0.0017077600000000, -0.0109957500000000,  0.0016635300000000 ]  - [  -0.0014658600000000, -0.0042663000000000,  0.0011278400000000 ]  - [  -0.0009903600000000, -0.0010718200000000, -0.0015793300000000 ]  - [  -0.0001749800000000, -0.0010833600000000,  0.0004715100000000 ]  - [   0.0049698200000000,  0.0093254400000000,  0.0025254700000000 ]  - [  -0.0001995200000000, -0.0014702500000000,  0.0003294000000000 ]  - [  -0.0050584100000000,  0.0020199500000000,  0.0094946000000000 ]  - [   0.0001294100000000, -0.0026852000000000,  0.0033815400000000 ]  - [   0.0110644500000000, -0.0204034300000000, -0.0121062000000000 ]  - [  -0.0011077500000000, -0.0038380700000000, -0.0030896500000000 ]  - [   0.0006552800000000, -0.0033938900000000, -0.0136014900000000 ]  - [  -0.0010129400000000, -0.0015685600000000, -0.0004702200000000 ]  - [   0.0017512300000000,  0.0007212400000000,  0.0012355100000000 ]  - [   0.0006136300000000, -0.0011419700000000,  0.0006588800000000 ]  - [  -0.0015981800000000, -0.0000218900000000, -0.0036132000000000 ]  - [   0.0014521000000000, -0.0015064000000000, -0.0003885300000000 ]  - [   0.0001873900000000,  0.0015243300000000,  0.0001469500000000 ]  - [  -0.0007485700000000, -0.0011621600000000,  0.0007053300000000 ]  - [   0.0008602600000000,  0.0007864900000000,  0.0001581600000000 ]  - [  -0.0022636000000000,  0.0017924600000000, -0.0005132900000000 ]  - [  -0.0008018400000000,  0.0015870200000000, -0.0005432400000000 ]  - [   0.0029469200000000,  0.0021678800000000,  0.0013697700000000 ]  - [  -0.0021852100000000, -0.0009832700000000, -0.0007273400000000 ]  - [   0.0002836700000000,  0.0013246300000000,  0.0001310500000000 ]  - [   0.0005288300000000, -0.0017480000000000, -0.0002281300000000 ]  - [  -0.0002752200000000,  0.0016209200000000,  0.0000779600000000 ]  - [   0.0000782300000000, -0.0075711500000000, -0.0006796000000000 ]  - [   0.0001535100000000,  0.0020619700000000, -0.0002707100000000 ]  - [  -0.0008204900000000, -0.0045606600000000, -0.0006225900000000 ]  - [  -0.0001252300000000,  0.0018092000000000,  0.0002646400000000 ]  - [  -0.0000604100000000, -0.0030238500000000, -0.0011718800000000 ]  - [   0.0002559500000000,  0.0020337700000000,  0.0000583900000000 ]  - [  -0.0015898300000000, -0.0101429900000000,  0.0005442100000000 ]  - [  -0.0010557100000000,  0.0036174600000000,  0.0004293100000000 ]  - [   0.0017684500000000,  0.0004491200000000, -0.0006276700000000 ]  - [  -0.0027359300000000,  0.0005627200000000,  0.0013131100000000 ]  - [  -0.0014992900000000, -0.0045577500000000,  0.0020169500000000 ]  - [  -0.0001689400000000,  0.0033422400000000, -0.0002604900000000 ]  - [   0.0245179700000000, -0.0530861700000000, -0.0073641700000000 ]  - [   0.0007251100000000,  0.0055412600000000, -0.0001548000000000 ]  - [  -0.0003642000000000, -0.0058701300000000, -0.0003602900000000 ]  - [  -0.0013645100000000,  0.0039457900000000, -0.0003964400000000 ]  - [   0.0080863600000000, -0.0279582500000000, -0.0059119800000000 ]  - [   0.0001167900000000,  0.0050281300000000,  0.0000920600000000 ]  - [  -0.0002041800000000,  0.0109907700000000,  0.0038646400000000 ]  - [   0.0074270500000000,  0.0045979200000000, -0.0054246100000000 ]  - [  -0.0023664400000000, -0.0021852200000000,  0.0006679500000000 ]  - [   0.0005689000000000,  0.0022544900000000, -0.0002835100000000 ]  - [   0.0043155700000000, -0.0005405400000000,  0.0017955300000000 ]  - [  -0.0008202000000000,  0.0040039700000000, -0.0003112700000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0805788200000000, -0.0322080400000000, -0.1179795000000000 ]  - [  -0.0003575600000000,  0.0007341200000000,  0.0005956900000000 ]  - [  -0.0133096300000000, -0.0014180300000000,  0.0049335900000000 ]  - [   0.0004676100000000,  0.0006217800000000, -0.0007173300000000 ]  - [   0.0020841300000000, -0.0015552900000000,  0.0031459200000000 ]  - [   0.0003678100000000, -0.0001947400000000,  0.0007159000000000 ]  - [  -0.0009100700000000, -0.0003202200000000, -0.0009890700000000 ]  - [  -0.0009245100000000, -0.0007163000000000, -0.0009716300000000 ]  - [  -0.0028842300000000,  0.0003176200000000,  0.0033534800000000 ]  - [   0.0004388900000000, -0.0004925200000000, -0.0006122100000000 ]  - [  -0.0008332300000000, -0.0006342200000000,  0.0011995900000000 ]  - [  -0.0005107700000000, -0.0003419400000000,  0.0007808500000000 ]  - [  -0.0035691000000000,  0.0008710700000000, -0.0019098400000000 ]  - [  -0.0006076900000000,  0.0006427500000000, -0.0007569600000000 ]  - [   0.0006438500000000,  0.0004632100000000,  0.0012455000000000 ]  - [   0.0003323900000000,  0.0009212900000000,  0.0012464300000000 ]  - [  -0.0006561300000000, -0.0017711800000000,  0.0042522400000000 ]  - [  -0.0002228600000000,  0.0006115800000000,  0.0037632500000000 ]  - [  -0.0008130300000000,  0.0005138700000000, -0.0025747100000000 ]  - [  -0.0000606700000000,  0.0000769700000000, -0.0035887200000000 ]  - [  -0.0014621400000000, -0.0000099900000000, -0.0008951700000000 ]  - [  -0.0012908200000000, -0.0000969000000000, -0.0009437800000000 ]  - [   0.0055559300000000, -0.0034852100000000, -0.0013922000000000 ]  - [   0.0011456800000000,  0.0001479100000000,  0.0006854700000000 ]  - [   0.0025656600000000,  0.0004337800000000, -0.0013085200000000 ]  - [   0.0010139600000000,  0.0001875800000000, -0.0009375000000000 ]  - [  -0.0017046500000000, -0.0007620500000000,  0.0063528500000000 ]  - [  -0.0011344300000000,  0.0006184000000000,  0.0012193500000000 ]  - [  -0.0006095100000000,  0.0003435200000000,  0.0010301600000000 ]  - [  -0.0009645200000000,  0.0006794000000000,  0.0010304200000000 ]  - [  -0.0001723500000000,  0.0007772700000000,  0.0000347000000000 ]  - [  -0.0007745700000000, -0.0015210300000000,  0.0000358900000000 ]  - [   0.0002351600000000, -0.0009877900000000, -0.0006349500000000 ]  - [  -0.0004673700000000,  0.0007599200000000,  0.0001920300000000 ]  - [   0.0014381400000000,  0.0059849600000000,  0.0151352600000000 ]  - [  -0.0002615300000000, -0.0002707300000000, -0.0005243600000000 ]  - [  -0.0016431000000000,  0.0017761800000000, -0.0009181700000000 ]  - [   0.0002873800000000, -0.0013848300000000, -0.0004858000000000 ]  - [   0.0016436400000000,  0.0005242700000000, -0.0033195700000000 ]  - [   0.0005949500000000,  0.0000172400000000,  0.0000714400000000 ]  - [  -0.0000889100000000,  0.0015760200000000,  0.0000889700000000 ]  - [   0.0007635000000000, -0.0004627200000000,  0.0000928300000000 ]  - [  -0.0012066000000000, -0.0014076900000000, -0.0039676200000000 ]  - [   0.0004938700000000,  0.0007746600000000,  0.0006152800000000 ]  - [  -0.0049578900000000, -0.0081862100000000,  0.0086771300000000 ]  - [   0.0000208200000000,  0.0004978600000000,  0.0036216900000000 ]  - [  -0.0025234500000000,  0.0060561000000000, -0.0039092000000000 ]  - [   0.0003221700000000,  0.0004607600000000, -0.0038835500000000 ]  - [  -0.0036710200000000,  0.0152143200000000,  0.0187478100000000 ]  - [  -0.0009252400000000,  0.0001515000000000, -0.0008274700000000 ]  - [   0.0019631800000000, -0.0010056800000000,  0.0015278300000000 ]  - [   0.0014988200000000,  0.0003530100000000,  0.0013473200000000 ]  - [   0.0030645300000000,  0.0014034700000000, -0.0017028600000000 ]  - [   0.0010902500000000,  0.0001150800000000, -0.0009149100000000 ]  - [  -0.0015229500000000, -0.0001260900000000,  0.0005356700000000 ]  - [  -0.0011976300000000,  0.0001899800000000,  0.0007848800000000 ]  - [  -0.0000656600000000, -0.0002565000000000,  0.0001950000000000 ]  - [   0.0002969900000000,  0.0000649300000000,  0.0001397400000000 ]  - [  -0.0000712000000000,  0.0001677200000000, -0.0000457000000000 ]  - [  -0.0026458100000000, -0.0026567700000000, -0.0011405100000000 ]  - [   0.0008957700000000,  0.0000870400000000,  0.0009080900000000 ]  - [   0.0000858700000000, -0.0001147300000000,  0.0002231900000000 ]  - [   0.0014479800000000,  0.0000162600000000, -0.0013112300000000 ]  - [   0.0001863700000000, -0.0002021800000000, -0.0001207400000000 ]  - [  -0.0044550700000000,  0.0041471300000000, -0.0044516600000000 ]  - [  -0.0001407600000000, -0.0003162700000000,  0.0000072500000000 ]  - [  -0.0003743800000000,  0.0004054300000000,  0.0010251400000000 ]  - [   0.0001183000000000, -0.0001442400000000, -0.0000039400000000 ]  - [  -0.0011053900000000,  0.0025067800000000, -0.0066115600000000 ]  - [  -0.0002250000000000, -0.0003405700000000, -0.0001509700000000 ]  - [  -0.0016538500000000,  0.0007771400000000,  0.0045108400000000 ]  - [  -0.0000127500000000, -0.0007625600000000,  0.0003149400000000 ]  - [   0.0002449600000000,  0.0009006600000000, -0.0005763700000000 ]  - [   0.0016619300000000, -0.0013161600000000, -0.0009150000000000 ]  - [   0.0040818000000000,  0.0019405100000000, -0.0055692200000000 ]  - [   0.0001829100000000, -0.0004739800000000, -0.0000497200000000 ]  - [  -0.0064916800000000,  0.0053069800000000,  0.0232886100000000 ]  - [  -0.0007354900000000, -0.0003048600000000,  0.0003764200000000 ]  - [   0.0020199700000000,  0.0014575100000000,  0.0026957500000000 ]  - [   0.0007751800000000, -0.0006377700000000,  0.0003792100000000 ]  - [  -0.0428133900000000,  0.0087161000000000,  0.0612772600000000 ]  - [  -0.0002133300000000, -0.0006286500000000,  0.0001556400000000 ]  - [  -0.0001767700000000, -0.0042774900000000, -0.0010487200000000 ]  - [  -0.0019938800000000,  0.0071873700000000,  0.0043695600000000 ]  - [   0.0012728800000000, -0.0003213000000000, -0.0015976800000000 ]  - [   0.0008334700000000,  0.0005421900000000, -0.0007664600000000 ]  - [  -0.0068237500000000, -0.0064509300000000, -0.0051029500000000 ]  - [  -0.0004792100000000, -0.0004767900000000, -0.0007980300000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0844258900000000,  0.0338291900000000,  0.1213540600000000 ]  - [  -0.0004755200000000,  0.0001820300000000,  0.0006980800000000 ]  - [   0.0140814400000000,  0.0023466100000000, -0.0062739700000000 ]  - [   0.0003664100000000,  0.0002959700000000, -0.0005765400000000 ]  - [  -0.0012752400000000,  0.0006452300000000, -0.0018663400000000 ]  - [   0.0004676900000000, -0.0007357000000000,  0.0005792000000000 ]  - [   0.0000849600000000, -0.0006012500000000, -0.0003071200000000 ]  - [   0.0000945000000000, -0.0002085200000000, -0.0003210400000000 ]  - [   0.0037254400000000, -0.0012378100000000, -0.0046281500000000 ]  - [   0.0003942300000000, -0.0004353600000000, -0.0006788400000000 ]  - [   0.0000088300000000, -0.0002828600000000,  0.0000907800000000 ]  - [  -0.0003226100000000, -0.0005864900000000,  0.0005132700000000 ]  - [   0.0027370200000000,  0.0000576400000000,  0.0006092000000000 ]  - [  -0.0002233700000000,  0.0002761500000000, -0.0005360200000000 ]  - [   0.0001846100000000,  0.0004580500000000,  0.0000474300000000 ]  - [   0.0004984000000000,  0.0000008600000000,  0.0000483100000000 ]  - [   0.0006614900000000,  0.0017756100000000,  0.0030548900000000 ]  - [   0.0002266300000000, -0.0006213500000000,  0.0035481200000000 ]  - [   0.0008189700000000, -0.0005031900000000, -0.0047406400000000 ]  - [   0.0000615300000000, -0.0000839600000000, -0.0037239000000000 ]  - [  -0.0006588000000000,  0.0000142500000000, -0.0007351200000000 ]  - [  -0.0008340800000000,  0.0000906800000000, -0.0006869200000000 ]  - [  -0.0033631300000000,  0.0034472400000000,  0.0031215100000000 ]  - [   0.0009853000000000, -0.0001519900000000,  0.0009521300000000 ]  - [  -0.0004252800000000, -0.0004191200000000, -0.0003339200000000 ]  - [   0.0011195900000000, -0.0001940100000000, -0.0006953200000000 ]  - [  -0.0004402900000000,  0.0007288700000000, -0.0047451600000000 ]  - [  -0.0010005200000000, -0.0006215500000000,  0.0004116000000000 ]  - [  -0.0002189800000000,  0.0005771100000000,  0.0002627600000000 ]  - [   0.0001370100000000,  0.0002439000000000,  0.0002636200000000 ]  - [   0.0010133900000000,  0.0001389300000000, -0.0013339800000000 ]  - [   0.0016178100000000,  0.0024617700000000, -0.0013326200000000 ]  - [   0.0005888800000000,  0.0000696900000000,  0.0019327300000000 ]  - [   0.0013154500000000, -0.0017022500000000,  0.0011090200000000 ]  - [  -0.0023431300000000, -0.0070557100000000, -0.0167875500000000 ]  - [  -0.0005743200000000, -0.0006596500000000, -0.0007689200000000 ]  - [   0.0025062500000000, -0.0027353700000000, -0.0003983200000000 ]  - [   0.0005512800000000,  0.0004700100000000, -0.0008082500000000 ]  - [  -0.0025059900000000, -0.0015302500000000,  0.0046296800000000 ]  - [  -0.0014439800000000, -0.0009511700000000,  0.0012300800000000 ]  - [  -0.0007483800000000, -0.0006672800000000, -0.0013824500000000 ]  - [  -0.0016094700000000,  0.0013964500000000, -0.0013786400000000 ]  - [   0.0020315500000000,  0.0023719800000000,  0.0053303600000000 ]  - [   0.0003361300000000,  0.0001408300000000,  0.0006770600000000 ]  - [   0.0050332200000000,  0.0083685600000000, -0.0014324500000000 ]  - [  -0.0000210600000000, -0.0005096200000000,  0.0036935700000000 ]  - [   0.0025482100000000, -0.0061876700000000, -0.0033665900000000 ]  - [  -0.0003309200000000, -0.0004799000000000, -0.0034207800000000 ]  - [   0.0015004700000000, -0.0149731900000000, -0.0201356300000000 ]  - [  -0.0012104000000000, -0.0001575400000000, -0.0008106700000000 ]  - [   0.0001819300000000,  0.0009963400000000,  0.0001062000000000 ]  - [   0.0006344700000000, -0.0003535700000000,  0.0002860900000000 ]  - [  -0.0009484200000000, -0.0013988500000000,  0.0000907400000000 ]  - [   0.0010410200000000, -0.0001243400000000, -0.0007142200000000 ]  - [  -0.0005964900000000,  0.0001297300000000,  0.0010987100000000 ]  - [  -0.0009333500000000, -0.0001946400000000,  0.0008511300000000 ]  - [   0.0000646700000000,  0.0002580700000000, -0.0001963900000000 ]  - [  -0.0003201700000000, -0.0000422800000000, -0.0001453900000000 ]  - [   0.0000712300000000, -0.0001563000000000,  0.0000489400000000 ]  - [   0.0026574900000000,  0.0026527200000000,  0.0011584800000000 ]  - [  -0.0009055500000000, -0.0000947000000000, -0.0009064600000000 ]  - [  -0.0000866400000000,  0.0001185100000000, -0.0002207600000000 ]  - [  -0.0014659900000000, -0.0000282500000000,  0.0013100400000000 ]  - [  -0.0001894200000000,  0.0002097400000000,  0.0001208900000000 ]  - [   0.0045668300000000, -0.0041812100000000,  0.0047110900000000 ]  - [   0.0001432600000000,  0.0003229800000000, -0.0000072900000000 ]  - [   0.0003447200000000, -0.0004384900000000, -0.0010391700000000 ]  - [  -0.0001199100000000,  0.0001522300000000,  0.0000048000000000 ]  - [   0.0011546900000000, -0.0025451400000000,  0.0065965300000000 ]  - [   0.0002280600000000,  0.0003499400000000,  0.0001523800000000 ]  - [   0.0016621000000000, -0.0008069000000000, -0.0045254400000000 ]  - [   0.0000075000000000,  0.0007833100000000, -0.0003087700000000 ]  - [  -0.0002496600000000, -0.0008991200000000,  0.0005849900000000 ]  - [  -0.0016802200000000,  0.0013196000000000,  0.0009288400000000 ]  - [  -0.0041096100000000, -0.0019648600000000,  0.0056057900000000 ]  - [  -0.0001858900000000,  0.0004860900000000,  0.0000511100000000 ]  - [   0.0062870000000000, -0.0050941600000000, -0.0232389300000000 ]  - [   0.0007441500000000,  0.0003168500000000, -0.0003785300000000 ]  - [  -0.0020292200000000, -0.0014645900000000, -0.0026775000000000 ]  - [  -0.0007829100000000,  0.0006541100000000, -0.0003795500000000 ]  - [   0.0458724800000000, -0.0095835500000000, -0.0636245100000000 ]  - [   0.0002154600000000,  0.0006508300000000, -0.0001586200000000 ]  - [   0.0001797800000000,  0.0043120700000000,  0.0010517100000000 ]  - [   0.0020530200000000, -0.0072281500000000, -0.0044530600000000 ]  - [  -0.0013058500000000,  0.0003321400000000,  0.0015983400000000 ]  - [  -0.0008410200000000, -0.0005427500000000,  0.0007651700000000 ]  - [   0.0069094900000000,  0.0065151700000000,  0.0051060800000000 ]  - [   0.0004855600000000,  0.0004865300000000,  0.0007949500000000 ]- atom:   17  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0013594400000000,  0.0011933700000000, -0.0000127300000000 ]  - [   0.0001391900000000, -0.0000020600000000,  0.0004236200000000 ]  - [   0.0033310800000000,  0.0114554800000000, -0.0032030200000000 ]  - [  -0.0002661100000000, -0.0006512600000000, -0.0003204200000000 ]  - [   0.0002446000000000,  0.0046175300000000,  0.0056583500000000 ]  - [   0.0001512000000000, -0.0005920300000000,  0.0006259700000000 ]  - [  -0.0010959400000000, -0.0015770600000000, -0.0009739700000000 ]  - [   0.0024832700000000,  0.0104729200000000,  0.0018679800000000 ]  - [   0.0023109100000000, -0.0011945700000000, -0.0014647700000000 ]  - [   0.0006991500000000, -0.0002848600000000, -0.0007088700000000 ]  - [  -0.0005733500000000, -0.0055283000000000, -0.0043316100000000 ]  - [  -0.0006794800000000, -0.0003338400000000,  0.0006683300000000 ]  - [   0.0024832700000000, -0.0104729200000000,  0.0018679800000000 ]  - [  -0.0010959400000000,  0.0015770600000000, -0.0009739700000000 ]  - [   0.0002446000000000, -0.0046175300000000,  0.0056583500000000 ]  - [   0.0001512000000000,  0.0005920300000000,  0.0006259700000000 ]  - [  -0.0397340500000000,  0.0000000000000000,  0.0039895800000000 ]  - [  -0.0004714600000000,  0.0000000000000000,  0.0036527900000000 ]  - [  -0.0012716600000000, -0.0000160900000000, -0.0036579600000000 ]  - [  -0.0012716600000000,  0.0000160900000000, -0.0036579600000000 ]  - [  -0.0017600300000000,  0.0000000000000000,  0.0001226700000000 ]  - [  -0.0012083100000000,  0.0000000000000000, -0.0007918900000000 ]  - [   0.0006647500000000,  0.0008865000000000, -0.0002257100000000 ]  - [   0.0006647500000000, -0.0008865000000000, -0.0002257100000000 ]  - [   0.0022341400000000, -0.0006035600000000, -0.0011719100000000 ]  - [   0.0022341400000000,  0.0006035600000000, -0.0011719100000000 ]  - [   0.0024751900000000,  0.0000000000000000,  0.0023894400000000 ]  - [  -0.0009056800000000,  0.0000000000000000,  0.0008251800000000 ]  - [  -0.0005733500000000,  0.0055283000000000, -0.0043316100000000 ]  - [  -0.0006794800000000,  0.0003338400000000,  0.0006683300000000 ]  - [   0.0023109100000000,  0.0011945700000000, -0.0014647700000000 ]  - [   0.0006991500000000,  0.0002848600000000, -0.0007088700000000 ]  - [   0.0009730100000000, -0.0009271900000000,  0.0008725500000000 ]  - [   