# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/e0fff053-6754-48d5-91cc-cf4579a68a5a/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 Li2Ga2GeS6 / Fdd2 (43) / materials id 554782](https://mdr.nims.go.jp/datasets/da2da7a6-520c-4092-b014-ae7baf688e56)

## 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: "Fdd2"  number: 43  Hall_symbol: "F 2 -2d"primitive_matrix:- [  0.000000000000000,  0.500000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     0.000000000000000,    11.286642320000000,     3.384256905000000 ] # a  - [     6.088637740000000,     0.000000000000000,     3.384256905000000 ] # b  - [     6.088637740000000,    11.286642320000000,     0.000000000000000 ] # c  points:  - symbol: Li # 1    coordinates: [  0.985541570000000,  0.229453010000000,  0.110730350000000 ]    mass: 6.941000  - symbol: Li # 2    coordinates: [  0.229453010000000,  0.985541570000000,  0.674275070000000 ]    mass: 6.941000  - symbol: Li # 3    coordinates: [  0.139269650000000,  0.575724930000000,  0.264458430000000 ]    mass: 6.941000  - symbol: Li # 4    coordinates: [  0.575724930000000,  0.139269650000000,  0.020546990000000 ]    mass: 6.941000  - symbol: Ga # 5    coordinates: [  0.545714450000000,  0.551453450000000,  0.723536730000000 ]    mass: 69.723000  - symbol: Ga # 6    coordinates: [  0.551453450000000,  0.545714450000000,  0.179295370000000 ]    mass: 69.723000  - symbol: Ga # 7    coordinates: [  0.526463270000000,  0.070704630000000,  0.704285550000000 ]    mass: 69.723000  - symbol: Ga # 8    coordinates: [  0.070704630000000,  0.526463270000000,  0.698546550000000 ]    mass: 69.723000  - symbol: Ge # 9    coordinates: [  0.844067180000000,  0.844067180000000,  0.655932820000000 ]    mass: 72.640000  - symbol: Ge # 10    coordinates: [  0.594067180000000,  0.594067180000000,  0.405932820000000 ]    mass: 72.640000  - symbol: S  # 11    coordinates: [  0.902453890000000,  0.160773470000000,  0.447775990000000 ]    mass: 32.065000  - symbol: S  # 12    coordinates: [  0.791977170000000,  0.536087650000000,  0.664573230000000 ]    mass: 32.065000  - symbol: S  # 13    coordinates: [  0.761003350000000,  0.802224010000000,  0.089226530000000 ]    mass: 32.065000  - symbol: S  # 14    coordinates: [  0.585426770000000,  0.242638050000000,  0.458022830000000 ]    mass: 32.065000  - symbol: S  # 15    coordinates: [  0.160773470000000,  0.902453890000000,  0.488996650000000 ]    mass: 32.065000  - symbol: S  # 16    coordinates: [  0.312255370000000,  0.176342770000000,  0.953796170000000 ]    mass: 32.065000  - symbol: S  # 17    coordinates: [  0.536087650000000,  0.791977170000000,  0.007361950000000 ]    mass: 32.065000  - symbol: S  # 18    coordinates: [  0.802224010000000,  0.761003350000000,  0.347546110000000 ]    mass: 32.065000  - symbol: S  # 19    coordinates: [  0.242638050000000,  0.585426770000000,  0.713912350000000 ]    mass: 32.065000  - symbol: S  # 20    coordinates: [  0.296203830000000,  0.692394310000000,  0.937744630000000 ]    mass: 32.065000  - symbol: S  # 21    coordinates: [  0.176342770000000,  0.312255370000000,  0.557605690000000 ]    mass: 32.065000  - symbol: S  # 22    coordinates: [  0.692394310000000,  0.296203830000000,  0.073657230000000 ]    mass: 32.065000  reciprocal_lattice: # without 2pi  - [    -0.082120175538642,     0.044300154627386,     0.147742920834788 ] # a*  - [     0.082120175538642,    -0.044300154627386,     0.147742920834788 ] # b*  - [     0.082120175538642,     0.044300154627386,    -0.147742920834788 ] # c*unit_cell:  lattice:  - [    12.177275480000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    22.573284640000001,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     6.768513810000000 ] # c  points:  - symbol: Li # 1    coordinates: [  0.670091680000000,  0.048135960000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 2    coordinates: [  0.829908320000000,  0.451864040000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 3    coordinates: [  0.920091680000000,  0.201864040000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 4    coordinates: [  0.579908320000000,  0.298135960000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Li # 5    coordinates: [  0.670091680000000,  0.548135960000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 6    coordinates: [  0.829908320000000,  0.951864040000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 7    coordinates: [  0.920091680000000,  0.701864040000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 8    coordinates: [  0.579908320000000,  0.798135960000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Li # 9    coordinates: [  0.170091680000000,  0.048135960000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 10    coordinates: [  0.329908320000000,  0.451864040000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 11    coordinates: [  0.420091680000000,  0.201864040000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 12    coordinates: [  0.079908320000000,  0.298135960000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Li # 13    coordinates: [  0.170091680000000,  0.548135960000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 14    coordinates: [  0.329908320000000,  0.951864040000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 15    coordinates: [  0.420091680000000,  0.701864040000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 16    coordinates: [  0.079908320000000,  0.798135960000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Ga # 17    coordinates: [  0.637495090000000,  0.134625590000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 18    coordinates: [  0.862504910000000,  0.365374410000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 19    coordinates: [  0.887495090000000,  0.115374410000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 20    coordinates: [  0.612504910000000,  0.384625590000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ga # 21    coordinates: [  0.637495090000000,  0.634625590000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 22    coordinates: [  0.862504910000000,  0.865374410000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 23    coordinates: [  0.887495090000000,  0.615374410000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 24    coordinates: [  0.612504910000000,  0.884625590000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ga # 25    coordinates: [  0.137495090000000,  0.134625590000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 26    coordinates: [  0.362504910000000,  0.365374410000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 27    coordinates: [  0.387495090000000,  0.115374410000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 28    coordinates: [  0.112504910000000,  0.384625590000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ga # 29    coordinates: [  0.137495090000000,  0.634625590000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 30    coordinates: [  0.362504910000000,  0.865374410000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 31    coordinates: [  0.387495090000000,  0.615374410000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 32    coordinates: [  0.112504910000000,  0.884625590000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ge # 33    coordinates: [  0.750000000000000,  0.250000000000000,  0.344067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 34    coordinates: [  0.500000000000000,  0.000000000000000,  0.094067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: Ge # 35    coordinates: [  0.750000000000000,  0.750000000000000,  0.844067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 36    coordinates: [  0.500000000000000,  0.500000000000000,  0.594067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: Ge # 37    coordinates: [  0.250000000000000,  0.250000000000000,  0.844067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 38    coordinates: [  0.000000000000000,  0.000000000000000,  0.594067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: Ge # 39    coordinates: [  0.250000000000000,  0.750000000000000,  0.344067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 40    coordinates: [  0.000000000000000,  0.500000000000000,  0.094067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: S  # 41    coordinates: [  0.804274730000000,  0.175114940000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 42    coordinates: [  0.600330440000000,  0.228275200000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 43    coordinates: [  0.945725270000000,  0.425114940000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 44    coordinates: [  0.850330440000000,  0.021724800000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 45    coordinates: [  0.695725270000000,  0.324885060000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 46    coordinates: [  0.565069470000000,  0.133025770000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 47    coordinates: [  0.899669560000000,  0.271724800000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 48    coordinates: [  0.554274730000000,  0.074885060000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 49    coordinates: [  0.649669560000000,  0.478275200000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 50    coordinates: [  0.815069470000000,  0.116974230000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 51    coordinates: [  0.934930530000000,  0.366974230000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 52    coordinates: [  0.684930530000000,  0.383025770000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 52  - symbol: S  # 53    coordinates: [  0.804274730000000,  0.675114940000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 54    coordinates: [  0.600330440000000,  0.728275200000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 55    coordinates: [  0.945725270000000,  0.925114940000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 56    coordinates: [  0.850330440000000,  0.521724800000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 57    coordinates: [  0.695725270000000,  0.824885060000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 58    coordinates: [  0.565069470000000,  0.633025770000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 59    coordinates: [  0.899669560000000,  0.771724800000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 60    coordinates: [  0.554274730000000,  0.574885060000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 61    coordinates: [  0.649669560000000,  0.978275200000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 62    coordinates: [  0.815069470000000,  0.616974230000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 63    coordinates: [  0.934930530000000,  0.866974230000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 64    coordinates: [  0.684930530000000,  0.883025770000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 52  - symbol: S  # 65    coordinates: [  0.304274730000000,  0.175114940000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 66    coordinates: [  0.100330440000000,  0.228275200000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 67    coordinates: [  0.445725270000000,  0.425114940000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 68    coordinates: [  0.350330440000000,  0.021724800000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 69    coordinates: [  0.195725270000000,  0.324885060000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 70    coordinates: [  0.065069470000000,  0.133025770000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 71    coordinates: [  0.399669560000000,  0.271724800000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 72    coordinates: [  0.054274730000000,  0.074885060000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 73    coordinates: [  0.149669560000000,  0.478275200000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 74    coordinates: [  0.315069470000000,  0.116974230000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 75    coordinates: [  0.434930530000000,  0.366974230000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 76    coordinates: [  0.184930530000000,  0.383025770000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 52  - symbol: S  # 77    coordinates: [  0.304274730000000,  0.675114940000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 78    coordinates: [  0.100330440000000,  0.728275200000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 79    coordinates: [  0.445725270000000,  0.925114940000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 80    coordinates: [  0.350330440000000,  0.521724800000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 81    coordinates: [  0.195725270000000,  0.824885060000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 82    coordinates: [  0.065069470000000,  0.633025770000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 83    coordinates: [  0.399669560000000,  0.771724800000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 84    coordinates: [  0.054274730000000,  0.574885060000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 85    coordinates: [  0.149669560000000,  0.978275200000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 86    coordinates: [  0.315069470000000,  0.616974230000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 87    coordinates: [  0.434930530000000,  0.866974230000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 88    coordinates: [  0.184930530000000,  0.883025770000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 52supercell:  lattice:  - [    12.177275480000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    22.573284640000001,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     6.768513810000000 ] # c  points:  - symbol: Li # 1    coordinates: [  0.670091680000000,  0.048135960000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 2    coordinates: [  0.829908320000000,  0.451864040000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 3    coordinates: [  0.920091680000000,  0.201864040000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 4    coordinates: [  0.579908320000000,  0.298135960000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Li # 5    coordinates: [  0.670091680000000,  0.548135960000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 6    coordinates: [  0.829908320000000,  0.951864040000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 7    coordinates: [  0.920091680000000,  0.701864040000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 8    coordinates: [  0.579908320000000,  0.798135960000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Li # 9    coordinates: [  0.170091680000000,  0.048135960000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 10    coordinates: [  0.329908320000000,  0.451864040000000,  0.107497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 11    coordinates: [  0.420091680000000,  0.201864040000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 12    coordinates: [  0.079908320000000,  0.298135960000000,  0.357497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Li # 13    coordinates: [  0.170091680000000,  0.548135960000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 1  - symbol: Li # 14    coordinates: [  0.329908320000000,  0.951864040000000,  0.607497290000000 ]    mass: 6.941000    reduced_to: 2  - symbol: Li # 15    coordinates: [  0.420091680000000,  0.701864040000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 3  - symbol: Li # 16    coordinates: [  0.079908320000000,  0.798135960000000,  0.857497290000000 ]    mass: 6.941000    reduced_to: 4  - symbol: Ga # 17    coordinates: [  0.637495090000000,  0.134625590000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 18    coordinates: [  0.862504910000000,  0.365374410000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 19    coordinates: [  0.887495090000000,  0.115374410000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 20    coordinates: [  0.612504910000000,  0.384625590000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ga # 21    coordinates: [  0.637495090000000,  0.634625590000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 22    coordinates: [  0.862504910000000,  0.865374410000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 23    coordinates: [  0.887495090000000,  0.615374410000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 24    coordinates: [  0.612504910000000,  0.884625590000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ga # 25    coordinates: [  0.137495090000000,  0.134625590000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 26    coordinates: [  0.362504910000000,  0.365374410000000,  0.548583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 27    coordinates: [  0.387495090000000,  0.115374410000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 28    coordinates: [  0.112504910000000,  0.384625590000000,  0.798583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ga # 29    coordinates: [  0.137495090000000,  0.634625590000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 17  - symbol: Ga # 30    coordinates: [  0.362504910000000,  0.865374410000000,  0.048583950000000 ]    mass: 69.723000    reduced_to: 18  - symbol: Ga # 31    coordinates: [  0.387495090000000,  0.615374410000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 19  - symbol: Ga # 32    coordinates: [  0.112504910000000,  0.884625590000000,  0.298583950000000 ]    mass: 69.723000    reduced_to: 20  - symbol: Ge # 33    coordinates: [  0.750000000000000,  0.250000000000000,  0.344067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 34    coordinates: [  0.500000000000000,  0.000000000000000,  0.094067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: Ge # 35    coordinates: [  0.750000000000000,  0.750000000000000,  0.844067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 36    coordinates: [  0.500000000000000,  0.500000000000000,  0.594067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: Ge # 37    coordinates: [  0.250000000000000,  0.250000000000000,  0.844067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 38    coordinates: [  0.000000000000000,  0.000000000000000,  0.594067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: Ge # 39    coordinates: [  0.250000000000000,  0.750000000000000,  0.344067180000000 ]    mass: 72.640000    reduced_to: 33  - symbol: Ge # 40    coordinates: [  0.000000000000000,  0.500000000000000,  0.094067180000000 ]    mass: 72.640000    reduced_to: 34  - symbol: S  # 41    coordinates: [  0.804274730000000,  0.175114940000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 42    coordinates: [  0.600330440000000,  0.228275200000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 43    coordinates: [  0.945725270000000,  0.425114940000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 44    coordinates: [  0.850330440000000,  0.021724800000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 45    