0.0021913200000000,  0.0002531400000000,  0.0013048000000000 ]  - [   0.0014733600000000,  0.0002725100000000,  0.0001669400000000 ]  - [  -0.0001343300000000, -0.0006427200000000, -0.0005869900000000 ]  - [  -0.0002661100000000,  0.0006512600000000, -0.0003204200000000 ]  - [   0.0033310800000000, -0.0114554800000000, -0.0032030200000000 ]  - [   0.0001391900000000,  0.0000020600000000,  0.0004236200000000 ]  - [   0.0013594400000000, -0.0011933700000000, -0.0000127300000000 ]  - [   0.0014733600000000, -0.0002725100000000,  0.0001669400000000 ]  - [  -0.0001343300000000,  0.0006427200000000, -0.0005869900000000 ]  - [   0.0021913200000000, -0.0002531400000000,  0.0013048000000000 ]  - [   0.0009730100000000,  0.0009271900000000,  0.0008725500000000 ]  - [   0.0007992700000000,  0.0000022200000000,  0.0036516300000000 ]  - [   0.0007992700000000, -0.0000022200000000,  0.0036516300000000 ]  - [   0.0031830600000000,  0.0000000000000000, -0.0036598900000000 ]  - [   0.0003013000000000,  0.0000000000000000, -0.0036523800000000 ]  - [   0.0001040200000000,  0.0006066700000000, -0.0004511300000000 ]  - [   0.0001040200000000, -0.0006066700000000, -0.0004511300000000 ]  - [   0.0045848700000000,  0.0000000000000000, -0.0007407600000000 ]  - [   0.0012222700000000,  0.0000000000000000,  0.0008008300000000 ]  - [   0.0003558100000000,  0.0000000000000000, -0.0017692600000000 ]  - [   0.0009179600000000,  0.0000000000000000, -0.0008345700000000 ]  - [  -0.0014585000000000, -0.0008875600000000,  0.0018494100000000 ]  - [  -0.0014585000000000,  0.0008875600000000,  0.0018494100000000 ]  - [   0.0042819300000000, -0.0000007400000000,  0.0000003100000000 ]  - [   0.0008917300000000,  0.0000002000000000, -0.0000000500000000 ]  - [  -0.0028935400000000,  0.0000053700000000, -0.0000023400000000 ]  - [  -0.0007173100000000, -0.0000007100000000, -0.0000001700000000 ]  - [  -0.0040720300000000,  0.0000000000000000, -0.0040989600000000 ]  - [  -0.0000876200000000,  0.0000000000000000, -0.0000289100000000 ]  - [  -0.0004818700000000,  0.0013920800000000,  0.0001815500000000 ]  - [  -0.0004818700000000, -0.0013920800000000,  0.0001815500000000 ]  - [  -0.0028935400000000, -0.0000053700000000, -0.0000023400000000 ]  - [  -0.0007173100000000,  0.0000007100000000, -0.0000001700000000 ]  - [   0.0042819300000000,  0.0000007400000000,  0.0000003100000000 ]  - [   0.0008917300000000, -0.0000002000000000, -0.0000000500000000 ]  - [  -0.0004761700000000, -0.0013887000000000, -0.0001809600000000 ]  - [  -0.0004761700000000,  0.0013887000000000, -0.0001809600000000 ]  - [  -0.0038384200000000,  0.0000000000000000,  0.0040168300000000 ]  - [  -0.0000867500000000,  0.0000000000000000,  0.0000290700000000 ]  - [   0.0202238400000000,  0.0001370800000000, -0.0000950800000000 ]  - [   0.0015650900000000,  0.0000024100000000, -0.0000010000000000 ]  - [   0.0202238400000000, -0.0001370800000000, -0.0000950800000000 ]  - [   0.0015650900000000, -0.0000024100000000, -0.0000010000000000 ]  - [  -0.0029165300000000, -0.0038507400000000,  0.0009800700000000 ]  - [  -0.0029165300000000,  0.0038507400000000,  0.0009800700000000 ]  - [  -0.0029389200000000,  0.0038532900000000, -0.0009862600000000 ]  - [  -0.0029389200000000, -0.0038532900000000, -0.0009862600000000 ]  - [  -0.0042968800000000, -0.0000069400000000,  0.0000066900000000 ]  - [  -0.0010687600000000,  0.0000018300000000,  0.0000006000000000 ]  - [  -0.0042968800000000,  0.0000069400000000,  0.0000066900000000 ]  - [  -0.0010687600000000, -0.0000018300000000,  0.0000006000000000 ]  - [  -0.0053114100000000,  0.0000000000000000,  0.0046965300000000 ]  - [   0.0000028600000000,  0.0000000000000000, -0.0000123800000000 ]  - [  -0.0052769200000000,  0.0000000000000000, -0.0047145700000000 ]  - [   0.0000054200000000,  0.0000000000000000,  0.0000128700000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0021469400000000, -0.0017226700000000, -0.0011307400000000 ]  - [  -0.0015092100000000,  0.0025447000000000,  0.0012652700000000 ]  - [   0.0171218600000000,  0.0208741800000000, -0.0068522800000000 ]  - [   0.0009762600000000,  0.0043019500000000, -0.0011196000000000 ]  - [   0.0075741200000000, -0.0025608400000000,  0.0089578700000000 ]  - [  -0.0004838700000000,  0.0022262900000000,  0.0001457400000000 ]  - [   0.0001472300000000,  0.0033918100000000, -0.0001790700000000 ]  - [   0.0159984700000000,  0.0196582400000000,  0.0053910000000000 ]  - [  -0.0003965600000000, -0.0025526500000000, -0.0001446300000000 ]  - [   0.0002209900000000,  0.0014992300000000, -0.0005682700000000 ]  - [  -0.0075741200000000, -0.0025608400000000,  0.0089578700000000 ]  - [   0.0004838700000000,  0.0022262900000000,  0.0001457400000000 ]  - [  -0.0171218600000000,  0.0208741800000000, -0.0068522800000000 ]  - [  -0.0009762600000000,  0.0043019500000000, -0.0011196000000000 ]  - [  -0.0066824800000000, -0.0015706700000000, -0.0075958100000000 ]  - [   0.0013163500000000,  0.0031487800000000,  0.0011552600000000 ]  - [   0.0000000000000000, -0.2476148300000000,  0.0012542300000000 ]  - [   0.0000000000000000,  0.0048612800000000,  0.0036493800000000 ]  - [   0.0000000000000000,  0.0066229800000000, -0.0008524100000000 ]  - [   0.0000000000000000,  0.0066534900000000, -0.0064379700000000 ]  - [  -0.0010520100000000, -0.0057013000000000, -0.0007911900000000 ]  - [  -0.0010616500000000,  0.0023048300000000, -0.0008110100000000 ]  - [   0.0014534200000000,  0.0024002400000000, -0.0017924900000000 ]  - [   0.0006610900000000,  0.0023985400000000,  0.0033827500000000 ]  - [  -0.0016183700000000,  0.0014625400000000,  0.0002993900000000 ]  - [   0.0037207200000000,  0.0014604800000000, -0.0019018800000000 ]  - [  -0.0010682900000000, -0.0040224300000000,  0.0008020200000000 ]  - [  -0.0010610000000000,  0.0020665700000000,  0.0008111100000000 ]  - [   0.0066824800000000, -0.0015706700000000, -0.0075958100000000 ]  - [  -0.0013163500000000,  0.0031487800000000,  0.0011552600000000 ]  - [   0.0012346900000000, -0.0016183400000000, -0.0011608400000000 ]  - [   0.0006094600000000,  0.0024199500000000, -0.0007306500000000 ]  - [  -0.0006773600000000,  0.0016184600000000,  0.0000334000000000 ]  - [   0.0029585100000000, -0.0026250000000000,  0.0024148200000000 ]  - [   0.0003965600000000, -0.0025526500000000, -0.0001446300000000 ]  - [  -0.0002209900000000,  0.0014992300000000, -0.0005682700000000 ]  - [  -0.0001472300000000,  0.0033918100000000, -0.0001790700000000 ]  - [  -0.0159984700000000,  0.0196582400000000,  0.0053910000000000 ]  - [   0.0006773600000000,  0.0016184600000000,  0.0000334000000000 ]  - [  -0.0029585100000000, -0.0026250000000000,  0.0024148200000000 ]  - [  -0.0012346900000000, -0.0016183400000000, -0.0011608400000000 ]  - [  -0.0006094600000000,  0.0024199500000000, -0.0007306500000000 ]  - [  -0.0021469400000000, -0.0017226700000000, -0.0011307400000000 ]  - [   0.0015092100000000,  0.0025447000000000,  0.0012652700000000 ]  - [   0.0000000000000000,  0.0009043300000000,  0.0033854400000000 ]  - [   0.0000000000000000,  0.0009140400000000,  0.0039096300000000 ]  - [   0.0000000000000000, -0.0055915600000000, -0.0036460100000000 ]  - [   0.0000000000000000,  0.0033979600000000, -0.0036480400000000 ]  - [   0.0016183700000000,  0.0014625400000000,  0.0002993900000000 ]  - [  -0.0037207200000000,  0.0014604800000000, -0.0019018800000000 ]  - [   0.0010682900000000, -0.0040224300000000,  0.0008020200000000 ]  - [   0.0010610000000000,  0.0020665700000000,  0.0008111100000000 ]  - [   0.0010520100000000, -0.0057013000000000, -0.0007911900000000 ]  - [   0.0010616500000000,  0.0023048300000000, -0.0008110100000000 ]  - [  -0.0014534200000000,  0.0024002400000000, -0.0017924900000000 ]  - [  -0.0006610900000000,  0.0023985400000000,  0.0033827500000000 ]  - [   0.0000000000000000,  0.0027023200000000, -0.0029735900000000 ]  - [   0.0000000000000000, -0.0035884500000000,  0.0007569500000000 ]  - [   0.0000000000000000,  0.0027143400000000,  0.0006011500000000 ]  - [   0.0000000000000000, -0.0026825700000000, -0.0004580500000000 ]  - [  -0.0000269700000000,  0.0105165000000000, -0.0000069800000000 ]  - [   0.0000016300000000, -0.0033347400000000,  0.0000009200000000 ]  - [   0.0015705200000000, -0.0022286400000000, -0.0004823900000000 ]  - [  -0.0015710800000000, -0.0022436000000000,  0.0004786200000000 ]  - [   0.0000000000000000,  0.0027361800000000, -0.0006080800000000 ]  - [   0.0000000000000000, -0.0026813900000000,  0.0004571800000000 ]  - [   0.0000000000000000,  0.0027583300000000,  0.0029752200000000 ]  - [   0.0000000000000000, -0.0035883100000000, -0.0007549400000000 ]  - [  -0.0015705200000000, -0.0022286400000000, -0.0004823900000000 ]  - [   0.0015710800000000, -0.0022436000000000,  0.0004786200000000 ]  - [   0.0000269700000000,  0.0105165000000000, -0.0000069800000000 ]  - [  -0.0000016300000000, -0.0033347400000000,  0.0000009200000000 ]  - [   0.0000000000000000,  0.0723445500000000, -0.0194329900000000 ]  - [   0.0000000000000000, -0.0074939700000000, -0.0016198800000000 ]  - [   0.0000000000000000,  0.0783050100000000,  0.0220311300000000 ]  - [   0.0000000000000000, -0.0074947300000000,  0.0016045100000000 ]  - [  -0.0092256900000000, -0.0099140300000000,  0.0029866300000000 ]  - [   0.0091964800000000, -0.0098922900000000, -0.0029715900000000 ]  - [   0.0092256900000000, -0.0099140300000000,  0.0029866300000000 ]  - [  -0.0091964800000000, -0.0098922900000000, -0.0029715900000000 ]  - [   0.0000000000000000,  0.0040680400000000,  0.0014084300000000 ]  - [   0.0000000000000000, -0.0039420900000000, -0.0007327200000000 ]  - [   0.0000000000000000,  0.0040415900000000, -0.0013899200000000 ]  - [   0.0000000000000000, -0.0039365600000000,  0.0007345000000000 ]  - [  -0.0000159200000000,  0.0191309800000000,  0.0000091300000000 ]  - [   0.0000021300000000, -0.0056420700000000, -0.0000010900000000 ]  - [   0.0000159200000000,  0.0191309800000000,  0.0000091300000000 ]  - [  -0.0000021300000000, -0.0056420700000000, -0.0000010900000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0010913500000000,  0.0002478600000000,  0.0012432300000000 ]  - [  -0.0005009100000000,  0.0005681900000000,  0.0007525400000000 ]  - [  -0.0052034500000000, -0.0079440600000000, -0.0009076100000000 ]  - [   0.0006319900000000,  0.0010316400000000, -0.0008765000000000 ]  - [   0.0053575700000000,  0.0054272900000000,  0.0057185800000000 ]  - [   0.0004766800000000, -0.0007368600000000,  0.0006082900000000 ]  - [  -0.0006319900000000, -0.0010316400000000, -0.0008765000000000 ]  - [   0.0052034500000000,  0.0079440600000000, -0.0009076100000000 ]  - [  -0.0005316200000000, -0.0004218800000000,  0.0004364000000000 ]  - [   0.0003418700000000, -0.0006703600000000, -0.0005780100000000 ]  - [  -0.0053575700000000,  0.0054272900000000,  0.0057185800000000 ]  - [  -0.0004766800000000, -0.0007368600000000,  0.0006082900000000 ]  - [   0.0052034500000000, -0.0079440600000000, -0.0009076100000000 ]  - [  -0.0006319900000000,  0.0010316400000000, -0.0008765000000000 ]  - [   0.0053575700000000, -0.0054272900000000,  0.0057185800000000 ]  - [   0.0004766800000000,  0.0007368600000000,  0.0006082900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0718972600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033787700000000 ]  - [   0.0000000000000000,  0.0027853100000000, -0.0039547600000000 ]  - [   0.0000000000000000, -0.0027853100000000, -0.0039547600000000 ]  - [   0.0003576700000000,  0.0000000000000000,  0.0045594900000000 ]  - [  -0.0009814400000000,  0.0000000000000000, -0.0006388200000000 ]  - [   0.0011381700000000, -0.0001965300000000,  0.0020753300000000 ]  - [   0.0011381700000000,  0.0001965300000000,  0.0020753300000000 ]  - [   0.0017708500000000, -0.0001184400000000, -0.0018589500000000 ]  - [   0.0017708500000000,  0.0001184400000000, -0.0018589500000000 ]  - [   0.0005064000000000,  0.0000000000000000, -0.0012051100000000 ]  - [  -0.0009778300000000,  0.0000000000000000,  0.0006471800000000 ]  - [  -0.0053575700000000, -0.0054272900000000,  0.0057185800000000 ]  - [  -0.0004766800000000,  0.0007368600000000,  0.0006082900000000 ]  - [  -0.0005316200000000,  0.0004218800000000,  0.0004364000000000 ]  - [   0.0003418700000000,  0.0006703600000000, -0.0005780100000000 ]  - [   0.0005009100000000, -0.0005681900000000,  0.0007525400000000 ]  - [   0.0010913500000000, -0.0002478600000000,  0.0012432300000000 ]  - [   0.0005316200000000, -0.0004218800000000,  0.0004364000000000 ]  - [  -0.0003418700000000, -0.0006703600000000, -0.0005780100000000 ]  - [   0.0006319900000000, -0.0010316400000000, -0.0008765000000000 ]  - [  -0.0052034500000000,  0.0079440600000000, -0.0009076100000000 ]  - [  -0.0005009100000000, -0.0005681900000000,  0.0007525400000000 ]  - [  -0.0010913500000000, -0.0002478600000000,  0.0012432300000000 ]  - [   0.0005316200000000,  0.0004218800000000,  0.0004364000000000 ]  - [  -0.0003418700000000,  0.0006703600000000, -0.0005780100000000 ]  - [   0.0010913500000000,  0.0002478600000000,  0.0012432300000000 ]  - [   0.0005009100000000,  0.0005681900000000,  0.0007525400000000 ]  - [   0.0000000000000000,  0.0002612000000000,  0.0039965200000000 ]  - [   0.0000000000000000, -0.0002612000000000,  0.0039965200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0024596300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035344400000000 ]  - [  -0.0017708500000000, -0.0001184400000000, -0.0018589500000000 ]  - [  -0.0017708500000000,  0.0001184400000000, -0.0018589500000000 ]  - [  -0.0005064000000000,  0.0000000000000000, -0.0012051100000000 ]  - [   0.0009778300000000,  0.0000000000000000,  0.0006471800000000 ]  - [  -0.0003576700000000,  0.0000000000000000,  0.0045594900000000 ]  - [   0.0009814400000000,  0.0000000000000000, -0.0006388200000000 ]  - [  -0.0011381700000000, -0.0001965300000000,  0.0020753300000000 ]  - [  -0.0011381700000000,  0.0001965300000000,  0.0020753300000000 ]  - [   0.0000000000000000, -0.0025681900000000, -0.0064946000000000 ]  - [   0.0000000000000000,  0.0001325400000000, -0.0002928700000000 ]  - [   0.0000000000000000,  0.0007915800000000,  0.0007498400000000 ]  - [   0.0000000000000000,  0.0001476300000000,  0.0001313500000000 ]  - [  -0.0044163500000000,  0.0000000000000000,  0.0016131200000000 ]  - [  -0.0000979100000000,  0.0000000000000000, -0.0000490300000000 ]  - [   0.0007493100000000, -0.0016375100000000, -0.0001480300000000 ]  - [   0.0007493100000000,  0.0016375100000000, -0.0001480300000000 ]  - [   0.0000000000000000, -0.0007915800000000,  0.0007498400000000 ]  - [   0.0000000000000000, -0.0001476300000000,  0.0001313500000000 ]  - [   0.0000000000000000,  0.0025681900000000, -0.0064946000000000 ]  - [   0.0000000000000000, -0.0001325400000000, -0.0002928700000000 ]  - [  -0.0007493100000000, -0.0016375100000000, -0.0001480300000000 ]  - [  -0.0007493100000000,  0.0016375100000000, -0.0001480300000000 ]  - [   0.0044163500000000,  0.0000000000000000,  0.0016131200000000 ]  - [   0.0000979100000000,  0.0000000000000000, -0.0000490300000000 ]  - [   0.0000000000000000, -0.0265175700000000,  0.0340956100000000 ]  - [   0.0000000000000000, -0.0006889900000000,  0.0011546300000000 ]  - [   0.0000000000000000,  0.0265175700000000,  0.0340956100000000 ]  - [   0.0000000000000000,  0.0006889900000000,  0.0011546300000000 ]  - [   0.0015596700000000,  0.0019598900000000, -0.0009676800000000 ]  - [   0.0015596700000000, -0.0019598900000000, -0.0009676800000000 ]  - [  -0.0015596700000000,  0.0019598900000000, -0.0009676800000000 ]  - [  -0.0015596700000000, -0.0019598900000000, -0.0009676800000000 ]  - [   0.0000000000000000, -0.0001109800000000, -0.0023940200000000 ]  - [   0.0000000000000000,  0.0000438300000000, -0.0004364700000000 ]  - [   0.0000000000000000,  0.0001109800000000, -0.0023940200000000 ]  - [   0.0000000000000000, -0.0000438300000000, -0.0004364700000000 ]  - [   0.0074717000000000,  0.0000000000000000, -0.0052521500000000 ]  - [   0.0000067500000000,  0.0000000000000000,  0.0000312000000000 ]  - [  -0.0074717000000000,  0.0000000000000000, -0.0052521500000000 ]  - [  -0.0000067500000000,  0.0000000000000000,  0.0000312000000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0002584400000000,  0.0006823200000000,  0.0000511000000000 ]  - [  -0.0003322800000000,  0.0003608600000000,  0.0005427600000000 ]  - [   0.0060459700000000,  0.0088657800000000, -0.0003679400000000 ]  - [   0.0001985100000000, -0.0001036900000000, -0.0004192000000000 ]  - [  -0.0044706600000000, -0.0062779800000000, -0.0043865500000000 ]  - [   0.0003550800000000, -0.0001922400000000,  0.0006854900000000 ]  - [  -0.0001985100000000,  0.0001036900000000, -0.0004192000000000 ]  - [  -0.0060459700000000, -0.0088657800000000, -0.0003679400000000 ]  - [   0.0013605900000000, -0.0005024800000000, -0.0017332900000000 ]  - [   0.0004901100000000, -0.0002591800000000, -0.0007169900000000 ]  - [   0.0044706600000000, -0.0062779800000000, -0.0043865500000000 ]  - [  -0.0003550800000000, -0.0001922400000000,  0.0006854900000000 ]  - [  -0.0060459700000000,  0.0088657800000000, -0.0003679400000000 ]  - [  -0.0001985100000000, -0.0001036900000000, -0.0004192000000000 ]  - [  -0.0044706600000000,  0.0062779800000000, -0.0043865500000000 ]  - [   0.0003550800000000,  0.0001922400000000,  0.0006854900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0794769000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0039264900000000 ]  - [   0.0000000000000000, -0.0028024800000000, -0.0033589300000000 ]  - [   0.0000000000000000,  0.0028024800000000, -0.0033589300000000 ]  - [  -0.0025032400000000,  0.0000000000000000, -0.0062091600000000 ]  - [  -0.0011451900000000,  0.0000000000000000, -0.0009884400000000 ]  - [   0.0009887900000000,  0.0001947500000000, -0.0004443400000000 ]  - [   0.0009887900000000, -0.0001947500000000, -0.0004443400000000 ]  - [   0.0003546500000000,  0.0001187000000000,  0.0002340500000000 ]  - [   0.0003546500000000, -0.0001187000000000,  0.0002340500000000 ]  - [  -0.0026381200000000,  0.0000000000000000,  0.0028285100000000 ]  - [  -0.0011495700000000,  0.0000000000000000,  0.0009794000000000 ]  - [   0.0044706600000000,  0.0062779800000000, -0.0043865500000000 ]  - [  -0.0003550800000000,  0.0001922400000000,  0.0006854900000000 ]  - [   0.0013605900000000,  0.0005024800000000, -0.0017332900000000 ]  - [   0.0004901100000000,  0.0002591800000000, -0.0007169900000000 ]  - [   0.0003322800000000, -0.0003608600000000,  0.0005427600000000 ]  - [  -0.0002584400000000, -0.0006823200000000,  0.0000511000000000 ]  - [  -0.0013605900000000, -0.0005024800000000, -0.0017332900000000 ]  - [  -0.0004901100000000, -0.0002591800000000, -0.0007169900000000 ]  - [   0.0001985100000000,  0.0001036900000000, -0.0004192000000000 ]  - [   0.0060459700000000, -0.0088657800000000, -0.0003679400000000 ]  - [  -0.0003322800000000, -0.0003608600000000,  0.0005427600000000 ]  - [   0.0002584400000000, -0.0006823200000000,  0.0000511000000000 ]  - [  -0.0013605900000000,  0.0005024800000000, -0.0017332900000000 ]  - [  -0.0004901100000000,  0.0002591800000000, -0.0007169900000000 ]  - [  -0.0002584400000000,  0.0006823200000000,  0.0000511000000000 ]  - [   0.0003322800000000,  0.0003608600000000,  0.0005427600000000 ]  - [   0.0000000000000000, -0.0002602800000000,  0.0033104000000000 ]  - [   0.0000000000000000,  0.0002602800000000,  0.0033104000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048487400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037714400000000 ]  - [  -0.0003546500000000,  0.0001187000000000,  0.0002340500000000 ]  - [  -0.0003546500000000, -0.0001187000000000,  0.0002340500000000 ]  - [   0.0026381200000000,  0.0000000000000000,  0.0028285100000000 ]  - [   0.0011495700000000,  0.0000000000000000,  0.0009794000000000 ]  - [   0.0025032400000000,  0.0000000000000000, -0.0062091600000000 ]  - [   0.0011451900000000,  0.0000000000000000, -0.0009884400000000 ]  - [  -0.0009887900000000,  0.0001947500000000, -0.0004443400000000 ]  - [  -0.0009887900000000, -0.0001947500000000, -0.0004443400000000 ]  - [   0.0000000000000000,  0.0026038000000000,  0.0065095000000000 ]  - [   0.0000000000000000, -0.0001322200000000,  0.0002913200000000 ]  - [   0.0000000000000000, -0.0007936300000000, -0.0007513000000000 ]  - [   0.0000000000000000, -0.0001477900000000, -0.0001316000000000 ]  - [   0.0043619900000000,  0.0000000000000000, -0.0016587900000000 ]  - [   0.0000978600000000,  0.0000000000000000,  0.0000488500000000 ]  - [  -0.0007504300000000,  0.0016377200000000,  0.0001476600000000 ]  - [  -0.0007504300000000, -0.0016377200000000,  0.0001476600000000 ]  - [   0.0000000000000000,  0.0007936300000000, -0.0007513000000000 ]  - [   0.0000000000000000,  0.0001477900000000, -0.0001316000000000 ]  - [   0.0000000000000000, -0.0026038000000000,  0.0065095000000000 ]  - [   0.0000000000000000,  0.0001322200000000,  0.0002913200000000 ]  - [   0.0007504300000000,  0.0016377200000000,  0.0001476600000000 ]  - [   0.0007504300000000, -0.0016377200000000,  0.0001476600000000 ]  - [  -0.0043619900000000,  0.0000000000000000, -0.0016587900000000 ]  - [  -0.0000978600000000,  0.0000000000000000,  0.0000488500000000 ]  - [   0.0000000000000000,  0.0258652700000000, -0.0342770700000000 ]  - [   0.0000000000000000,  0.0006893700000000, -0.0011533300000000 ]  - [   0.0000000000000000, -0.0258652700000000, -0.0342770700000000 ]  - [   0.0000000000000000, -0.0006893700000000, -0.0011533300000000 ]  - [  -0.0015375000000000, -0.0019372600000000,  0.0009631600000000 ]  - [  -0.0015375000000000,  0.0019372600000000,  0.0009631600000000 ]  - [   0.0015375000000000, -0.0019372600000000,  0.0009631600000000 ]  - [   0.0015375000000000,  0.0019372600000000,  0.0009631600000000 ]  - [   0.0000000000000000,  0.0001078800000000,  0.0023903500000000 ]  - [   0.0000000000000000, -0.0000435200000000,  0.0004355700000000 ]  - [   0.0000000000000000, -0.0001078800000000,  0.0023903500000000 ]  - [   0.0000000000000000,  0.0000435200000000,  0.0004355700000000 ]  - [  -0.0074569700000000,  0.0000000000000000,  0.0052631300000000 ]  - [  -0.0000069700000000,  0.0000000000000000, -0.0000318500000000 ]  - [   0.0074569700000000,  0.0000000000000000,  0.0052631300000000 ]  - [   0.0000069700000000,  0.0000000000000000, -0.0000318500000000 ]- atom:   21  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0016342300000000, -0.0003349600000000,  0.0002458500000000 ]  - [   0.0005915000000000,  0.0002178600000000,  0.0004202000000000 ]  - [   0.0012138600000000,  0.0011538900000000,  0.0002484500000000 ]  - [   0.0003084700000000,  0.0000094700000000, -0.0002124100000000 ]  - [   0.0011302700000000,  0.0002784900000000, -0.0008553700000000 ]  - [   0.0005418600000000, -0.0006328400000000,  0.0006999300000000 ]  - [  -0.0008155600000000, -0.0003951800000000, -0.0005804200000000 ]  - [  -0.0025307400000000, -0.0009875400000000, -0.0000073400000000 ]  - [   0.0105052500000000, -0.0096388900000000,  0.0037749700000000 ]  - [   0.0001453400000000, -0.0000650100000000, -0.0005678600000000 ]  - [  -0.0068265000000000,  0.0012143200000000, -0.0018753100000000 ]  - [  -0.0008389800000000, -0.0004120000000000,  0.0007892200000000 ]  - [  -0.0025307400000000,  0.0009875400000000, -0.0000073400000000 ]  - [  -0.0008155600000000,  0.0003951800000000, -0.0005804200000000 ]  - [   0.0011302700000000, -0.0002784900000000, -0.0008553700000000 ]  - [   0.0005418600000000,  0.0006328400000000,  0.0006999300000000 ]  - [  -0.0007100700000000,  0.0000000000000000,  0.0051008400000000 ]  - [  -0.0001461700000000,  0.0000000000000000,  0.0037372200000000 ]  - [  -0.0004032200000000,  0.0003869200000000, -0.0035782100000000 ]  - [  -0.0004032200000000, -0.0003869200000000, -0.0035782100000000 ]  - [  -0.0968074300000000,  0.0000000000000000, -0.0506229200000000 ]  - [  -0.0014596900000000,  0.0000000000000000, -0.0009549700000000 ]  - [   0.0048796000000000,  0.0032906900000000,  0.0020847200000000 ]  - [   0.0048796000000000, -0.0032906900000000,  0.0020847200000000 ]  - [   0.0003426700000000, -0.0006441600000000, -0.0006513900000000 ]  - [   0.0003426700000000,  0.0006441600000000, -0.0006513900000000 ]  - [   0.0007745500000000,  0.0000000000000000,  0.0011019000000000 ]  - [  -0.0008519400000000,  0.0000000000000000,  0.0009383100000000 ]  - [  -0.0068265000000000, -0.0012143200000000, -0.0018753100000000 ]  - [  -0.0008389800000000,  0.0004120000000000,  0.0007892200000000 ]  - [   0.0105052500000000,  0.0096388900000000,  0.0037749700000000 ]  - [   0.0001453400000000,  0.0000650100000000, -0.0005678600000000 ]  - [   0.0001353700000000, -0.0008520800000000,  0.0006237700000000 ]  - [   0.0002723400000000,  0.0022009600000000, -0.0013565000000000 ]  - [   0.0038860600000000,  0.0008030800000000, -0.0001869900000000 ]  - [   0.0001776300000000, -0.0001485000000000, -0.0005153300000000 ]  - [   0.0003084700000000, -0.0000094700000000, -0.0002124100000000 ]  - [   0.0012138600000000, -0.0011538900000000,  0.0002484500000000 ]  - [   0.0005915000000000, -0.0002178600000000,  0.0004202000000000 ]  - [   0.0016342300000000,  0.0003349600000000,  0.0002458500000000 ]  - [   0.0038860600000000, -0.0008030800000000, -0.0001869900000000 ]  - [   0.0001776300000000,  0.0001485000000000, -0.0005153300000000 ]  - [   0.0002723400000000, -0.0022009600000000, -0.0013565000000000 ]  - [   0.0001353700000000,  0.0008520800000000,  0.0006237700000000 ]  - [   0.0011701000000000, -0.0026651000000000,  0.0029475500000000 ]  - [   0.0011701000000000,  0.0026651000000000,  0.0029475500000000 ]  - [   0.0035207500000000,  0.0000000000000000, -0.0052214800000000 ]  - [   0.0001587900000000,  0.0000000000000000, -0.0037404000000000 ]  - [  -0.0001353100000000, -0.0001784200000000, -0.0007404500000000 ]  - [  -0.0001353100000000,  0.0001784200000000, -0.0007404500000000 ]  - [   0.0023343100000000,  0.0000000000000000,  0.0008585700000000 ]  - [   0.0009616100000000,  0.0000000000000000,  0.0009084900000000 ]  - [   0.0110400100000000,  0.0000000000000000, -0.0028936500000000 ]  - [   0.0013216600000000,  0.0000000000000000, -0.0009675900000000 ]  - [  -0.0038678200000000,  0.0010450800000000,  0.0012223200000000 ]  - [  -0.0038678200000000, -0.0010450800000000,  0.0012223200000000 ]  - [   0.0089599200000000, -0.0033747000000000, -0.0004358500000000 ]  - [   0.0004493100000000, -0.0009052000000000,  0.0001554100000000 ]  - [  -0.0020299400000000, -0.0009753400000000, -0.0013496000000000 ]  - [  -0.0003011800000000,  0.0002860900000000, -0.0001082600000000 ]  - [   0.0085763500000000,  0.0000000000000000, -0.0156017800000000 ]  - [   0.0002972600000000,  0.0000000000000000, -0.0000177500000000 ]  - [   0.0023202400000000,  0.0017926300000000, -0.0002286500000000 ]  - [   0.0023202400000000, -0.0017926300000000, -0.0002286500000000 ]  - [  -0.0020299400000000,  0.0009753400000000, -0.0013496000000000 ]  - [  -0.0003011800000000, -0.0002860900000000, -0.0001082600000000 ]  - [   0.0089599200000000,  0.0033747000000000, -0.0004358500000000 ]  - [   0.0004493100000000,  0.0009052000000000,  0.0001554100000000 ]  - [  -0.0014555500000000, -0.0004218500000000,  0.0006001600000000 ]  - [  -0.0014555500000000,  0.0004218500000000,  0.0006001600000000 ]  - [  -0.0031827600000000,  0.0000000000000000, -0.0015546400000000 ]  - [  -0.0002784100000000,  0.0000000000000000, -0.0000540200000000 ]  - [   0.0019412600000000,  0.0016870200000000, -0.0002483100000000 ]  - [   0.0004577300000000, -0.0004853100000000, -0.0003005000000000 ]  - [   0.0019412600000000, -0.0016870200000000, -0.0002483100000000 ]  - [   0.0004577300000000,  0.0004853100000000, -0.0003005000000000 ]  - [  -0.0030995300000000, -0.0004955900000000, -0.0016152100000000 ]  - [  -0.0030995300000000,  0.0004955900000000, -0.0016152100000000 ]  - [   0.0037891700000000,  0.0014553300000000, -0.0000894700000000 ]  - [   0.0037891700000000, -0.0014553300000000, -0.0000894700000000 ]  - [  -0.0098448200000000,  0.0042202400000000,  0.0055165200000000 ]  - [  -0.0004932100000000, -0.0016071800000000,  0.0006945000000000 ]  - [  -0.0098448200000000, -0.0042202400000000,  0.0055165200000000 ]  - [  -0.0004932100000000,  0.0016071800000000,  0.0006945000000000 ]  - [   0.0579765800000000,  0.0000000000000000,  0.0560230800000000 ]  - [   0.0007397400000000,  0.0000000000000000,  0.0000146200000000 ]  - [  -0.0078694800000000,  0.0000000000000000,  0.0038828000000000 ]  - [  -0.0008152700000000,  0.0000000000000000,  0.0000230400000000 ]- atom:   21  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0024616500000000,  0.0012663300000000,  0.0010486700000000 ]  - [  -0.0014204900000000,  0.0007046100000000,  0.0008762700000000 ]  - [  -0.0003860500000000, -0.0002236600000000, -0.0015325400000000 ]  - [   0.0005189900000000,  0.0009158800000000, -0.0010766200000000 ]  - [  -0.0003179100000000, -0.0011983000000000,  0.0021352800000000 ]  - [   0.0002860000000000, -0.0002930000000000,  0.0005925400000000 ]  - [  -0.0000164300000000, -0.0005341800000000, -0.0007139000000000 ]  - [   0.0016925500000000,  0.0000686800000000, -0.0012706600000000 ]  - [  -0.0097724500000000,  0.0088485300000000, -0.0051456800000000 ]  - [   0.0006893400000000, -0.0008628600000000, -0.0007274700000000 ]  - [   0.0059388800000000, -0.0022024700000000,  0.0032948300000000 ]  - [   0.0000078900000000, -0.0005138000000000,  0.0005046300000000 ]  - [   0.0016925500000000, -0.0000686800000000, -0.0012706600000000 ]  - [  -0.0000164300000000,  0.0005341800000000, -0.0007139000000000 ]  - [  -0.0003179100000000,  0.0011983000000000,  0.0021352800000000 ]  - [   0.0002860000000000,  0.0002930000000000,  0.0005925400000000 ]  - [   0.0006952900000000,  0.0000000000000000,  0.0022360800000000 ]  - [   0.0001446400000000,  0.0000000000000000,  0.0035695400000000 ]  - [   0.0003905600000000, -0.0004057700000000, -0.0037241600000000 ]  - [   0.0003905600000000,  0.0004057700000000, -0.0037241600000000 ]  - [   0.0947236000000000,  0.0000000000000000,  0.0509217200000000 ]  - [  -0.0006688000000000,  0.0000000000000000, -0.0006738100000000 ]  - [  -0.0027319500000000, -0.0032738500000000, -0.0004504900000000 ]  - [  -0.0027319500000000,  0.0032738500000000, -0.0004504900000000 ]  - [   0.0017898600000000,  0.0006425500000000, -0.0009727200000000 ]  - [   0.0017898600000000, -0.0006425500000000, -0.0009727200000000 ]  - [  -0.0028981000000000,  0.0000000000000000,  0.0005243900000000 ]  - [  -0.0012763400000000,  0.0000000000000000,  0.0006885200000000 ]  - [   0.0059388800000000,  0.0022024700000000,  0.0032948300000000 ]  - [   0.0000078900000000,  0.0005138000000000,  0.0005046300000000 ]  - [  -0.0097724500000000, -0.0088485300000000, -0.0051456800000000 ]  - [   0.0006893400000000,  0.0008628600000000, -0.0007274700000000 ]  - [   0.0006992800000000, -0.0000752700000000,  0.0006728100000000 ]  - [   0.0005745400000000, -0.0031293500000000,  0.0026567700000000 ]  - [  -0.0047140400000000, -0.0017232700000000, -0.0011132800000000 ]  - [  -0.0010099000000000, -0.0007812200000000, -0.0007802400000000 ]  - [   0.0005189900000000, -0.0009158800000000, -0.0010766200000000 ]  - [  -0.0003860500000000,  0.0002236600000000, -0.0015325400000000 ]  - [  -0.0014204900000000, -0.0007046100000000,  0.0008762700000000 ]  - [  -0.0024616500000000, -0.0012663300000000,  0.0010486700000000 ]  - [  -0.0047140400000000,  0.0017232700000000, -0.0011132800000000 ]  - [  -0.0010099000000000,  0.0007812200000000, -0.0007802400000000 ]  - [   0.0005745400000000,  0.0031293500000000,  0.0026567700000000 ]  - [   0.0006992800000000,  0.0000752700000000,  0.0006728100000000 ]  - [  -0.0011679800000000,  0.0026740900000000,  0.0043604800000000 ]  - [  -0.0011679800000000, -0.0026740900000000,  0.0043604800000000 ]  - [  -0.0035384500000000,  0.0000000000000000, -0.0020741000000000 ]  - [  -0.0001570900000000,  0.0000000000000000, -0.0035652100000000 ]  - [  -0.0019916000000000,  0.0001801400000000, -0.0008877900000000 ]  - [  -0.0019916000000000, -0.0001801400000000, -0.0008877900000000 ]  - [  -0.0001746500000000,  0.0000000000000000,  0.0007480200000000 ]  - [   0.0011682700000000,  0.0000000000000000,  0.0007198700000000 ]  - [  -0.0088150900000000,  0.0000000000000000,  0.0012596200000000 ]  - [   0.0008051100000000,  0.0000000000000000, -0.0006611000000000 ]  - [   0.0017269400000000, -0.0010537600000000,  0.0004048900000000 ]  - [   0.0017269400000000,  0.0010537600000000,  0.0004048900000000 ]  - [  -0.0086362200000000,  0.0029431500000000,  0.0005082200000000 ]  - [  -0.0004446900000000,  0.0009006500000000, -0.0001546200000000 ]  - [   0.0020222000000000,  0.0009747300000000,  0.0013518300000000 ]  - [   0.0002990200000000, -0.0002868600000000,  0.0001081800000000 ]  - [  -0.0084751400000000,  0.0000000000000000,  0.0158150500000000 ]  - [  -0.0002980300000000,  0.0000000000000000,  0.0000175600000000 ]  - [  -0.0023354200000000, -0.0017777000000000,  0.0002307900000000 ]  - [  -0.0023354200000000,  0.0017777000000000,  0.0002307900000000 ]  - [   0.0020222000000000, -0.0009747300000000,  0.0013518300000000 ]  - [   0.0002990200000000,  0.0002868600000000,  0.0001081800000000 ]  - [  -0.0086362200000000, -0.0029431500000000,  0.0005082200000000 ]  - [  -0.0004446900000000, -0.0009006500000000, -0.0001546200000000 ]  - [   0.0014555300000000,  0.0004161400000000, -0.0005945900000000 ]  - [   0.0014555300000000, -0.0004161400000000, -0.0005945900000000 ]  - [   0.0031741000000000,  0.0000000000000000,  0.0015380600000000 ]  - [   0.0002793900000000,  0.0000000000000000,  0.0000536800000000 ]  - [  -0.0018540700000000, -0.0016879500000000,  0.0001993800000000 ]  - [  -0.0004539100000000,  0.0004953700000000,  0.0002950500000000 ]  - [  -0.0018540700000000,  0.0016879500000000,  0.0001993800000000 ]  - [  -0.0004539100000000, -0.0004953700000000,  0.0002950500000000 ]  - [   0.0030971700000000,  0.0004881700000000,  0.0016047300000000 ]  - [   0.0030971700000000, -0.0004881700000000,  0.0016047300000000 ]  - [  -0.0038006500000000, -0.0014387100000000,  0.0000896600000000 ]  - [  -0.0038006500000000,  0.0014387100000000,  0.0000896600000000 ]  - [   0.0098447300000000, -0.0042439100000000, -0.0055300700000000 ]  - [   0.0004872900000000,  0.0016098700000000, -0.0006929300000000 ]  - [   0.0098447300000000,  0.0042439100000000, -0.0055300700000000 ]  - [   0.0004872900000000, -0.0016098700000000, -0.0006929300000000 ]  - [  -0.0586359000000000,  0.0000000000000000, -0.0583740200000000 ]  - [  -0.0007425600000000,  0.0000000000000000, -0.0000132000000000 ]  - [   0.0078593700000000,  0.0000000000000000, -0.0038444000000000 ]  - [   0.0008196800000000,  0.0000000000000000, -0.0000207400000000 ]- atom:   21  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0003565600000000, -0.0004884200000000,  0.0006328300000000 ]  - [  -0.0009046500000000,  0.0015941100000000,  0.0005519400000000 ]  - [   0.0011002400000000, -0.0002491900000000,  0.0003612500000000 ]  - [   0.0005010700000000,  0.0016040600000000, -0.0009975900000000 ]  - [   0.0024383500000000, -0.0024025300000000,  0.0002169200000000 ]  - [  -0.0001523100000000,  0.0009247800000000,  0.0004543800000000 ]  - [   0.0000657900000000,  0.0011535500000000, -0.0000237900000000 ]  - [  -0.0003694200000000, -0.0002746200000000, -0.0013880600000000 ]  - [  -0.0083910700000000,  0.0011071300000000, -0.0041291900000000 ]  - [   0.0003015200000000,  0.0009194900000000, -0.0004958400000000 ]  - [   0.0039673200000000,  0.0029299700000000, -0.0144843500000000 ]  - [  -0.0000704500000000,  0.0011049700000000,  0.0004911300000000 ]  - [  -0.0004750000000000,  0.0006501300000000,  0.0001037600000000 ]  - [  -0.0008979500000000,  0.0020812300000000, -0.0012641100000000 ]  - [  -0.0016088800000000, -0.0014698300000000,  0.0010699500000000 ]  - [   0.0009841600000000,  0.0018529700000000,  0.0008367400000000 ]  - [  -0.0000036100000000, -0.0057012600000000,  0.0036595300000000 ]  - [  -0.0000001600000000,  0.0023059900000000,  0.0036556300000000 ]  - [   0.0008841900000000,  0.0023957400000000, -0.0038487800000000 ]  - [  -0.0008898100000000,  0.0024030500000000, -0.0034576600000000 ]  - [  -0.0017392700000000, -0.0659731500000000, -0.0010013700000000 ]  - [  -0.0010666200000000,  0.0014635200000000, -0.0008163900000000 ]  - [   0.0043598000000000,  0.0034030900000000,  0.0020695000000000 ]  - [  -0.0022054400000000,  0.0033754100000000, -0.0004333700000000 ]  - [   0.0004215800000000,  0.0007054500000000, -0.0009799400000000 ]  - [   0.0017072100000000,  0.0007104300000000, -0.0006470700000000 ]  - [  -0.0010617100000000, -0.0016778200000000,  0.0008154700000000 ]  - [  -0.0010647900000000,  0.0010347500000000,  0.0008156200000000 ]  - [  -0.0047908500000000,  0.0038837400000000,  0.0157020300000000 ]  - [  -0.0007632600000000,  0.0020323100000000,  0.0008010600000000 ]  - [   0.0091882400000000,  0.0020523100000000,  0.0028044500000000 ]  - [   0.0005295800000000,  0.0018456700000000, -0.0007966300000000 ]  - [  -0.0003813800000000,  0.0010423200000000,  0.0005270100000000 ]  - [   0.0027175600000000, -0.0004321200000000, -0.0007544600000000 ]  - [  -0.0019541100000000, -0.0019959600000000, -0.0007739400000000 ]  - [  -0.0001046200000000,  0.0006994100000000, -0.0004531100000000 ]  - [   0.0003308000000000,  0.0006768000000000, -0.0002904900000000 ]  - [  -0.0002653900000000, -0.0011794200000000, -0.0016410100000000 ]  - [   0.0000766300000000,  0.0006671100000000,  0.0007405100000000 ]  - [  -0.0004667700000000, -0.0014126500000000,  0.0006559600000000 ]  - [   0.0011344600000000, -0.0010688000000000, -0.0005177000000000 ]  - [  -0.0007247500000000,  0.0016263600000000, -0.0008389200000000 ]  - [  -0.0018996600000000,  0.0004870500000000,  0.0020488200000000 ]  - [   0.0012102300000000,  0.0019711400000000,  0.0007658900000000 ]  - [  -0.0006022800000000,  0.0014550600000000,  0.0037710300000000 ]  - [   0.0006075800000000,  0.0014681500000000,  0.0035355800000000 ]  - [   0.0000087200000000, -0.0040220500000000, -0.0036582600000000 ]  - [   0.0000004100000000,  0.0020673900000000, -0.0036551700000000 ]  - [  -0.0008833000000000,  0.0002416400000000, -0.0009280600000000 ]  - [  -0.0012428600000000,  0.0002431900000000, -0.0007027400000000 ]  - [   0.0010794200000000, -0.0026576000000000,  0.0008115300000000 ]  - [   0.0010654500000000,  0.0011147300000000,  0.0008161900000000 ]  - [   0.0010674200000000, -0.0048033600000000, -0.0008250300000000 ]  - [   0.0010665400000000,  0.0014054200000000, -0.0008161500000000 ]  - [  -0.0021211400000000,  0.0037526900000000,  0.0020237600000000 ]  - [  -0.0000230600000000,  0.0037250700000000, -0.0003833200000000 ]  - [  -0.0048100400000000,  0.0119032800000000,  0.0000061000000000 ]  - [  -0.0002880900000000, -0.0024607200000000,  0.0003327700000000 ]  - [  -0.0009057400000000,  0.0011804600000000, -0.0004533100000000 ]  - [   0.0002245300000000, -0.0012620600000000, -0.0002286700000000 ]  - [   0.0000256900000000,  0.0049999900000000, -0.0000579000000000 ]  - [   0.0000010300000000, -0.0019424000000000, -0.0000004100000000 ]  - [   0.0010037500000000, -0.0032886900000000,  0.0013794500000000 ]  - [  -0.0009938200000000, -0.0032957600000000, -0.0013628100000000 ]  - [   0.0008943100000000,  0.0011891600000000,  0.0004455100000000 ]  - [  -0.0002252100000000, -0.0012636400000000,  0.0002278200000000 ]  - [   0.0053317700000000,  0.0123471300000000,  0.0000922500000000 ]  - [   0.0002880700000000, -0.0024516000000000, -0.0003314100000000 ]  - [  -0.0006960500000000, -0.0005947100000000,  0.0006540000000000 ]  - [   0.0006890600000000, -0.0005944300000000, -0.0006482900000000 ]  - [  -0.0000068100000000,  0.0024265700000000, -0.0000024500000000 ]  - [  -0.0000007300000000, -0.0016500700000000, -0.0000002900000000 ]  - [   0.0058318000000000,  0.0031693700000000, -0.0027640300000000 ]  - [  -0.0003422900000000, -0.0036644100000000, -0.0001292600000000 ]  - [  -0.0057878500000000,  0.0031771200000000,  0.0027157900000000 ]  - [   0.0003431000000000, -0.0036681700000000,  0.0001247000000000 ]  - [  -0.0015542000000000, -0.0007555500000000, -0.0017274700000000 ]  - [   0.0015377600000000, -0.0007536500000000,  0.0017162700000000 ]  - [   0.0020240000000000, -0.0037603000000000, -0.0024720500000000 ]  - [  -0.0020033700000000, -0.0037637400000000,  0.0024491000000000 ]  - [   0.0053181000000000,  0.0020601800000000, -0.0025616100000000 ]  - [  -0.0003288900000000, -0.0029694700000000, -0.0003883500000000 ]  - [  -0.0053527800000000,  0.0020362900000000,  0.0025904000000000 ]  - [   0.0003278700000000, -0.0029615900000000,  0.0003938700000000 ]  - [   0.0001288400000000,  0.0264703300000000,  0.0002588600000000 ]  - [   0.0000019600000000, -0.0035418200000000,  0.0000010400000000 ]  - [  -0.0000073900000000,  0.0063984300000000,  0.0000033700000000 ]  - [  -0.0000015200000000, -0.0030840900000000,  0.0000010300000000 ]- atom:   21  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0006194100000000,  0.0006089400000000,  0.0005667000000000 ]  - [  -0.0001209100000000,  0.0002340100000000,  0.0005201600000000 ]  - [   0.0009203200000000,  0.0008893100000000,  0.0000557300000000 ]  - [   0.0001434400000000,  0.0003059800000000, -0.0001222400000000 ]  - [  -0.0013122800000000,  0.0000103800000000,  0.0001740200000000 ]  - [   0.0001410300000000, -0.0001325400000000,  0.0005304500000000 ]  - [  -0.0001528900000000, -0.0000539100000000, -0.0002480800000000 ]  - [   0.0015505600000000, -0.0036939100000000,  0.0048901100000000 ]  - [   0.0074213900000000, -0.0043642200000000, -0.0028556800000000 ]  - [   0.0004843400000000, -0.0001922400000000, -0.0007822600000000 ]  - [  -0.0078289600000000, -0.0132053400000000,  0.0199660000000000 ]  - [  -0.0003405800000000, -0.0001211000000000,  0.0006414300000000 ]  - [   0.0015505600000000,  0.0036939100000000,  0.0048901100000000 ]  - [  -0.0001528900000000,  0.0000539100000000, -0.0002480800000000 ]  - [  -0.0013122800000000, -0.0000103800000000,  0.0001740200000000 ]  - [   0.0001410300000000,  0.0001325400000000,  0.0005304500000000 ]  - [   0.0009628600000000,  0.0000000000000000,  0.0090484300000000 ]  - [   0.0000220100000000,  0.0000000000000000,  0.0038299300000000 ]  - [  -0.0010297000000000, -0.0025687500000000, -0.0023937200000000 ]  - [  -0.0010297000000000,  0.0025687500000000, -0.0023937200000000 ]  - [  -0.0491205900000000,  0.0000000000000000, -0.2062883700000000 ]  - [  -0.0012027500000000,  0.0000000000000000, -0.0010729900000000 ]  - [   0.0023155100000000,  0.0012340400000000,  0.0014423500000000 ]  - [   0.0023155100000000, -0.0012340400000000,  0.0014423500000000 ]  - [   0.0008987100000000,  0.0001690700000000,  0.0003964500000000 ]  - [   0.0008987100000000, -0.0001690700000000,  0.0003964500000000 ]  - [  -0.0013533300000000,  0.0000000000000000,  0.0015727900000000 ]  - [  -0.0011879600000000,  0.0000000000000000,  0.0009908900000000 ]  - [  -0.0078289600000000,  0.0132053400000000,  0.0199660000000000 ]  - [  -0.0003405800000000,  0.0001211000000000,  0.0006414300000000 ]  - [   0.0074213900000000,  0.0043642200000000, -0.0028556800000000 ]  - [   0.0004843400000000,  0.0001922400000000, -0.0007822600000000 ]  - [   0.0001765100000000, -0.0000348500000000,  0.0005472800000000 ]  - [  -0.0019542500000000, -0.0032585700000000, -0.0002625600000000 ]  - [   0.0010078600000000,  0.0002058000000000, -0.0009287300000000 ]  - [  -0.0003113900000000, -0.0003540900000000, -0.0006805700000000 ]  - [   0.0001434400000000, -0.0003059800000000, -0.0001222400000000 ]  - [   0.0009203200000000, -0.0008893100000000,  0.0000557300000000 ]  - [  -0.0001209100000000, -0.0002340100000000,  0.0005201600000000 ]  - [  -0.0006194100000000, -0.0006089400000000,  0.0005667000000000 ]  - [   0.0010078600000000, -0.0002058000000000, -0.0009287300000000 ]  - [  -0.0003113900000000,  0.0003540900000000, -0.0006805700000000 ]  - [  -0.0019542500000000,  0.0032585700000000, -0.0002625600000000 ]  - [   0.0001765100000000,  0.0000348500000000,  0.0005472800000000 ]  - [   0.0003607500000000, -0.0011014500000000,  0.0026064000000000 ]  - [   0.0003607500000000,  0.0011014500000000,  0.0026064000000000 ]  - [  -0.0015645800000000,  0.0000000000000000, -0.0056823800000000 ]  - [  -0.0000126900000000,  0.0000000000000000, -0.0038193700000000 ]  - [  -0.0009901300000000,  0.0001145400000000, -0.0005474100000000 ]  - [  -0.0009901300000000, -0.0001145400000000, -0.0005474100000000 ]  - [   0.0011111900000000,  0.0000000000000000,  0.0150872200000000 ]  - [   0.0011575800000000,  0.0000000000000000,  0.0010072100000000 ]  - [   0.0031124600000000,  0.0000000000000000, -0.0037291700000000 ]  - [   0.0012162400000000,  0.0000000000000000, -0.0010889800000000 ]  - [  -0.0014662500000000,  0.0011937100000000,  0.0000839400000000 ]  - [  -0.0014662500000000, -0.0011937100000000,  0.0000839400000000 ]  - [  -0.0007847600000000,  0.0013590900000000,  0.0041922300000000 ]  - [  -0.0000040800000000, -0.0005093100000000,  0.0002822600000000 ]  - [   0.0003137300000000,  0.0003225600000000, -0.0017259400000000 ]  - [  -0.0000001500000000, -0.0001247800000000, -0.0002025200000000 ]  - [  -0.0132710500000000,  0.0000000000000000,  0.0309312100000000 ]  - [  -0.0000017000000000,  0.0000000000000000, -0.0000538800000000 ]  - [  -0.0004126500000000,  0.0024361100000000,  0.0007515400000000 ]  - [  -0.0004126500000000, -0.0024361100000000,  0.0007515400000000 ]  - [   0.0003137300000000, -0.0003225600000000, -0.0017259400000000 ]  - [  -0.0000001500000000,  0.0001247800000000, -0.0002025200000000 ]  - [  -0.0007847600000000, -0.0013590900000000,  0.0041922300000000 ]  - [  -0.0000040800000000,  0.0005093100000000,  0.0002822600000000 ]  - [  -0.0000581500000000,  0.0000870900000000,  0.0003967500000000 ]  - [  -0.0000581500000000, -0.0000870900000000,  0.0003967500000000 ]  - [  -0.0008446000000000,  0.0000000000000000, -0.0006502500000000 ]  - [   0.0000111000000000,  0.0000000000000000, -0.0000602600000000 ]  - [   0.0063129400000000,  0.0002908600000000, -0.0108390000000000 ]  - [  -0.0002291500000000,  0.0011004300000000, -0.0011353300000000 ]  - [   0.0063129400000000, -0.0002908600000000, -0.0108390000000000 ]  - [  -0.0002291500000000, -0.0011004300000000, -0.0011353300000000 ]  - [  -0.0004665700000000, -0.0008643300000000, -0.0008370200000000 ]  - [  -0.0004665700000000,  0.0008643300000000, -0.0008370200000000 ]  - [   0.0002990900000000, -0.0031926300000000, -0.0011156300000000 ]  - [   0.0002990900000000,  0.0031926300000000, -0.0011156300000000 ]  - [  -0.0011193100000000, -0.0003852100000000,  0.0070611000000000 ]  - [   0.0000964400000000, -0.0003874200000000,  0.0008250100000000 ]  - [  -0.0011193100000000,  0.0003852100000000,  0.0070611000000000 ]  - [   0.0000964400000000,  0.0003874200000000,  0.0008250100000000 ]  - [   0.0542691700000000,  0.0000000000000000,  0.1157169700000000 ]  - [  -0.0000585200000000,  0.0000000000000000,  0.0001294300000000 ]  - [   0.0001256200000000,  0.0000000000000000,  0.0014676100000000 ]  - [   0.0001474400000000,  0.0000000000000000,  0.0001575700000000 ]- atom:   21  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0002153000000000,  0.0003199100000000,  0.0007224200000000 ]  - [  -0.0007146100000000,  0.0006961400000000,  0.0007727600000000 ]  - [  -0.0000772000000000,  0.0000450300000000, -0.0013617700000000 ]  - [   0.0006938500000000,  0.0006223100000000, -0.0011791200000000 ]  - [   0.0021636000000000, -0.0009464200000000,  0.0011449800000000 ]  - [   0.0006954200000000, -0.0007993900000000,  0.0007669800000000 ]  - [  -0.0006800200000000, -0.0008686500000000, -0.0010518300000000 ]  - [  -0.0023803100000000,  0.0027241500000000, -0.0062021600000000 ]  - [  -0.0066005900000000,  0.0034644400000000,  0.0016611800000000 ]  - [   0.0003458800000000, -0.0007356600000000, -0.0005093300000000 ]  - [   0.0071207900000000,  0.0125837200000000, -0.0189233200000000 ]  - [  -0.0004943000000000, -0.0008092600000000,  0.0006561300000000 ]  - [  -0.0023803100000000, -0.0027241500000000, -0.0062021600000000 ]  - [  -0.0006800200000000,  0.0008686500000000, -0.0010518300000000 ]  - [   0.0021636000000000,  0.0009464200000000,  0.0011449800000000 ]  - [   0.0006954200000000,  0.0007993900000000,  0.0007669800000000 ]  - [  -0.0009289200000000,  0.0000000000000000, -0.0017226000000000 ]  - [  -0.0000210500000000,  0.0000000000000000,  0.0034764600000000 ]  - [   0.0010452000000000,  0.0026060100000000, -0.0049112900000000 ]  - [   0.0010452000000000, -0.0026060100000000, -0.0049112900000000 ]  - [   0.0524768300000000,  0.0000000000000000,  0.2102474100000000 ]  - [  -0.0009236900000000,  0.0000000000000000, -0.0005524600000000 ]  - [  -0.0002185300000000, -0.0012675900000000,  0.0001776200000000 ]  - [  -0.0002185300000000,  0.0012675900000000,  0.0001776200000000 ]  - [   0.0012220300000000, -0.0001630000000000, -0.0020187300000000 ]  - [   0.0012220300000000,  0.0001630000000000, -0.0020187300000000 ]  - [  -0.0007765200000000,  0.0000000000000000,  0.0000556000000000 ]  - [  -0.0009392800000000,  0.0000000000000000,  0.0006361900000000 ]  - [   0.0071207900000000, -0.0125837200000000, -0.0189233200000000 ]  - [  -0.0004943000000000,  0.0008092600000000,  0.0006561300000000 ]  - [  -0.0066005900000000, -0.0034644400000000,  0.0016611800000000 ]  - [   0.0003458800000000,  0.0007356600000000, -0.0005093300000000 ]  - [   0.0006553400000000, -0.0008918100000000,  0.0007446100000000 ]  - [   0.0027790500000000,  0.0023178500000000,  0.0015285300000000 ]  - [  -0.0018372400000000, -0.0011356700000000, -0.0003610300000000 ]  - [  -0.0005200600000000, -0.0005721800000000, -0.0006113200000000 ]  - [   0.0006938500000000, -0.0006223100000000, -0.0011791200000000 ]  - [  -0.0000772000000000, -0.0000450300000000, -0.0013617700000000 ]  - [  -0.0007146100000000, -0.0006961400000000,  0.0007727600000000 ]  - [  -0.0002153000000000, -0.0003199100000000,  0.0007224200000000 ]  - [  -0.0018372400000000,  0.0011356700000000, -0.0003610300000000 ]  - [  -0.0005200600000000,  0.0005721800000000, -0.0006113200000000 ]  - [   0.0027790500000000, -0.0023178500000000,  0.0015285300000000 ]  - [   0.0006553400000000,  0.0008918100000000,  0.0007446100000000 ]  - [  -0.0003615900000000,  0.0010992300000000,  0.0046971900000000 ]  - [  -0.0003615900000000, -0.0010992300000000,  0.0046971900000000 ]  - [   0.0015670800000000,  0.0000000000000000, -0.0016461300000000 ]  - [   0.0000121100000000,  0.0000000000000000, -0.0034851300000000 ]  - [  -0.0011396300000000, -0.0001126400000000, -0.0010814100000000 ]  - [  -0.0011396300000000,  0.0001126400000000, -0.0010814100000000 ]  - [   0.0010015700000000,  0.0000000000000000, -0.0133095800000000 ]  - [   0.0009701900000000,  0.0000000000000000,  0.0006213900000000 ]  - [  -0.0010397500000000,  0.0000000000000000,  0.0021042900000000 ]  - [   0.0009108800000000,  0.0000000000000000, -0.0005351100000000 ]  - [  -0.0006501300000000, -0.0012149100000000,  0.0015277800000000 ]  - [  -0.0006501300000000,  0.0012149100000000,  0.0015277800000000 ]  - [   0.0007649000000000, -0.0013546200000000, -0.0041810300000000 ]  - [   0.0000023900000000,  0.0005157200000000, -0.0002841900000000 ]  - [  -0.0002950300000000, -0.0003071300000000,  0.0017131100000000 ]  - [   0.0000025800000000,  0.0001238700000000,  0.0002032700000000 ]  - [   0.0124159200000000,  0.0000000000000000, -0.0292151300000000 ]  - [   0.0000030400000000,  0.0000000000000000,  0.0000563100000000 ]  - [   0.0004202900000000, -0.0024299500000000, -0.0007742300000000 ]  - [   0.0004202900000000,  0.0024299500000000, -0.0007742300000000 ]  - [  -0.0002950300000000,  0.0003071300000000,  0.0017131100000000 ]  - [   0.0000025800000000, -0.0001238700000000,  0.0002032700000000 ]  - [   0.0007649000000000,  0.0013546200000000, -0.0041810300000000 ]  - [   0.0000023900000000, -0.0005157200000000, -0.0002841900000000 ]  - [   0.0000572200000000, -0.0000846600000000, -0.0004063400000000 ]  - [   0.0000572200000000,  0.0000846600000000, -0.0004063400000000 ]  - [   0.0008397900000000,  0.0000000000000000,  0.0006686000000000 ]  - [  -0.0000117200000000,  0.0000000000000000,  0.0000628600000000 ]  - [  -0.0063834000000000, -0.0002719900000000,  0.0108486700000000 ]  - [   0.0002274900000000, -0.0011148100000000,  0.0011416500000000 ]  - [  -0.0063834000000000,  0.0002719900000000,  0.0108486700000000 ]  - [   0.0002274900000000,  0.0011148100000000,  0.0011416500000000 ]  - [   0.0004693900000000,  0.0008629300000000,  0.0008619400000000 ]  - [   0.0004693900000000, -0.0008629300000000,  0.0008619400000000 ]  - [  -0.0002893900000000,  0.0031678900000000,  0.0011502200000000 ]  - [  -0.0002893900000000, -0.0031678900000000,  0.0011502200000000 ]  - [   0.0010948400000000,  0.0004072000000000, -0.0070274800000000 ]  - [  -0.0000932200000000,  0.0003824100000000, -0.0008259000000000 ]  - [   0.0010948400000000, -0.0004072000000000, -0.0070274800000000 ]  - [  -0.0000932200000000, -0.0003824100000000, -0.0008259000000000 ]  - [  -0.0589676000000000,  0.0000000000000000, -0.1228706100000000 ]  - [   0.0000616800000000,  0.0000000000000000, -0.0001323800000000 ]  - [  -0.0001185900000000,  0.0000000000000000, -0.0015159700000000 ]  - [  -0.0001513600000000,  0.0000000000000000, -0.0001610700000000 ]- atom:   57  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0014502400000000, -0.0004005100000000,  0.0005832500000000 ]  - [  -0.0035179800000000,  0.0027320300000000,  0.0009572500000000 ]  - [   0.0012219200000000, -0.0003398300000000, -0.0007206900000000 ]  - [   0.0030934200000000,  0.0034165700000000, -0.0033021300000000 ]  - [   0.0030934200000000, -0.0034165700000000,  0.0033021300000000 ]  - [   0.0012219200000000,  0.0003398300000000,  0.0007206900000000 ]  - [  -0.0001120600000000, -0.0003051900000000, -0.0005066500000000 ]  - [   0.0048144800000000, -0.0003947800000000,  0.0038960600000000 ]  - [  -0.0026938900000000,  0.0018111400000000, -0.0003400400000000 ]  - [  -0.0006176300000000, -0.0013134600000000, -0.0007134600000000 ]  - [   0.0022524900000000,  0.0024964300000000, -0.0020005200000000 ]  - [   0.0003798800000000, -0.0012610700000000,  0.0005784800000000 ]  - [   0.0003798800000000,  0.0012610700000000, -0.0005784800000000 ]  - [   0.0022524900000000, -0.0024964300000000,  0.0020005200000000 ]  - [   0.0057449600000000,  0.0005564800000000,  0.0051267300000000 ]  - [   0.0007244300000000,  0.0006149100000000,  0.0007906500000000 ]  - [   0.0042811100000000,  0.0000063100000000,  0.0036643900000000 ]  - [   0.0008910800000000, -0.0000012800000000,  0.0036566300000000 ]  - [   