coordinates: [  0.695725270000000,  0.324885060000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 46    coordinates: [  0.565069470000000,  0.133025770000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 47    coordinates: [  0.899669560000000,  0.271724800000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 48    coordinates: [  0.554274730000000,  0.074885060000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 49    coordinates: [  0.649669560000000,  0.478275200000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 50    coordinates: [  0.815069470000000,  0.116974230000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 51    coordinates: [  0.934930530000000,  0.366974230000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 52    coordinates: [  0.684930530000000,  0.383025770000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 52  - symbol: S  # 53    coordinates: [  0.804274730000000,  0.675114940000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 54    coordinates: [  0.600330440000000,  0.728275200000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 55    coordinates: [  0.945725270000000,  0.925114940000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 56    coordinates: [  0.850330440000000,  0.521724800000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 57    coordinates: [  0.695725270000000,  0.824885060000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 58    coordinates: [  0.565069470000000,  0.633025770000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 59    coordinates: [  0.899669560000000,  0.771724800000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 60    coordinates: [  0.554274730000000,  0.574885060000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 61    coordinates: [  0.649669560000000,  0.978275200000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 62    coordinates: [  0.815069470000000,  0.616974230000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 63    coordinates: [  0.934930530000000,  0.866974230000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 64    coordinates: [  0.684930530000000,  0.883025770000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 52  - symbol: S  # 65    coordinates: [  0.304274730000000,  0.175114940000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 66    coordinates: [  0.100330440000000,  0.228275200000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 67    coordinates: [  0.445725270000000,  0.425114940000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 68    coordinates: [  0.350330440000000,  0.021724800000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 69    coordinates: [  0.195725270000000,  0.324885060000000,  0.031613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 70    coordinates: [  0.065069470000000,  0.133025770000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 71    coordinates: [  0.399669560000000,  0.271724800000000,  0.664032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 72    coordinates: [  0.054274730000000,  0.074885060000000,  0.781613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 73    coordinates: [  0.149669560000000,  0.478275200000000,  0.914032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 74    coordinates: [  0.315069470000000,  0.116974230000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 75    coordinates: [  0.434930530000000,  0.366974230000000,  0.244299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 76    coordinates: [  0.184930530000000,  0.383025770000000,  0.494299070000000 ]    mass: 32.065000    reduced_to: 52  - symbol: S  # 77    coordinates: [  0.304274730000000,  0.675114940000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 41  - symbol: S  # 78    coordinates: [  0.100330440000000,  0.728275200000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 42  - symbol: S  # 79    coordinates: [  0.445725270000000,  0.925114940000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 43  - symbol: S  # 80    coordinates: [  0.350330440000000,  0.521724800000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 44  - symbol: S  # 81    coordinates: [  0.195725270000000,  0.824885060000000,  0.531613680000000 ]    mass: 32.065000    reduced_to: 45  - symbol: S  # 82    coordinates: [  0.065069470000000,  0.633025770000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 46  - symbol: S  # 83    coordinates: [  0.399669560000000,  0.771724800000000,  0.164032410000000 ]    mass: 32.065000    reduced_to: 47  - symbol: S  # 84    coordinates: [  0.054274730000000,  0.574885060000000,  0.281613680000000 ]    mass: 32.065000    reduced_to: 48  - symbol: S  # 85    coordinates: [  0.149669560000000,  0.978275200000000,  0.414032410000000 ]    mass: 32.065000    reduced_to: 49  - symbol: S  # 86    coordinates: [  0.315069470000000,  0.616974230000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 50  - symbol: S  # 87    coordinates: [  0.434930530000000,  0.866974230000000,  0.744299070000000 ]    mass: 32.065000    reduced_to: 51  - symbol: S  # 88    coordinates: [  0.184930530000000,  0.883025770000000,  0.994299070000000 ]    mass: 32.065000    reduced_to: 52displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0130596300000000,  0.0063159300000000,  0.0047378400000000 ]  - [  -0.0002593900000000, -0.0001034500000000,  0.0001511900000000 ]  - [   0.0004788500000000,  0.0001040300000000,  0.0002277400000000 ]  - [  -0.0002965300000000, -0.0002493400000000,  0.0001478700000000 ]  - [   0.0002173900000000,  0.0001087800000000,  0.0001401300000000 ]  - [  -0.0013080400000000, -0.0008671700000000, -0.0005019700000000 ]  - [   0.0002282400000000, -0.0001800700000000,  0.0001266600000000 ]  - [  -0.0002963700000000,  0.0001760600000000,  0.0001027100000000 ]  - [   0.0010107600000000,  0.0000575700000000,  0.0000019600000000 ]  - [  -0.0002096300000000, -0.0001273900000000,  0.0001491000000000 ]  - [   0.0004781200000000, -0.0004591200000000,  0.0002646100000000 ]  - [  -0.0001160500000000,  0.0002051600000000,  0.0001505000000000 ]  - [   0.0002431000000000,  0.0001041500000000,  0.0001485800000000 ]  - [   0.0005859200000000,  0.0002806400000000,  0.0004276300000000 ]  - [   0.0002279200000000, -0.0000622100000000,  0.0001676800000000 ]  - [  -0.0001168700000000, -0.0000272100000000,  0.0001609500000000 ]  - [  -0.0049849500000000, -0.0016609100000000, -0.0010004600000000 ]  - [  -0.0001465200000000,  0.0006130500000000,  0.0000326100000000 ]  - [   0.0013935100000000,  0.0032054000000000, -0.0014328600000000 ]  - [  -0.0000761100000000, -0.0002897000000000, -0.0000240700000000 ]  - [  -0.0000808100000000, -0.0002173700000000,  0.0001390100000000 ]  - [  -0.0008246500000000, -0.0007232700000000, -0.0000389700000000 ]  - [  -0.0000520800000000,  0.0002425700000000,  0.0001571500000000 ]  - [   0.0000086200000000,  0.0010999700000000,  0.0005078100000000 ]  - [   0.0014769500000000,  0.0002609900000000,  0.0001952600000000 ]  - [   0.0000603600000000, -0.0000468700000000,  0.0002322000000000 ]  - [   0.0029131400000000, -0.0006820000000000, -0.0000407700000000 ]  - [   0.0002078200000000, -0.0002861100000000,  0.0001571700000000 ]  - [  -0.0000094800000000, -0.0003050700000000,  0.0000947300000000 ]  - [   0.0007533900000000,  0.0007657100000000,  0.0003403600000000 ]  - [  -0.0000322700000000,  0.0002478800000000,  0.0001120800000000 ]  - [   0.0004284500000000, -0.0009011400000000, -0.0001777500000000 ]  - [  -0.0021342000000000,  0.0011593400000000, -0.0014705400000000 ]  - [   0.0009181300000000,  0.0030648900000000, -0.0002104800000000 ]  - [  -0.0003481400000000,  0.0000989700000000,  0.0002327400000000 ]  - [  -0.0000545700000000, -0.0000451700000000,  0.0000003600000000 ]  - [   0.0006491100000000, -0.0003474000000000,  0.0002613100000000 ]  - [   0.0041713400000000, -0.0012237300000000,  0.0026694500000000 ]  - [   0.0002882500000000, -0.0000929900000000, -0.0002630900000000 ]  - [   0.0000470900000000,  0.0000344100000000, -0.0001413500000000 ]  - [   0.0009789900000000, -0.0013441300000000,  0.0004198400000000 ]  - [   0.0009952500000000,  0.0004763900000000,  0.0008838300000000 ]  - [  -0.0000382700000000,  0.0001410300000000, -0.0000351800000000 ]  - [   0.0022262900000000, -0.0014328100000000, -0.0028026800000000 ]  - [   0.0004012900000000, -0.0003125300000000,  0.0002961500000000 ]  - [   0.0036732900000000, -0.0039374600000000, -0.0021566100000000 ]  - [   0.0005181500000000, -0.0004579400000000,  0.0004488800000000 ]  - [   0.0028921600000000, -0.0005135100000000,  0.0014170500000000 ]  - [   0.0004012700000000, -0.0001422300000000,  0.0001466900000000 ]  - [   0.0008770800000000, -0.0003262800000000, -0.0007880800000000 ]  - [   0.0001107600000000, -0.0001847400000000, -0.0002408400000000 ]  - [   0.0002982300000000,  0.0001082900000000, -0.0003139800000000 ]  - [   0.0000910200000000,  0.0001968000000000, -0.0001209100000000 ]  - [  -0.0002903100000000, -0.0001194800000000,  0.0001034800000000 ]  - [  -0.0001399000000000,  0.0012098400000000, -0.0003537000000000 ]  - [  -0.0003515400000000,  0.0000658100000000,  0.0001448300000000 ]  - [   0.0002011700000000, -0.0006011600000000, -0.0001787500000000 ]  - [  -0.0001594300000000,  0.0000644900000000, -0.0003220600000000 ]  - [   0.0006474900000000,  0.0002781400000000,  0.0000728900000000 ]  - [   0.0000261600000000, -0.0002142300000000, -0.0000675700000000 ]  - [   0.0020576200000000, -0.0019841300000000,  0.0005485700000000 ]  - [  -0.0001496500000000, -0.0000622600000000, -0.0003240900000000 ]  - [   0.0001276500000000,  0.0005120100000000, -0.0003004500000000 ]  - [   0.0009155900000000,  0.0001486600000000, -0.0005252000000000 ]  - [  -0.0006717000000000,  0.0007718100000000,  0.0000693900000000 ]  - [  -0.0008819100000000, -0.0001964000000000, -0.0000216900000000 ]  - [   0.0000282900000000,  0.0003195600000000, -0.0000711600000000 ]  - [  -0.0014380500000000, -0.0002622200000000,  0.0001556200000000 ]  - [  -0.0001855300000000, -0.0001396000000000, -0.0000960600000000 ]  - [  -0.0012338700000000, -0.0005526900000000, -0.0004108700000000 ]  - [   0.0001448900000000,  0.0003520200000000,  0.0001032900000000 ]  - [  -0.0009454900000000, -0.0007153700000000, -0.0005006100000000 ]  - [   0.0003069300000000, -0.0000588400000000,  0.0001497500000000 ]  - [  -0.0012152100000000, -0.0000885200000000, -0.0005261900000000 ]  - [   0.0002249800000000, -0.0000182100000000, -0.0003363700000000 ]  - [   0.0000580700000000,  0.0001394300000000, -0.0003343300000000 ]  - [  -0.0000571000000000,  0.0002504200000000, -0.0000040100000000 ]  - [  -0.0004308600000000, -0.0000436100000000,  0.0001562700000000 ]  - [  -0.0002988100000000, -0.0005080100000000, -0.0004522300000000 ]  - [  -0.0003582100000000,  0.0001117600000000,  0.0001378500000000 ]  - [  -0.0001832900000000, -0.0000035100000000, -0.0000070000000000 ]  - [  -0.0001758000000000,  0.0001012800000000, -0.0003202600000000 ]  - [   0.0001293900000000, -0.0000880100000000,  0.0001983600000000 ]  - [  -0.0000074200000000, -0.0002332500000000, -0.0000377400000000 ]  - [  -0.0011176100000000,  0.0005068900000000,  0.0001160800000000 ]  - [  -0.0002204600000000, -0.0000859400000000, -0.0003322400000000 ]  - [   0.0001165500000000, -0.0004062100000000, -0.0003272600000000 ]  - [  -0.0002783500000000,  0.0000308800000000, -0.0001957800000000 ]- atom:    1  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0134020700000000, -0.0061877800000000, -0.0042807000000000 ]  - [  -0.0002025800000000, -0.0001187000000000,  0.0001431400000000 ]  - [  -0.0000138000000000, -0.0003273400000000,  0.0000664600000000 ]  - [  -0.0001660700000000,  0.0004716700000000,  0.0001458900000000 ]  - [   0.0002436100000000,  0.0001140300000000,  0.0001535800000000 ]  - [   0.0008397600000000,  0.0006388200000000,  0.0007950900000000 ]  - [   0.0002341800000000, -0.0000446400000000,  0.0001675100000000 ]  - [  -0.0001632500000000,  0.0000463800000000,  0.0001913300000000 ]  - [  -0.0005478000000000,  0.0001668200000000,  0.0002930100000000 ]  - [  -0.0002504900000000, -0.0000941000000000,  0.0001453300000000 ]  - [  -0.0000167100000000,  0.0002365900000000,  0.0000292800000000 ]  - [  -0.0003477300000000,  0.0000213400000000,  0.0001436000000000 ]  - [   0.0002183200000000,  0.0001191600000000,  0.0001459700000000 ]  - [  -0.0010534600000000, -0.0005068400000000, -0.0001341200000000 ]  - [   0.0002332600000000, -0.0001600400000000,  0.0001258500000000 ]  - [  -0.0003474500000000,  0.0002522200000000,  0.0001328300000000 ]  - [   0.0048971600000000,  0.0011532900000000,  0.0012312100000000 ]  - [   0.0002231500000000, -0.0001083100000000,  0.0002049900000000 ]  - [  -0.0014607400000000, -0.0026939900000000,  0.0016617600000000 ]  - [   0.0001538000000000, -0.0002126000000000,  0.0002625900000000 ]  - [   0.0000030200000000, -0.0002853900000000,  0.0000996800000000 ]  - [   0.0008947200000000,  0.0012201200000000,  0.0002786800000000 ]  - [  -0.0000279000000000,  0.0002611200000000,  0.0000829200000000 ]  - [   0.0000733200000000, -0.0015939200000000, -0.0002646200000000 ]  - [  -0.0015533600000000, -0.0007620200000000,  0.0000425500000000 ]  - [   0.0000176600000000,  0.0005497700000000,  0.0000065500000000 ]  - [  -0.0029878600000000,  0.0012071300000000,  0.0002871700000000 ]  - [  -0.0001295900000000, -0.0002174400000000,  0.0000820800000000 ]  - [  -0.0000703300000000, -0.0001972300000000,  0.0001428400000000 ]  - [  -0.0006746200000000, -0.0002631700000000, -0.0001012900000000 ]  - [  -0.0000473400000000,  0.0002546800000000,  0.0001281600000000 ]  - [  -0.0003491200000000,  0.0003974700000000,  0.0004165100000000 ]  - [   0.0021287700000000, -0.0011557500000000,  0.0013251500000000 ]  - [  -0.0009002900000000, -0.0030679400000000,  0.0000742800000000 ]  - [   0.0003451700000000, -0.0000968400000000, -0.0003710800000000 ]  - [   0.0000526700000000,  0.0000455400000000, -0.0001392300000000 ]  - [  -0.0006474300000000,  0.0003461300000000, -0.0003997600000000 ]  - [  -0.0041516100000000,  0.0012178700000000, -0.0028245800000000 ]  - [  -0.0002896700000000,  0.0000937100000000,  0.0001237900000000 ]  - [  -0.0000468800000000, -0.0000324400000000, -0.0000005100000000 ]  - [  -0.0009533500000000,  0.0018062300000000, -0.0005332600000000 ]  - [  -0.0017014600000000, -0.0006601400000000, -0.0006007600000000 ]  - [   0.0000186800000000,  0.0003213200000000, -0.0000795100000000 ]  - [  -0.0027013600000000,  0.0015475900000000,  0.0029431500000000 ]  - [  -0.0004148200000000, -0.0001556500000000, -0.0004043200000000 ]  - [  -0.0040934700000000,  0.0042195000000000,  0.0015864600000000 ]  - [   0.0001898900000000,  0.0006443100000000, -0.0001674300000000 ]  - [  -0.0029024100000000,  0.0000554800000000, -0.0015899800000000 ]  - [   0.0003086700000000, -0.0000389300000000,  0.0001378000000000 ]  - [  -0.0012289900000000,  0.0001683800000000,  0.0001593000000000 ]  - [   0.0002354800000000,  0.0000274000000000, -0.0003860400000000 ]  - [   0.0000690200000000,  0.0000442700000000, -0.0003221000000000 ]  - [  -0.0000767600000000,  0.0002705400000000,  0.0000127000000000 ]  - [  -0.0004189600000000, -0.0000652400000000,  0.0001795100000000 ]  - [   0.0001220200000000, -0.0007371500000000,  0.0002440100000000 ]  - [  -0.0003593900000000,  0.0001127900000000,  0.0001404400000000 ]  - [  -0.0002186300000000,  0.0001331000000000,  0.0000638300000000 ]  - [  -0.0001902300000000,  0.0000914000000000, -0.0003106800000000 ]  - [   0.0000626200000000, -0.0000951400000000,  0.0002095400000000 ]  - [  -0.0000097200000000, -0.0002523000000000, -0.0000459400000000 ]  - [  -0.0013616900000000,  0.0018160400000000, -0.0002869400000000 ]  - [  -0.0002148200000000, -0.0000914200000000, -0.0003155200000000 ]  - [   0.0002302400000000, -0.0006669100000000, -0.0003346600000000 ]  - [  -0.0005582100000000,  0.0000028300000000, -0.0001051000000000 ]  - [   0.0006803600000000, -0.0003018300000000, -0.0001769800000000 ]  - [   0.0001704000000000,  0.0000126100000000,  0.0003055900000000 ]  - [  -0.0000461100000000,  0.0001455900000000, -0.0000441000000000 ]  - [   0.0007261600000000,  0.0004407200000000,  0.0001173800000000 ]  - [   0.0001719900000000, -0.0003303400000000, -0.0000115400000000 ]  - [   0.0008615900000000,  0.0007058800000000, -0.0002244000000000 ]  - [   0.0005640300000000, -0.0001645700000000,  0.0001777500000000 ]  - [   0.0009550700000000,  0.0002470100000000,  0.0003914700000000 ]  - [   0.0004010900000000, -0.0001169700000000,  0.0001357000000000 ]  - [   0.0008584300000000, -0.0000697200000000, -0.0001073000000000 ]  - [   0.0001246500000000, -0.0001383800000000, -0.0002925600000000 ]  - [   0.0003090800000000,  0.0000155500000000, -0.0003052600000000 ]  - [   0.0000686700000000,  0.0002190400000000, -0.0001032800000000 ]  - [  -0.0002793600000000, -0.0001440000000000,  0.0001254000000000 ]  - [   0.0002735500000000,  0.0009669500000000,  0.0003388100000000 ]  - [  -0.0003513300000000,  0.0000666000000000,  0.0001477300000000 ]  - [   0.0001669900000000, -0.0004649400000000, -0.0001062300000000 ]  - [  -0.0001719000000000,  0.0000549200000000, -0.0003074300000000 ]  - [   0.0005780300000000,  0.0002831100000000,  0.0000805000000000 ]  - [   0.0000243400000000, -0.0002296300000000, -0.0000782000000000 ]  - [   0.0018303100000000, -0.0006891300000000,  0.0001692800000000 ]  - [  -0.0001473900000000, -0.0000685300000000, -0.0003078400000000 ]  - [   0.0002372800000000,  0.0002506400000000, -0.0002956000000000 ]  - [   0.0006471300000000,  0.0001237700000000, -0.0004372900000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0066333300000000, -0.0139316000000000, -0.0011034600000000 ]  - [  -0.0002303500000000,  0.0001638900000000,  0.0001718700000000 ]  - [   0.0005855800000000, -0.0001722800000000,  0.0004277700000000 ]  - [  -0.0003004100000000,  0.0004942100000000,  0.0001831300000000 ]  - [   0.0002347200000000,  0.0003812400000000,  0.0001206800000000 ]  - [  -0.0009910100000000, -0.0002098400000000,  0.0001274900000000 ]  - [   0.0001889400000000,  0.0001222700000000,  0.0001799300000000 ]  - [   0.0001211100000000,  0.0004950300000000,  0.0002951100000000 ]  - [   0.0001832800000000, -0.0003203600000000,  0.0001153300000000 ]  - [  -0.0002523300000000,  0.0001077900000000,  0.0001597800000000 ]  - [   0.0000221200000000, -0.0001735900000000,  0.0000742900000000 ]  - [  -0.0000961700000000,  0.0002268600000000,  0.0001947200000000 ]  - [   0.0002278700000000,  0.0003477300000000,  0.0001375300000000 ]  - [   0.0001550800000000, -0.0005065200000000, -0.0001024300000000 ]  - [   0.0003060500000000,  0.0001220100000000,  0.0001270800000000 ]  - [  -0.0003292300000000,  0.0002287700000000,  0.0000896900000000 ]  - [   0.0003155100000000, -0.0006893500000000,  0.0028988100000000 ]  - [   0.0000089900000000,  0.0010399900000000,  0.0001478000000000 ]  - [   0.0020049700000000, -0.0029309000000000, -0.0000772200000000 ]  - [  -0.0001471600000000,  0.0004196900000000, -0.0000365200000000 ]  - [  -0.0000235000000000,  0.0004611000000000,  0.0001673700000000 ]  - [  -0.0016330500000000,  0.0004736800000000, -0.0001107100000000 ]  - [  -0.0001398800000000,  0.0008664000000000,  0.0001793200000000 ]  - [   0.0006285900000000,  0.0018990200000000, -0.0009066800000000 ]  - [  -0.0005054600000000, -0.0008400900000000,  0.0005332100000000 ]  - [   0.0000609500000000,  0.0007540900000000,  0.0001768000000000 ]  - [  -0.0031424800000000, -0.0017097500000000,  0.0001566100000000 ]  - [   0.0001633200000000,  0.0001751700000000,  0.0001395100000000 ]  - [   0.0000025200000000,  0.0002157900000000,  0.0000315600000000 ]  - [   0.0004579000000000,  0.0006401300000000, -0.0000774300000000 ]  - [  -0.0000123700000000,  0.0007645600000000,  0.0001229900000000 ]  - [  -0.0002346800000000, -0.0005288900000000, -0.0000992000000000 ]  - [  -0.0008634800000000,  0.0016772800000000, -0.0011609000000000 ]  - [   0.0039077400000000, -0.0049599400000000, -0.0011891700000000 ]  - [  -0.0001070100000000,  0.0009660500000000, -0.0000705100000000 ]  - [  -0.0001429400000000,  0.0006871400000000,  0.0000042700000000 ]  - [  -0.0002332400000000,  0.0004404300000000, -0.0001702400000000 ]  - [  -0.0008835600000000, -0.0006730800000000, -0.0006815400000000 ]  - [   0.0001942300000000,  0.0004695400000000, -0.0001602700000000 ]  - [  -0.0000929800000000,  0.0006927700000000, -0.0001349000000000 ]  - [   0.0000575800000000, -0.0010086600000000,  0.0005916600000000 ]  - [  -0.0004191800000000, -0.0001698800000000,  0.0000478700000000 ]  - [  -0.0001177600000000, -0.0002453200000000, -0.0000546500000000 ]  - [  -0.0013122800000000,  0.0021179300000000,  0.0009608800000000 ]  - [   0.0001758600000000, -0.0009104200000000,  0.0000044900000000 ]  - [  -0.0052859000000000,  0.0107518100000000,  0.0035382000000000 ]  - [   0.0001727100000000, -0.0007446900000000,  0.0006354500000000 ]  - [  -0.0005424800000000,  0.0040417000000000, -0.0017915400000000 ]  - [   0.0004738400000000, -0.0005782200000000,  0.0000713900000000 ]  - [  -0.0007003700000000,  0.0007442900000000, -0.0011942400000000 ]  - [   0.0000758100000000, -0.0004166600000000, -0.0001909100000000 ]  - [   0.0001966800000000, -0.0002177700000000, -0.0003389400000000 ]  - [   0.0001678500000000, -0.0002704000000000, -0.0000928500000000 ]  - [  -0.0004560200000000, -0.0007513700000000,  0.0000747500000000 ]  - [   0.0005314500000000,  0.0006481700000000, -0.0001518700000000 ]  - [  -0.0002589800000000, -0.0003622800000000,  0.0002247400000000 ]  - [   0.0001635200000000, -0.0008107000000000,  0.0000552100000000 ]  - [  -0.0002096500000000, -0.0002259300000000, -0.0003559000000000 ]  - [   0.0006811800000000, -0.0003565500000000,  0.0002869600000000 ]  - [  -0.0000966600000000, -0.0007264000000000, -0.0000887600000000 ]  - [  -0.0013886800000000,  0.0039440000000000, -0.0014308500000000 ]  - [  -0.0001728500000000, -0.0003852000000000, -0.0002895200000000 ]  - [   0.0006039900000000, -0.0000078600000000, -0.0003275400000000 ]  - [   0.0007770200000000, -0.0014372400000000, -0.0001463700000000 ]  - [   0.0009563100000000, -0.0001367300000000, -0.0004359500000000 ]  - [  -0.0002765900000000,  0.0000472800000000,  0.0001516900000000 ]  - [  -0.0000820700000000, -0.0001889300000000, -0.0000906600000000 ]  - [  -0.0003307200000000,  0.0017973500000000,  0.0004014100000000 ]  - [   0.0000422300000000, -0.0004603600000000, -0.0000378100000000 ]  - [  -0.0001619400000000,  0.0009729300000000, -0.0004325000000000 ]  - [   0.0003808200000000, -0.0002008200000000,  0.0001937300000000 ]  - [   0.0003475700000000,  0.0005888900000000,  0.0000558800000000 ]  - [   0.0003857500000000, -0.0004803500000000,  0.0000911500000000 ]  - [   0.0004495500000000,  0.0003519900000000, -0.0002610400000000 ]  - [   0.0002593400000000, -0.0003547100000000, -0.0002789900000000 ]  - [   0.0002104800000000, -0.0001381200000000, -0.0003416900000000 ]  - [   0.0000314600000000, -0.0001068700000000, -0.0000537800000000 ]  - [  -0.0004110500000000, -0.0004128900000000,  0.0001037700000000 ]  - [  -0.0008818100000000,  0.0003643600000000,  0.0003531200000000 ]  - [  -0.0002807800000000, -0.0003047200000000,  0.0002104900000000 ]  - [  -0.0000045900000000, -0.0003921500000000, -0.0000688600000000 ]  - [  -0.0001322700000000, -0.0002053500000000, -0.0003150700000000 ]  - [   0.0001760500000000, -0.0001555700000000,  0.0002577200000000 ]  - [  -0.0000752600000000, -0.0006416200000000, -0.0000464300000000 ]  - [   0.0006764700000000,  0.0002743600000000,  0.0002521100000000 ]  - [  -0.0002097800000000, -0.0003254000000000, -0.0002774700000000 ]  - [  -0.0003430800000000, -0.0003194100000000, -0.0000774900000000 ]  - [   0.0001157200000000,  0.0001181000000000, -0.0002724400000000 ]- atom:    1  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0058843900000000,  0.0139603100000000,  0.0010526600000000 ]  - [  -0.0002339200000000, -0.0003909800000000,  0.0001223300000000 ]  - [  -0.0001197300000000, -0.0000561400000000, -0.0001307000000000 ]  - [  -0.0001641700000000, -0.0002701300000000,  0.0001098300000000 ]  - [   0.0002298400000000, -0.0001541900000000,  0.0001730500000000 ]  - [   0.0005276100000000, -0.0000124700000000,  0.0001670500000000 ]  - [   0.0002763100000000, -0.0003503900000000,  0.0001134500000000 ]  - [  -0.0005896900000000, -0.0002700200000000, -0.0000049100000000 ]  - [   0.0002810400000000,  0.0005470800000000,  0.0001784400000000 ]  - [  -0.0002113400000000, -0.0003335200000000,  0.0001339000000000 ]  - [   0.0004412300000000, -0.0000551900000000,  0.0002190800000000 ]  - [  -0.0003653300000000, -0.0000014300000000,  0.0000984000000000 ]  - [   0.0002354000000000, -0.0001210000000000,  0.0001565400000000 ]  - [  -0.0006224800000000,  0.0002817300000000,  0.0003955200000000 ]  - [   0.0001585700000000, -0.0003494900000000,  0.0001669200000000 ]  - [  -0.0001337100000000, -0.0000014600000000,  0.0002035000000000 ]  - [  -0.0004011500000000,  0.0001715800000000, -0.0026633900000000 ]  - [   0.0000665200000000, -0.0005322300000000,  0.0000878900000000 ]  - [  -0.0020756200000000,  0.0034130000000000,  0.0003044800000000 ]  - [   0.0002238000000000, -0.0009251300000000,  0.0002719900000000 ]  - [  -0.0000507100000000, -0.0009689700000000,  0.0000655600000000 ]  - [   0.0017297200000000,  0.0000334100000000,  0.0003485500000000 ]  - [   0.0000626900000000, -0.0003618700000000,  0.0000569700000000 ]  - [  -0.0005598200000000, -0.0024065600000000,  0.0011737500000000 ]  - [   0.0004316100000000,  0.0003312200000000, -0.0002967700000000 ]  - [   0.0000149500000000, -0.0002530100000000,  0.0000586400000000 ]  - [   0.0030747000000000,  0.0022188100000000,  0.0000753600000000 ]  - [  -0.0000850300000000, -0.0006823400000000,  0.0000967200000000 ]  - [  -0.0000786700000000, -0.0007198400000000,  0.0002024500000000 ]  - [  -0.0003832900000000, -0.0001343300000000,  0.0003149200000000 ]  - [  -0.0000657800000000, -0.0002604600000000,  0.0001153400000000 ]  - [   0.0003128700000000,  0.0000296500000000,  0.0003361200000000 ]  - [   0.0008457600000000, -0.0016643300000000,  0.0010065600000000 ]  - [  -0.0039035900000000,  0.0049727000000000,  0.0010457400000000 ]  - [   0.0001062300000000, -0.0009679600000000, -0.0000657700000000 ]  - [   0.0001426100000000, -0.0006877100000000, -0.0001457200000000 ]  - [   0.0002346200000000, -0.0004434100000000,  0.0000312100000000 ]  - [   0.0008693400000000,  0.0006812300000000,  0.0005177200000000 ]  - [  -0.0001956300000000, -0.0004678800000000,  0.0000207400000000 ]  - [   0.0000935800000000, -0.0006928600000000, -0.0000075900000000 ]  - [  -0.0000433200000000,  0.0014633700000000, -0.0007029600000000 ]  - [  -0.0002806700000000, -0.0000145000000000,  0.0002463900000000 ]  - [   0.0001008500000000,  0.0007115000000000, -0.0000711800000000 ]  - [   0.0006226100000000, -0.0019290400000000, -0.0006630600000000 ]  - [  -0.0001871600000000,  0.0004412700000000, -0.0001267600000000 ]  - [   0.0046537400000000, -0.0103088700000000, -0.0039679400000000 ]  - [   0.0005320200000000,  0.0009273800000000, -0.0003418700000000 ]  - [   0.0005627500000000, -0.0045082400000000,  0.0016541300000000 ]  - [   0.0002300700000000,  0.0003952100000000,  0.0002184400000000 ]  - [   0.0003360600000000, -0.0008958400000000,  0.0005758600000000 ]  - [   0.0002775900000000,  0.0002566800000000, -0.0004304100000000 ]  - [   0.0001713800000000,  0.0003749100000000, -0.0002852900000000 ]  - [  -0.0001560900000000,  0.0007416700000000, -0.0000273000000000 ]  - [  -0.0002467500000000,  0.0005659400000000,  0.0002134300000000 ]  - [  -0.0005548400000000, -0.0001915700000000,  0.0000245700000000 ]  - [  -0.0004458300000000,  0.0005428100000000,  0.0000673100000000 ]  - [  -0.0001745000000000,  0.0003364700000000, -0.0001814300000000 ]  - [  -0.0001519400000000,  0.0003822400000000, -0.0002625600000000 ]  - [   0.0000184100000000,  0.0005502400000000, -0.0000034400000000 ]  - [   0.0001121900000000,  0.0002618900000000, -0.0000382300000000 ]  - [   0.0020787300000000, -0.0042046200000000,  0.0018493600000000 ]  - [  -0.0001987500000000,  0.0002307600000000, -0.0003393000000000 ]  - [  -0.0002554100000000, -0.0001551700000000, -0.0002869500000000 ]  - [  -0.0004065700000000,  0.0016132600000000, -0.0004842600000000 ]  - [  -0.0009444800000000,  0.0006082600000000,  0.0003143500000000 ]  - [  -0.0004296100000000, -0.0002312100000000,  0.0001389100000000 ]  - [   0.0000646700000000,  0.0006531900000000, -0.0000366800000000 ]  - [  -0.0003747900000000, -0.0016141200000000, -0.0001130100000000 ]  - [  -0.0000561200000000, -0.0000089900000000, -0.0000842200000000 ]  - [  -0.0002069800000000, -0.0008127100000000, -0.0001922900000000 ]  - [   0.0003219000000000,  0.0003935800000000,  0.0000928400000000 ]  - [  -0.0003317700000000, -0.0010542100000000, -0.0001781700000000 ]  - [   0.0003173700000000,  0.0002995400000000,  0.0002013800000000 ]  - [  -0.0008103300000000, -0.0005097900000000, -0.0003636500000000 ]  - [   0.0000992900000000,  0.0001970800000000, -0.0003366800000000 ]  - [   0.0001653600000000,  0.0002928900000000, -0.0002889900000000 ]  - [  -0.0000159200000000,  0.0005747000000000, -0.0000706400000000 ]  - [  -0.0002931300000000,  0.0002229500000000,  0.0001838900000000 ]  - [   0.0008611500000000,  0.0000960600000000, -0.0004786500000000 ]  - [  -0.0004231700000000,  0.0004916000000000,  0.0000782000000000 ]  - [  -0.0000076200000000, -0.0000799300000000, -0.0000526400000000 ]  - [  -0.0002225400000000,  0.0003633800000000, -0.0003042600000000 ]  - [   0.0005291600000000,  0.0003440300000000,  0.0000286000000000 ]  - [   0.0000918200000000,  0.0001773600000000, -0.0000793000000000 ]  - [   0.0000355600000000, -0.0004615100000000,  0.0000410600000000 ]  - [  -0.0001611400000000,  0.0001689900000000, -0.0003452700000000 ]  - [   0.0006988700000000,  0.0001596300000000, -0.0005408300000000 ]  - [   0.0002629300000000,  0.0000360500000000, -0.0003570600000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0047896900000000, -0.0009243400000000, -0.0124940900000000 ]  - [  -0.0002336500000000, -0.0001362900000000,  0.0001439400000000 ]  - [   0.0003477600000000, -0.0000379100000000, -0.0000926800000000 ]  - [  -0.0001842600000000,  0.0002603100000000,  0.0002378700000000 ]  - [   0.0002226100000000,  0.0000843300000000,  0.0001530200000000 ]  - [   0.0004222700000000, -0.0000907300000000,  0.0008100500000000 ]  - [   0.0002495700000000, -0.0000901800000000,  0.0001635600000000 ]  - [  -0.0002284400000000,  0.0001457700000000,  0.0002382500000000 ]  - [   0.0000840600000000,  0.0000801200000000,  0.0001939900000000 ]  - [  -0.0002309500000000, -0.0001241900000000,  0.0001483300000000 ]  - [   0.0003079200000000, -0.0003878500000000, -0.0000919600000000 ]  - [  -0.0002425500000000,  0.0000528300000000,  0.0001622600000000 ]  - [   0.0002304800000000,  0.0001015000000000,  0.0001493800000000 ]  - [  -0.0005078900000000,  0.0001401900000000,  0.0000875500000000 ]  - [   0.0002098900000000, -0.0001454400000000,  0.0001639000000000 ]  - [  -0.0002320700000000,  0.0001584000000000,  0.0001623200000000 ]  - [  -0.0022737800000000, -0.0005694900000000,  0.0044804400000000 ]  - [   0.0000154900000000,  0.0001974100000000,  0.0000745800000000 ]  - [  -0.0004787900000000, -0.0016785300000000,  0.0023366700000000 ]  - [   0.0000745100000000, -0.0003239200000000,  0.0001571700000000 ]  - [  -0.0000373400000000, -0.0003280600000000,  0.0001178800000000 ]  - [   0.0000386500000000,  0.0005304400000000,  0.0000274200000000 ]  - [   0.0000228500000000,  0.0001971100000000,  0.0000285000000000 ]  - [   0.0000709800000000, -0.0025345500000000, -0.0019809500000000 ]  - [  -0.0002799000000000, -0.0003834200000000,  0.0003069800000000 ]  - [   0.0000690300000000,  0.0003538100000000,  0.0000356800000000 ]  - [  -0.0017228700000000, -0.0003882000000000,  0.0007166400000000 ]  - [   0.0000072600000000, -0.0002956700000000,  0.0001349800000000 ]  - [  -0.0000316100000000, -0.0002319400000000,  0.0001394000000000 ]  - [  -0.0002616800000000,  0.0002987400000000,  0.0004872800000000 ]  - [  -0.0000698100000000,  0.0002403000000000,  0.0001280700000000 ]  - [   0.0000258200000000,  0.0002718400000000,  0.0002362400000000 ]  - [   0.0000640300000000, -0.0002186300000000,  0.0002809800000000 ]  - [  -0.0021513500000000,  0.0049698500000000,  0.0045238200000000 ]  - [   0.0002492100000000, -0.0001976700000000, -0.0006350500000000 ]  - [   0.0000193900000000, -0.0000344800000000, -0.0001050400000000 ]  - [  -0.0002801600000000, -0.0001107000000000, -0.0000962300000000 ]  - [  -0.0010524300000000,  0.0007203600000000, -0.0026470800000000 ]  - [  -0.0000677100000000,  0.0000386100000000, -0.0000337900000000 ]  - [   0.0000312600000000, -0.0000391600000000, -0.0000581200000000 ]  - [   0.0003373100000000,  0.0009516300000000, -0.0004353200000000 ]  - [  -0.0001495900000000,  0.0002445600000000, -0.0000170600000000 ]  - [   0.0000012800000000,  0.0002528100000000, -0.0000464000000000 ]  - [  -0.0024922400000000,  0.0009332200000000,  0.0042985200000000 ]  - [  -0.0000887700000000, -0.0001245400000000, -0.0000693200000000 ]  - [  -0.0013058000000000,  0.0033994000000000,  0.0002935600000000 ]  - [   0.0003903200000000,  0.0000621700000000,  0.0000719500000000 ]  - [   0.0019868600000000, -0.0018962600000000, -0.0003835100000000 ]  - [   0.0003369500000000, -0.0000357400000000,  0.0001479400000000 ]  - [  -0.0003396900000000,  0.0000252000000000, -0.0023183200000000 ]  - [   0.0001908700000000, -0.0000382100000000, -0.0003273900000000 ]  - [   0.0001812900000000,  0.0001321300000000, -0.0003227100000000 ]  - [  -0.0001318100000000,  0.0004177700000000,  0.0000590500000000 ]  - [  -0.0003562800000000, -0.0000571900000000,  0.0002249600000000 ]  - [  -0.0001954800000000, -0.0000065000000000,  0.0003728100000000 ]  - [  -0.0003802700000000,  0.0001580000000000,  0.0001441400000000 ]  - [  -0.0002909100000000,  0.0005399100000000,  0.0002640200000000 ]  - [  -0.0001589800000000,  0.0001101100000000, -0.0003006900000000 ]  - [   0.0002954600000000, -0.0000154100000000,  0.0002539000000000 ]  - [   0.0000122600000000, -0.0002046400000000, -0.0000498200000000 ]  - [   0.0014238700000000, -0.0029381300000000,  0.0038777200000000 ]  - [  -0.0001966600000000, -0.0000672900000000, -0.0003205800000000 ]  - [   0.0001159200000000, -0.0003165100000000, -0.0003052100000000 ]  - [   0.0001128600000000, -0.0003152500000000,  0.0000862000000000 ]  - [   0.0003925700000000,  0.0001723000000000, -0.0003041400000000 ]  - [  -0.0003036600000000,  0.0000466000000000,  0.0001837200000000 ]  - [  -0.0000148700000000,  0.0002232000000000, -0.0000407200000000 ]  - [  -0.0003123800000000, -0.0004831100000000, -0.0009966400000000 ]  - [   0.0000293000000000, -0.0001990800000000, -0.0000611600000000 ]  - [  -0.0000826600000000,  0.0004199700000000, -0.0006008500000000 ]  - [   0.0004733800000000, -0.0000162300000000,  0.0001682800000000 ]  - [   0.0002826400000000, -0.0001338400000000,  0.0002854400000000 ]  - [   0.0003531400000000, -0.0000662900000000,  0.0001433800000000 ]  - [   0.0001276400000000,  0.0000343000000000, -0.0001849400000000 ]  - [   0.0001457800000000, -0.0000722900000000, -0.0003026000000000 ]  - [   0.0002366800000000,  0.0000647100000000, -0.0003030000000000 ]  - [   0.0000371300000000,  0.0002189900000000, -0.0000619400000000 ]  - [  -0.0003439700000000, -0.0001209900000000,  0.0001352500000000 ]  - [   0.0007002800000000, -0.0000414800000000, -0.0011531100000000 ]  - [  -0.0003514800000000,  0.0001061900000000,  0.0001406800000000 ]  - [   0.0000972900000000, -0.0003648500000000, -0.0000250400000000 ]  - [  -0.0001951700000000,  0.0000872400000000, -0.0003133700000000 ]  - [   0.0004048000000000,  0.0000087100000000,  0.0000840900000000 ]  - [   0.0000001900000000, -0.0002255100000000, -0.0000596500000000 ]  - [   0.0013053600000000, -0.0006009700000000,  0.0002283200000000 ]  - [  -0.0001720100000000, -0.0000854600000000, -0.0003207400000000 ]  - [   0.0006356100000000,  0.0002585600000000, -0.0002092100000000 ]  - [   0.0002701200000000, -0.0000124700000000, -0.0004226800000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0042246400000000,  0.0012307000000000,  0.0127661100000000 ]  - [  -0.0002256600000000, -0.0000855800000000,  0.0001497000000000 ]  - [   0.0001131600000000, -0.0001826200000000,  0.0003844700000000 ]  - [  -0.0002736700000000, -0.0000399100000000,  0.0000549600000000 ]  - [   0.0002366400000000,  0.0001374300000000,  0.0001409200000000 ]  - [  -0.0008753400000000, -0.0001307500000000, -0.0005135800000000 ]  - [   0.0002077100000000, -0.0001297300000000,  0.0001300400000000 ]  - [  -0.0002273600000000,  0.0000732500000000,  0.0000554300000000 ]  - [   0.0003743900000000,  0.0001413000000000,  0.0001002600000000 ]  - [  -0.0002290500000000, -0.0000991400000000,  0.0001456500000000 ]  - [   0.0001477100000000,  0.0001698900000000,  0.0003853300000000 ]  - [  -0.0002142200000000,  0.0001669800000000,  0.0001310000000000 ]  - [   0.0002281100000000,  0.0001195200000000,  0.0001443100000000 ]  - [   0.0000517400000000, -0.0003594300000000,  0.0002059500000000 ]  - [   0.0002504200000000, -0.0000784000000000,  0.0001302400000000 ]  - [  -0.0002247700000000,  0.0000620900000000,  0.0001311300000000 ]  - [   0.0021732800000000,  0.0000940600000000, -0.0042433400000000 ]  - [   0.0000627800000000,  0.0003048700000000,  0.0001654900000000 ]  - [   0.0004097600000000,  0.0021719000000000, -0.0020785600000000 ]  - [   0.0000037500000000, -0.0001790500000000,  0.0000851400000000 ]  - [  -0.0000401500000000, -0.0001746800000000,  0.0001216300000000 ]  - [   0.0000367700000000, -0.0000276100000000,  0.0002103800000000 ]  - [  -0.0001009700000000,  0.0003055700000000,  0.0002127200000000 ]  - [   0.0000075300000000,  0.0020255300000000,  0.0022107100000000 ]  - [   0.0002022800000000, -0.0001169700000000, -0.0000664900000000 ]  - [   0.0000080500000000,  0.0001481900000000,  0.0002023900000000 ]  - [   0.0016568300000000,  0.0008971300000000, -0.0004725600000000 ]  - [   0.0000708400000000, -0.0002080700000000,  0.0001066600000000 ]  - [  -0.0000458000000000, -0.0002712400000000,  0.0001008400000000 ]  - [   0.0003378600000000,  0.0002044300000000, -0.0002480800000000 ]  - [  -0.0000080100000000,  0.0002622400000000,  0.0001139700000000 ]  - [   0.0000519500000000, -0.0007741400000000,  0.0000047500000000 ]  - [  -0.0000602400000000,  0.0002180500000000, -0.0004154100000000 ]  - [   0.0021455100000000, -0.0049822800000000, -0.0046699100000000 ]  - [  -0.0002485900000000,  0.0001969800000000,  0.0004934500000000 ]  - [  -0.0000188600000000,  0.0000342000000000, -0.0000381000000000 ]  - [   0.0002812500000000,  0.0001091300000000, -0.0000408600000000 ]  - [   0.0010457200000000, -0.0007196000000000,  0.0025022700000000 ]  - [   0.0000669200000000, -0.0000387200000000, -0.0001063800000000 ]  - [  -0.0000311100000000,  0.0000382400000000, -0.0000833300000000 ]  - [  -0.0003294000000000, -0.0004856700000000,  0.0003193700000000 ]  - [  -0.0005602900000000, -0.0004245600000000,  0.0003015400000000 ]  - [  -0.0000147100000000,  0.0002138400000000, -0.0000598700000000 ]  - [   0.0018631100000000, -0.0007700400000000, -0.0040527300000000 ]  - [   0.0000776900000000, -0.0003423100000000, -0.0000345900000000 ]  - [   0.0009281200000000, -0.0032073900000000, -0.0009476500000000 ]  - [   0.0003226700000000,  0.0001181200000000,  0.0002093800000000 ]  - [  -0.0020725700000000,  0.0014769500000000,  0.0001290000000000 ]  - [   0.0003735400000000, -0.0001379200000000,  0.0001370100000000 ]  - [  -0.0000238800000000, -0.0001962500000000,  0.0016665500000000 ]  - [   0.0001617600000000, -0.0001255800000000, -0.0003138800000000 ]  - [   0.0001783100000000,  0.0000326700000000, -0.0003222600000000 ]  - [   0.0001399000000000,  0.0000515900000000, -0.0001593300000000 ]  - [  -0.0003554600000000, -0.0001308800000000,  0.0000540600000000 ]  - [   0.0001779700000000,  0.0004680300000000, -0.0004823100000000 ]  - [  -0.0003334500000000,  0.0000165300000000,  0.0001412900000000 ]  - [   0.0002800000000000, -0.0010028900000000, -0.0003659000000000 ]  - [  -0.0001964200000000,  0.0000539400000000, -0.0003276700000000 ]  - [   0.0004149500000000,  0.0002023700000000,  0.0000255700000000 ]  - [   0.0000055800000000, -0.0002552100000000, -0.0000622000000000 ]  - [  -0.0007509700000000,  0.0026108500000000, -0.0033860700000000 ]  - [  -0.0001756800000000, -0.0000947600000000, -0.0003260400000000 ]  - [   0.0002281700000000,  0.0001488900000000, -0.0003260600000000 ]  - [   0.0002563400000000,  0.0004753800000000, -0.0007290700000000 ]  - [  -0.0003899700000000,  0.0003005900000000,  0.0002059100000000 ]  - [  -0.0004077900000000, -0.0002348700000000,  0.0000948600000000 ]  - [  -0.0000035900000000,  0.0002382100000000, -0.0000698400000000 ]  - [  -0.0003996700000000,  0.0006538100000000,  0.0012850400000000 ]  - [  -0.0000397900000000, -0.0002675000000000, -0.0000431500000000 ]  - [  -0.0002731200000000, -0.0002554800000000, -0.0000304600000000 ]  - [   0.0002378400000000,  0.0002038800000000,  0.0001101800000000 ]  - [  -0.0002666000000000, -0.0003262000000000, -0.0003979500000000 ]  - [   0.0003601500000000, -0.0001096300000000,  0.0001410600000000 ]  - [  -0.0004997400000000, -0.0001967800000000, -0.0004625800000000 ]  - [   0.0002003200000000, -0.0000916700000000, -0.0003282300000000 ]  - [   0.0001323800000000,  0.0000980800000000, -0.0003386000000000 ]  - [  -0.0000233200000000,  0.0002442400000000, -0.0000454300000000 ]  - [  -0.0003666000000000, -0.0000643100000000,  0.0001462100000000 ]  - [  -0.0007209800000000,  0.0005031500000000,  0.0010455900000000 ]  - [  -0.0003597000000000,  0.0000764900000000,  0.0001419100000000 ]  - [  -0.0001051800000000, -0.0001048300000000, -0.0000755900000000 ]  - [  -0.0001490800000000,  0.0000785800000000, -0.0003227300000000 ]  - [   0.0003072700000000,  0.0001778400000000,  0.0001962700000000 ]  - [   0.0000171600000000, -0.0002373300000000, -0.0000492700000000 ]  - [  -0.0005933900000000,  0.0004290800000000,  0.0000579700000000 ]  - [  -0.0001912500000000, -0.0000783400000000, -0.0003144800000000 ]  - [  -0.0002856300000000, -0.0004221800000000, -0.0004208300000000 ]  - [   0.0001025300000000,  0.0001757200000000, -0.0002233200000000 ]- atom:   17  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0047100100000000,  0.0004707900000000, -0.0020700200000000 ]  - [  -0.0004190400000000, -0.0001419700000000,  0.0001700600000000 ]  - [   0.0031970000000000,  0.0029967400000000, -0.0015455300000000 ]  - [  -0.0002645600000000, -0.0004838700000000,  0.0001181900000000 ]  - [   0.0001921200000000,  0.0001273400000000,  0.0001483800000000 ]  - [  -0.0010950300000000, -0.0017977800000000,  0.0001456300000000 ]  - [   0.0002404100000000, -0.0001400700000000,  0.0001159100000000 ]  - [  -0.0003499200000000,  0.0003004400000000,  0.0001106900000000 ]  - [   0.0017491600000000, -0.0003569800000000, -0.0000946800000000 ]  - [  -0.0002112600000000, -0.0000908800000000,  0.0001172400000000 ]  - [   0.0016618300000000, -0.0021504600000000, -0.0002891700000000 ]  - [   0.0001558000000000,  0.0003888800000000,  0.0001599200000000 ]  - [   0.0002650100000000,  0.0001540700000000,  0.0001539400000000 ]  - [   0.0004809700000000,  0.0003072600000000,  0.0004461600000000 ]  - [   0.0002228000000000, -0.0000133100000000,  0.0002087000000000 ]  - [  -0.0000637600000000, -0.0000122400000000,  0.0001778300000000 ]  - [  -0.1384523200000000,  0.0093798700000000,  0.0026094500000000 ]  - [  -0.0007705800000000,  0.0016611800000000, -0.0005628200000000 ]  - [   0.0087574400000000, -0.0008724800000000,  0.0146868900000000 ]  - [   0.0002478300000000, -0.0005750700000000,  0.0000728400000000 ]  - [  -0.0001184000000000, -0.0001466100000000,  0.0001429100000000 ]  - [  -0.0012035400000000, -0.0006386400000000, -0.0002999600000000 ]  - [  -0.0000325200000000,  0.0003566200000000,  0.0001361100000000 ]  - [   0.0002484100000000,  0.0005747100000000,  0.0002002800000000 ]  - [   0.0027561900000000,  0.0009836500000000,  0.0015946800000000 ]  - [   0.0001364200000000, -0.0003676400000000,  0.0004900500000000 ]  - [   0.0086885800000000,  0.0003494600000000,  0.0051174200000000 ]  - [   0.0004478600000000, -0.0002295600000000,  0.0002831800000000 ]  - [   0.0000616400000000, -0.0001723800000000,  0.0000446700000000 ]  - [   0.0010086500000000,  0.0012064700000000,  0.0010164100000000 ]  - [  -0.0000327600000000,  0.0003655000000000,  0.0000998800000000 ]  - [   0.0004491600000000, -0.0010026900000000, -0.0003120200000000 ]  - [  -0.0075129800000000,  0.0071315600000000, -0.0011869500000000 ]  - [   0.0033059900000000,  0.0085985500000000,  0.0034379200000000 ]  - [  -0.0004033700000000,  0.0002033800000000,  0.0001842000000000 ]  - [  -0.0000117900000000,  0.0000223800000000,  0.0000414700000000 ]  - [   0.0017786900000000, -0.0014359600000000,  0.0015319800000000 ]  - [   0.0025522200000000, -0.0019398800000000, -0.0003738000000000 ]  - [   0.0004794500000000,  0.0000349400000000, -0.0003927000000000 ]  - [   0.0001470400000000,  0.0002805000000000, -0.0003787200000000 ]  - [   0.0013554800000000, -0.0022573200000000, -0.0027683200000000 ]  - [   0.0137723600000000, -0.0151909400000000, -0.0029017100000000 ]  - [  -0.0001458500000000, -0.0003168300000000,  0.0000635700000000 ]  - [  -0.0020625000000000,  0.0017358100000000, -0.0017448700000000 ]  - [   0.0011962300000000,  0.0006046300000000,  0.0015528200000000 ]  - [   0.0159416500000000,  0.0008931300000000,  0.0241716700000000 ]  - [   0.0013108000000000, -0.0021180300000000,  0.0001482900000000 ]  - [   0.0148784100000000,  0.0117771600000000, -0.0157828400000000 ]  - [   0.0003544800000000, -0.0001516000000000,  0.0001293100000000 ]  - [   0.0830459400000000, -0.0162488700000000, -0.0187412500000000 ]  - [   0.0000967300000000, -0.0004134200000000, -0.0001449800000000 ]  - [   0.0005983400000000,  0.0003048900000000, -0.0002752700000000 ]  - [   0.0001023900000000,  0.0001574500000000, -0.0001189000000000 ]  - [  -0.0002605100000000, -0.0001857700000000,  0.0001145200000000 ]  - [  -0.0000111400000000,  0.0018997800000000, -0.0003501800000000 ]  - [  -0.0003139000000000, -0.0000415000000000,  0.0001949700000000 ]  - [   0.0002230500000000, -0.0005959400000000, -0.0001210100000000 ]  - [  -0.0001651900000000,  0.0000153200000000, -0.0003152900000000 ]  - [   0.0007137800000000,  0.0002912000000000,  0.0000970300000000 ]  - [   0.0000215300000000, -0.0002477500000000, -0.0000665200000000 ]  - [   0.0014099000000000, -0.0018800200000000, -0.0007841300000000 ]  - [  -0.0001215300000000, -0.0001055400000000, -0.0003038500000000 ]  - [   0.0001638200000000,  0.0003906900000000, -0.0002650800000000 ]  - [   0.0008737700000000, -0.0000852900000000, -0.0005962000000000 ]  - [  -0.0019973600000000,  0.0019841400000000, -0.0005090500000000 ]  - [  -0.0020258300000000, -0.0004148300000000, -0.0005423400000000 ]  - [   0.0000234000000000,  0.0003347900000000, -0.0001016400000000 ]  - [  -0.0022943100000000, -0.0012756700000000, -0.0006796700000000 ]  - [  -0.0004882300000000, -0.0000338900000000, -0.0002788300000000 ]  - [  -0.0034005300000000, -0.0000558100000000, -0.0029753800000000 ]  - [  -0.0001498000000000,  0.0006357400000000, -0.0000042800000000 ]  - [  -0.0014327000000000, -0.0000669400000000,  0.0003867000000000 ]  - [   0.0002460400000000, -0.0000897100000000,  0.0001483500000000 ]  - [  -0.0019486700000000, -0.0002252700000000, -0.0011085900000000 ]  - [   0.0003585600000000, -0.0003224200000000, -0.0004997700000000 ]  - [  -0.0000923700000000,  0.0001345800000000, -0.0003637500000000 ]  - [  -0.0000557700000000,  0.0001608700000000,  0.0000158200000000 ]  - [  -0.0004925900000000, -0.0001568800000000,  0.0001493000000000 ]  - [  -0.0010791800000000, -0.0016438300000000, -0.0008879900000000 ]  - [  -0.0003619700000000,  0.0000393000000000,  0.0001340300000000 ]  - [  -0.0002275300000000, -0.0000242700000000,  0.0000610700000000 ]  - [  -0.0001947700000000,  0.0000547800000000, -0.0003208600000000 ]  - [  -0.0000069200000000, -0.0004277900000000,  0.0001764300000000 ]  - [  -0.0000930300000000, -0.0004155300000000,  0.0000122900000000 ]  - [  -0.0003978900000000,  0.0007996300000000,  0.0005134600000000 ]  - [  -0.0002529400000000, -0.0001673000000000, -0.0003093200000000 ]  - [   0.0003417800000000, -0.0003233900000000, -0.0003241400000000 ]  - [  -0.0005342600000000, -0.0000573400000000, -0.0001402700000000 ]- atom:   17  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0051647600000000, -0.0002526600000000,  0.0023760200000000 ]  - [  -0.0000420200000000, -0.0000791500000000,  0.0001243700000000 ]  - [  -0.0027117100000000, -0.0032133200000000,  0.0018343700000000 ]  - [  -0.0001926500000000,  0.0006985300000000,  0.0001817200000000 ]  - [   0.0002698200000000,  0.0000949200000000,  0.0001460900000000 ]  - [   0.0006336800000000,  0.0015701100000000,  0.0001469400000000 ]  - [   0.0002189800000000, -0.0000819500000000,  0.0001782000000000 ]  - [  -0.0001123800000000, -0.0000770300000000,  0.0001827700000000 ]  - [  -0.0012901800000000,  0.0005744400000000,  0.0003878000000000 ]  - [  -0.0002474300000000, -0.0001302900000000,  0.0001778500000000 ]  - [  -0.0011986900000000,  0.0019376800000000,  0.0006006600000000 ]  - [  -0.0006137200000000, -0.0001665500000000,  0.0001349500000000 ]  - [   0.0001957500000000,  0.0000677200000000,  0.0001403200000000 ]  - [  -0.0009386600000000, -0.0005274700000000, -0.0001540200000000 ]  - [   0.0002369600000000, -0.0002074500000000,  0.0000853800000000 ]  - [  -0.0003957900000000,  0.0002332800000000,  0.0001158500000000 ]  - [   0.1341701700000000, -0.0085796600000000, -0.0014844500000000 ]  - [   0.0008396900000000, -0.0011485500000000,  0.0007964200000000 ]  - [  -0.0087344100000000,  0.0013576300000000, -0.0144030200000000 ]  - [  -0.0001734500000000,  0.0000637200000000,  0.0001611100000000 ]  - [   0.0000438000000000, -0.0003572400000000,  0.0000924600000000 ]  - [   0.0012755900000000,  0.0011383000000000,  0.0005348600000000 ]  - [  -0.0000418500000000,  0.0001470500000000,  0.0001000700000000 ]  - [  -0.0001735200000000, -0.0010735700000000,  0.0000382600000000 ]  - [  -0.0028287300000000, -0.0014951100000000, -0.0013590800000000 ]  - [  -0.0000606300000000,  0.0008736300000000, -0.0002553100000000 ]  - [  -0.0088018400000000,  0.0001257200000000, -0.0049536400000000 ]  - [  -0.0003722900000000, -0.0002729000000000, -0.0000495000000000 ]  - [  -0.0001364900000000, -0.0003311500000000,  0.0001905700000000 ]  - [  -0.0009295100000000, -0.0007026300000000, -0.0007755200000000 ]  - [  -0.0000431400000000,  0.0001372000000000,  0.0001368900000000 ]  - [  -0.0003710000000000,  0.0004991200000000,  0.0005446700000000 ]  - [   0.0074743400000000, -0.0071205700000000,  0.0010511100000000 ]  - [  -0.0033049000000000, -0.0086172700000000, -0.0035524400000000 ]  - [   0.0004024500000000, -0.0002032200000000, -0.0003230100000000 ]  - [   0.0000111800000000, -0.0000229100000000, -0.0001816800000000 ]  - [  -0.0017772000000000,  0.0014552700000000, -0.0016855400000000 ]  - [  -0.0025290400000000,  0.0019410400000000,  0.0002436500000000 ]  - [  -0.0004768600000000, -0.0000344800000000,  0.0002517700000000 ]  - [  -0.0001478100000000, -0.0002788700000000,  0.0002384900000000 ]  - [  -0.0013417000000000,  0.0027119900000000,  0.0026656000000000 ]  - [  -0.0143438100000000,  0.0148669800000000,  0.0031082600000000 ]  - [   0.0001335400000000,  0.0007874600000000, -0.0001716300000000 ]  - [   0.0013319800000000, -0.0015428100000000,  0.0020088100000000 ]  - [  -0.0012061700000000, -0.0010686400000000, -0.0016542500000000 ]  - [  -0.0161921800000000, -0.0007151000000000, -0.0251550600000000 ]  - [  -0.0005998900000000,  0.0022773700000000,  0.0001323700000000 ]  - [  -0.0148616300000000, -0.0125012300000000,  0.0159342400000000 ]  - [   0.0003541600000000, -0.0000294700000000,  0.0001525800000000 ]  - [  -0.0795024500000000,  0.0152559100000000,  0.0173490900000000 ]  - [   0.0002712700000000,  0.0002538700000000, -0.0004907200000000 ]  - [  -0.0002396400000000, -0.0001443900000000, -0.0003577400000000 ]  - [  -0.0000886700000000,  0.0003153400000000,  0.0000110400000000 ]  - [  -0.0004472400000000,  0.0000033900000000,  0.0001681900000000 ]  - [  -0.0000017800000000, -0.0014201200000000,  0.0002434700000000 ]  - [  -0.0003947800000000,  0.0002176100000000,  0.0000896100000000 ]  - [  -0.0002401900000000,  0.0001265900000000,  0.0000073700000000 ]  - [  -0.0001904800000000,  0.0001432000000000, -0.0003150200000000 ]  - [  -0.0000034000000000, -0.0001182600000000,  0.0001886800000000 ]  - [  -0.0000062900000000, -0.0002225300000000, -0.0000435200000000 ]  - [  -0.0006947500000000,  0.0016959700000000,  0.0010624100000000 ]  - [  -0.0002445600000000, -0.0000516600000000, -0.0003326000000000 ]  - [   0.0002016800000000, -0.0005488500000000, -0.0003741100000000 ]  - [  -0.0005213600000000,  0.0002454200000000, -0.0000313300000000 ]  - [   0.0020162300000000, -0.0015227500000000,  0.0004160700000000 ]  - [   0.0013175400000000,  0.0002368500000000,  0.0008321700000000 ]  - [  -0.0000374000000000,  0.0001364400000000, -0.0000095600000000 ]  - [   0.0015768200000000,  0.0014588700000000,  0.0009646000000000 ]  - [   0.0004720900000000, -0.0004383100000000,  0.0001698300000000 ]  - [   0.0030344100000000,  0.0002200600000000,  0.0023396900000000 ]  - [   0.0008545400000000, -0.0004600200000000,  0.0002906200000000 ]  - [   0.0014505800000000, -0.0004113000000000, -0.0005050900000000 ]  - [   0.0004626300000000, -0.0000952700000000,  0.0001319300000000 ]  - [   0.0015899700000000,  0.0000681100000000,  0.0004735400000000 ]  - [   0.0000014300000000,  0.0001659000000000, -0.0001308100000000 ]  - [   0.0004483200000000,  0.0000226200000000, -0.0002638900000000 ]  - [   0.0000697800000000,  0.0003107200000000, -0.0001231600000000 ]  - [  -0.0002167300000000, -0.0000271100000000,  0.0001328300000000 ]  - [   0.0010569300000000,  0.0020984700000000,  0.0007681300000000 ]  - [  -0.0003462200000000,  0.0001402700000000,  0.0001505400000000 ]  - [   0.0002121300000000, -0.0004473400000000, -0.0001716500000000 ]  - [  -0.0001592600000000,  0.0001057000000000, -0.0003075000000000 ]  - [   0.0007144000000000,  0.0006075000000000,  0.0001046300000000 ]  - [   0.0001076000000000, -0.0000547100000000, -0.0001238700000000 ]  - [   0.0011040600000000, -0.0009820100000000, -0.0002315900000000 ]  - [  -0.0001138600000000,  0.0000089000000000, -0.0003251700000000 ]  - [   0.0000243900000000,  0.0001653200000000, -0.0003038100000000 ]  - [   0.0008967100000000,  0.0002136900000000, -0.0004906300000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0011765000000000, -0.0003146200000000, -0.0001931600000000 ]  - [   0.0001281500000000,  0.0006719800000000,  0.0002001700000000 ]  - [   0.0011807900000000, -0.0020786100000000,  0.0007869500000000 ]  - [  -0.0015838900000000,  0.0022797600000000, -0.0021360200000000 ]  - [   0.0002660400000000,  0.0008293100000000,  0.0000699600000000 ]  - [  -0.0012002300000000,  0.0001044700000000, -0.0001308300000000 ]  - [   0.0002354000000000,  0.0003987600000000,  0.0001569100000000 ]  - [  -0.0001952300000000,  0.0007862700000000,  0.0000738000000000 ]  - [   0.0007443200000000, -0.0004702700000000,  0.0000132700000000 ]  - [  -0.0005311800000000,  0.0003881700000000,  0.0000442400000000 ]  - [  -0.0027218700000000, -0.0032914100000000,  0.0020737000000000 ]  - [   0.0004194500000000, -0.0001659500000000,  0.0006699500000000 ]  - [   0.0001788500000000,  0.0005825600000000,  0.0001657300000000 ]  - [   0.0002829800000000,  0.0002756500000000,  0.0000983300000000 ]  - [   0.0002410800000000,  0.0005000500000000,  0.0002018000000000 ]  - [  -0.0001983700000000,  0.0005447800000000,  0.0001029300000000 ]  - [   0.0095742500000000, -0.0977640000000000, -0.0046981500000000 ]  - [   0.0014394000000000,  0.0015598000000000,  0.0001323100000000 ]  - [  -0.0001502700000000, -0.0020146500000000, -0.0030742700000000 ]  - [  -0.0007901800000000,  0.0031647800000000,  0.0002762800000000 ]  - [   0.0000695500000000,  0.0011934300000000,  0.0000837600000000 ]  - [  -0.0008509400000000,  0.0009297700000000, -0.0000786000000000 ]  - [  -0.0001508600000000,  0.0015763800000000,  0.0002547500000000 ]  - [   0.0003530100000000,  0.0031560500000000,  0.0008479200000000 ]  - [   0.0012045300000000, -0.0020307600000000, -0.0000890300000000 ]  - [  -0.0005840800000000,  0.0001233000000000,  0.0014409200000000 ]  - [   0.0010873800000000, -0.0020079000000000,  0.0004191300000000 ]  - [   0.0007874600000000,  0.0001240500000000,  0.0004774200000000 ]  - [   0.0000433700000000,  0.0009036000000000,  0.0000304100000000 ]  - [   0.0009921800000000,  0.0017804700000000,  0.0004523000000000 ]  - [  -0.0001402000000000,  0.0015756700000000,  0.0001173100000000 ]  - [   0.0000160500000000,  0.0001254200000000, -0.0002600100000000 ]  - [   0.0155917200000000,  0.0025587600000000,  0.0109166900000000 ]  - [   0.0066857800000000,  0.0111842600000000,  0.0032372300000000 ]  - [  -0.0000847400000000,  0.0017820100000000,  0.0003284500000000 ]  - [  -0.0007105400000000,  