0.0008910800000000,  0.0000012800000000, -0.0036566300000000 ]  - [   0.0042811100000000, -0.0000063100000000, -0.0036643900000000 ]  - [   0.0075491300000000, -0.0048414300000000, -0.0016344800000000 ]  - [  -0.0006208700000000, -0.0002888800000000, -0.0008233200000000 ]  - [   0.0015146200000000, -0.0002875800000000,  0.0008164800000000 ]  - [   0.0100478000000000, -0.0053004500000000,  0.0000866800000000 ]  - [   0.0007660700000000,  0.0002244200000000, -0.0008182700000000 ]  - [  -0.0009650700000000, -0.0008989100000000, -0.0011207100000000 ]  - [  -0.0030865700000000, -0.0009011600000000,  0.0005122100000000 ]  - [  -0.0013660500000000,  0.0002251700000000,  0.0008214100000000 ]  - [   0.0048144800000000,  0.0003947800000000, -0.0038960600000000 ]  - [  -0.0001120600000000,  0.0003051900000000,  0.0005066500000000 ]  - [  -0.0054600400000000, -0.0003732300000000, -0.0009974200000000 ]  - [   0.0001265600000000,  0.0003333500000000, -0.0005292700000000 ]  - [   0.0001265600000000, -0.0003333500000000,  0.0005292700000000 ]  - [  -0.0054600400000000,  0.0003732300000000,  0.0009974200000000 ]  - [  -0.0035179800000000, -0.0027320300000000, -0.0009572500000000 ]  - [  -0.0014502400000000,  0.0004005100000000, -0.0005832500000000 ]  - [   0.0007244300000000, -0.0006149100000000, -0.0007906500000000 ]  - [   0.0057449600000000, -0.0005564800000000, -0.0051267300000000 ]  - [  -0.0007081100000000, -0.0005866500000000,  0.0007673400000000 ]  - [  -0.0063130100000000, -0.0012774800000000,  0.0002780200000000 ]  - [  -0.0063130100000000,  0.0012774800000000, -0.0002780200000000 ]  - [  -0.0007081100000000,  0.0005866500000000, -0.0007673400000000 ]  - [  -0.0006176300000000,  0.0013134600000000,  0.0007134600000000 ]  - [  -0.0026938900000000, -0.0018111400000000,  0.0003400400000000 ]  - [  -0.0007174200000000, -0.0000005300000000,  0.0036565200000000 ]  - [  -0.0028934200000000,  0.0000082700000000,  0.0036572700000000 ]  - [  -0.0028934200000000, -0.0000082700000000, -0.0036572700000000 ]  - [  -0.0007174200000000,  0.0000005300000000, -0.0036565200000000 ]  - [  -0.0013660500000000, -0.0002251700000000, -0.0008214100000000 ]  - [  -0.0030865700000000,  0.0009011600000000, -0.0005122100000000 ]  - [  -0.0009650700000000,  0.0008989100000000,  0.0011207100000000 ]  - [   0.0007660700000000, -0.0002244200000000,  0.0008182700000000 ]  - [   0.0100478000000000,  0.0053004500000000, -0.0000866800000000 ]  - [   0.0015146200000000,  0.0002875800000000, -0.0008164800000000 ]  - [  -0.0006208700000000,  0.0002888800000000,  0.0008233200000000 ]  - [   0.0075491300000000,  0.0048414300000000,  0.0016344800000000 ]  - [  -0.0759458000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0005382000000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0042978900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0004808500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0059595300000000, -0.0064819600000000, -0.0069768100000000 ]  - [   0.0000802200000000,  0.0009213800000000, -0.0000875000000000 ]  - [   0.0000802200000000, -0.0009213800000000,  0.0000875000000000 ]  - [   0.0059595300000000,  0.0064819600000000,  0.0069768100000000 ]  - [   0.0019535700000000,  0.0000022100000000,  0.0000008400000000 ]  - [   0.0019535700000000, -0.0000022100000000, -0.0000008400000000 ]  - [  -0.0062830100000000, -0.0000280600000000, -0.0000007800000000 ]  - [  -0.0062830100000000,  0.0000280600000000,  0.0000007800000000 ]  - [   0.0000781800000000,  0.0009205800000000, -0.0000875100000000 ]  - [   0.0059701100000000, -0.0065394500000000, -0.0070406900000000 ]  - [   0.0059701100000000,  0.0065394500000000,  0.0070406900000000 ]  - [   0.0000781800000000, -0.0009205800000000,  0.0000875100000000 ]  - [  -0.0228985500000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0006719200000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0051840900000000, -0.0000100900000000, -0.0000003500000000 ]  - [  -0.0051840900000000,  0.0000100900000000,  0.0000003500000000 ]  - [   0.0000847500000000,  0.0012436900000000,  0.0001202800000000 ]  - [   0.0099012100000000, -0.0089531800000000,  0.0104814200000000 ]  - [   0.0000916400000000, -0.0012420600000000, -0.0001198700000000 ]  - [   0.0099154000000000,  0.0088772800000000, -0.0104085900000000 ]  - [   0.0048880400000000,  0.0000091400000000, -0.0000036800000000 ]  - [   0.0048880400000000, -0.0000091400000000,  0.0000036800000000 ]  - [   0.0138735000000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0007199600000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0099154000000000, -0.0088772800000000,  0.0104085900000000 ]  - [   0.0000916400000000,  0.0012420600000000,  0.0001198700000000 ]  - [   0.0099012100000000,  0.0089531800000000, -0.0104814200000000 ]  - [   0.0000847500000000, -0.0012436900000000, -0.0001202800000000 ]- atom:   57  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0008816900000000, -0.0003213600000000,  0.0003910200000000 ]  - [   0.0018579800000000, -0.0013360000000000,  0.0007031100000000 ]  - [  -0.0003603600000000, -0.0011268000000000, -0.0008133500000000 ]  - [   0.0003303000000000, -0.0017039300000000,  0.0020000400000000 ]  - [   0.0004916000000000, -0.0026266100000000,  0.0033089700000000 ]  - [   0.0011912400000000, -0.0020573500000000,  0.0004898100000000 ]  - [  -0.0009052700000000, -0.0025263700000000, -0.0009678500000000 ]  - [   0.0002206400000000,  0.0070867400000000,  0.0035200800000000 ]  - [   0.0026830500000000, -0.0022510200000000, -0.0005953800000000 ]  - [  -0.0000457500000000, -0.0012556000000000, -0.0009057000000000 ]  - [  -0.0004916000000000, -0.0026266100000000,  0.0033089700000000 ]  - [  -0.0011912400000000, -0.0020573500000000,  0.0004898100000000 ]  - [   0.0003603600000000, -0.0011268000000000, -0.0008133500000000 ]  - [  -0.0003303000000000, -0.0017039300000000,  0.0020000400000000 ]  - [   0.0010767800000000,  0.0080552700000000,  0.0048092900000000 ]  - [  -0.0000741000000000, -0.0015977400000000,  0.0003292600000000 ]  - [   0.0000000000000000,  0.0027535500000000,  0.0010559100000000 ]  - [   0.0000000000000000, -0.0035883900000000,  0.0037837100000000 ]  - [   0.0000000000000000, -0.0035879500000000, -0.0035196800000000 ]  - [   0.0000000000000000,  0.0027073500000000, -0.0062262800000000 ]  - [  -0.0044796700000000,  0.0123909300000000,  0.0004881700000000 ]  - [  -0.0019595200000000, -0.0024523200000000, -0.0013222900000000 ]  - [   0.0001542000000000, -0.0024601900000000,  0.0002981200000000 ]  - [  -0.0018411500000000,  0.0118599000000000,  0.0022221200000000 ]  - [   0.0013508500000000, -0.0012616500000000, -0.0006885400000000 ]  - [   0.0000847300000000,  0.0011793300000000, -0.0011238300000000 ]  - [  -0.0020338100000000,  0.0011893400000000,  0.0004941300000000 ]  - [  -0.0007775400000000, -0.0012636400000000,  0.0009369000000000 ]  - [  -0.0010767800000000,  0.0080552700000000,  0.0048092900000000 ]  - [   0.0000741000000000, -0.0015977400000000,  0.0003292600000000 ]  - [   0.0029691500000000,  0.0050295800000000, -0.0010676800000000 ]  - [  -0.0000967900000000, -0.0013438400000000, -0.0005000100000000 ]  - [   0.0009320200000000, -0.0022726900000000,  0.0007968500000000 ]  - [  -0.0021386000000000,  0.0040984100000000,  0.0002226300000000 ]  - [  -0.0026830500000000, -0.0022510200000000, -0.0005953800000000 ]  - [   0.0000457500000000, -0.0012556000000000, -0.0009057000000000 ]  - [   0.0009052700000000, -0.0025263700000000, -0.0009678500000000 ]  - [  -0.0002206400000000,  0.0070867400000000,  0.0035200800000000 ]  - [  -0.0009320200000000, -0.0022726900000000,  0.0007968500000000 ]  - [   0.0021386000000000,  0.0040984100000000,  0.0002226300000000 ]  - [  -0.0029691500000000,  0.0050295800000000, -0.0010676800000000 ]  - [   0.0000967900000000, -0.0013438400000000, -0.0005000100000000 ]  - [   0.0008816900000000, -0.0003213600000000,  0.0003910200000000 ]  - [  -0.0018579800000000, -0.0013360000000000,  0.0007031100000000 ]  - [   0.0000000000000000, -0.0026792400000000,  0.0035045800000000 ]  - [   0.0000000000000000,  0.0027217600000000,  0.0028592900000000 ]  - [   0.0000000000000000,  0.0027297600000000, -0.0044440000000000 ]  - [   0.0000000000000000, -0.0026846800000000, -0.0037988900000000 ]  - [  -0.0013508500000000, -0.0012616500000000, -0.0006885400000000 ]  - [  -0.0000847300000000,  0.0011793300000000, -0.0011238300000000 ]  - [   0.0020338100000000,  0.0011893400000000,  0.0004941300000000 ]  - [   0.0007775400000000, -0.0012636400000000,  0.0009369000000000 ]  - [   0.0044796700000000,  0.0123909300000000,  0.0004881700000000 ]  - [   0.0019595200000000, -0.0024523200000000, -0.0013222900000000 ]  - [  -0.0001542000000000, -0.0024601900000000,  0.0002981200000000 ]  - [   0.0018411500000000,  0.0118599000000000,  0.0022221200000000 ]  - [   0.0000000000000000, -0.0928754400000000,  0.0028157200000000 ]  - [   0.0000000000000000,  0.0028435400000000, -0.0003600500000000 ]  - [   0.0000000000000000, -0.0030680100000000, -0.0013773500000000 ]  - [   0.0000000000000000,  0.0019071800000000,  0.0002862500000000 ]  - [  -0.0063079900000000, -0.0010912200000000,  0.0061573000000000 ]  - [   0.0004519200000000,  0.0025885400000000, -0.0002615500000000 ]  - [  -0.0004568200000000,  0.0025869700000000, -0.0002640700000000 ]  - [   0.0062900200000000, -0.0010541300000000,  0.0061329300000000 ]  - [   0.0000000000000000,  0.0005732700000000, -0.0004730700000000 ]  - [   0.0000000000000000,  0.0005808600000000, -0.0004756800000000 ]  - [   0.0000000000000000,  0.0159756300000000,  0.0011817900000000 ]  - [   0.0000000000000000,  0.0157664600000000,  0.0011709600000000 ]  - [   0.0004568200000000,  0.0025869700000000, -0.0002640700000000 ]  - [  -0.0062900200000000, -0.0010541300000000,  0.0061329300000000 ]  - [   0.0063079900000000, -0.0010912200000000,  0.0061573000000000 ]  - [  -0.0004519200000000,  0.0025885400000000, -0.0002615500000000 ]  - [   0.0000000000000000, -0.0141468700000000, -0.0064965900000000 ]  - [   0.0000000000000000,  0.0054651800000000,  0.0000692800000000 ]  - [   0.0000000000000000,  0.0034392300000000, -0.0021916500000000 ]  - [   0.0000000000000000,  0.0034577200000000, -0.0021863800000000 ]  - [   0.0010868700000000,  0.0041401700000000,  0.0005385600000000 ]  - [  -0.0102919600000000, -0.0016764700000000, -0.0114129200000000 ]  - [  -0.0010868700000000,  0.0041401700000000,  0.0005385600000000 ]  - [   0.0102919600000000, -0.0016764700000000, -0.0114129200000000 ]  - [   0.0000000000000000,  0.0011758100000000,  0.0020575000000000 ]  - [   0.0000000000000000,  0.0011861000000000,  0.0020655700000000 ]  - [   0.0000000000000000, -0.0068359600000000,  0.0050053000000000 ]  - [   0.0000000000000000,  0.0042886900000000, -0.0002888500000000 ]  - [  -0.0103252700000000, -0.0017209600000000, -0.0114578800000000 ]  - [   0.0010761700000000,  0.0041419500000000,  0.0005330600000000 ]  - [   0.0103252700000000, -0.0017209600000000, -0.0114578800000000 ]  - [  -0.0010761700000000,  0.0041419500000000,  0.0005330600000000 ]- atom:   57  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0005375800000000,  0.0003092100000000,  0.0008424200000000 ]  - [  -0.0008842100000000,  0.0009755400000000,  0.0007893600000000 ]  - [   0.0001824600000000, -0.0000797900000000, -0.0006907600000000 ]  - [   0.0008167300000000,  0.0018457600000000, -0.0017861400000000 ]  - [   0.0000032300000000,  0.0009114600000000, -0.0005128600000000 ]  - [   0.0006443300000000, -0.0010008000000000,  0.0005949100000000 ]  - [  -0.0003452500000000, -0.0001950300000000, -0.0006378100000000 ]  - [   0.0023798500000000,  0.0002097900000000, -0.0050975400000000 ]  - [  -0.0000568300000000,  0.0000528400000000, -0.0005054300000000 ]  - [   0.0002952400000000, -0.0006196200000000, -0.0004514300000000 ]  - [  -0.0000032300000000,  0.0009114600000000, -0.0005128600000000 ]  - [  -0.0006443300000000, -0.0010008000000000,  0.0005949100000000 ]  - [  -0.0001824600000000, -0.0000797900000000, -0.0006907600000000 ]  - [  -0.0008167300000000,  0.0018457600000000, -0.0017861400000000 ]  - [   0.0032827000000000,  0.0011714500000000, -0.0040648100000000 ]  - [   0.0004862400000000,  0.0007345000000000,  0.0006527800000000 ]  - [   0.0000000000000000, -0.0030000900000000, -0.0028575600000000 ]  - [   0.0000000000000000,  0.0007562400000000,  0.0033637600000000 ]  - [   0.0000000000000000,  0.0007556200000000, -0.0039481900000000 ]  - [   0.0000000000000000, -0.0029488500000000, -0.0101459100000000 ]  - [  -0.0015158600000000, -0.0000799400000000,  0.0033623900000000 ]  - [  -0.0009130700000000,  0.0003302000000000, -0.0005351100000000 ]  - [   0.0012226300000000,  0.0003328800000000,  0.0011008300000000 ]  - [   0.0005702700000000, -0.0000033700000000,  0.0050108200000000 ]  - [   0.0011751300000000,  0.0002278400000000, -0.0010195900000000 ]  - [   0.0024209800000000,  0.0004513800000000, -0.0025368800000000 ]  - [   0.0002807800000000,  0.0004471100000000, -0.0009028900000000 ]  - [  -0.0009584800000000,  0.0002286200000000,  0.0006135200000000 ]  - [  -0.0032827000000000,  0.0011714500000000, -0.0040648100000000 ]  - [  -0.0004862400000000,  0.0007345000000000,  0.0006527800000000 ]  - [  -0.0012151800000000, -0.0001614400000000,  0.0003797400000000 ]  - [   0.0004735200000000,  0.0007287000000000, -0.0006509900000000 ]  - [   0.0003586900000000, -0.0001999400000000,  0.0006415600000000 ]  - [   0.0020442300000000, -0.0010851500000000,  0.0016829300000000 ]  - [   0.0000568300000000,  0.0000528400000000, -0.0005054300000000 ]  - [  -0.0002952400000000, -0.0006196200000000, -0.0004514300000000 ]  - [   0.0003452500000000, -0.0001950300000000, -0.0006378100000000 ]  - [  -0.0023798500000000,  0.0002097900000000, -0.0050975400000000 ]  - [  -0.0003586900000000, -0.0001999400000000,  0.0006415600000000 ]  - [  -0.0020442300000000, -0.0010851500000000,  0.0016829300000000 ]  - [   0.0012151800000000, -0.0001614400000000,  0.0003797400000000 ]  - [  -0.0004735200000000,  0.0007287000000000, -0.0006509900000000 ]  - [   0.0005375800000000,  0.0003092100000000,  0.0008424200000000 ]  - [   0.0008842100000000,  0.0009755400000000,  0.0007893600000000 ]  - [   0.0000000000000000,  0.0004586000000000,  0.0037874000000000 ]  - [   0.0000000000000000, -0.0006061100000000,  0.0044064300000000 ]  - [   0.0000000000000000, -0.0006038900000000, -0.0029037900000000 ]  - [   0.0000000000000000,  0.0004568500000000, -0.0035243600000000 ]  - [  -0.0011751300000000,  0.0002278400000000, -0.0010195900000000 ]  - [  -0.0024209800000000,  0.0004513800000000, -0.0025368800000000 ]  - [  -0.0002807800000000,  0.0004471100000000, -0.0009028900000000 ]  - [   0.0009584800000000,  0.0002286200000000,  0.0006135200000000 ]  - [   0.0015158600000000, -0.0000799400000000,  0.0033623900000000 ]  - [   0.0009130700000000,  0.0003302000000000, -0.0005351100000000 ]  - [  -0.0012226300000000,  0.0003328800000000,  0.0011008300000000 ]  - [  -0.0005702700000000, -0.0000033700000000,  0.0050108200000000 ]  - [   0.0000000000000000,  0.0028133400000000, -0.0244137100000000 ]  - [   0.0000000000000000, -0.0003598500000000, -0.0000172700000000 ]  - [   0.0000000000000000,  0.0013769800000000,  0.0012582300000000 ]  - [   0.0000000000000000, -0.0002855600000000, -0.0000072000000000 ]  - [  -0.0049684300000000,  0.0048445700000000,  0.0012798000000000 ]  - [  -0.0001209200000000, -0.0005635600000000,  0.0000006900000000 ]  - [   0.0001198000000000, -0.0005635600000000,  0.0000026600000000 ]  - [   0.0049509200000000,  0.0048284900000000,  0.0013159000000000 ]  - [   0.0000000000000000, -0.0004729100000000,  0.0003273000000000 ]  - [   0.0000000000000000, -0.0004759100000000,  0.0003261300000000 ]  - [   0.0000000000000000, -0.0012031800000000, -0.0024074300000000 ]  - [   0.0000000000000000, -0.0011486500000000, -0.0024071900000000 ]  - [  -0.0001198000000000, -0.0005635600000000,  0.0000026600000000 ]  - [  -0.0049509200000000,  0.0048284900000000,  0.0013159000000000 ]  - [   0.0049684300000000,  0.0048445700000000,  0.0012798000000000 ]  - [   0.0001209200000000, -0.0005635600000000,  0.0000006900000000 ]  - [   0.0000000000000000,  0.0037534400000000,  0.0373469900000000 ]  - [   0.0000000000000000, -0.0009546100000000,  0.0002878600000000 ]  - [   0.0000000000000000,  0.0017095700000000,  0.0031630100000000 ]  - [   0.0000000000000000,  0.0016596200000000,  0.0031554900000000 ]  - [   0.0001240300000000, -0.0001932000000000, -0.0001454200000000 ]  - [   0.0090980700000000, -0.0074389800000000,  0.0010526400000000 ]  - [  -0.0001240300000000, -0.0001932000000000, -0.0001454200000000 ]  - [  -0.0090980700000000, -0.0074389800000000,  0.0010526400000000 ]  - [   0.0000000000000000, -0.0002547700000000, -0.0010065200000000 ]  - [   0.0000000000000000, -0.0002512500000000, -0.0009986700000000 ]  - [   0.0000000000000000,  0.0017898500000000, -0.0042177600000000 ]  - [   0.0000000000000000, -0.0006636400000000, -0.0000944200000000 ]  - [   0.0090529300000000, -0.0073998700000000,  0.0011186400000000 ]  - [   0.0001215100000000, -0.0001965100000000, -0.0001402400000000 ]  - [  -0.0090529300000000, -0.0073998700000000,  0.0011186400000000 ]  - [  -0.0001215100000000, -0.0001965100000000, -0.0001402400000000 ]- atom:   61  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0038040400000000,  0.0026470900000000,  0.0015474100000000 ]  - [  -0.0009052700000000,  0.0001814200000000,  0.0007335400000000 ]  - [  -0.0029705300000000, -0.0017321200000000,  0.0002530900000000 ]  - [  -0.0000694300000000,  0.0007504700000000, -0.0005601600000000 ]  - [  -0.0019988300000000, -0.0009911100000000, -0.0008106800000000 ]  - [  -0.0000088700000000, -0.0001897800000000,  0.0004575900000000 ]  - [  -0.0000941100000000, -0.0015230300000000, -0.0006353800000000 ]  - [   0.0071785800000000, -0.0019369700000000,  0.0010392800000000 ]  - [   0.0035307800000000, -0.0004089300000000, -0.0017693800000000 ]  - [   0.0008381700000000, -0.0007210500000000, -0.0008719500000000 ]  - [   0.0027254600000000, -0.0005112200000000, -0.0004901700000000 ]  - [   0.0000066300000000, -0.0002087400000000,  0.0004194100000000 ]  - [   0.0071785800000000,  0.0019369700000000,  0.0010392800000000 ]  - [  -0.0000941100000000,  