0.0015934800000000,  0.0003623300000000 ]  - [  -0.0012837200000000, -0.0021598200000000,  0.0002844100000000 ]  - [  -0.0000643800000000, -0.0005216300000000, -0.0006529500000000 ]  - [   0.0005384400000000,  0.0014107400000000, -0.0003186400000000 ]  - [   0.0000980300000000,  0.0014707800000000, -0.0002436100000000 ]  - [  -0.0028164800000000,  0.0036771800000000, -0.0012318600000000 ]  - [  -0.0172151700000000,  0.0555096600000000,  0.0154665400000000 ]  - [  -0.0004645000000000, -0.0007925300000000, -0.0000626700000000 ]  - [   0.0000793900000000,  0.0012228700000000,  0.0001232000000000 ]  - [  -0.0013249900000000, -0.0033138000000000, -0.0024719900000000 ]  - [   0.0000526000000000,  0.0055456900000000, -0.0008347700000000 ]  - [  -0.0029137100000000, -0.0003123200000000, -0.0002734200000000 ]  - [   0.0123617700000000,  0.0172384500000000, -0.0189827800000000 ]  - [   0.0008450100000000, -0.0013910100000000, -0.0001775400000000 ]  - [  -0.0160050700000000,  0.0094674600000000,  0.0020062700000000 ]  - [  -0.0005288500000000, -0.0003096400000000, -0.0001532600000000 ]  - [  -0.0004790300000000, -0.0016238600000000, -0.0004020000000000 ]  - [   0.0003144700000000, -0.0008455200000000, -0.0001666400000000 ]  - [  -0.0005008900000000, -0.0011540100000000, -0.0000612500000000 ]  - [   0.0002810000000000,  0.0002814100000000, -0.0000944000000000 ]  - [  -0.0003022200000000, -0.0009115100000000,  0.0002896500000000 ]  - [   0.0004270000000000, -0.0018112000000000, -0.0002008500000000 ]  - [  -0.0001514900000000, -0.0006512700000000, -0.0003729700000000 ]  - [   0.0004582400000000, -0.0006830500000000,  0.0002414300000000 ]  - [  -0.0001277500000000, -0.0013011700000000, -0.0001565100000000 ]  - [   0.0001482000000000, -0.0024428400000000, -0.0009558500000000 ]  - [  -0.0002096400000000, -0.0007420500000000, -0.0002610600000000 ]  - [   0.0003691000000000, -0.0002910700000000, -0.0002128900000000 ]  - [   0.0007172700000000, -0.0008441900000000, -0.0008164100000000 ]  - [   0.0002742500000000,  0.0022602100000000,  0.0006483600000000 ]  - [  -0.0003177100000000,  0.0014493700000000,  0.0004304600000000 ]  - [   0.0000603000000000, -0.0003708700000000, -0.0003171100000000 ]  - [  -0.0019983700000000,  0.0005858300000000, -0.0014725800000000 ]  - [  -0.0002797500000000,  0.0003993600000000, -0.0000074700000000 ]  - [  -0.0000538800000000,  0.0010352900000000,  0.0007321600000000 ]  - [   0.0015241100000000,  0.0010980400000000, -0.0002067700000000 ]  - [  -0.0004489300000000,  0.0000758600000000,  0.0001250300000000 ]  - [   0.0002446700000000, -0.0006769100000000,  0.0000484600000000 ]  - [  -0.0011359900000000,  0.0009307500000000, -0.0003248800000000 ]  - [   0.0012611900000000, -0.0013465300000000, -0.0008903800000000 ]  - [   0.0002716500000000,  0.0000977700000000, -0.0005775800000000 ]  - [   0.0001586700000000, -0.0007444900000000, -0.0000146200000000 ]  - [  -0.0005674900000000, -0.0009751100000000,  0.0000143900000000 ]  - [  -0.0009771400000000, -0.0013245100000000, -0.0004649900000000 ]  - [  -0.0000426800000000, -0.0009533900000000,  0.0002809500000000 ]  - [   0.0000018700000000, -0.0009274100000000, -0.0000211700000000 ]  - [  -0.0001972900000000, -0.0005267300000000, -0.0003705100000000 ]  - [  -0.0000764800000000, -0.0010547000000000,  0.0003463200000000 ]  - [  -0.0002194800000000, -0.0011217300000000, -0.0000184400000000 ]  - [   0.0003787000000000, -0.0001153800000000,  0.0001679500000000 ]  - [  -0.0001877400000000, -0.0007128900000000, -0.0002279000000000 ]  - [  -0.0002354700000000, -0.0009731400000000, -0.0003124100000000 ]  - [  -0.0001922900000000, -0.0003852400000000, -0.0002493500000000 ]- atom:   17  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0016357400000000,  0.0005444400000000,  0.0004726800000000 ]  - [  -0.0005908000000000, -0.0008980800000000,  0.0000936100000000 ]  - [  -0.0007108100000000,  0.0018513500000000, -0.0004977700000000 ]  - [   0.0011139100000000, -0.0020322300000000,  0.0024243100000000 ]  - [   0.0001957300000000, -0.0006043800000000,  0.0002240600000000 ]  - [   0.0007447200000000, -0.0003349700000000,  0.0004280200000000 ]  - [   0.0002274500000000, -0.0006255700000000,  0.0001368200000000 ]  - [  -0.0002699700000000, -0.0005609400000000,  0.0002201100000000 ]  - [  -0.0002813400000000,  0.0006980200000000,  0.0002815100000000 ]  - [   0.0000694800000000, -0.0006169900000000,  0.0002511200000000 ]  - [   0.0031746700000000,  0.0030531400000000, -0.0017761900000000 ]  - [  -0.0008775600000000,  0.0003899700000000, -0.0003746700000000 ]  - [   0.0002834300000000, -0.0003573600000000,  0.0001282200000000 ]  - [  -0.0007444900000000, -0.0004988300000000,  0.0001935400000000 ]  - [   0.0002209200000000, -0.0007275100000000,  0.0000935400000000 ]  - [  -0.0002640700000000, -0.0003176100000000,  0.0001912300000000 ]  - [  -0.0083852700000000,  0.0949995200000000,  0.0026184000000000 ]  - [  -0.0013652800000000, -0.0010503800000000,  0.0001026300000000 ]  - [   0.0000689600000000,  0.0025175200000000,  0.0032959100000000 ]  - [   0.0008629700000000, -0.0036821700000000, -0.0000379700000000 ]  - [  -0.0001470200000000, -0.0016991900000000,  0.0001543000000000 ]  - [   0.0009305800000000, -0.0004271800000000,  0.0003170900000000 ]  - [   0.0000750100000000, -0.0010747600000000, -0.0000170400000000 ]  - [  -0.0002825700000000, -0.0036914100000000, -0.0006290400000000 ]  - [  -0.0012770500000000,  0.0015262400000000,  0.0003208600000000 ]  - [   0.0006623500000000,  0.0003816300000000, -0.0012081700000000 ]  - [  -0.0011453600000000,  0.0025236100000000, -0.0001844600000000 ]  - [  -0.0007095100000000, -0.0006284700000000, -0.0002390800000000 ]  - [  -0.0001193800000000, -0.0014075600000000,  0.0002075300000000 ]  - [  -0.0009132500000000, -0.0012751400000000, -0.0002004400000000 ]  - [   0.0000633200000000, -0.0010749400000000,  0.0001208300000000 ]  - [   0.0000632900000000, -0.0006271000000000,  0.0004980100000000 ]  - [  -0.0155634300000000, -0.0025059000000000, -0.0110058300000000 ]  - [  -0.0067769300000000, -0.0112266700000000, -0.0032986200000000 ]  - [   0.0000875600000000, -0.0017874300000000, -0.0004747900000000 ]  - [   0.0007103900000000, -0.0015970300000000, -0.0005050300000000 ]  - [   0.0012809100000000,  0.0021526200000000, -0.0004229800000000 ]  - [   0.0000699900000000,  0.0005246500000000,  0.0005114500000000 ]  - [  -0.0005377800000000, -0.0014128300000000,  0.0001755300000000 ]  - [  -0.0000976200000000, -0.0014720600000000,  0.0001006500000000 ]  - [   0.0028248300000000, -0.0032026500000000,  0.0011220200000000 ]  - [   0.0159022600000000, -0.0532387600000000, -0.0141267000000000 ]  - [   0.0004502100000000,  0.0012606300000000, -0.0000539200000000 ]  - [  -0.0007884100000000, -0.0010452200000000,  0.0001625500000000 ]  - [   0.0013214800000000,  0.0028481300000000,  0.0023807200000000 ]  - [  -0.0002241100000000, -0.0053705400000000,  0.0006191300000000 ]  - [   0.0036110900000000,  0.0004880700000000,  0.0005475300000000 ]  - [  -0.0127957800000000, -0.0180885900000000,  0.0195448500000000 ]  - [  -0.0001413900000000,  0.0012157000000000,  0.0004637300000000 ]  - [   0.0153105200000000, -0.0094088300000000, -0.0025776200000000 ]  - [   0.0008919200000000,  0.0001572600000000, -0.0004706500000000 ]  - [   0.0008478900000000,  0.0017725500000000, -0.0002341700000000 ]  - [  -0.0003049700000000,  0.0013218900000000,  0.0000542300000000 ]  - [  -0.0002018900000000,  0.0009671300000000,  0.0003432400000000 ]  - [  -0.0002945000000000,  0.0001909400000000, -0.0000167000000000 ]  - [  -0.0004023400000000,  0.0010908500000000, -0.0000038300000000 ]  - [  -0.0004418900000000,  0.0013472000000000,  0.0000896700000000 ]  - [  -0.0001976800000000,  0.0008054300000000, -0.0002494400000000 ]  - [   0.0002441200000000,  0.0008613000000000,  0.0000441100000000 ]  - [   0.0001435600000000,  0.0008334400000000,  0.0000377400000000 ]  - [   0.0005729400000000,  0.0022765400000000,  0.0012439700000000 ]  - [  -0.0001615600000000,  0.0005917100000000, -0.0003697200000000 ]  - [  -0.0000021700000000,  0.0001378200000000, -0.0004193600000000 ]  - [  -0.0003645200000000,  0.0010008300000000,  0.0001899800000000 ]  - [  -0.0002629000000000, -0.0017818600000000, -0.0007605000000000 ]  - [  -0.0003866100000000, -0.0016319400000000, -0.0001478700000000 ]  - [  -0.0000711700000000,  0.0008460500000000,  0.0002068700000000 ]  - [   0.0012961200000000, -0.0004110300000000,  0.0017549600000000 ]  - [   0.0002637900000000, -0.0008695900000000, -0.0001080600000000 ]  - [  -0.0002998400000000, -0.0008807200000000, -0.0013514000000000 ]  - [  -0.0008154800000000, -0.0009240900000000,  0.0004925200000000 ]  - [   0.0004622400000000, -0.0005503000000000, -0.0002422200000000 ]  - [   0.0004579000000000,  0.0004926000000000,  0.0002328300000000 ]  - [   0.0007653000000000, -0.0010842300000000, -0.0003122800000000 ]  - [  -0.0009100400000000,  0.0011974800000000,  0.0002581600000000 ]  - [   0.0000782700000000,  0.0000538200000000, -0.0000461900000000 ]  - [  -0.0001475300000000,  0.0012196300000000, -0.0000966300000000 ]  - [  -0.0001353200000000,  0.0007944400000000,  0.0002704000000000 ]  - [   0.0009592400000000,  0.0017739500000000,  0.0003409000000000 ]  - [  -0.0006616400000000,  0.0011323100000000,  0.0000050800000000 ]  - [  -0.0000172400000000,  0.0004583900000000, -0.0000957200000000 ]  - [  -0.0001589700000000,  0.0006808100000000, -0.0002586300000000 ]  - [   0.0007800000000000,  0.0012260200000000, -0.0000606800000000 ]  - [   0.0002313300000000,  0.0006487700000000, -0.0000951900000000 ]  - [   0.0003225800000000, -0.0000740400000000,  0.0001135500000000 ]  - [  -0.0001741800000000,  0.0005600600000000, -0.0004076000000000 ]  - [   0.0006050700000000,  0.0008245400000000, -0.0003268100000000 ]  - [   0.0005376200000000,  0.0005380400000000, -0.0003767100000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0008890500000000,  0.0028772100000000,  0.0044995600000000 ]  - [  -0.0001438600000000, -0.0001426400000000,  0.0001031700000000 ]  - [   0.0000656800000000, -0.0001540000000000,  0.0007485700000000 ]  - [  -0.0006138700000000, -0.0009261400000000, -0.0019481800000000 ]  - [   0.0002472900000000,  0.0001621300000000,  0.0001462600000000 ]  - [  -0.0000676200000000,  0.0001205100000000,  0.0000554600000000 ]  - [   0.0002163700000000, -0.0001130400000000,  0.0001550900000000 ]  - [  -0.0000829300000000, -0.0000458800000000,  0.0001842400000000 ]  - [   0.0003027100000000,  0.0005261500000000,  0.0003356200000000 ]  - [  -0.0003425500000000, -0.0001719300000000,  0.0000647100000000 ]  - [  -0.0013155800000000,  0.0000808600000000,  0.0023573200000000 ]  - [   0.0000683200000000, -0.0001067100000000,  0.0002638200000000 ]  - [   0.0002051200000000,  0.0000271200000000,  0.0001669600000000 ]  - [  -0.0004466500000000,  0.0000861600000000,  0.0005136500000000 ]  - [   0.0002643800000000, -0.0001720600000000,  0.0000572000000000 ]  - [  -0.0002632200000000,  0.0001300000000000,  0.0001627400000000 ]  - [   0.0032902300000000, -0.0035427700000000, -0.1267884000000000 ]  - [   0.0007184500000000,  0.0002360900000000,  0.0000963600000000 ]  - [   0.0050022600000000, -0.0000558400000000, -0.0038827100000000 ]  - [  -0.0000403100000000,  0.0004825900000000,  0.0007901900000000 ]  - [  -0.0000171000000000, -0.0002870000000000,  0.0001679800000000 ]  - [   0.0004588200000000,  0.0004471100000000,  0.0002286600000000 ]  - [  -0.0000581400000000,  0.0002525200000000,  0.0001333200000000 ]  - [   0.0000847700000000, -0.0000922500000000,  0.0007875600000000 ]  - [   0.0014364000000000, -0.0004560300000000, -0.0021648900000000 ]  - [  -0.0003299100000000, -0.0010718000000000,  0.0010031100000000 ]  - [   0.0144717600000000,  0.0034373900000000, -0.0038770100000000 ]  - [   0.0004686200000000, -0.0006305700000000,  0.0002780000000000 ]  - [  -0.0001133500000000, -0.0003404800000000,  0.0001388500000000 ]  - [  -0.0008543300000000, -0.0000769100000000, -0.0013783900000000 ]  - [  -0.0000253200000000,  0.0001148600000000,  0.0001339900000000 ]  - [  -0.0001258200000000,  0.0001055500000000,  0.0002790700000000 ]  - [   0.0048399200000000,  0.0031185200000000,  0.0055115300000000 ]  - [  -0.0022067500000000, -0.0058302900000000, -0.0134611700000000 ]  - [   0.0000554600000000, -0.0000388000000000,  0.0000370800000000 ]  - [  -0.0001525800000000, -0.0001252600000000,  0.0001520000000000 ]  - [   0.0006668900000000, -0.0013777800000000,  0.0003424300000000 ]  - [  -0.0001643400000000,  0.0005095700000000,  0.0001073800000000 ]  - [  -0.0004369600000000, -0.0000431100000000,  0.0002274200000000 ]  - [   0.0002062000000000, -0.0001183300000000, -0.0001374800000000 ]  - [  -0.0019716800000000,  0.0003519200000000, -0.0014920600000000 ]  - [  -0.0045909000000000,  0.0154832300000000,  0.0089439400000000 ]  - [  -0.0001527000000000,  0.0002427100000000, -0.0000907900000000 ]  - [  -0.0003888800000000, -0.0005748000000000,  0.0005773100000000 ]  - [   0.0001225200000000,  0.0001990600000000, -0.0005756800000000 ]  - [   0.0221866300000000,  0.0002483700000000,  0.0722176800000000 ]  - [  -0.0008039500000000,  0.0002493400000000, -0.0000699300000000 ]  - [  -0.0167302900000000, -0.0185955800000000,  0.0389484000000000 ]  - [   0.0004258600000000, -0.0001143700000000,  0.0000549600000000 ]  - [  -0.0167742200000000,  0.0025354900000000,  0.0099903300000000 ]  - [  -0.0000880200000000,  0.0000558800000000, -0.0002713400000000 ]  - [  -0.0003549400000000, -0.0008825300000000, -0.0002144800000000 ]  - [   0.0000270400000000,  0.0001964100000000, -0.0000755400000000 ]  - [  -0.0003913800000000, -0.0000505300000000,  0.0001179800000000 ]  - [  -0.0000896100000000, -0.0001917800000000, -0.0000336000000000 ]  - [  -0.0004285100000000,  0.0000917500000000,  0.0001383100000000 ]  - [  -0.0000050500000000, -0.0004030500000000, -0.0001417800000000 ]  - [  -0.0001961300000000,  0.0001181300000000, -0.0003301200000000 ]  - [   0.0002436200000000,  0.0000645000000000,  0.0001343300000000 ]  - [   0.0000662200000000, -0.0001673700000000, -0.0001095700000000 ]  - [   0.0000818900000000, -0.0001016200000000,  0.0014118200000000 ]  - [  -0.0001987800000000, -0.0000688300000000, -0.0003247900000000 ]  - [   0.0001211500000000, -0.0002180400000000, -0.0003235800000000 ]  - [  -0.0000760100000000,  0.0002296500000000, -0.0001841200000000 ]  - [  -0.0019362900000000,  0.0017016800000000,  0.0010805200000000 ]  - [  -0.0005831100000000,  0.0000883300000000,  0.0002100900000000 ]  - [   0.0001434200000000,  0.0005914300000000, -0.0002122200000000 ]  - [  -0.0009370600000000, -0.0019230500000000,  0.0032747500000000 ]  - [  -0.0003791000000000,  0.0003853300000000,  0.0000013100000000 ]  - [   0.0002090900000000,  0.0000752000000000,  0.0012119200000000 ]  - [   0.0002834300000000,  0.0013203800000000, -0.0000775400000000 ]  - [  -0.0009098800000000, -0.0004011300000000,  0.0004158400000000 ]  - [   0.0002210900000000,  0.0001320700000000,  0.0001846400000000 ]  - [  -0.0037347400000000, -0.0004992000000000, -0.0008914600000000 ]  - [   0.0007318600000000, -0.0003299600000000, -0.0008710100000000 ]  - [   0.0000166100000000,  0.0004889100000000, -0.0004564600000000 ]  - [   0.0000426800000000,  0.0003095200000000, -0.0001282100000000 ]  - [  -0.0002489100000000, -0.0000682500000000,  0.0001432700000000 ]  - [   0.0015977700000000,  0.0028218600000000,  0.0020390900000000 ]  - [  -0.0003287000000000,  0.0001219600000000,  0.0001127100000000 ]  - [   0.0001314800000000, -0.0003536100000000, -0.0001405500000000 ]  - [  -0.0001842300000000,  0.0001090100000000, -0.0003050400000000 ]  - [   0.0006936300000000,  0.0007728600000000,  0.0002143100000000 ]  - [   0.0000072600000000, -0.0001459100000000, -0.0000533200000000 ]  - [   0.0002694900000000, -0.0004390400000000,  0.0001196100000000 ]  - [  -0.0001355100000000,  0.0000393200000000, -0.0003100000000000 ]  - [   0.0001469700000000, -0.0002199400000000, -0.0002711300000000 ]  - [   0.0004694100000000, -0.0000704200000000, -0.0001798700000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0013519200000000, -0.0026768100000000, -0.0042245300000000 ]  - [  -0.0003236800000000, -0.0000871600000000,  0.0001936800000000 ]  - [   0.0004023100000000, -0.0000784400000000, -0.0004409300000000 ]  - [   0.0001481000000000,  0.0011615900000000,  0.0022443000000000 ]  - [   0.0002184800000000,  0.0000657100000000,  0.0001504400000000 ]  - [  -0.0003981900000000, -0.0003456700000000,  0.0002393400000000 ]  - [   0.0002478800000000, -0.0001142200000000,  0.0001419200000000 ]  - [  -0.0003809000000000,  0.0002711900000000,  0.0001112800000000 ]  - [   0.0001607100000000, -0.0002966600000000, -0.0000380300000000 ]  - [  -0.0001238000000000, -0.0000584800000000,  0.0002327900000000 ]  - [   0.0017861900000000, -0.0003078000000000, -0.0020575000000000 ]  - [  -0.0005360700000000,  0.0003363400000000,  0.0000317700000000 ]  - [   0.0002620600000000,  0.0002017700000000,  0.0001296900000000 ]  - [  -0.0000171100000000, -0.0003148400000000, -0.0002212400000000 ]  - [   0.0002033700000000, -0.0000588900000000,  0.0002398000000000 ]  - [  -0.0002010700000000,  0.0000958000000000,  0.0001330800000000 ]  - [  -0.0007662600000000,  0.0037584500000000,  0.1291812200000000 ]  - [  -0.0006442900000000,  0.0002690500000000,  0.0001464600000000 ]  - [  -0.0050613300000000,  0.0005499600000000,  0.0041061000000000 ]  - [   0.0001181300000000, -0.0009982000000000, -0.0005491600000000 ]  - [  -0.0000630900000000, -0.0002204900000000,  0.0000727400000000 ]  - [  -0.0003829200000000,  0.0000561400000000,  0.0000138600000000 ]  - [  -0.0000174800000000,  0.0002534600000000,  0.0001075800000000 ]  - [  -0.0000097600000000, -0.0004104900000000, -0.0005510900000000 ]  - [  -0.0015103400000000, -0.0000499800000000,  0.0024048400000000 ]  - [   0.0004102800000000,  0.0015826300000000, -0.0007670200000000 ]  - [  -0.0146134700000000, -0.0029303900000000,  0.0041126100000000 ]  - [  -0.0003926800000000,  0.0001243700000000, -0.0000395800000000 ]  - [   0.0000389200000000, -0.0001665900000000,  0.0000979900000000 ]  - [   0.0009335600000000,  0.0005803600000000,  0.0016206600000000 ]  - [  -0.0000558100000000,  0.0003895000000000,  0.0001089700000000 ]  - [   0.0002032200000000, -0.0006138500000000, -0.0000407600000000 ]  - [  -0.0048735800000000, -0.0030606300000000, -0.0056884300000000 ]  - [   0.0022433800000000,  0.0058442300000000,  0.0133111100000000 ]  - [  -0.0000552800000000,  0.0000383900000000, -0.0001745700000000 ]  - [   0.0001538300000000,  0.0001247400000000, -0.0002919400000000 ]  - [  -0.0006703300000000,  0.0013840900000000, -0.0004820700000000 ]  - [   0.0001666000000000, -0.0005091800000000, -0.0002402100000000 ]  - [   0.0004368700000000,  0.0000421000000000, -0.0003662700000000 ]  - [  -0.0002068300000000,  0.0001185600000000, -0.0000013400000000 ]  - [   0.0019759300000000,  0.0001095300000000,  0.0013758700000000 ]  - [   0.0038811300000000, -0.0155315700000000, -0.0087400400000000 ]  - [   0.0001375400000000,  0.0002301500000000, -0.0000353900000000 ]  - [  -0.0003199600000000,  0.0007617700000000, -0.0002865200000000 ]  - [  -0.0001282000000000, -0.0006630600000000,  0.0004710400000000 ]  - [  -0.0241078900000000, -0.0001492300000000, -0.0759485300000000 ]  - [   0.0015142800000000, -0.0000667700000000,  0.0003633600000000 ]  - [   0.0160449300000000,  0.0172208300000000, -0.0382472100000000 ]  - [   0.0002746100000000, -0.0000661600000000,  0.0002362900000000 ]  - [   0.0161027800000000, -0.0026336100000000, -0.0104597000000000 ]  - [   0.0004492600000000, -0.0002123200000000, -0.0003517200000000 ]  - [   0.0007221300000000,  0.0010345000000000, -0.0004132800000000 ]  - [  -0.0000103700000000,  0.0002776200000000, -0.0000524200000000 ]  - [  -0.0003125300000000, -0.0001304700000000,  0.0001712300000000 ]  - [   0.0000773700000000,  0.0006694000000000, -0.0000908400000000 ]  - [  -0.0002712000000000,  0.0000935700000000,  0.0001519700000000 ]  - [  -0.0000085200000000, -0.0000715800000000,  0.0000196000000000 ]  - [  -0.0001637000000000,  0.0000367300000000, -0.0002961300000000 ]  - [   0.0004592300000000,  0.0001166400000000,  0.0001564700000000 ]  - [  -0.0000521200000000, -0.0003060700000000, -0.0000149200000000 ]  - [   0.0006213600000000, -0.0000739100000000, -0.0011255400000000 ]  - [  -0.0001609300000000, -0.0000840900000000, -0.0002984100000000 ]  - [   0.0002483100000000,  0.0000647400000000, -0.0003053400000000 ]  - [   0.0004351400000000, -0.0000742300000000, -0.0004448100000000 ]  - [   0.0019615400000000, -0.0012334800000000, -0.0012109000000000 ]  - [  -0.0001201700000000, -0.0002686800000000,  0.0000798200000000 ]  - [  -0.0001576200000000, -0.0001187200000000,  0.0000884600000000 ]  - [   0.0002497100000000,  0.0021219400000000, -0.0029859600000000 ]  - [   0.0003662500000000, -0.0008622300000000, -0.0001243800000000 ]  - [  -0.0005773900000000,  0.0000818900000000, -0.0018385400000000 ]  - [   0.0004216300000000, -0.0011468500000000,  0.0003699000000000 ]  - [   0.0009200800000000, -0.0000748100000000, -0.0005405800000000 ]  - [   0.0004819600000000, -0.0003136600000000,  0.0001054400000000 ]  - [   0.0033725400000000,  0.0003442800000000,  0.0002665200000000 ]  - [  -0.0003742500000000,  0.0001793600000000,  0.0002460900000000 ]  - [   0.0003453000000000, -0.0003363300000000, -0.0001691300000000 ]  - [  -0.0000278700000000,  0.0001656100000000,  0.0000029100000000 ]  - [  -0.0004499900000000, -0.0001166100000000,  0.0001459500000000 ]  - [  -0.0016162000000000, -0.0023545200000000, -0.0021651500000000 ]  - [  -0.0003738200000000,  0.0000619400000000,  0.0001776200000000 ]  - [  -0.0001478200000000, -0.0001176200000000,  0.0000138100000000 ]  - [  -0.0001806900000000,  0.0000449200000000, -0.0003097300000000 ]  - [   0.0000080200000000, -0.0005904400000000,  0.0000761200000000 ]  - [   0.0000092300000000, -0.0003248800000000, -0.0000780900000000 ]  - [   0.0004336900000000,  0.0002541900000000,  0.0001686600000000 ]  - [  -0.0002363000000000, -0.0001898300000000, -0.0003131500000000 ]  - [   0.0002135500000000,  0.0000657700000000, -0.0003564000000000 ]  - [  -0.0001114800000000,  0.0002266800000000, -0.0004419400000000 ]- atom:   33  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0019038600000000, -0.0007487600000000,  0.0002084400000000 ]  - [  -0.0023631300000000, -0.0009644600000000,  0.0000855200000000 ]  - [   0.0011417600000000, -0.0040222600000000, -0.0020079700000000 ]  - [   0.0006808100000000, -0.0037927900000000,  0.0022898100000000 ]  - [  -0.0001225800000000, -0.0000009400000000,  0.0003963300000000 ]  - [  -0.0005747800000000, -0.0002165600000000, -0.0001016100000000 ]  - [   0.0001750800000000,  0.0000327200000000,  0.0001661700000000 ]  - [  -0.0002778200000000,  0.0002483500000000,  0.0001272900000000 ]  - [   0.0008763900000000, -0.0001239600000000, -0.0001345400000000 ]  - [   0.0004238900000000, -0.0003401100000000,  0.0004267400000000 ]  - [   0.0043754900000000,  0.0007676500000000, -0.0009082200000000 ]  - [   0.0039444300000000,  0.0009887900000000,  0.0011896000000000 ]  - [   0.0005179300000000,  0.0003049200000000,  0.0000794800000000 ]  - [   0.0000638400000000,  0.0000881300000000,  0.0002140000000000 ]  - [   0.0002738800000000, -0.0000159100000000,  0.0001780200000000 ]  - [  -0.0001798800000000,  0.0002009700000000,  0.0001149600000000 ]  - [  -0.0075228700000000,  0.0153005400000000,  0.0049720200000000 ]  - [  -0.0074637200000000,  0.0158553800000000, -0.0047414900000000 ]  - [   0.0032570300000000, -0.0064884600000000, -0.0020913000000000 ]  - [   0.0033531300000000, -0.0069755200000000,  0.0023589700000000 ]  - [  -0.0004420500000000, -0.0003380100000000,  0.0001747700000000 ]  - [  -0.0003627600000000,  0.0001657100000000,  0.0000643000000000 ]  - [  -0.0000502000000000,  0.0009623000000000, -0.0000334700000000 ]  - [   0.0000280400000000,  0.0004584500000000,  0.0002729200000000 ]  - [   0.0017364900000000, -0.0015351900000000,  0.0007897800000000 ]  - [   0.0018180300000000, -0.0010298800000000, -0.0005477800000000 ]  - [   0.0024965600000000,  0.0003211900000000, -0.0000429100000000 ]  - [   0.0025848800000000, -0.0001868500000000,  0.0002879700000000 ]  - [   0.0004403400000000,  0.0002873500000000, -0.0003178800000000 ]  - [   0.0005174200000000,  0.0007884100000000,  0.0005566000000000 ]  - [   0.0001086800000000,  0.0001531700000000,  0.0003267200000000 ]  - [   0.0001856900000000, -0.0003483800000000, -0.0000865700000000 ]  - [  -0.1571914700000000,  0.0159535000000000,  0.0015968500000000 ]  - [   0.0008525200000000,  0.0019349800000000,  0.0017592300000000 ]  - [  -0.0002544800000000,  0.0003983000000000, -0.0000706500000000 ]  - [   0.0008578900000000, -0.0003095300000000, -0.0006593700000000 ]  - [   0.0042364000000000, -0.0005596400000000, -0.0000629700000000 ]  - [   0.0008524200000000, -0.0003075600000000,  0.0005158900000000 ]  - [   0.0004739300000000,  0.0002528500000000, -0.0000693300000000 ]  - [   0.0008564400000000,  0.0019411200000000, -0.0019074500000000 ]  - [   0.0151858700000000, -0.0163759200000000,  0.0151435000000000 ]  - [   0.0603586300000000,  0.0072100700000000,  0.0308170500000000 ]  - [  -0.0005419900000000, -0.0031720300000000,  0.0005149700000000 ]  - [  -0.0012103900000000,  0.0015972400000000,  0.0001015900000000 ]  - [   0.0153438700000000, -0.0167909800000000, -0.0152374300000000 ]  - [  -0.0005550000000000, -0.0032936200000000, -0.0032154300000000 ]  - [   0.0631377500000000,  0.0080191500000000, -0.0321907700000000 ]  - [  -0.0005303400000000, -0.0036202300000000, -0.0006049700000000 ]  - [  -0.0004979100000000,  0.0014309500000000,  0.0001738000000000 ]  - [   0.0034771000000000,  0.0001244800000000,  0.0000826500000000 ]  - [  -0.0002133300000000, -0.0034572800000000,  0.0025596400000000 ]  - [   0.0038279100000000,  0.0002721400000000, -0.0007289100000000 ]  - [   0.0001703000000000, -0.0001165800000000, -0.0000358800000000 ]  - [  -0.0002323600000000, -0.0002027900000000,  0.0001289700000000 ]  - [   0.0000511600000000,  0.0005285300000000, -0.0002245600000000 ]  - [   0.0000225000000000, -0.0007028100000000,  0.0005420600000000 ]  - [   0.0001592200000000, -0.0005786800000000, -0.0000619800000000 ]  - [  -0.0001867100000000,  0.0001995900000000, -0.0003506000000000 ]  - [   0.0004817000000000, -0.0000245000000000,  0.0001521100000000 ]  - [   0.0000613700000000,  0.0000669000000000,  0.0001275200000000 ]  - [   0.0007361600000000, -0.0008803100000000, -0.0002607800000000 ]  - [   0.0000972800000000, -0.0002212000000000, -0.0001666900000000 ]  - [   0.0001646000000000,  0.0000421200000000, -0.0002937300000000 ]  - [   0.0004497800000000, -0.0000662700000000, -0.0004769500000000 ]  - [  -0.0015935300000000,  0.0005807900000000, -0.0007821300000000 ]  - [  -0.0028219700000000,  0.0003884300000000, -0.0002098900000000 ]  - [  -0.0000204700000000,  0.0004305000000000,  0.0003105400000000 ]  - [  -0.0009472500000000, -0.0002601900000000,  0.0000522900000000 ]  - [  -0.0015963500000000,  0.0001220500000000,  0.0006741800000000 ]  - [  -0.0014219100000000,  0.0014408700000000, -0.0005892400000000 ]  - [  -0.0020962100000000,  0.0005614100000000,  0.0004835600000000 ]  - [  -0.0000100400000000, -0.0000344800000000, -0.0004051000000000 ]  - [  -0.0002357700000000, -0.0004373300000000,  0.0002277200000000 ]  - [  -0.0017558800000000,  0.0000114900000000, -0.0005730400000000 ]  - [  -0.0010642600000000,  0.0012806200000000, -0.0000601900000000 ]  - [  -0.0014135900000000,  0.0001687500000000, -0.0000715100000000 ]  - [  -0.0001011800000000,  0.0001709900000000, -0.0000621700000000 ]  - [  -0.0006004600000000, -0.0004920000000000,  0.0001133700000000 ]  - [  -0.0006041400000000, -0.0008437600000000, -0.0004555400000000 ]  - [  -0.0006996100000000,  0.0003432800000000,  0.0001296500000000 ]  - [  -0.0001098700000000, -0.0002933700000000, -0.0000348800000000 ]  - [  -0.0001947400000000, -0.0001481900000000, -0.0003019800000000 ]  - [   0.0001145000000000, -0.0003099300000000,  0.0001653100000000 ]  - [  -0.0005924900000000, -0.0013057800000000,  0.0003553900000000 ]  - [   0.0000160200000000,  0.0001658000000000,  0.0001516500000000 ]  - [  -0.0004704800000000, -0.0002399500000000, -0.0003599300000000 ]  - [   0.0001547700000000, -0.0003027800000000, -0.0003374500000000 ]  - [  -0.0001120700000000, -0.0000851700000000, -0.0002846300000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0013862900000000,  0.0017800400000000, -0.0000706400000000 ]  - [   0.0009292300000000,  0.0015615300000000,  0.0003658500000000 ]  - [  -0.0028333300000000, -0.0050716900000000, -0.0048221900000000 ]  - [  -0.0033002400000000, -0.0048612200000000,  0.0051302800000000 ]  - [   0.0003262900000000,  0.0010769200000000, -0.0000501000000000 ]  - [  -0.0001306500000000,  0.0008564900000000,  0.0003448700000000 ]  - [   0.0002733900000000,  0.0005776800000000,  0.0001817500000000 ]  - [  -0.0001838100000000,  0.0007968500000000,  0.0001128300000000 ]  - [  -0.0001171400000000,  0.0005497500000000,  0.0000366600000000 ]  - [  -0.0005760800000000,  0.0003322700000000,  0.0002562200000000 ]  - [   0.0014542800000000, -0.0007854700000000, -0.0005774800000000 ]  - [   0.0009870800000000, -0.0005698800000000,  0.0008628100000000 ]  - [   0.0001346100000000,  0.0005778100000000,  0.0001862000000000 ]  - [  -0.0003219500000000,  0.0003594300000000,  0.0001084900000000 ]  - [   0.0001959400000000,  0.0005827000000000,  0.0001857400000000 ]  - [  -0.0002610800000000,  0.0008017000000000,  0.0001087600000000 ]  - [   0.0070590200000000,  0.0022853700000000,  0.0031930900000000 ]  - [   0.0071934500000000,  0.0027767500000000, -0.0029867800000000 ]  - [  -0.0086117800000000,  0.0114082000000000,  0.0059622000000000 ]  - [  -0.0086026700000000,  0.0110004000000000, -0.0057114700000000 ]  - [   0.0001645100000000,  0.0015325300000000,  0.0000813600000000 ]  - [   0.0002414700000000,  0.0020345300000000,  0.0001579100000000 ]  - [  -0.0000613900000000,  0.0018444500000000,  0.0002440000000000 ]  - [   0.0000162700000000,  0.0013429700000000, -0.0000055200000000 ]  - [  -0.0014831400000000, -0.0024059300000000, -0.0012576400000000 ]  - [  -0.0014080300000000, -0.0019090300000000,  0.0015040400000000 ]  - [   0.0018997900000000, -0.0002712100000000, -0.0003882700000000 ]  - [   0.0019810200000000, -0.0007777500000000,  0.0006312000000000 ]  - [  -0.0000048900000000,  0.0011597100000000,  0.0000787900000000 ]  - [   0.0000735900000000,  0.0016620800000000,  0.0001621600000000 ]  - [  -0.0003180100000000,  0.0017211000000000,  0.0002376500000000 ]  - [  -0.0002405400000000,  0.0012194200000000,  0.0000021300000000 ]  - [   0.0159784500000000, -0.1671974800000000, -0.0019028700000000 ]  - [   0.0003070200000000,  0.0019150800000000,  0.0001779300000000 ]  - [   0.0003977300000000,  0.0019024400000000, -0.0000710100000000 ]  - [  -0.0019382100000000,  0.0019153800000000,  0.0008303200000000 ]  - [  -0.0005598500000000, -0.0043732100000000, -0.0000656600000000 ]  - [  -0.0019370500000000,  0.0019168800000000, -0.0009704800000000 ]  - [   0.0002527800000000,  0.0018196500000000, -0.0000699400000000 ]  - [   0.0003090900000000,  0.0019168100000000, -0.0003196300000000 ]  - [  -0.0163393700000000,  0.0587133000000000, -0.0388772600000000 ]  - [   0.0091214000000000,  0.0158809800000000,  0.0058538600000000 ]  - [  -0.0007705000000000, -0.0004997300000000,  0.0001493500000000 ]  - [   0.0011067600000000, -0.0020618000000000,  0.0007241300000000 ]  - [  -0.0172745500000000,  0.0600715400000000,  0.0405342500000000 ]  - [  -0.0018477200000000,  0.0009613900000000,  0.0003333500000000 ]  - [   0.0097575100000000,  0.0159262600000000, -0.0054787500000000 ]  - [  -0.0007567000000000, -0.0009663500000000, -0.0002328000000000 ]  - [   0.0018276500000000, -0.0022232900000000, -0.0004539700000000 ]  - [   0.0002598900000000, -0.0013821500000000, -0.0015601800000000 ]  - [  -0.0015179600000000,  0.0008007000000000, -0.0010035500000000 ]  - [   0.0006003800000000, -0.0012191100000000,  0.0009216500000000 ]  - [   0.0002415300000000, -0.0010005000000000, -0.0000688300000000 ]  - [  -0.0006233100000000, -0.0012885400000000, -0.0000668300000000 ]  - [  -0.0000138300000000, -0.0011457200000000,  0.0002375800000000 ]  - [  -0.0004551500000000, -0.0010508900000000,  0.0002554500000000 ]  - [   0.0002268600000000, -0.0014586300000000, -0.0000265500000000 ]  - [  -0.0000606900000000, -0.0008273400000000, -0.0004052100000000 ]  - [   0.0000920800000000, -0.0011143000000000,  0.0003432400000000 ]  - [  -0.0000010200000000, -0.0016077200000000, -0.0003296200000000 ]  - [   0.0002614200000000, -0.0012327100000000,  0.0000182600000000 ]  - [  -0.0002854400000000, -0.0009530200000000, -0.0002850000000000 ]  - [   0.0002868300000000, -0.0009955100000000, -0.0002418000000000 ]  - [   0.0000640500000000, -0.0007849300000000, -0.0003528700000000 ]  - [  -0.0007997400000000,  0.0022594500000000, -0.0004007700000000 ]  - [   0.0005002300000000,  0.0023544400000000,  0.0012386100000000 ]  - [   0.0008753400000000, -0.0001387700000000, -0.0003769300000000 ]  - [  -0.0009282700000000, -0.0004357100000000,  0.0001453800000000 ]  - [  -0.0008009200000000,  0.0017967000000000,  0.0003119100000000 ]  - [   0.0029606800000000, -0.0002489200000000, -0.0012036100000000 ]  - [   0.0012291200000000,  0.0025388200000000, -0.0009703000000000 ]  - [   0.0008879600000000, -0.0006000400000000,  0.0002832200000000 ]  - [  -0.0002124400000000, -0.0006011000000000,  0.0001350000000000 ]  - [  -0.0003954100000000,  0.0006226000000000, -0.0001223600000000 ]  - [   0.0033185300000000, -0.0004279700000000,  0.0005587400000000 ]  - [  -0.0000320200000000,  0.0007918700000000, -0.0005348600000000 ]  - [   0.0002788300000000, -0.0009381200000000, -0.0000612000000000 ]  - [  -0.0005293400000000, -0.0012105100000000, -0.0000385800000000 ]  - [  -0.0002951100000000, -0.0007341200000000, -0.0001145200000000 ]  - [   0.0002313600000000, -0.0009515400000000,  0.0003050000000000 ]  - [   0.0002688300000000, -0.0014025800000000, -0.0000277300000000 ]  - [  -0.0002604600000000, -0.0006209700000000, -0.0004207300000000 ]  - [   0.0001888300000000, -0.0010386500000000,  0.0003159200000000 ]  - [  -0.0002851100000000, -0.0011972400000000,  0.0000251200000000 ]  - [   0.0009467500000000, -0.0011210900000000, -0.0000271400000000 ]  - [  -0.0000846400000000, -0.0008129900000000, -0.0002347300000000 ]  - [   0.0001010600000000, -0.0007861600000000, -0.0002294000000000 ]  - [   0.0002644300000000, -0.0006433100000000, -0.0004174800000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0011712700000000, -0.0009718800000000,  0.0004966500000000 ]  - [   0.0011712700000000,  0.0009718800000000,  0.0004966500000000 ]  - [   0.0000948000000000,  0.0010051500000000,  0.0047452600000000 ]  - [  -0.0000948000000000, -0.0010051500000000,  0.0047452600000000 ]  - [   0.0005292100000000,  0.0001076700000000, -0.0004164000000000 ]  - [  -0.0005292100000000, -0.0001076700000000, -0.0004164000000000 ]  - [   0.0002967600000000, -0.0001850100000000,  0.0001141200000000 ]  - [  -0.0002967600000000,  0.0001850100000000,  0.0001141200000000 ]  - [   0.0005571300000000,  0.0000081400000000,  0.0001202500000000 ]  - [  -0.0005571300000000, -0.0000081400000000,  0.0001202500000000 ]  - [   0.0029681700000000,  0.0004906700000000, -0.0024266300000000 ]  - [  -0.0029681700000000, -0.0004906700000000, -0.0024266300000000 ]  - [   0.0000319100000000,  0.0000182200000000,  0.0001847700000000 ]  - [  -0.0000319100000000, -0.0000182200000000,  0.0001847700000000 ]  - [   0.0001544200000000, -0.0000453500000000,  0.0001608700000000 ]  - [  -0.0001544200000000,  0.0000453500000000,  0.0001608700000000 ]  - [  -0.0011792100000000,  0.0107111200000000,  0.0057191500000000 ]  - [   0.0011792100000000, -0.0107111200000000,  0.0057191500000000 ]  - [   0.0034641800000000, -0.0030195800000000, -0.0132766000000000 ]  - [  -0.0034641800000000,  0.0030195800000000, -0.0132766000000000 ]  - [   0.0002149000000000,  0.0001512300000000,  0.0002262500000000 ]  - [  -0.0002149000000000, -0.0001512300000000,  0.0002262500000000 ]  - [   0.0000732100000000, -0.0001823700000000,  0.0003433400000000 ]  - [  -0.0000732100000000,  0.0001823700000000,  0.0003433400000000 ]  - [   0.0015715400000000,  0.0001045000000000,  0.0005355900000000 ]  - [  -0.0015715400000000, -0.0001045000000000,  0.0005355900000000 ]  - [  -0.0003465700000000,  0.0008364500000000,  0.0002964400000000 ]  - [   0.0003465700000000, -0.0008364500000000,  0.0002964400000000 ]  - [  -0.0003588900000000, -0.0004988000000000,  0.0004162400000000 ]  - [   0.0003588900000000,  0.0004988000000000,  0.0004162400000000 ]  - [  -0.0003465200000000,  0.0004230300000000,  0.0000522800000000 ]  - [   0.0003465200000000, -0.0004230300000000,  0.0000522800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1502551100000000 ]  - [   0.0005858600000000,  0.0009002300000000,  0.0013656200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001071900000000 ]  - [  -0.0018353300000000,  0.0002479000000000,  0.0013674700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016233800000000 ]  - [   0.0018353300000000, -0.0002479000000000,  0.0013674700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002416500000000 ]  - [  -0.0005858600000000, -0.0009002300000000,  0.0013656200000000 ]  - [   0.0131822200000000, -0.0365088500000000,  0.0473513300000000 ]  - [   0.0310220100000000,  0.0036726300000000,  0.0296969000000000 ]  - [   0.0005544200000000,  0.0028490800000000, -0.0004790300000000 ]  - [  -0.0018708700000000,  0.0038680800000000,  0.0008774400000000 ]  - [  -0.0131822200000000,  0.0365088500000000,  0.0473513300000000 ]  - [   0.0001413000000000, -0.0004690800000000, -0.0015372200000000 ]  - [  -0.0310220100000000, -0.0036726300000000,  0.0296969000000000 ]  - [  -0.0005544200000000, -0.0028490800000000, -0.0004790300000000 ]  - [   0.0018708700000000, -0.0038680800000000,  0.0008774400000000 ]  - [   0.0015580700000000, -0.0027251100000000,  0.0017446000000000 ]  - [  -0.0001413000000000,  0.0004690800000000, -0.0015372200000000 ]  - [  -0.0015580700000000,  0.0027251100000000,  0.0017446000000000 ]  - [  -0.0000421100000000,  0.0003449800000000, -0.0001160500000000 ]  - [  -0.0004111900000000, -0.0001519800000000,  0.0000947000000000 ]  - [  -0.0000511200000000,  0.0004974100000000, -0.0003905700000000 ]  - [  -0.0005475400000000,  0.0005410100000000, -0.0001911100000000 ]  - [   0.0000421100000000, -0.0003449800000000, -0.0001160500000000 ]  - [  -0.0000147100000000, -0.0003242000000000, -0.0002825800000000 ]  - [   0.0004111900000000,  0.0001519800000000,  0.0000947000000000 ]  - [   0.0000511200000000, -0.0004974100000000, -0.0003905700000000 ]  - [   0.0005475400000000, -0.0005410100000000, -0.0001911100000000 ]  - [  -0.0004188900000000, -0.0001113200000000, -0.0004923700000000 ]  - [   0.0000147100000000,  0.0003242000000000, -0.0002825800000000 ]  - [   0.0004188900000000,  0.0001113200000000, -0.0004923700000000 ]  - [  -0.0010969600000000, -0.0002639700000000, -0.0012603700000000 ]  - [  -0.0003742800000000, -0.0003489600000000, -0.0004611200000000 ]  - [   0.0005529400000000,  0.0003190800000000, -0.0005760400000000 ]  - [  -0.0002903600000000, -0.0000159400000000,  0.0000291800000000 ]  - [   0.0010969600000000,  0.0002639700000000, -0.0012603700000000 ]  - [  -0.0024715000000000,  0.0004110300000000,  0.0014412700000000 ]  - [   0.0003742800000000,  0.0003489600000000, -0.0004611200000000 ]  - [  -0.0005529400000000, -0.0003190800000000, -0.0005760400000000 ]  - [   0.0002903600000000,  0.0000159400000000,  0.0000291800000000 ]  - [  -0.0006773700000000, -0.0003505500000000, -0.0003601900000000 ]  - [   0.0024715000000000, -0.0004110300000000,  0.0014412700000000 ]  - [   0.0006773700000000,  0.0003505500000000, -0.0003601900000000 ]  - [   0.0000776100000000,  0.0001629500000000, -0.0000180400000000 ]  - [  -0.0002885300000000,  0.0001031100000000,  0.0001473200000000 ]  - [  -0.0004139100000000, -0.0004558400000000, -0.0003037800000000 ]  - [   0.0001233400000000,  0.0000194300000000,  0.0001147900000000 ]  - [  -0.0000776100000000, -0.0001629500000000, -0.0000180400000000 ]  - [  -0.0001625700000000,  0.0002208400000000, -0.0003668400000000 ]  - [   0.0002885300000000, -0.0001031100000000,  0.0001473200000000 ]  - [   0.0004139100000000,  0.0004558400000000, -0.0003037800000000 ]  - [  -0.0001233400000000, -0.0000194300000000,  0.0001147900000000 ]  - [   0.0000130100000000, -0.0000675300000000, -0.0003037900000000 ]  - [   0.0001625700000000, -0.0002208400000000, -0.0003668400000000 ]  - [  -0.0000130100000000,  0.0000675300000000, -0.0003037900000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0016258100000000,  0.0011925900000000, -0.0002012000000000 ]  - [  -0.0016258100000000, -0.0011925900000000, -0.0002012000000000 ]  - [   0.0003821000000000, -0.0012292300000000, -0.0044511600000000 ]  - [  -0.0003821000000000,  0.0012292300000000, -0.0044511600000000 ]  - [  -0.0000756700000000,  0.0001107900000000,  0.0007106600000000 ]  - [   0.0000756700000000, -0.0001107900000000,  0.0007106600000000 ]  - [   0.0001623100000000, -0.0000362800000000,  0.0001800900000000 ]  - [  -0.0001623100000000,  0.0000362800000000,  0.0001800900000000 ]  - [  -0.0001014100000000,  0.0002085000000000,  0.0001729600000000 ]  - [   0.0001014100000000, -0.0002085000000000,  0.0001729600000000 ]  - [  -0.0025227800000000, -0.0007114900000000,  0.0027208000000000 ]  - [   0.0025227800000000,  0.0007114900000000,  0.0027208000000000 ]  - [   0.0004223500000000,  0.0002005300000000,  0.0001108300000000 ]  - [  -0.0004223500000000, -0.0002005300000000,  0.0001108300000000 ]  - [   0.0003024700000000, -0.0001766100000000,  0.0001347200000000 ]  - [  -0.0003024700000000,  0.0001766100000000,  0.0001347200000000 ]  - [   0.0010576000000000, -0.0112141300000000, -0.0054806600000000 ]  - [  -0.0010576000000000,  0.0112141300000000, -0.0054806600000000 ]  - [  -0.0035275500000000,  0.0035214200000000,  0.0134944000000000 ]  - [   0.0035275500000000, -0.0035214200000000,  0.0134944000000000 ]  - [  -0.0002913800000000, -0.0006563200000000,  0.0000136300000000 ]  - [   0.0002913800000000,  0.0006563200000000,  0.0000136300000000 ]  - [  -0.0001490300000000,  0.0006886300000000, -0.0001013500000000 ]  - [   0.0001490300000000, -0.0006886300000000, -0.0001013500000000 ]  - [  -0.0016450200000000, -0.0006063500000000, -0.0002879700000000 ]  - [   0.0016450200000000,  0.0006063500000000, -0.0002879700000000 ]  - [   0.0002702800000000, -0.0003239100000000, -0.0000527300000000 ]  - [  -0.0002702800000000,  0.0003239100000000, -0.0000527300000000 ]  - [   0.0002824300000000, -0.0000080600000000, -0.0001757700000000 ]  - [  -0.0002824300000000,  0.0000080600000000, -0.0001757700000000 ]  - [   0.0002690700000000,  0.0000827700000000,  0.0001878000000000 ]  - [  -0.0002690700000000, -0.0000827700000000,  0.0001878000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1497229900000000 ]  - [  -0.0005887800000000, -0.0009002300000000, -0.0015069300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002445500000000 ]  - [   0.0018319200000000, -0.0002498100000000, -0.0015036600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017570700000000 ]  - [  -0.0018319200000000,  0.0002498100000000, -0.0015036600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001018500000000 ]  - [   0.0005887800000000,  0.0009002300000000, -0.0015069300000000 ]  - [  -0.0127181900000000,  0.0358506200000000, -0.0469326900000000 ]  - [  -0.0326721300000000, -0.0041087700000000, -0.0297628200000000 ]  - [  -0.0005710000000000, -0.0023789100000000,  0.0003741400000000 ]  - [   0.0011596500000000, -0.0036866000000000, -0.0005977100000000 ]  - [   0.0127181900000000, -0.0358506200000000, -0.0469326900000000 ]  - [  -0.0004845700000000,  0.0006160300000000,  0.0008857500000000 ]  - [   0.0326721300000000,  0.0041087700000000, -0.0297628200000000 ]  - [   0.0005710000000000,  0.0023789100000000,  0.0003741400000000 ]  - [  -0.0011596500000000,  0.0036866000000000, -0.0005977100000000 ]  - [  -0.0019060900000000,  0.0025868000000000, -0.0023650200000000 ]  - [   0.0004845700000000, -0.0006160300000000,  0.0008857500000000 ]  - [   0.0019060900000000, -0.0025868000000000, -0.0023650200000000 ]  - [   0.0000545400000000,  0.0001325600000000,  0.0000073100000000 ]  - [  -0.0002959200000000, -0.0000282900000000,  0.0001861000000000 ]  - [   0.0000370700000000, -0.0000227900000000,  0.0002793900000000 ]  - [  -0.0001589700000000, -0.0003658500000000,  0.0004745400000000 ]  - [  -0.0000545400000000, -0.0001325600000000,  0.0000073100000000 ]  - [  -0.0003379700000000,  0.0004793200000000, -0.0003462000000000 ]  - [   0.0002959200000000,  0.0000282900000000,  0.0001861000000000 ]  - [  -0.0000370700000000,  0.0000227900000000,  0.0002793900000000 ]  - [   0.0001589700000000,  0.0003658500000000,  0.0004745400000000 ]  - [   0.0000551500000000, -0.0000421300000000, -0.0001442200000000 ]  - [   0.0003379700000000, -0.0004793200000000, -0.0003462000000000 ]  - [  -0.0000551500000000,  0.0000421300000000, -0.0001442200000000 ]  - [   0.0011042900000000,  0.0007379700000000,  0.0011498100000000 ]  - [  -0.0003367700000000,  0.0001707800000000,  0.0007379900000000 ]  - [  -0.0005642200000000,  0.0001606500000000,  0.0004681100000000 ]  - [  -0.0004145400000000,  0.0001888200000000,  0.0002530900000000 ]  - [  -0.0011042900000000, -0.0007379700000000,  0.0011498100000000 ]  - [   0.0020979000000000, -0.0002481700000000, -0.0020751900000000 ]  - [   0.0003367700000000, -0.0001707800000000,  0.0007379900000000 ]  - [   0.0005642200000000, -0.0001606500000000,  0.0004681100000000 ]  - [   0.0004145400000000, -0.0001888200000000,  0.0002530900000000 ]  - [   0.0003199400000000,  0.0001950200000000, -0.0002768200000000 ]  - [  -0.0020979000000000,  0.0002481700000000, -0.0020751900000000 ]  - [  -0.0003199400000000, -0.0001950200000000, -0.0002768200000000 ]  - [  -0.0000654500000000,  0.0003116800000000, -0.0000905700000000 ]  - [  -0.0004145200000000, -0.0002823400000000,  0.0001330800000000 ]  - [   0.0003989000000000,  0.0009279300000000,  0.0001922800000000 ]  - [  -0.0008307000000000,  0.0001581000000000,  0.0001669500000000 ]  - [   0.0000654500000000, -0.0003116800000000, -0.0000905700000000 ]  - [  -0.0001916000000000, -0.0000656200000000, -0.0002628800000000 ]  - [   0.0004145200000000,  0.0002823400000000,  0.0001330800000000 ]  - [  -0.0003989000000000, -0.0009279300000000,  0.0001922800000000 ]  - [   0.0008307000000000, -0.0001581000000000,  0.0001669500000000 ]  - [  -0.0003758100000000, -0.0000861600000000, -0.0003305100000000 ]  - [   0.0001916000000000,  0.0000656200000000, -0.0002628800000000 ]  - [   0.0003758100000000,  0.0000861600000000, -0.0003305100000000 ]- atom:   41  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0011956200000000,  0.0001478500000000,  0.0004798100000000 ]  - [   0.0001753700000000,  0.0000699100000000,  0.0002301200000000 ]  - [   0.0031338700000000,  0.0004414000000000,  0.0022105100000000 ]  - [  -0.0005189500000000,  0.0009829100000000, -0.0005634600000000 ]  - [   0.0003149700000000,  0.0002755000000000,  0.0000112800000000 ]  - [  -0.0000178900000000,  0.0000565400000000,  0.0004343500000000 ]  - [   0.0002488500000000, -0.0000058000000000,  0.0001512600000000 ]  - [  -0.0001942000000000,  0.0001843800000000,  0.0001532000000000 ]  - [  -0.0004435300000000,  0.0010645500000000,  0.0005388600000000 ]  - [  -0.0004109700000000, -0.0000647200000000,  0.0001113500000000 ]  - [  -0.0007188100000000, -0.0004539700000000,  0.0004207800000000 ]  - [  -0.0003610800000000, -0.0004315100000000,  0.0003342900000000 ]  - [   0.0001715500000000,  0.0001391500000000,  0.0001772800000000 ]  - [  -0.0004052100000000, -0.0001110300000000,  0.0000451200000000 ]  - [   0.0002192400000000, -0.0000311100000000,  0.0001388400000000 ]  - [  -0.0002606700000000,  0.0002234100000000,  0.0001404500000000 ]  - [   0.0013111900000000, -0.0030700800000000, -0.0018429100000000 ]  - [   0.0012362400000000, -0.0010628600000000, -0.0000058000000000 ]  - [   0.0148128200000000, -0.0124910500000000, -0.0164160100000000 ]  - [  -0.0010256100000000,  0.0007158200000000, -0.0014846000000000 ]  - [   0.0000553800000000,  0.0000570600000000,  0.0001407800000000 ]  - [   0.0002746100000000,  0.0006911800000000,  0.0001198700000000 ]  - [  -0.0000238100000000,  0.0003908300000000,  0.0001796300000000 ]  - [   0.0000697900000000, -0.0003201600000000, -0.0000305800000000 ]  - [  -0.0020442600000000,  0.0000168900000000, -0.0018315200000000 ]  - [  -0.0004393100000000, -0.0000197800000000,  0.0004954500000000 ]  - [  -0.0014915100000000,  0.0007054500000000, -0.0007892800000000 ]  - [   0.0000377500000000, -0.0005414900000000,  0.0002031400000000 ]  - [  -0.0001049700000000, -0.0001000900000000,  0.0001572100000000 ]  - [  -0.0001802300000000,  0.0002637700000000, -0.0000178100000000 ]  - [  -0.0001383700000000,  0.0004802400000000,  0.0001175300000000 ]  - [  -0.0001011100000000,  0.0002027000000000,  0.0002632900000000 ]  - [   0.0153374900000000, -0.0167610100000000,  0.0128732400000000 ]  - [  -0.0000176600000000, -0.0008830200000000, -0.0006286000000000 ]  - [   0.0001665100000000,  0.0002342200000000, -0.0001199500000000 ]  - [  -0.0005986400000000,  0.0002881600000000,  0.0003384500000000 ]  - [  -0.0015930200000000, -0.0008004300000000, -0.0011743100000000 ]  - [  -0.0005424500000000,  0.0007620300000000, -0.0006361400000000 ]  - [  -0.0001047400000000,  0.0002718200000000,  0.0000015900000000 ]  - [   0.0000559900000000,  0.0000073900000000, -0.0000260500000000 ]  - [  -0.0465494700000000,  0.0369524100000000,  0.0041582900000000 ]  - [   0.0030904400000000, -0.0032205500000000,  0.0067800500000000 ]  - [  -0.0001123800000000,  0.0003274300000000, -0.0000220100000000 ]  - [  -0.0003388200000000, -0.0021771500000000, -0.0005764900000000 ]  - [   0.0013749500000000, -0.0040317100000000,  0.0020203900000000 ]  - [   0.0043174500000000,  0.0016156100000000, -0.0016731400000000 ]  - [  -0.0010312300000000,  0.0038749500000000, -0.0025993800000000 ]  - [  -0.0000599800000000,  0.0006925900000000,  0.0001762500000000 ]  - [   0.0008094900000000, -0.0010819800000000,  0.0001801800000000 ]  - [  -0.0013670800000000,  0.0003325900000000,  0.0013974300000000 ]  - [   0.0000188500000000,  0.0004894800000000, -0.0007502000000000 ]  - [  -0.0003225700000000, -0.0000798400000000, -0.0002347800000000 ]  - [   0.0000066000000000,  0.0000943300000000, -0.0000564100000000 ]  - [  -0.0004312100000000, -0.0002611000000000,  0.0001105300000000 ]  - [  -0.0001073600000000, -0.0001488800000000,  0.0000553600000000 ]  - [  -0.0004336700000000,  0.0000471400000000,  0.0001278200000000 ]  - [  -0.0000378000000000, -0.0003150300000000, -0.0000329400000000 ]  - [  -0.0001469800000000, -0.0001154800000000, -0.0003272800000000 ]  - [   0.0002469100000000, -0.0001261900000000,  0.0001903600000000 ]  - [   0.0000080300000000, -0.0004727100000000, -0.0001468200000000 ]  - [   0.0001942300000000,  0.0000577200000000,  0.0002405300000000 ]  - [  -0.0002493600000000, -0.0002177700000000, -0.0003426800000000 ]  - [   0.0002373400000000, -0.0004071800000000, -0.0003321500000000 ]  - [  -0.0000013900000000, -0.0000351900000000, -0.0002193400000000 ]  - [   0.0014536400000000,  0.0003154600000000, -0.0000483900000000 ]  - [   0.0013507000000000,  0.0006563200000000,  0.0014758900000000 ]  - [   0.0001575300000000,  0.0002348600000000, -0.0002034700000000 ]  - [   0.0003632800000000,  0.0005805600000000,  0.0001905800000000 ]  - [   0.0001314300000000,  0.0002422000000000,  0.0001636700000000 ]  - [   0.0056752500000000, -0.0038467500000000, -0.0037002300000000 ]  - [   0.0015485500000000,  0.0006002300000000,  0.0000931600000000 ]  - [  -0.0000610200000000, -0.0005888800000000,  0.0004287200000000 ]  - [   0.0003265800000000, -0.0000407500000000,  0.0001504200000000 ]  - [   0.0006501600000000, -0.0000867600000000,  0.0001806000000000 ]  - [   0.0007303700000000, -0.0003185900000000, -0.0004418300000000 ]  - [   0.0004123000000000,  0.0002489700000000, -0.0003858700000000 ]  - [   0.0000891700000000,  0.0000458300000000, -0.0000773700000000 ]  - [  -0.0003307700000000, -0.0002267000000000,  0.0001139600000000 ]  - [   0.0001592400000000,  0.0004596600000000,  0.0000397700000000 ]  - [  -0.0001765400000000, -0.0000933900000000,  0.0001520900000000 ]  - [   0.0001024100000000, -0.0004878400000000, -0.0000856200000000 ]  - [  -0.0002042400000000,  0.0000178200000000, -0.0003394300000000 ]  - [   0.0004235000000000,  0.0000219300000000,  0.0001590000000000 ]  - [   0.0000082300000000, -0.0002652600000000, -0.0000581300000000 ]  - [   0.0005540400000000, -0.0005453100000000,  0.0001260800000000 ]  - [  -0.0001081900000000, -0.0001665400000000, -0.0002895700000000 ]  - [   0.0001985900000000, -0.0000889300000000, -0.0002865800000000 ]  - [   0.0003506100000000,  0.0000132700000000, -0.0003816600000000 ]- atom:   41  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0007357500000000,  0.0000489600000000, -0.0001893600000000 ]  - [  -0.0006383600000000, -0.0002905700000000,  0.0000622500000000 ]  - [  -0.0026628200000000, -0.0006616500000000, -0.0018455500000000 ]  - [   0.0000551500000000, -0.0007623000000000,  0.0008565200000000 ]  - [   0.0001462600000000, -0.0000535500000000,  0.0002815400000000 ]  - [  -0.0004431300000000, -0.0002788200000000, -0.0001382000000000 ]  - [   0.0002147700000000, -0.0002158500000000,  0.0001422900000000 ]  - [  -0.0002678600000000,  0.0000369800000000,  0.0001397500000000 ]  - [   0.0009053700000000, -0.0008409800000000, -0.0002444000000000 ]  - [  -0.0000526500000000, -0.0001605500000000,  0.0001826500000000 ]  - [   0.0011806800000000,  0.0002332300000000, -0.0001291300000000 ]  - [  -0.0000984800000000,  0.0006512100000000, -0.0000404400000000 ]  - [   0.0002923800000000,  0.0000847900000000,  0.0001159300000000 ]  - [  -0.0000569400000000, -0.0001099600000000,  0.0002473100000000 ]  - [   0.0002447300000000, -0.0001930300000000,  0.0001544400000000 ]  - [  -0.0002026000000000, -0.0000007000000000,  0.0001525800000000 ]  - [  -0.0013880400000000,  0.0025722100000000,  0.0021063100000000 ]  - [  -0.0011680400000000,  0.0015788200000000,  0.0002466700000000 ]  - [  -0.0149245100000000,  0.0126584600000000,  0.0163530600000000 ]  - [   0.0011074300000000, -0.0012185600000000,  0.0017293500000000 ]  - [  -0.0001342800000000, -0.0005598800000000,  0.0000993200000000 ]  - [  -0.0001940100000000, -0.0001854400000000,  0.0001202600000000 ]  - [  -0.0000531700000000,  0.0001139800000000,  0.0000596800000000 ]  - [   0.0000089100000000, -0.0001843600000000,  0.0002683000000000 ]  - [   0.0019682400000000, -0.0005197000000000,  0.0020660000000000 ]  - [   0.0005203700000000,  0.0005201600000000, -0.0002501600000000 ]  - [   0.0013951400000000, -0.0002097200000000,  0.0010386100000000 ]  - [   0.0000455200000000,  0.0000377200000000,  0.0000393500000000 ]  - [   0.0000265500000000, -0.0004029800000000,  0.0000833600000000 ]  - [   0.0002588000000000,  0.0002397700000000,  0.0002596100000000 ]  - [   0.0000615200000000,  0.0000228000000000,  0.0001207400000000 ]  - [   0.0001757000000000, -0.0007067800000000, -0.0000263500000000 ]  - [  -0.0151937900000000,  0.0168448900000000, -0.0130240600000000 ]  - [   0.0000139800000000,  0.0008831500000000,  0.0004912700000000 ]  - [  -0.0001658200000000, -0.0002330900000000, -0.0000214600000000 ]  - [   0.0005983200000000, -0.0002882500000000, -0.0004775100000000 ]  - [   0.0015942000000000,  0.0007990600000000,  0.0010256200000000 ]  - [   0.0005311400000000, -0.0007627200000000,  0.0004889700000000 ]  - [   0.0001043100000000, -0.0002708800000000, -0.0001416200000000 ]  - [  -0.0000545500000000, -0.0000052100000000, -0.0001146700000000 ]  - [   0.0464749100000000, -0.0362016300000000, -0.0040214300000000 ]  - [  -0.0038411300000000,  0.0030655100000000, -0.0065727500000000 ]  - [   0.0000976100000000,  0.0001386600000000, -0.0000853100000000 ]  - [  -0.0003766300000000,  0.0023260500000000,  0.0008514300000000 ]  - [  -0.0013880600000000,  0.0036023700000000, -0.0021297200000000 ]  - [  -0.0047351900000000, -0.0014726800000000,  0.0010782800000000 ]  - [   0.0017380200000000, -0.0037082200000000,  0.0028882500000000 ]  - [   0.0000760700000000, -0.0011645800000000, -0.0002869300000000 ]  - [  -0.0000990800000000,  0.0009063900000000,  0.0000995700000000 ]  - [   0.0010091800000000, -0.0004835600000000, -0.0019894200000000 ]  - [   0.0003365800000000, -0.0006628500000000,  0.0001135600000000 ]  - [   0.0006850700000000,  0.0002492500000000, -0.0004033700000000 ]  - [   0.0000112500000000,  0.0003708700000000, -0.0000554300000000 ]  - [  -0.0002799000000000,  0.0000855500000000,  0.0001716300000000 ]  - [   0.0000992200000000,  0.0006195600000000, -0.0001541400000000 ]  - [  -0.0002746100000000,  0.0001380500000000,  0.0001489900000000 ]  - [   0.0000217900000000, -0.0001524800000000, -0.0000772100000000 ]  - [  -0.0002161300000000,  0.0002834200000000, -0.0003171200000000 ]  - [   0.0004632100000000,  