0.0015230300000000, -0.0006353800000000 ]  - [  -0.0019988300000000,  0.0009911100000000, -0.0008106800000000 ]  - [  -0.0000088700000000,  0.0001897800000000,  0.0004575900000000 ]  - [  -0.0038259800000000,  0.0000000000000000, -0.0006925800000000 ]  - [  -0.0000866100000000,  0.0000000000000000,  0.0035577900000000 ]  - [  -0.0004755900000000, -0.0015680800000000, -0.0044031900000000 ]  - [  -0.0004755900000000,  0.0015680800000000, -0.0044031900000000 ]  - [   0.0074222100000000,  0.0000000000000000, -0.0137392500000000 ]  - [  -0.0007675200000000,  0.0000000000000000, -0.0008178900000000 ]  - [  -0.0003903100000000, -0.0006961100000000,  0.0007577300000000 ]  - [  -0.0003903100000000,  0.0006961100000000,  0.0007577300000000 ]  - [   0.0033896700000000,  0.0009992100000000, -0.0003969300000000 ]  - [   0.0033896700000000, -0.0009992100000000, -0.0003969300000000 ]  - [  -0.0042380400000000,  0.0000000000000000,  0.0016495700000000 ]  - [  -0.0013442500000000,  0.0000000000000000,  0.0008035000000000 ]  - [   0.0027254600000000,  0.0005112200000000, -0.0004901700000000 ]  - [   0.0000066300000000,  0.0002087400000000,  0.0004194100000000 ]  - [   0.0035307800000000,  0.0004089300000000, -0.0017693800000000 ]  - [   0.0008381700000000,  0.0007210500000000, -0.0008719500000000 ]  - [   0.0007363100000000,  0.0005990600000000,  0.0006560800000000 ]  - [   0.0079098000000000,  0.0008429300000000,  0.0022766500000000 ]  - [  -0.0028363200000000,  0.0000531500000000, -0.0021028900000000 ]  - [  -0.0008423600000000, -0.0007395200000000, -0.0008339500000000 ]  - [  -0.0000694300000000, -0.0007504700000000, -0.0005601600000000 ]  - [  -0.0029705300000000,  0.0017321200000000,  0.0002530900000000 ]  - [  -0.0009052700000000, -0.0001814200000000,  0.0007335400000000 ]  - [  -0.0038040400000000, -0.0026470900000000,  0.0015474100000000 ]  - [  -0.0028363200000000, -0.0000531500000000, -0.0021028900000000 ]  - [  -0.0008423600000000,  0.0007395200000000, -0.0008339500000000 ]  - [   0.0079098000000000, -0.0008429300000000,  0.0022766500000000 ]  - [   0.0007363100000000, -0.0005990600000000,  0.0006560800000000 ]  - [  -0.0004825500000000,  0.0015728300000000,  0.0029041200000000 ]  - [  -0.0004825500000000, -0.0015728300000000,  0.0029041200000000 ]  - [  -0.0040837500000000,  0.0000000000000000, -0.0080833600000000 ]  - [  -0.0000879800000000,  0.0000000000000000, -0.0037535000000000 ]  - [  -0.0025211000000000,  0.0006893800000000, -0.0008742200000000 ]  - [  -0.0025211000000000, -0.0006893800000000, -0.0008742200000000 ]  - [   0.0096281500000000,  0.0000000000000000, -0.0119346700000000 ]  - [   0.0013630100000000,  0.0000000000000000,  0.0008132100000000 ]  - [  -0.0021171500000000,  0.0000000000000000,  0.0000335300000000 ]  - [   0.0007867600000000,  0.0000000000000000, -0.0008263600000000 ]  - [   0.0012653500000000, -0.0009983600000000,  0.0012300900000000 ]  - [   0.0012653500000000,  0.0009983600000000,  0.0012300900000000 ]  - [   0.0059702400000000, -0.0063268200000000, -0.0049819300000000 ]  - [   0.0000773500000000,  0.0004546600000000, -0.0001205900000000 ]  - [   0.0059592600000000,  0.0062714600000000, -0.0049375700000000 ]  - [   0.0000805300000000, -0.0004536100000000, -0.0001202600000000 ]  - [  -0.0611663900000000,  0.0000000000000000,  0.0374976200000000 ]  - [  -0.0006290200000000,  0.0000000000000000, -0.0001321400000000 ]  - [  -0.0016659400000000, -0.0000020100000000,  0.0002046800000000 ]  - [  -0.0016659400000000,  0.0000020100000000,  0.0002046800000000 ]  - [   0.0059592600000000, -0.0062714600000000, -0.0049375700000000 ]  - [   0.0000805300000000,  0.0004536100000000, -0.0001202600000000 ]  - [   0.0059702400000000,  0.0063268200000000, -0.0049819300000000 ]  - [   0.0000773500000000, -0.0004546600000000, -0.0001205900000000 ]  - [   0.0013471400000000,  0.0000032000000000,  0.0000532900000000 ]  - [   0.0013471400000000, -0.0000032000000000,  0.0000532900000000 ]  - [   0.0062733400000000,  0.0000000000000000, -0.0010496100000000 ]  - [   0.0004428900000000,  0.0000000000000000, -0.0000719900000000 ]  - [   0.0071375000000000, -0.0112225600000000,  0.0086286700000000 ]  - [   0.0002979400000000,  0.0013234900000000,  0.0002490700000000 ]  - [   0.0071375000000000,  0.0112225600000000,  0.0086286700000000 ]  - [   0.0002979400000000, -0.0013234900000000,  0.0002490700000000 ]  - [   0.0044970700000000,  0.0000089100000000, -0.0005698500000000 ]  - [   0.0044970700000000, -0.0000089100000000, -0.0005698500000000 ]  - [  -0.0111993100000000, -0.0000238800000000, -0.0031395500000000 ]  - [  -0.0111993100000000,  0.0000238800000000, -0.0031395500000000 ]  - [   0.0071438900000000, -0.0111325100000000,  0.0085728000000000 ]  - [   0.0003025900000000,  0.0013260100000000,  0.0002481100000000 ]  - [   0.0071438900000000,  0.0111325100000000,  0.0085728000000000 ]  - [   0.0003025900000000, -0.0013260100000000,  0.0002481100000000 ]  - [  -0.0150631800000000,  0.0000000000000000, -0.0091162100000000 ]  - [  -0.0010504300000000,  0.0000000000000000,  0.0001647400000000 ]  - [   0.0072794600000000,  0.0000000000000000,  0.0003001500000000 ]  - [   0.0010050900000000,  0.0000000000000000,  0.0001715000000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0020987600000000,  0.0014335500000000,  0.0007406100000000 ]  - [  -0.0005709300000000, -0.0008612000000000,  0.0005323300000000 ]  - [  -0.0020987600000000,  0.0014335500000000, -0.0007406100000000 ]  - [   0.0005709300000000, -0.0008612000000000, -0.0005323300000000 ]  - [  -0.0005231700000000,  0.0012925700000000,  0.0006281300000000 ]  - [   0.0010929400000000, -0.0020855000000000,  0.0008546500000000 ]  - [  -0.0017896400000000, -0.0040875500000000, -0.0014230100000000 ]  - [  -0.0006194300000000,  0.0090351000000000,  0.0002147900000000 ]  - [   0.0000594500000000,  0.0025925900000000,  0.0018880200000000 ]  - [   0.0007596400000000, -0.0024975500000000, -0.0009942200000000 ]  - [  -0.0000594500000000,  0.0025925900000000, -0.0018880200000000 ]  - [  -0.0007596400000000, -0.0024975500000000,  0.0009942200000000 ]  - [   0.0001298200000000,  0.0106345900000000, -0.0013669100000000 ]  - [   0.0009520700000000, -0.0031635900000000,  0.0001216200000000 ]  - [   0.0013599400000000,  0.0022101200000000,  0.0006731500000000 ]  - [  -0.0002617000000000, -0.0011578700000000,  0.0004426100000000 ]  - [   0.0000170100000000,  0.0105164200000000,  0.0036546700000000 ]  - [  -0.0000009300000000, -0.0033343900000000,  0.0036490000000000 ]  - [  -0.0013917100000000, -0.0022304000000000, -0.0052887200000000 ]  - [   0.0013887700000000, -0.0022401700000000, -0.0020132400000000 ]  - [  -0.0011010100000000,  0.0050002100000000, -0.0007236900000000 ]  - [  -0.0010621500000000, -0.0019422900000000, -0.0008109400000000 ]  - [   0.0006432600000000, -0.0005917400000000,  0.0008987900000000 ]  - [   0.0014809500000000, -0.0005971400000000,  0.0007268200000000 ]  - [   0.0028537300000000, -0.0033022500000000, -0.0032516900000000 ]  - [  -0.0007167900000000, -0.0032823600000000,  0.0016142400000000 ]  - [  -0.0010628100000000,  0.0024263300000000,  0.0008118400000000 ]  - [  -0.0010610100000000, -0.0016500200000000,  0.0008105100000000 ]  - [  -0.0007490600000000,  0.0034767600000000,  0.0031634700000000 ]  - [  -0.0000739900000000, -0.0015717600000000,  0.0003033900000000 ]  - [   0.0007490600000000,  0.0034767600000000, -0.0031634700000000 ]  - [   0.0000739900000000, -0.0015717600000000, -0.0003033900000000 ]  - [   0.0017896400000000, -0.0040875500000000,  0.0014230100000000 ]  - [   0.0006194300000000,  0.0090351000000000, -0.0002147900000000 ]  - [   0.0005231700000000,  0.0012925700000000, -0.0006281300000000 ]  - [  -0.0010929400000000, -0.0020855000000000, -0.0008546500000000 ]  - [   0.0002592400000000, -0.0017837100000000, -0.0007652800000000 ]  - [   0.0029226300000000,  0.0004994100000000, -0.0005585800000000 ]  - [  -0.0002592400000000, -0.0017837100000000,  0.0007652800000000 ]  - [  -0.0029226300000000,  0.0004994100000000,  0.0005585800000000 ]  - [  -0.0013599400000000,  0.0022101200000000, -0.0006731500000000 ]  - [   0.0002617000000000, -0.0011578700000000, -0.0004426100000000 ]  - [  -0.0001298200000000,  0.0106345900000000,  0.0013669100000000 ]  - [  -0.0009520700000000, -0.0031635900000000, -0.0001216200000000 ]  - [   0.0013917100000000, -0.0022304000000000,  0.0052887200000000 ]  - [  -0.0013887700000000, -0.0022401700000000,  0.0020132400000000 ]  - [  -0.0000170100000000,  0.0105164200000000, -0.0036546700000000 ]  - [   0.0000009300000000, -0.0033343900000000, -0.0036490000000000 ]  - [  -0.0006432600000000, -0.0005917400000000, -0.0008987900000000 ]  - [  -0.0014809500000000, -0.0005971400000000, -0.0007268200000000 ]  - [   0.0011010100000000,  0.0050002100000000,  0.0007236900000000 ]  - [   0.0010621500000000, -0.0019422900000000,  0.0008109400000000 ]  - [   0.0010628100000000,  0.0024263300000000, -0.0008118400000000 ]  - [   0.0010610100000000, -0.0016500200000000, -0.0008105100000000 ]  - [  -0.0028537300000000, -0.0033022500000000,  0.0032516900000000 ]  - [   0.0007167900000000, -0.0032823600000000, -0.0016142400000000 ]  - [  -0.0065010000000000, -0.0010487000000000,  0.0048242600000000 ]  - [   0.0009241300000000,  0.0025888400000000, -0.0005641400000000 ]  - [   0.0065010000000000, -0.0010487000000000, -0.0048242600000000 ]  - [  -0.0009241300000000,  0.0025888400000000,  0.0005641400000000 ]  - [   0.0000000000000000, -0.0764258900000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0034636600000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0015012700000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0015113100000000,  0.0000000000000000 ]  - [  -0.0065201500000000, -0.0010954900000000,  0.0048492000000000 ]  - [   0.0009177500000000,  0.0025864400000000, -0.0005628200000000 ]  - [   0.0065201500000000, -0.0010954900000000, -0.0048492000000000 ]  - [  -0.0009177500000000,  0.0025864400000000,  0.0005628200000000 ]  - [   0.0000000000000000,  0.0001641400000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0001733800000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0035235700000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0021088000000000,  0.0000000000000000 ]  - [  -0.0125691200000000, -0.0053561300000000, -0.0093320800000000 ]  - [   0.0015309000000000,  0.0049910600000000,  0.0009828500000000 ]  - [   0.0126116900000000, -0.0054202400000000,  0.0093885400000000 ]  - [  -0.0015231500000000,  0.0049952900000000, -0.0009801200000000 ]  - [   0.0000000000000000,  0.0022649900000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0022699900000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0227603600000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0225295600000000,  0.0000000000000000 ]  - [  -0.0126116900000000, -0.0054202400000000, -0.0093885400000000 ]  - [   0.0015231500000000,  0.0049952900000000,  0.0009801200000000 ]  - [   0.0125691200000000, -0.0053561300000000,  0.0093320800000000 ]  - [  -0.0015309000000000,  0.0049910600000000, -0.0009828500000000 ]  - [   0.0000000000000000, -0.0130483100000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0051938100000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0047585600000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0038566700000000,  0.0000000000000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0014926900000000,  0.0011904000000000,  0.0015568900000000 ]  - [  -0.0004833200000000,  0.0003297900000000,  0.0008697700000000 ]  - [  -0.0006431300000000, -0.0002656600000000,  0.0002572100000000 ]  - [   0.0003545400000000,  0.0005915000000000, -0.0004262600000000 ]  - [  -0.0002802000000000, -0.0006848500000000, -0.0006579800000000 ]  - [   0.0003350500000000, -0.0003827000000000,  0.0005270800000000 ]  - [  -0.0004283500000000, -0.0008877700000000, -0.0003364500000000 ]  - [   0.0008466200000000, -0.0009307200000000,  0.0038726900000000 ]  - [  -0.0009714100000000,  0.0006927700000000, -0.0072469500000000 ]  - [   0.0004957400000000, -0.0005175400000000, -0.0008010400000000 ]  - [  -0.0018605700000000, -0.0016499200000000, -0.0059620200000000 ]  - [  -0.0003413700000000, -0.0004016400000000,  0.0004963300000000 ]  - [   0.0008466200000000,  0.0009307200000000,  0.0038726900000000 ]  - [  -0.0004283500000000,  0.0008877700000000, -0.0003364500000000 ]  - [  -0.0002802000000000,  0.0006848500000000, -0.0006579800000000 ]  - [   0.0003350500000000,  0.0003827000000000,  0.0005270800000000 ]  - [  -0.0040209800000000,  0.0000000000000000,  0.0053314900000000 ]  - [  -0.0000284500000000,  0.0000000000000000,  0.0036095300000000 ]  - [  -0.0001809500000000, -0.0004821200000000, -0.0037980700000000 ]  - [  -0.0001809500000000,  0.0004821200000000, -0.0037980700000000 ]  - [  -0.0163311200000000,  0.0000000000000000,  0.0283333200000000 ]  - [  -0.0010849000000000,  0.0000000000000000, -0.0008762600000000 ]  - [   0.0016611400000000,  0.0006487500000000,  0.0012186200000000 ]  - [   0.0016611400000000, -0.0006487500000000,  0.0012186200000000 ]  - [   0.0012922900000000, -0.0013741900000000, -0.0000454400000000 ]  - [   0.0012922900000000,  0.0013741900000000, -0.0000454400000000 ]  - [   0.0004850600000000,  0.0000000000000000,  0.0001622200000000 ]  - [  -0.0010133100000000,  0.0000000000000000,  0.0007581700000000 ]  - [  -0.0018605700000000,  0.0016499200000000, -0.0059620200000000 ]  - [  -0.0003413700000000,  0.0004016400000000,  0.0004963300000000 ]  - [  -0.0009714100000000, -0.0006927700000000, -0.0072469500000000 ]  - [   0.0004957400000000,  0.0005175400000000, -0.0008010400000000 ]  - [   0.0004068300000000, -0.0000252800000000,  0.0009593700000000 ]  - [   0.0016637300000000, -0.0000148100000000,  0.0051631800000000 ]  - [  -0.0011110000000000, -0.0002352900000000, -0.0019636100000000 ]  - [  -0.0005009100000000, -0.0005375200000000, -0.0007694400000000 ]  - [   0.0003545400000000, -0.0005915000000000, -0.0004262600000000 ]  - [  -0.0006431300000000,  0.0002656600000000,  0.0002572100000000 ]  - [  -0.0004833200000000, -0.0003297900000000,  0.0008697700000000 ]  - [  -0.0014926900000000, -0.0011904000000000,  0.0015568900000000 ]  - [  -0.0011110000000000,  0.0002352900000000, -0.0019636100000000 ]  - [  -0.0005009100000000,  0.0005375200000000, -0.0007694400000000 ]  - [   0.0016637300000000,  0.0000148100000000,  0.0051631800000000 ]  - [   0.0004068300000000,  0.0000252800000000,  0.0009593700000000 ]  - [  -0.0001812800000000,  0.0004785600000000,  0.0035025500000000 ]  - [  -0.0001812800000000, -0.0004785600000000,  0.0035025500000000 ]  - [  -0.0040953900000000,  0.0000000000000000, -0.0020590800000000 ]  - [  -0.0000292600000000,  0.0000000000000000, -0.0037072400000000 ]  - [  -0.0004663000000000, -0.0006541300000000, -0.0004154300000000 ]  - [  -0.0004663000000000,  0.0006541300000000, -0.0004154300000000 ]  - [  -0.0151012300000000,  0.0000000000000000,  0.0318148600000000 ]  - [   0.0010494400000000,  0.0000000000000000,  0.0007655500000000 ]  - [   0.0026080800000000,  0.0000000000000000, -0.0014807200000000 ]  - [   0.0011210300000000,  0.0000000000000000, -0.0008814700000000 ]  - [  -0.0008321800000000,  0.0013679200000000,  0.0015704100000000 ]  - [  -0.0008321800000000, -0.0013679200000000,  0.0015704100000000 ]  - [  -0.0069885800000000,  0.0061259600000000,  0.0013183600000000 ]  - [  -0.0000877300000000, -0.0002627100000000,  0.0000022900000000 ]  - [  -0.0070291000000000, -0.0061644200000000,  0.0012773300000000 ]  - [  -0.0000865700000000,  0.0002630700000000,  0.0000007000000000 ]  - [   0.0375157700000000,  0.0000000000000000, -0.1147249700000000 ]  - [  -0.0001324100000000,  0.0000000000000000, -0.0001879400000000 ]  - [  -0.0002049100000000,  0.0000150300000000,  0.0018340400000000 ]  - [  -0.0002049100000000, -0.0000150300000000,  0.0018340400000000 ]  - [  -0.0070291000000000,  0.0061644200000000,  0.0012773300000000 ]  - [  -0.0000865700000000, -0.0002630700000000,  0.0000007000000000 ]  - [  -0.0069885800000000, -0.0061259600000000,  0.0013183600000000 ]  - [  -0.0000877300000000,  0.0002627100000000,  0.0000022900000000 ]  - [   0.0000534600000000,  0.0000020200000000,  0.0005220900000000 ]  - [   0.0000534600000000, -0.0000020200000000,  0.0005220900000000 ]  - [   0.0010501700000000,  0.0000000000000000, -0.0020257900000000 ]  - [   0.0000726700000000,  0.0000000000000000, -0.0001242500000000 ]  - [   0.0073379700000000, -0.0071012000000000,  0.0029051100000000 ]  - [   0.0001234000000000,  0.0004844700000000,  0.0001608500000000 ]  - [   0.0073379700000000,  0.0071012000000000,  0.0029051100000000 ]  - [   0.0001234000000000, -0.0004844700000000,  0.0001608500000000 ]  - [   0.0005950000000000, -0.0000053600000000, -0.0014077800000000 ]  - [   0.0005950000000000,  0.0000053600000000, -0.0014077800000000 ]  - [  -0.0026204200000000, -0.0000434500000000, -0.0053757400000000 ]  - [  -0.0026204200000000,  0.0000434500000000, -0.0053757400000000 ]  - [   0.0072975600000000, -0.0070741800000000,  0.0030029400000000 ]  - [   0.0001265800000000,  0.0004845000000000,  0.0001667900000000 ]  - [   0.0072975600000000,  0.0070741800000000,  0.0030029400000000 ]  - [   0.0001265800000000, -0.0004845000000000,  0.0001667900000000 ]  - [   0.0060903300000000,  0.0000000000000000,  0.0473138200000000 ]  - [  -0.0001252400000000,  0.0000000000000000,  0.0002806900000000 ]  - [   0.0002324700000000,  0.0000000000000000,  0.0034837800000000 ]  - [   0.0001394100000000,  0.0000000000000000,  0.0002575300000000 ]- atom:   73  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0019923200000000, -0.0013070200000000,  0.0008941800000000 ]  - [  -0.0038237700000000,  0.0032106500000000,  0.0023242700000000 ]  - [   0.0026588100000000,  0.0002669800000000, -0.0008329300000000 ]  - [   0.0050248600000000,  0.0079325700000000, -0.0026787900000000 ]  - [   0.0050248600000000, -0.0079325700000000,  0.0026787900000000 ]  - [   0.0026588100000000, -0.0002669800000000,  0.0008329300000000 ]  - [  -0.0000017200000000, -0.0003396900000000, -0.0004332800000000 ]  - [   0.0595789000000000,  0.0072847400000000,  0.0421932000000000 ]  - [  -0.0029883600000000,  0.0022775600000000,  0.0010164500000000 ]  - [  -0.0011612000000000, -0.0022164500000000, -0.0004013900000000 ]  - [   0.0041682100000000,  0.0070095300000000, -0.0013703300000000 ]  - [   0.0017896400000000, -0.0006773800000000,  0.0004751700000000 ]  - [   0.0017896400000000,  0.0006773800000000, -0.0004751700000000 ]  - [   0.0041682100000000, -0.0070095300000000,  0.0013703300000000 ]  - [   0.0628104400000000,  0.0089671300000000,  0.0464916500000000 ]  - [   0.0008347700000000,  0.0005784300000000,  0.0008620900000000 ]  - [   0.0202209400000000, -0.0002335800000000,  0.0037471000000000 ]  - [   0.0015651400000000,  0.0000004900000000,  0.0036554900000000 ]  - [   0.0015651400000000, -0.0000004900000000, -0.0036554900000000 ]  - [   0.0202209400000000,  0.0002335800000000, -0.0037471000000000 ]  - [   0.0008351000000000,  0.0058195700000000,  0.0055484600000000 ]  - [  -0.0006114900000000, -0.0003452300000000, -0.0010463200000000 ]  - [   0.0015266400000000, -0.0003422600000000,  0.0005893400000000 ]  - [   0.0029649500000000,  0.0058013200000000,  0.0071486300000000 ]  - [   0.0005751100000000,  0.0003258900000000, -0.0009126700000000 ]  - [  -0.0087671100000000, -0.0053119600000000,  0.0003072900000000 ]  - [  -0.0109247000000000, -0.0053600100000000,  0.0019072500000000 ]  - [  -0.0015503700000000,  0.0003300700000000,  0.0007228700000000 ]  - [   0.0595789000000000, -0.0072847400000000, -0.0421932000000000 ]  - [  -0.0000017200000000,  0.0003396900000000,  0.0004332800000000 ]  - [  -0.0092373600000000, -0.0010538800000000,  0.0034423000000000 ]  - [  -0.0000327100000000,  0.0002877100000000, -0.0004612500000000 ]  - [  -0.0000327100000000, -0.0002877100000000,  0.0004612500000000 ]  - [  -0.0092373600000000,  0.0010538800000000, -0.0034423000000000 ]  - [  -0.0038237700000000, -0.0032106500000000, -0.0023242700000000 ]  - [  -0.0019923200000000,  0.0013070200000000, -0.0008941800000000 ]  - [   0.0008347700000000, -0.0005784300000000, -0.0008620900000000 ]  - [   0.0628104400000000, -0.0089671300000000, -0.0464916500000000 ]  - [  -0.0008656500000000, -0.0006321200000000,  0.0008340600000000 ]  - [  -0.0100576400000000, -0.0019656200000000,  0.0047499300000000 ]  - [  -0.0100576400000000,  0.0019656200000000, -0.0047499300000000 ]  - [  -0.0008656500000000,  0.0006321200000000, -0.0008340600000000 ]  - [  -0.0011612000000000,  0.0022164500000000,  0.0004013900000000 ]  - [  -0.0029883600000000, -0.0022775600000000, -0.0010164500000000 ]  - [  -0.0010686800000000, -0.0000027600000000,  0.0036566100000000 ]  - [  -0.0042967000000000, -0.0000033100000000,  0.0036547900000000 ]  - [  -0.0042967000000000,  0.0000033100000000, -0.0036547900000000 ]  - [  -0.0010686800000000,  0.0000027600000000, -0.0036566100000000 ]  - [  -0.0015503700000000, -0.0003300700000000, -0.0007228700000000 ]  - [  -0.0109247000000000,  0.0053600100000000, -0.0019072500000000 ]  - [  -0.0087671100000000,  0.0053119600000000, -0.0003072900000000 ]  - [   0.0005751100000000, -0.0003258900000000,  0.0009126700000000 ]  - [   0.0029649500000000, -0.0058013200000000, -0.0071486300000000 ]  - [   0.0015266400000000,  0.0003422600000000, -0.0005893400000000 ]  - [  -0.0006114900000000,  0.0003452300000000,  0.0010463200000000 ]  - [   0.0008351000000000, -0.0058195700000000, -0.0055484600000000 ]  - [  -0.0228926700000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0006789900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0138781700000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0007185600000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0071300500000000, -0.0125506900000000,  0.0072671400000000 ]  - [   0.0003019800000000,  0.0015253300000000,  0.0001243000000000 ]  - [   0.0003019800000000, -0.0015253300000000, -0.0001243000000000 ]  - [   0.0071300500000000,  0.0125506900000000, -0.0072671400000000 ]  - [   0.0048876100000000,  0.0000134700000000, -0.0000027100000000 ]  - [   0.0048876100000000, -0.0000134700000000,  0.0000027100000000 ]  - [  -0.0051863700000000, -0.0000052600000000,  0.0000046200000000 ]  - [  -0.0051863700000000,  0.0000052600000000, -0.0000046200000000 ]  - [   0.0002976600000000,  0.0015280500000000,  0.0001254000000000 ]  - [   0.0071508100000000, -0.0126288800000000,  0.0073691100000000 ]  - [   0.0071508100000000,  0.0126288800000000, -0.0073691100000000 ]  - [   0.0002976600000000, -0.0015280500000000, -0.0001254000000000 ]  - [  -0.3416320800000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0007437600000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0100298200000000, -0.0000399100000000, -0.0000200600000000 ]  - [  -0.0100298200000000,  0.0000399100000000,  0.0000200600000000 ]  - [  -0.0002956500000000,  0.0017662500000000,  0.0001037800000000 ]  - [   0.0241732400000000, -0.0272563300000000, -0.0146795700000000 ]  - [  -0.0002758600000000, -0.0017719400000000, -0.0001037500000000 ]  - [   0.0241349700000000,  0.0271693100000000,  0.0144960500000000 ]  - [   0.0064122100000000,  0.0000037300000000,  0.0000033500000000 ]  - [   0.0064122100000000, -0.0000037300000000, -0.0000033500000000 ]  - [   0.0184500900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0011515900000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0241349700000000, -0.0271693100000000, -0.0144960500000000 ]  - [  -0.0002758600000000,  0.0017719400000000,  0.0001037500000000 ]  - [   0.0241732400000000,  0.0272563300000000,  0.0146795700000000 ]  - [  -0.0002956500000000, -0.0017662500000000, -0.0001037800000000 ]- atom:   73  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0018052900000000,  0.0000133300000000,  0.0015458300000000 ]  - [   0.0014332000000000, -0.0001008700000000, -0.0006652800000000 ]  - [  -0.0078201600000000, -0.0105330300000000,  0.0036444700000000 ]  - [   0.0071792200000000, -0.0040960500000000, -0.0078395700000000 ]  - [  -0.0063864900000000, -0.0050516400000000, -0.0065749900000000 ]  - [   0.0086705000000000, -0.0114622800000000,  0.0049427800000000 ]  - [  -0.0015212000000000, -0.0054925500000000, -0.0012860500000000 ]  - [   0.0119782700000000,  0.0276515700000000,  0.0086038700000000 ]  - [   0.0022726900000000, -0.0010191600000000, -0.0019689000000000 ]  - [  -0.0009730400000000, -0.0009163900000000,  0.0002517900000000 ]  - [   0.0063864900000000, -0.0050516400000000, -0.0065749900000000 ]  - [  -0.0086705000000000, -0.0114622800000000,  0.0049427800000000 ]  - [   0.0078201600000000, -0.0105330300000000,  0.0036444700000000 ]  - [  -0.0071792200000000, -0.0040960500000000, -0.0078395700000000 ]  - [   0.0125718500000000,  0.0283751000000000,  0.0096807700000000 ]  - [  -0.0006955300000000, -0.0045741600000000,  0.0000076100000000 ]  - [   0.0000000000000000,  0.0783249800000000, -0.0238416800000000 ]  - [   0.0000000000000000, -0.0074851700000000,  0.0029645200000000 ]  - [   0.0000000000000000, -0.0075053500000000, -0.0043412100000000 ]  - [   0.0000000000000000,  0.0723278700000000, -0.0285997100000000 ]  - [   0.0006280400000000,  0.0031907200000000, -0.0005218500000000 ]  - [  -0.0015513000000000, -0.0036658800000000,  0.0003007800000000 ]  - [   0.0005682700000000, -0.0036657800000000,  0.0019151000000000 ]  - [   0.0027488600000000,  0.0031561600000000,  0.0010838400000000 ]  - [   0.0026705500000000, -0.0029629900000000, -0.0011921000000000 ]  - [  -0.0031681500000000,  0.0020354200000000, -0.0011987100000000 ]  - [  -0.0052956700000000,  0.0020625700000000,  0.0004072500000000 ]  - [   0.0005460900000000, -0.0029652500000000,  0.0004223500000000 ]  - [  -0.0125718500000000,  0.0283751000000000,  0.0096807700000000 ]  - [   0.0006955300000000, -0.0045741600000000,  0.0000076100000000 ]  - [   0.0031801300000000,  0.0050160900000000, -0.0025952100000000 ]  - [  -0.0005153400000000, -0.0028797500000000, -0.0001684100000000 ]  - [   0.0013497200000000, -0.0038029900000000,  0.0011293000000000 ]  - [  -0.0023679300000000,  0.0040950000000000, -0.0013106600000000 ]  - [  -0.0022726900000000, -0.0010191600000000, -0.0019689000000000 ]  - [   0.0009730400000000, -0.0009163900000000,  0.0002517900000000 ]  - [   0.0015212000000000, -0.0054925500000000, -0.0012860500000000 ]  - [  -0.0119782700000000,  0.0276515700000000,  0.0086038700000000 ]  - [  -0.0013497200000000, -0.0038029900000000,  0.0011293000000000 ]  - [   0.0023679300000000,  0.0040950000000000, -0.0013106600000000 ]  - [  -0.0031801300000000,  0.0050160900000000, -0.0025952100000000 ]  - [   0.0005153400000000, -0.0028797500000000, -0.0001684100000000 ]  - [   0.0018052900000000,  0.0000133300000000,  0.0015458300000000 ]  - [  -0.0014332000000000, -0.0001008700000000, -0.0006652800000000 ]  - [   0.0000000000000000, -0.0039396000000000,  0.0036952900000000 ]  - [   0.0000000000000000,  0.0040456800000000,  0.0035398900000000 ]  - [   0.0000000000000000,  0.0040667200000000, -0.0037639500000000 ]  - [   0.0000000000000000, -0.0039416800000000, -0.0036070700000000 ]  - [  -0.0026705500000000, -0.0029629900000000, -0.0011921000000000 ]  - [   0.0031681500000000,  0.0020354200000000, -0.0011987100000000 ]  - [   0.0052956700000000,  0.0020625700000000,  0.0004072500000000 ]  - [  -0.0005460900000000, -0.0029652500000000,  0.0004223500000000 ]  - [  -0.0006280400000000,  0.0031907200000000, -0.0005218500000000 ]  - [   0.0015513000000000, -0.0036658800000000,  0.0003007800000000 ]  - [  -0.0005682700000000, -0.0036657800000000,  0.0019151000000000 ]  - [  -0.0027488600000000,  0.0031561600000000,  0.0010838400000000 ]  - [   0.0000000000000000, -0.0141488000000000,  0.0037533100000000 ]  - [   0.0000000000000000,  0.0054632700000000, -0.0009548200000000 ]  - [   0.0000000000000000, -0.0068352400000000, -0.0017908000000000 ]  - [   0.0000000000000000,  0.0042862900000000,  0.0006646100000000 ]  - [  -0.0112080600000000, -0.0054026500000000, -0.0071095100000000 ]  - [   0.0013198100000000,  0.0049875500000000,  0.0004839700000000 ]  - [  -0.0013292700000000,  0.0049985800000000,  0.0004859900000000 ]  - [   0.0111470600000000, -0.0053749800000000, -0.0070657900000000 ]  - [   0.0000000000000000,  0.0011805700000000, -0.0002540600000000 ]  - [   0.0000000000000000,  0.0011839200000000, -0.0002515700000000 ]  - [   0.0000000000000000,  0.0034481400000000, -0.0016777600000000 ]  - [   0.0000000000000000,  0.0034501100000000, -0.0016917300000000 ]  - [   0.0013292700000000,  0.0049985800000000,  0.0004859900000000 ]  - [  -0.0111470600000000, -0.0053749800000000, -0.0070657900000000 ]  - [   0.0112080600000000, -0.0054026500000000, -0.0071095100000000 ]  - [  -0.0013198100000000,  0.0049875500000000,  0.0004839700000000 ]  - [   0.0000000000000000, -0.3039659500000000,  0.0055000200000000 ]  - [   0.0000000000000000,  0.0124087900000000,  0.0014756800000000 ]  - [   0.0000000000000000,  0.0525660700000000,  0.0100451500000000 ]  - [   0.0000000000000000,  0.0521352500000000,  0.0101434000000000 ]  - [   0.0052019100000000,  0.0107184000000000, -0.0017866600000000 ]  - [  -0.0156398700000000, -0.0030633300000000,  0.0102722200000000 ]  - [  -0.0052019100000000,  0.0107184000000000, -0.0017866600000000 ]  - [   0.0156398700000000, -0.0030633300000000,  0.0102722200000000 ]  - [   0.0000000000000000,  0.0009097100000000,  0.0004925300000000 ]  - [   0.0000000000000000,  0.0009238500000000,  0.0004817000000000 ]  - [   0.0000000000000000, -0.0093805200000000,  0.0039910100000000 ]  - [   0.0000000000000000,  0.0068795400000000, -0.0008373600000000 ]  - [  -0.0157026700000000, -0.0031874100000000,  0.0103221700000000 ]  - [   0.0051855100000000,  0.0107174500000000, -0.0017841200000000 ]  - [   0.0157026700000000, -0.0031874100000000,  0.0103221700000000 ]  - [  -0.0051855100000000,  0.0107174500000000, -0.0017841200000000 ]- atom:   73  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0003894500000000,  0.0010803400000000,  0.0000674100000000 ]  - [   0.0003577900000000, -0.0008494500000000, -0.0002692200000000 ]  - [   0.0031555200000000,  0.0043341000000000, -0.0017067200000000 ]  - [  -0.0025509100000000, -0.0050054900000000,  0.0037490300000000 ]  - [   0.0033853300000000, -0.0059411900000000,  0.0050687300000000 ]  - [  -0.0022928000000000,  0.0033839100000000, -0.0003942300000000 ]  - [  -0.0004451800000000, -0.0005474400000000, -0.0004920300000000 ]  - [   0.0405508800000000,  0.0050660300000000,  0.0605064300000000 ]  - [   0.0012026300000000, -0.0017815200000000, -0.0015711100000000 ]  - [   0.0012217000000000,  0.0001616900000000, -0.0012275100000000 ]  - [  -0.0033853300000000, -0.0059411900000000,  0.0050687300000000 ]  - [   0.0022928000000000,  0.0033839100000000, -0.0003942300000000 ]  - [  -0.0031555200000000,  0.0043341000000000, -0.0017067200000000 ]  - [   0.0025509100000000, -0.0050054900000000,  0.0037490300000000 ]  - [   0.0444463400000000,  0.0067950500000000,  0.0643994300000000 ]  - [   0.0003857200000000,  0.0003713100000000,  0.0008047700000000 ]  - [   0.0000000000000000, -0.0204019100000000,  0.0378353000000000 ]  - [   0.0000000000000000, -0.0016076700000000,  0.0048035700000000 ]  - [   0.0000000000000000, -0.0016167600000000, -0.0024965100000000 ]  - [   0.0000000000000000, -0.0210058800000000,  0.0305413200000000 ]  - [  -0.0012578300000000, -0.0027484400000000, -0.0116320900000000 ]  - [  -0.0013592200000000, -0.0001266700000000, -0.0019424300000000 ]  - [   0.0007639500000000, -0.0001272300000000, -0.0003275800000000 ]  - [   0.0008107200000000, -0.0027317000000000, -0.0100565400000000 ]  - [   0.0003666200000000, -0.0003907700000000,  0.0000167600000000 ]  - [  -0.0044597200000000, -0.0025729900000000,  0.0062441800000000 ]  - [  -0.0065854400000000, -0.0025785100000000,  0.0078460200000000 ]  - [  -0.0017543200000000, -0.0003908400000000,  0.0016345800000000 ]  - [  -0.0444463400000000,  0.0067950500000000,  0.0643994300000000 ]  - [  -0.0003857200000000,  0.0003713100000000,  0.0008047700000000 ]  - [   0.0067119300000000,  0.0024779500000000, -0.0062336100000000 ]  - [   0.0004244500000000,  0.0002021300000000, -0.0006990700000000 ]  - [   0.0004077000000000, -0.0007191200000000,  0.0005988700000000 ]  - [  -0.0058876100000000,  0.0015617800000000, -0.0049451400000000 ]  - [  -0.0012026300000000, -0.0017815200000000, -0.0015711100000000 ]  - [  -0.0012217000000000,  0.0001616900000000, -0.0012275100000000 ]  - [   0.0004451800000000, -0.0005474400000000, -0.0004920300000000 ]  - [  -0.0405508800000000,  0.0050660300000000,  0.0605064300000000 ]  - [  -0.0004077000000000, -0.0007191200000000,  0.0005988700000000 ]  - [   0.0058876100000000,  0.0015617800000000, -0.0049451400000000 ]  - [  -0.0067119300000000,  0.0024779500000000, -0.0062336100000000 ]  - [  -0.0004244500000000,  0.0002021300000000, -0.0006990700000000 ]  - [  -0.0003894500000000,  0.0010803400000000,  0.0000674100000000 ]  - [  -0.0003577900000000, -0.0008494500000000, -0.0002692200000000 ]  - [   0.0000000000000000, -0.0007355700000000,  0.0032144300000000 ]  - [   0.0000000000000000,  0.0013873500000000,  0.0012582200000000 ]  - [   0.0000000000000000,  0.0014096100000000, -0.0060430300000000 ]  - [   0.0000000000000000, -0.0007312200000000, -0.0040864300000000 ]  - [  -0.0003666200000000, -0.0003907700000000,  0.0000167600000000 ]  - [   0.0044597200000000, -0.0025729900000000,  0.0062441800000000 ]  - [   0.0065854400000000, -0.0025785100000000,  0.0078460200000000 ]  - [   0.0017543200000000, -0.0003908400000000,  0.0016345800000000 ]  - [   0.0012578300000000, -0.0027484400000000, -0.0116320900000000 ]  - [   0.0013592200000000, -0.0001266700000000, -0.0019424300000000 ]  - [  -0.0007639500000000, -0.0001272300000000, -0.0003275800000000 ]  - [  -0.0008107200000000, -0.0027317000000000, -0.0100565400000000 ]  - [   0.0000000000000000, -0.0064962900000000,  0.0373495400000000 ]  - [   0.0000000000000000,  0.0000690500000000,  0.0002844000000000 ]  - [   0.0000000000000000, -0.0050057800000000, -0.0042170200000000 ]  - [   0.0000000000000000,  0.0002893900000000, -0.0000946900000000 ]  - [   0.0085771900000000, -0.0093410800000000,  0.0029613500000000 ]  - [   0.0002480900000000,  0.0009787300000000,  0.0001624900000000 ]  - [  -0.0002490000000000,  0.0009848300000000,  0.0001617600000000 ]  - [  -0.0086254200000000, -0.0093796900000000,  0.0029458300000000 ]  - [   0.0000000000000000,  0.0020642300000000, -0.0010045300000000 ]  - [   0.0000000000000000,  0.0020588300000000, -0.0010008600000000 ]  - [   0.0000000000000000,  0.0022019700000000,  0.0031652500000000 ]  - [   0.0000000000000000,  0.0021765300000000,  0.0031503500000000 ]  - [   0.0002490000000000,  0.0009848300000000,  0.0001617600000000 ]  - [   0.0086254200000000, -0.0093796900000000,  0.0029458300000000 ]  - [  -0.0085771900000000, -0.0093410800000000,  0.0029613500000000 ]  - [  -0.0002480900000000,  0.0009787300000000,  0.0001624900000000 ]  - [   0.0000000000000000,  0.0054146900000000, -0.3704105800000000 ]  - [   0.0000000000000000,  0.0014754400000000, -0.0013441500000000 ]  - [   0.0000000000000000, -0.0101131300000000, -0.0141124200000000 ]  - [   0.0000000000000000, -0.0100769600000000, -0.0140397200000000 ]  - [  -0.0013599600000000, -0.0013391800000000,  0.0002733700000000 ]  - [  -0.0216682900000000,  0.0255869900000000,  0.0111649500000000 ]  - [   0.0013599600000000, -0.0013391800000000,  0.0002733700000000 ]  - [   0.0216682900000000,  0.0255869900000000,  0.0111649500000000 ]  - [   0.0000000000000000,  0.0004855400000000,  0.0029431200000000 ]  - [   0.0000000000000000,  0.0004886900000000,  0.0029293300000000 ]  - [   0.0000000000000000, -0.0039910800000000,  0.0136893400000000 ]  - [   0.0000000000000000,  0.0008386100000000,  0.0005222000000000 ]  - [  -0.0217956500000000,  0.0256291100000000,  0.0112038300000000 ]  - [  -0.0013509200000000, -0.0013314900000000,  0.0002692700000000 ]  - [   0.0217956500000000,  0.0256291100000000,  0.0112038300000000 ]  - [   0.0013509200000000, -0.0013314900000000,  0.0002692700000000 ]- atom:   77  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0362521500000000, -0.0261630100000000, -0.0060597100000000 ]  - [   0.0012296300000000, -0.0002621600000000, -0.0000917800000000 ]  - [   0.0358312300000000,  0.0252567300000000, -0.0067273000000000 ]  - [   0.0020650500000000,  0.0011879500000000, -0.0013908100000000 ]  - [   0.0063396500000000, -0.0048044300000000,  0.0075237600000000 ]  - [   0.0016854200000000,  0.0003594400000000,  0.0011336000000000 ]  - [  -0.0115135500000000, -0.0008773100000000, -0.0026879400000000 ]  - [  -0.0020874100000000, -0.0018257400000000, -0.0014305300000000 ]  - [  -0.0036395200000000,  0.0019171900000000,  0.0006415600000000 ]  - [  -0.0010008200000000, -0.0010307800000000,  0.0001844500000000 ]  - [  -0.0044716400000000, -0.0028237500000000,  0.0019383600000000 ]  - [  -0.0018399200000000,  0.0001031100000000,  0.0014907700000000 ]  - [  -0.0115135500000000,  0.0008773100000000, -0.0026879400000000 ]  - [  -0.0020874100000000,  0.0018257400000000, -0.0014305300000000 ]  - [   0.0016854200000000, -0.0003594400000000,  0.0011336000000000 ]  - [   0.0063396500000000,  0.0048044300000000,  0.0075237600000000 ]  - [  -0.0029360100000000, -0.0092334600000000,  0.0052024700000000 ]  - [  -0.0029360100000000,  0.0092334600000000,  0.0052024700000000 ]  - [  -0.0052882200000000,  0.0000000000000000,  0.0037929000000000 ]  - [   0.0000008200000000,  0.0000000000000000, -0.0036440700000000 ]  - [  -0.0041576200000000, -0.0015380500000000, -0.0012756500000000 ]  - [  -0.0041576200000000,  0.0015380500000000, -0.0012756500000000 ]  - [   0.0590546000000000,  0.0000000000000000,  0.0563485200000000 ]  - [   0.0018006000000000,  0.0000000000000000,  0.0007483000000000 ]  - [  -0.0068153900000000,  0.0000000000000000, -0.0009318100000000 ]  - [   0.0002413500000000,  0.0000000000000000, -0.0009577400000000 ]  - [   0.0027380600000000,  0.0020150700000000,  0.0005125700000000 ]  - [   0.0027380600000000, -0.0020150700000000,  0.0005125700000000 ]  - [  -0.0018399200000000, -0.0001031100000000,  0.0014907700000000 ]  - [  -0.0044716400000000,  0.0028237500000000,  0.0019383600000000 ]  - [  -0.0010008200000000,  0.0010307800000000,  0.0001844500000000 ]  - [  -0.0036395200000000, -0.0019171900000000,  0.0006415600000000 ]  - [  -0.0106742700000000, -0.0000867000000000, -0.0013613300000000 ]  - [  -0.0012491300000000,  0.0009011600000000, -0.0001288600000000 ]  - [   0.0055025700000000,  0.0038832400000000,  0.0062098200000000 ]  - [   0.0008510600000000, -0.0012838200000000, -0.0001677800000000 ]  - [   0.0358312300000000, -0.0252567300000000, -0.0067273000000000 ]  - [   0.0020650500000000, -0.0011879500000000, -0.0013908100000000 ]  - [   0.0362521500000000,  0.0261630100000000, -0.0060597100000000 ]  - [   0.0012296300000000,  0.0002621600000000, -0.0000917800000000 ]  - [   0.0008510600000000,  0.0012838200000000, -0.0001677800000000 ]  - [   0.0055025700000000, -0.0038832400000000,  0.0062098200000000 ]  - [  -0.0106742700000000,  0.0000867000000000, -0.0013613300000000 ]  - [  -0.0012491300000000, -0.0009011600000000, -0.0001288600000000 ]  - [  -0.0052979600000000,  0.0000000000000000,  0.0111348300000000 ]  - [   0.0000013100000000,  0.0000000000000000,  0.0036563200000000 ]  - [  -0.0029195500000000,  0.0091885100000000, -0.0021033500000000 ]  - [  -0.0029195500000000, -0.0091885100000000, -0.0021033500000000 ]  - [   0.0575575400000000,  0.0000000000000000,  0.0568170000000000 ]  - [  -0.0003208500000000,  0.0000000000000000, -0.0008718500000000 ]  - [  -0.0020385000000000,  0.0015524800000000,  0.0003415000000000 ]  - [  -0.0020385000000000, -0.0015524800000000,  0.0003415000000000 ]  - [   0.0048504700000000, -0.0020101800000000, -0.0011012300000000 ]  - [   0.0048504700000000,  0.0020101800000000, -0.0011012300000000 ]  - [  -0.0089114900000000,  0.0000000000000000,  0.0006895000000000 ]  - [  -0.0018790700000000,  0.0000000000000000,  0.0006570900000000 ]  - [   0.0000891200000000,  0.0010780000000000,  0.0001237200000000 ]  - [   0.0098941900000000, -0.0102641900000000,  0.0090342800000000 ]  - [   0.0000868400000000, -0.0010834000000000,  0.0001217100000000 ]  - [   0.0099242500000000,  0.0103519000000000,  0.0091180200000000 ]  - [   0.0044967700000000, -0.0000118100000000,  0.0005949600000000 ]  - [   0.0044967700000000,  0.0000118100000000,  0.0005949600000000 ]  - [   0.0072788300000000,  0.0000000000000000, -0.0002320600000000 ]  - [   0.0010046900000000,  0.0000000000000000, -0.0001395300000000 ]  - [   0.0099242500000000, -0.0103519000000000,  0.0091180200000000 ]  - [   0.0000868400000000,  0.0010834000000000,  0.0001217100000000 ]  - [   0.0098941900000000,  0.0102641900000000,  0.0090342800000000 ]  - [   0.0000891200000000, -0.0010780000000000,  0.0001237200000000 ]  - [  -0.0150565100000000,  0.0000000000000000,  0.0060900900000000 ]  - [  -0.0010571500000000,  0.0000000000000000, -0.0001255900000000 ]  - [  -0.0112022900000000,  0.0000086300000000,  0.0026202100000000 ]  - [  -0.0112022900000000, -0.0000086300000000,  0.0026202100000000 ]  - [  -0.0002860500000000,  0.0051955200000000, -0.0013603400000000 ]  - [   0.0241373800000000, -0.0155822100000000, -0.0216851400000000 ]  - [   0.0241373800000000,  0.0155822100000000, -0.0216851400000000 ]  - [  -0.0002860500000000, -0.0051955200000000, -0.0013603400000000 ]  - [  -0.3175859600000000,  0.0000000000000000, -0.0852295300000000 ]  - [  -0.0028845800000000,  0.0000000000000000,  0.0004566700000000 ]  - [   0.0240322900000000,  0.0000000000000000,  0.0019174400000000 ]  - [   0.0035326100000000,  0.0000000000000000,  0.0007154200000000 ]  - [   0.0241704700000000, -0.0157601800000000, -0.0217783400000000 ]  - [  -0.0002853500000000,  0.0051919300000000, -0.0013516400000000 ]  - [  -0.0002853500000000, -0.0051919300000000, -0.0013516400000000 ]  - [   0.0241704700000000,  0.0157601800000000, -0.0217783400000000 ]  - [   0.0076834700000000, -0.0000145500000000, -0.0003417800000000 ]  - [   0.0076834700000000,  0.0000145500000000, -0.0003417800000000 ]  - [  -0.0122298500000000,  0.0000003200000000, -0.0011941700000000 ]  - [  -0.0122298500000000, -0.0000003200000000, -0.0011941700000000 ]- atom:   77  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0223386100000000,  0.0534265100000000,  0.0053496500000000 ]  - [   0.0000597300000000, -0.0050817600000000,  0.0003400300000000 ]  - [   0.0223386100000000,  0.0534265100000000, -0.0053496500000000 ]  - [  -0.0000597300000000, -0.0050817600000000, -0.0003400300000000 ]  - [   0.0001882900000000,  0.0000364900000000,  0.0071322000000000 ]  - [   0.0018264400000000, -0.0044648000000000,  0.0011338900000000 ]  - [   0.0101872400000000,  0.0054593800000000,  0.0008075700000000 ]  - [  -0.0021909800000000, -0.0044087500000000, -0.0012958200000000 ]  - [   0.0012515800000000,  0.0017097300000000, -0.0009729900000000 ]  - [  -0.0000586000000000, -0.0027081000000000, -0.0001080800000000 ]  - [  -0.0012515800000000,  0.0017097300000000,  0.0009729900000000 ]  - [   0.0000586000000000, -0.0027081000000000,  0.0001080800000000 ]  - [  -0.0110184900000000,  0.0063875900000000, -0.0021165500000000 ]  - [   0.0013546000000000, -0.0034832500000000, -0.0000028900000000 ]  - [  -0.0009802300000000, -0.0035406600000000,  0.0001707300000000 ]  - [   0.0006681000000000,  0.0009743000000000, -0.0058332900000000 ]  - [  -0.0038503200000000, -0.0099321800000000,  0.0056094400000000 ]  - [   0.0038537400000000, -0.0098734500000000,  0.0017120100000000 ]  - [   0.0000054800000000,  0.0191304700000000, -0.0036669800000000 ]  - [   0.0000025800000000, -0.0056427800000000, -0.0036593300000000 ]  - [  -0.0015592500000000, -0.0007566200000000, -0.0016846700000000 ]  - [  -0.0005762800000000, -0.0007515300000000,  0.0000428600000000 ]  - [   0.0012528700000000,  0.0264699500000000,  0.0011772700000000 ]  - [   0.0010676400000000, -0.0035419100000000,  0.0008197800000000 ]  - [   0.0010685600000000,  0.0064000500000000, -0.0008139800000000 ]  - [   0.0010646100000000, -0.0030837900000000, -0.0008168700000000 ]  - [   0.0003741800000000, -0.0037553800000000,  0.0039800700000000 ]  - [  -0.0025182800000000, -0.0037701000000000, -0.0023802800000000 ]  - [  -0.0008928800000000, -0.0017919400000000,  0.0011926100000000 ]  - [   0.0004212500000000,  0.0026288400000000,  0.0003209200000000 ]  - [   0.0008928800000000, -0.0017919400000000, -0.0011926100000000 ]  - [  -0.0004212500000000,  0.0026288400000000, -0.0003209200000000 ]  - [  -0.0101872400000000,  0.0054593800000000, -0.0008075700000000 ]  - [   0.0021909800000000, -0.0044087500000000,  0.0012958200000000 ]  - [  -0.0001882900000000,  0.0000364900000000, -0.0071322000000000 ]  - [  -0.0018264400000000, -0.0044648000000000, -0.0011338900000000 ]  - [  -0.0238733200000000,  0.0550561900000000,  0.0050712600000000 ]  - [   0.0009090900000000, -0.0059932700000000, -0.0009630300000000 ]  - [   0.0238733200000000,  0.0550561900000000, -0.0050712600000000 ]  - [  -0.0009090900000000, -0.0059932700000000,  0.0009630300000000 ]  - [   0.0009802300000000, -0.0035406600000000, -0.0001707300000000 ]  - [  -0.0006681000000000,  0.0009743000000000,  0.0058332900000000 ]  - [   0.0110184900000000,  0.0063875900000000,  0.0021165500000000 ]  - [  -0.0013546000000000, -0.0034832500000000,  0.0000028900000000 ]  - [  -0.0000054800000000,  0.0191304700000000,  0.0036669800000000 ]  - [  -0.0000025800000000, -0.0056427800000000,  0.0036593300000000 ]  - [   0.0038503200000000, -0.0099321800000000, -0.0056094400000000 ]  - [  -0.0038537400000000, -0.0098734500000000, -0.0017120100000000 ]  - [  -0.0012528700000000,  0.0264699500000000, -0.0011772700000000 ]  - [  -0.0010676400000000, -0.0035419100000000, -0.0008197800000000 ]  - [   0.0015592500000000, -0.0007566200000000,  0.0016846700000000 ]  - [   0.0005762800000000, -0.0007515300000000, -0.0000428600000000 ]  - [  -0.0003741800000000, -0.0037553800000000, -0.0039800700000000 ]  - [   0.0025182800000000, -0.0037701000000000,  0.0023802800000000 ]  - [  -0.0010685600000000,  0.0064000500000000,  0.0008139800000000 ]  - [  -0.0010646100000000, -0.0030837900000000,  0.0008168700000000 ]  - [   0.0012367200000000,  0.0041392600000000, -0.0001943700000000 ]  - [  -0.0089358100000000, -0.0017191600000000, -0.0074330800000000 ]  - [  -0.0012367200000000,  0.0041392600000000,  0.0001943700000000 ]  - [   0.0089358100000000, -0.0017191600000000,  0.0074330800000000 ]  - [   0.0000000000000000,  0.0022698900000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0022685000000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0047566200000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0038594800000000,  0.0000000000000000 ]  - [  -0.0088931100000000, -0.0016773000000000, -0.0074048800000000 ]  - [   0.0012482000000000,  0.0041426600000000, -0.0001944200000000 ]  - [   0.0088931100000000, -0.0016773000000000,  0.0074048800000000 ]  - [  -0.0012482000000000,  0.0041426600000000,  0.0001944200000000 ]  - [   0.0000000000000000, -0.0130509400000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0051921300000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0225159500000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0227708700000000,  0.0000000000000000 ]  - [   0.0017580400000000,  0.0107242700000000, -0.0013373700000000 ]  - [  -0.0272686900000000, -0.0030861900000000,  0.0256397500000000 ]  - [   0.0271572300000000, -0.0031633800000000, -0.0255783700000000 ]  - [  -0.0017803500000000,  0.0107122000000000,  0.0013342400000000 ]  - [   0.0000000000000000, -0.3047034100000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0118855400000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0256662500000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0089124700000000,  0.0000000000000000 ]  - [  -0.0271572300000000, -0.0031633800000000,  0.0255783700000000 ]  - [   0.0017803500000000,  0.0107122000000000, -0.0013342400000000 ]  - [  -0.0017580400000000,  0.0107242700000000,  0.0013373700000000 ]  - [   0.0272686900000000, -0.0030861900000000, -0.0256397500000000 ]  - [   0.0000000000000000,  0.0011586300000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0011553700000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0079270800000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0079181300000000,  0.0000000000000000 ]- atom:   77  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0076464400000000,  0.0082890000000000,  0.0239428900000000 ]  - [  -0.0008459600000000,  0.0006209800000000,  0.0010266800000000 ]  - [  -0.0068696800000000, -0.0074396900000000,  0.0225844700000000 ]  - [  -0.0000107800000000,  0.0003110300000000, -0.0002699100000000 ]  - [   0.0007680800000000,  0.0013535500000000, -0.0044473600000000 ]  - [   0.0002210600000000, -0.0007793800000000, -0.0001423200000000 ]  - [   0.0035820000000000, -0.0000938400000000,  0.0020352900000000 ]  - [  -0.0000166300000000, -0.0000682500000000, -0.0002704400000000 ]  - [   0.0012633200000000, -0.0011243700000000, -0.0022487100000000 ]  - [   0.0006485700000000, -0.0001807300000000, -0.0014191900000000 ]  - [   0.0004403800000000,  0.0002091400000000, -0.0009470400000000 ]  - [  -0.0001854200000000, -0.0007456000000000, -0.0001161200000000 ]  - [   0.0035820000000000,  0.0000938400000000,  0.0020352900000000 ]  - [  -0.0000166300000000,  0.0000682500000000, -0.0002704400000000 ]  - [   0.0002210600000000,  0.0007793800000000, -0.0001423200000000 ]  - [   0.0007680800000000, -0.0013535500000000, -0.0044473600000000 ]  - [   0.0009795200000000,  0.0029576500000000,  0.0026918600000000 ]  - [   0.0009795200000000, -0.0029576500000000,  0.0026918600000000 ]  - [   0.0047394300000000,  0.0000000000000000, -0.0089014000000000 ]  - [  -0.0000131400000000,  0.0000000000000000, -0.0036212300000000 ]  - [  -0.0026668300000000, -0.0017158700000000, -0.0016602000000000 ]  - [  -0.0026668300000000,  0.0017158700000000, -0.0016602000000000 ]  - [   0.0559660800000000,  0.0000000000000000,  0.1165196000000000 ]  - [   0.0010728500000000,  0.0000000000000000,  0.0009389700000000 ]  - [  -0.0028116800000000,  0.0000000000000000,  0.0006894300000000 ]  - [   0.0010346900000000,  0.0000000000000000, -0.0006472000000000 ]  - [  -0.0009720600000000,  0.0024707200000000, -0.0003182200000000 ]  - [  -0.0009720600000000, -0.0024707200000000, -0.0003182200000000 ]  - [  -0.0001854200000000,  0.0007456000000000, -0.0001161200000000 ]  - [   0.0004403800000000, -0.0002091400000000, -0.0009470400000000 ]  - [   0.0006485700000000,  0.0001807300000000, -0.0014191900000000 ]  - [   0.0012633200000000,  0.0011243700000000, -0.0022487100000000 ]  - [   0.0044441700000000, -0.0008442700000000,  0.0033394400000000 ]  - [   0.0008188000000000, -0.0008606000000000,  0.0010290800000000 ]  - [  -0.0001011000000000, -0.0022428700000000, -0.0057627100000000 ]  - [  -0.0006189100000000, -0.0001552800000000, -0.0014465800000000 ]  - [  -0.0068696800000000,  0.0074396900000000,  0.0225844700000000 ]  - [  -0.0000107800000000, -0.0003110300000000, -0.0002699100000000 ]  - [  -0.0076464400000000, -0.0082890000000000,  0.0239428900000000 ]  - [  -0.0008459600000000, -0.0006209800000000,  0.0010266800000000 ]  - [  -0.0006189100000000,  0.0001552800000000, -0.0014465800000000 ]  - [  -0.0001011000000000,  0.0022428700000000, -0.0057627100000000 ]  - [   0.0044441700000000,  0.0008442700000000,  0.0033394400000000 ]  - [   0.0008188000000000,  0.0008606000000000,  0.0010290800000000 ]  - [   0.0046751300000000,  0.0000000000000000, -0.0016110700000000 ]  - [  -0.0000148400000000,  0.0000000000000000,  0.0036782400000000 ]  - [   0.0009878500000000, -0.0030010100000000, -0.0046236600000000 ]  - [   0.0009878500000000,  0.0030010100000000, -0.0046236600000000 ]  - [   0.0585041300000000,  0.0000000000000000,  0.1220752300000000 ]  - [  -0.0010488900000000,  0.0000000000000000, -0.0006809000000000 ]  - [  -0.0005513400000000,  0.0017266000000000, -0.0000348400000000 ]  - [  -0.0005513400000000, -0.0017266000000000, -0.0000348400000000 ]  - [   0.0011524600000000, -0.0024494000000000, -0.0019492400000000 ]  - [   0.0011524600000000,  0.0024494000000000, -0.0019492400000000 ]  - [  -0.0049121100000000,  0.0000000000000000,  0.0022918600000000 ]  - [  -0.0010847400000000,  0.0000000000000000,  0.0009688500000000 ]  - [   0.0001187900000000,  0.0005329300000000, -0.0001422300000000 ]  - [   0.0104061100000000, -0.0114119700000000,  0.0010876400000000 ]  - [   0.0001217500000000, -0.0005389900000000, -0.0001466900000000 ]  - [   0.0104837700000000,  0.0114586700000000,  0.0010830000000000 ]  - [  -0.0005702500000000,  0.0000011400000000, -0.0014073600000000 ]  - [  -0.0005702500000000, -0.0000011400000000, -0.0014073600000000 ]  - [  -0.0003008700000000,  0.0000000000000000,  0.0034874200000000 ]  - [  -0.0001714200000000,  0.0000000000000000,  0.0002534200000000 ]  - [   0.0104837700000000, -0.0114586700000000,  0.0010830000000000 ]  - [   0.0001217500000000,  0.0005389900000000, -0.0001466900000000 ]  - [   0.0104061100000000,  0.0114119700000000,  0.0010876400000000 ]  - [   0.0001187900000000, -0.0005329300000000, -0.0001422300000000 ]  - [  -0.0091161000000000,  0.0000000000000000,  0.0473138500000000 ]  - [   0.0001640000000000,  0.0000000000000000,  0.0002785700000000 ]  - [   0.0031400400000000,  0.0000144500000000, -0.0053761100000000 ]  - [   0.0031400400000000, -0.0000144500000000, -0.0053761100000000 ]  - [   0.0001001300000000, -0.0017814200000000,  0.0002641500000000 ]  - [  -0.0146198000000000,  0.0103359100000000,  0.0111370300000000 ]  - [  -0.0146198000000000, -0.0103359100000000,  0.0111370300000000 ]  - [   0.0001001300000000,  0.0017814200000000,  0.0002641500000000 ]  - [  -0.0853204100000000,  0.0000000000000000, -0.3891633900000000 ]  - [   0.0004570000000000,  0.0000000000000000, -0.0005442800000000 ]  - [  -0.0019178700000000,  0.0000000000000000, -0.0090782400000000 ]  - [  -0.0007153200000000,  0.0000000000000000, -0.0006162400000000 ]  - [  -0.0145540500000000,  0.0102582800000000,  0.0112326500000000 ]  - [   0.0001072000000000, -0.0017895200000000,  0.0002798800000000 ]  - [   0.0001072000000000,  0.0017895200000000,  0.0002798800000000 ]  - [  -0.0145540500000000, -0.0102582800000000,  0.0112326500000000 ]  - [  -0.0003416500000000, -0.0000076200000000,  0.0030421500000000 ]  - [  -0.0003416500000000,  0.0000076200000000,  0.0030421500000000 ]  - [   0.0011939600000000, -0.0000265400000000,  0.0061369700000000 ]  - [   0.0011939600000000,  0.0000265400000000,  0.0061369700000000 ]