0.0002994000000000,  0.0000925900000000 ]  - [   0.0000009500000000,  0.0000007300000000,  0.0000460300000000 ]  - [   0.0005139200000000, -0.0002401300000000,  0.0000357700000000 ]  - [  -0.0000998900000000,  0.0000473400000000, -0.0002861900000000 ]  - [   0.0001402400000000,  0.0002378800000000, -0.0003110900000000 ]  - [   0.0003496500000000,  0.0002046800000000, -0.0004114600000000 ]  - [  -0.0014387300000000,  0.0001539100000000, -0.0000533900000000 ]  - [  -0.0020483300000000, -0.0008360400000000, -0.0011849000000000 ]  - [  -0.0001709700000000,  0.0002370900000000,  0.0000980700000000 ]  - [  -0.0010749800000000, -0.0004048100000000,  0.0000891400000000 ]  - [  -0.0001466700000000, -0.0007094500000000, -0.0002634400000000 ]  - [  -0.0059485100000000,  0.0039870300000000,  0.0030190200000000 ]  - [  -0.0008337300000000, -0.0004173800000000,  0.0001871700000000 ]  - [   0.0000748800000000,  0.0001258000000000, -0.0005357300000000 ]  - [   0.0003814000000000, -0.0001385100000000,  0.0001305300000000 ]  - [  -0.0010154200000000, -0.0000793300000000, -0.0008168000000000 ]  - [  -0.0003690900000000,  0.0001502200000000, -0.0001986700000000 ]  - [  -0.0000523500000000, -0.0000798300000000, -0.0002557200000000 ]  - [  -0.0000746100000000,  0.0004242800000000, -0.0000293800000000 ]  - [  -0.0003817200000000,  0.0000549600000000,  0.0001693700000000 ]  - [  -0.0001669900000000,  0.0000133200000000, -0.0001394100000000 ]  - [  -0.0005324600000000,  0.0002755800000000,  0.0001274600000000 ]  - [  -0.0001208900000000,  0.0000219800000000, -0.0000272600000000 ]  - [  -0.0001719600000000,  0.0001484600000000, -0.0003052300000000 ]  - [   0.0002886000000000,  0.0001490200000000,  0.0001246300000000 ]  - [  -0.0000005300000000, -0.0002090300000000, -0.0000410800000000 ]  - [   0.0001551400000000,  0.0003573900000000,  0.0001505000000000 ]  - [  -0.0002426000000000, -0.0000037000000000, -0.0003511200000000 ]  - [   0.0001739200000000, -0.0000770900000000, -0.0003587600000000 ]  - [  -0.0000050600000000,  0.0001558600000000, -0.0002483500000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0013420000000000, -0.0011148900000000,  0.0008624000000000 ]  - [  -0.0003161000000000, -0.0007950500000000,  0.0000367400000000 ]  - [   0.0005244600000000,  0.0041584000000000,  0.0018540900000000 ]  - [   0.0005061100000000,  0.0002524700000000, -0.0001299400000000 ]  - [   0.0001992200000000, -0.0003929500000000,  0.0003303600000000 ]  - [  -0.0006056400000000, -0.0006908100000000, -0.0006265300000000 ]  - [   0.0002168500000000, -0.0006116600000000,  0.0001202000000000 ]  - [  -0.0003220000000000, -0.0003045700000000,  0.0001391100000000 ]  - [   0.0007722800000000, -0.0002608300000000,  0.0000823800000000 ]  - [  -0.0001381100000000, -0.0003393500000000,  0.0001140500000000 ]  - [   0.0007185500000000,  0.0007107000000000,  0.0000498400000000 ]  - [  -0.0012108600000000,  0.0005391700000000, -0.0000918300000000 ]  - [   0.0002480900000000, -0.0002280500000000,  0.0001345900000000 ]  - [  -0.0000047600000000, -0.0002729600000000,  0.0002779000000000 ]  - [   0.0002365400000000, -0.0005259700000000,  0.0001411300000000 ]  - [  -0.0001437400000000, -0.0003668300000000,  0.0001650100000000 ]  - [  -0.0025339200000000,  0.0031886600000000,  0.0002477600000000 ]  - [   0.0008728700000000, -0.0028280700000000, -0.0003112800000000 ]  - [  -0.0119370300000000,  0.0177282300000000,  0.0176642700000000 ]  - [   0.0019149600000000, -0.0018095800000000,  0.0027236200000000 ]  - [  -0.0001175000000000, -0.0013426600000000,  0.0000783800000000 ]  - [  -0.0003238800000000, -0.0013276800000000,  0.0002867300000000 ]  - [  -0.0000278700000000, -0.0008170400000000,  0.0000532000000000 ]  - [  -0.0000585500000000, -0.0008634700000000,  0.0004771000000000 ]  - [   0.0017174700000000,  0.0017630100000000,  0.0015952400000000 ]  - [   0.0002451000000000,  0.0008923700000000, -0.0005053000000000 ]  - [  -0.0002111600000000,  0.0005678200000000,  0.0002837500000000 ]  - [  -0.0016245700000000, -0.0002086100000000, -0.0003088700000000 ]  - [  -0.0001108900000000, -0.0012387200000000,  0.0001912800000000 ]  - [   0.0002505700000000, -0.0004415100000000,  0.0002380900000000 ]  - [   0.0001417700000000, -0.0006345500000000,  0.0000316400000000 ]  - [   0.0005885400000000, -0.0012825300000000,  0.0001275100000000 ]  - [  -0.0170730000000000,  0.0603021500000000, -0.0371027800000000 ]  - [  -0.0001972600000000, -0.0003677400000000,  0.0000096000000000 ]  - [  -0.0003494400000000, -0.0012307800000000,  0.0000366800000000 ]  - [   0.0010787500000000, -0.0009661100000000, -0.0007673400000000 ]  - [   0.0003552800000000,  0.0020356300000000, -0.0005668500000000 ]  - [   0.0033976500000000, -0.0007372300000000,  0.0025419000000000 ]  - [  -0.0000619200000000, -0.0011695900000000, -0.0001458800000000 ]  - [  -0.0002981600000000, -0.0013778600000000,  0.0001882300000000 ]  - [   0.0368417300000000, -0.1007972900000000,  0.0243769700000000 ]  - [  -0.0015997700000000, -0.0019229700000000, -0.0020774200000000 ]  - [   0.0003777300000000,  0.0013004900000000, -0.0001150600000000 ]  - [  -0.0041839600000000,  0.0093010600000000,  0.0008274100000000 ]  - [  -0.0038685800000000,  0.0054808700000000, -0.0041421100000000 ]  - [   0.0016815400000000, -0.0006845700000000, -0.0011327200000000 ]  - [   0.0007892300000000,  0.0057928100000000, -0.0058504900000000 ]  - [   0.0003665300000000, -0.0003928700000000,  0.0002862400000000 ]  - [  -0.0005016300000000,  0.0016459600000000,  0.0001443000000000 ]  - [   0.0000906100000000,  0.0000329100000000,  0.0012952100000000 ]  - [   0.0010890800000000,  0.0011390000000000, -0.0012620100000000 ]  - [  -0.0000893300000000,  0.0004167800000000, -0.0002790900000000 ]  - [  -0.0001322800000000,  0.0010477100000000, -0.0000710900000000 ]  - [  -0.0001720000000000,  0.0006742600000000,  0.0002695000000000 ]  - [  -0.0001035400000000,  0.0012998900000000, -0.0006993300000000 ]  - [  -0.0003878900000000,  0.0008992000000000,  0.0000166100000000 ]  - [  -0.0000881200000000,  0.0004465500000000, -0.0001276200000000 ]  - [  -0.0002629700000000,  0.0006805300000000, -0.0002605400000000 ]  - [   0.0005966600000000,  0.0009253100000000, -0.0000355900000000 ]  - [   0.0000387700000000,  0.0005185100000000,  0.0000864500000000 ]  - [   0.0006440800000000,  0.0001539500000000,  0.0000583900000000 ]  - [  -0.0001396500000000,  0.0004893000000000, -0.0003419900000000 ]  - [  -0.0001019300000000,  0.0009800000000000, -0.0003245800000000 ]  - [   0.0004905300000000,  0.0006911900000000, -0.0004765200000000 ]  - [   0.0000877000000000, -0.0013001700000000,  0.0000742300000000 ]  - [  -0.0004712400000000, -0.0013513800000000, -0.0000381300000000 ]  - [  -0.0002347500000000,  0.0004432300000000,  0.0001116000000000 ]  - [  -0.0003079200000000, -0.0001052600000000,  0.0003314000000000 ]  - [   0.0004680900000000, -0.0012683000000000, -0.0001858700000000 ]  - [  -0.0034647600000000,  0.0007005000000000,  0.0013563800000000 ]  - [   0.0000391700000000, -0.0008127500000000,  0.0004380500000000 ]  - [  -0.0009171400000000, -0.0003951200000000, -0.0008371600000000 ]  - [   0.0006928300000000,  0.0003255600000000,  0.0001986200000000 ]  - [  -0.0005064900000000, -0.0007363100000000, -0.0005462700000000 ]  - [  -0.0006514600000000,  0.0001237500000000, -0.0003398400000000 ]  - [   0.0004585200000000, -0.0001374000000000, -0.0002301700000000 ]  - [  -0.0001785800000000,  0.0009683100000000, -0.0000318600000000 ]  - [  -0.0002744000000000,  0.0006781200000000,  0.0002642800000000 ]  - [  -0.0000062800000000,  0.0004436500000000, -0.0000651900000000 ]  - [  -0.0006647900000000,  0.0007154900000000,  0.0000700700000000 ]  - [  -0.0002639500000000,  0.0005689700000000, -0.0000580900000000 ]  - [  -0.0001451900000000,  0.0005558700000000, -0.0002557100000000 ]  - [   0.0003846700000000,  0.0007126800000000,  0.0000400600000000 ]  - [   0.0002464400000000,  0.0005174600000000, -0.0001462400000000 ]  - [  -0.0005885000000000,  0.0005681700000000,  0.0001702400000000 ]  - [  -0.0002137500000000,  0.0003854200000000, -0.0003637300000000 ]  - [   0.0002226900000000,  0.0002241300000000, -0.0004191100000000 ]  - [  -0.0000623700000000,  0.0004659000000000, -0.0002285800000000 ]- atom:   41  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0018040300000000,  0.0013478900000000, -0.0005733000000000 ]  - [  -0.0001554300000000,  0.0005602500000000,  0.0002560500000000 ]  - [  -0.0000473600000000, -0.0043866100000000, -0.0015212500000000 ]  - [  -0.0009663900000000, -0.0000185500000000,  0.0004159000000000 ]  - [   0.0002674100000000,  0.0006206600000000, -0.0000351000000000 ]  - [   0.0001383200000000,  0.0004576900000000,  0.0009172300000000 ]  - [   0.0002485700000000,  0.0003832000000000,  0.0001735800000000 ]  - [  -0.0001443800000000,  0.0005304600000000,  0.0001546400000000 ]  - [  -0.0003033500000000,  0.0004813200000000,  0.0002080700000000 ]  - [  -0.0003289200000000,  0.0001082300000000,  0.0001795800000000 ]  - [  -0.0002466000000000, -0.0009367700000000,  0.0002438700000000 ]  - [   0.0007395600000000, -0.0003044600000000,  0.0003825200000000 ]  - [   0.0002193900000000,  0.0004574200000000,  0.0001591900000000 ]  - [  -0.0004612000000000,  0.0000449500000000,  0.0000155000000000 ]  - [   0.0002299500000000,  0.0002974000000000,  0.0001525700000000 ]  - [  -0.0003219100000000,  0.0005923800000000,  0.0001282600000000 ]  - [   0.0024376800000000, -0.0036841100000000,  0.0000028500000000 ]  - [  -0.0007971000000000,  0.0033306800000000,  0.0005508800000000 ]  - [   0.0123418500000000, -0.0176007600000000, -0.0181526800000000 ]  - [  -0.0018211700000000,  0.0012973400000000, -0.0024513000000000 ]  - [   0.0000387600000000,  0.0008323700000000,  0.0001610200000000 ]  - [   0.0004027500000000,  0.0018303800000000, -0.0000466300000000 ]  - [  -0.0000523300000000,  0.0013167600000000,  0.0001884100000000 ]  - [   0.0001405400000000,  0.0003564800000000, -0.0002349700000000 ]  - [  -0.0017893900000000, -0.0022707100000000, -0.0013399700000000 ]  - [  -0.0001590500000000, -0.0003804500000000,  0.0007429800000000 ]  - [   0.0001301100000000, -0.0000624300000000, -0.0000439600000000 ]  - [   0.0016972400000000, -0.0002923900000000,  0.0005489500000000 ]  - [   0.0000290000000000,  0.0007295200000000,  0.0000500700000000 ]  - [  -0.0001693000000000,  0.0009417600000000,  0.0000046900000000 ]  - [  -0.0002207800000000,  0.0011352300000000,  0.0002110800000000 ]  - [  -0.0005071600000000,  0.0007747300000000,  0.0001160400000000 ]  - [   0.0161071100000000, -0.0584902800000000,  0.0352751100000000 ]  - [   0.0001986000000000,  0.0003690300000000, -0.0001471100000000 ]  - [   0.0003482800000000,  0.0012257300000000, -0.0001771900000000 ]  - [  -0.0010705700000000,  0.0009620400000000,  0.0006218900000000 ]  - [  -0.0003442700000000, -0.0020188100000000,  0.0004373200000000 ]  - [  -0.0033958500000000,  0.0007247700000000, -0.0026849400000000 ]  - [   0.0000602800000000,  0.0011657300000000,  0.0000069900000000 ]  - [   0.0002963200000000,  0.0013740800000000, -0.0003277500000000 ]  - [  -0.0363270100000000,  0.0997392800000000, -0.0219705600000000 ]  - [   0.0008824900000000,  0.0017166900000000,  0.0023502200000000 ]  - [  -0.0003881500000000, -0.0008267700000000, -0.0000021300000000 ]  - [   0.0035023700000000, -0.0092468000000000, -0.0005416300000000 ]  - [   0.0037654300000000, -0.0057817200000000,  0.0039701500000000 ]  - [  -0.0020353700000000,  0.0008444900000000,  0.0005082000000000 ]  - [  -0.0000333000000000, -0.0055842600000000,  0.0060292600000000 ]  - [  -0.0003501600000000, -0.0000773900000000, -0.0004177400000000 ]  - [   0.0012003200000000, -0.0018116400000000,  0.0001375400000000 ]  - [  -0.0004392900000000, -0.0001786700000000, -0.0019064100000000 ]  - [  -0.0007138700000000, -0.0012958100000000,  0.0006205800000000 ]  - [   0.0004423600000000, -0.0002536300000000, -0.0003453800000000 ]  - [   0.0001464500000000, -0.0005755200000000, -0.0000529700000000 ]  - [  -0.0005334500000000, -0.0008557100000000,  0.0000146700000000 ]  - [   0.0000879000000000, -0.0008292600000000,  0.0005803000000000 ]  - [  -0.0003182500000000, -0.0007140600000000,  0.0002682100000000 ]  - [   0.0000720400000000, -0.0009114500000000,  0.0000038300000000 ]  - [  -0.0000998000000000, -0.0005201300000000, -0.0003624300000000 ]  - [   0.0001093400000000, -0.0007402300000000,  0.0003186300000000 ]  - [  -0.0000219900000000, -0.0009824000000000, -0.0002101300000000 ]  - [   0.0000634700000000, -0.0003328800000000,  0.0002262800000000 ]  - [  -0.0002283100000000, -0.0006437300000000, -0.0002852700000000 ]  - [   0.0004576600000000, -0.0011372100000000, -0.0003017500000000 ]  - [  -0.0001266500000000, -0.0005322800000000, -0.0001490300000000 ]  - [  -0.0000726000000000,  0.0017615500000000, -0.0001959900000000 ]  - [  -0.0002516300000000,  0.0011642000000000,  0.0003126000000000 ]  - [   0.0002158600000000,  0.0000231100000000, -0.0002323800000000 ]  - [  -0.0003963500000000,  0.0002925400000000, -0.0000510100000000 ]  - [  -0.0004831500000000,  0.0007928800000000,  0.0000588900000000 ]  - [   0.0030747000000000, -0.0005139200000000, -0.0019871900000000 ]  - [   0.0006604000000000,  0.0009869800000000, -0.0001521000000000 ]  - [   0.0009369300000000, -0.0000777100000000,  0.0007195100000000 ]  - [   0.0000152100000000, -0.0005084800000000,  0.0000851400000000 ]  - [   0.0001464800000000,  0.0005746500000000, -0.0000822700000000 ]  - [   0.0010083700000000, -0.0002806000000000, -0.0002879700000000 ]  - [  -0.0000948900000000,  0.0002924700000000, -0.0003956200000000 ]  - [   0.0001942100000000, -0.0004978200000000, -0.0000907700000000 ]  - [  -0.0004337300000000, -0.0008546200000000,  0.0000221000000000 ]  - [  -0.0000111700000000,  0.0000206400000000, -0.0000611200000000 ]  - [  -0.0000428800000000, -0.0005301100000000,  0.0002136900000000 ]  - [   0.0002494000000000, -0.0010375100000000, -0.0000626000000000 ]  - [  -0.0002174000000000, -0.0003953100000000, -0.0003725700000000 ]  - [   0.0003239000000000, -0.0005241900000000,  0.0002410600000000 ]  - [  -0.0002313500000000, -0.0009853500000000,  0.0000239800000000 ]  - [   0.0012976500000000, -0.0007419300000000,  0.0001166700000000 ]  - [  -0.0001465900000000, -0.0005438600000000, -0.0002641400000000 ]  - [   0.0001380600000000, -0.0003810100000000, -0.0002026800000000 ]  - [   0.0004331000000000, -0.0003076500000000, -0.0004067500000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0007067000000000,  0.0007680300000000, -0.0002242000000000 ]  - [  -0.0005716200000000, -0.0001786900000000,  0.0001287000000000 ]  - [   0.0017819500000000,  0.0016396600000000, -0.0000411800000000 ]  - [   0.0001782200000000,  0.0005241800000000, -0.0009522400000000 ]  - [   0.0001600800000000,  0.0000784800000000,  0.0002552800000000 ]  - [  -0.0001085300000000, -0.0002295000000000,  0.0004587300000000 ]  - [   0.0002172200000000, -0.0000904600000000,  0.0001528500000000 ]  - [  -0.0002128100000000,  0.0000876700000000,  0.0001611400000000 ]  - [   0.0003482100000000, -0.0002670200000000, -0.0001095300000000 ]  - [  -0.0001858800000000, -0.0001380300000000,  0.0001402800000000 ]  - [  -0.0002194300000000, -0.0002261900000000,  0.0004864900000000 ]  - [   0.0000745600000000,  0.0000250600000000,  0.0005740300000000 ]  - [   0.0002694900000000,  0.0001187500000000,  0.0001400500000000 ]  - [  -0.0002758800000000, -0.0001036200000000,  0.0001742100000000 ]  - [   0.0002446500000000, -0.0001292500000000,  0.0001413000000000 ]  - [  -0.0002464500000000,  0.0001192200000000,  0.0001529800000000 ]  - [  -0.0027617400000000, -0.0014123700000000, -0.0013217200000000 ]  - [  -0.0015584200000000,  0.0026614400000000, -0.0004064600000000 ]  - [  -0.0155247000000000,  0.0190356600000000,  0.0383054200000000 ]  - [   0.0008609100000000, -0.0006468100000000,  0.0022118500000000 ]  - [  -0.0001027400000000, -0.0003550600000000,  0.0001053900000000 ]  - [   0.0000989900000000,  0.0003816200000000,  0.0000386200000000 ]  - [  -0.0000490000000000,  0.0003362000000000,  0.0000702500000000 ]  - [   0.0000832900000000, -0.0005028700000000, -0.0000304500000000 ]  - [  -0.0004979300000000,  0.0004652100000000,  0.0012715300000000 ]  - [   0.0002609300000000,  0.0001887400000000,  0.0001795100000000 ]  - [   0.0004151000000000,  0.0000576900000000,  0.0005952000000000 ]  - [   0.0003320600000000, -0.0002819700000000,  0.0001474200000000 ]  - [   0.0000344300000000, -0.0002027300000000,  0.0000515900000000 ]  - [  -0.0000780300000000,  0.0002046400000000,  0.0000401900000000 ]  - [   0.0000327200000000,  0.0002012700000000,  0.0001281200000000 ]  - [  -0.0000824500000000, -0.0002480800000000,  0.0000885000000000 ]  - [   0.0149633400000000, -0.0390836500000000,  0.0467792700000000 ]  - [  -0.0003590300000000, -0.0003295000000000, -0.0005978000000000 ]  - [   0.0000106800000000, -0.0000218100000000, -0.0001327700000000 ]  - [   0.0004040800000000, -0.0000684600000000, -0.0003215900000000 ]  - [  -0.0007285100000000, -0.0003567200000000, -0.0012805300000000 ]  - [  -0.0005458200000000,  0.0001976100000000, -0.0004860800000000 ]  - [  -0.0000144600000000, -0.0000152300000000, -0.0000386300000000 ]  - [   0.0001765800000000,  0.0002817300000000, -0.0004068800000000 ]  - [   0.0039186000000000,  0.0231816400000000, -0.1006567700000000 ]  - [   0.0033103800000000, -0.0033355600000000,  0.0036916500000000 ]  - [  -0.0001118900000000, -0.0003952900000000,  0.0000854900000000 ]  - [  -0.0002316200000000, -0.0021476500000000, -0.0006593700000000 ]  - [  -0.0020789900000000,  0.0038111700000000, -0.0032561400000000 ]  - [  -0.0025314700000000, -0.0002660100000000,  0.0003544900000000 ]  - [   0.0001030600000000, -0.0074106900000000,  0.0039437500000000 ]  - [   0.0004941300000000,  0.0005415400000000,  0.0000276300000000 ]  - [   0.0000419600000000,  0.0007502100000000,  0.0000196200000000 ]  - [   0.0002383900000000,  0.0017730900000000,  0.0100750300000000 ]  - [   0.0001161900000000, -0.0007021000000000,  0.0006518400000000 ]  - [   0.0003673700000000, -0.0001291500000000, -0.0005514500000000 ]  - [   0.0000082700000000,  0.0002269900000000, -0.0000370700000000 ]  - [  -0.0003352200000000, -0.0000651000000000,  0.0001544600000000 ]  - [  -0.0000440000000000,  0.0001838500000000,  0.0000797200000000 ]  - [  -0.0003122500000000, -0.0000017900000000,  0.0002071100000000 ]  - [  -0.0000324100000000, -0.0001689700000000, -0.0000291500000000 ]  - [  -0.0002123400000000,  0.0001742400000000, -0.0003205800000000 ]  - [   0.0003325700000000,  0.0000754200000000,  0.0001586600000000 ]  - [   0.0000006900000000, -0.0001538000000000,  0.0000088900000000 ]  - [   0.0004186700000000,  0.0001147900000000,  0.0002175700000000 ]  - [  -0.0001301900000000, -0.0000756000000000, -0.0002797900000000 ]  - [   0.0002620200000000, -0.0002494700000000, -0.0003330700000000 ]  - [   0.0000951900000000,  0.0000658800000000, -0.0002273400000000 ]  - [   0.0000080100000000,  0.0003693200000000,  0.0005218600000000 ]  - [   0.0005294500000000, -0.0000191500000000,  0.0008115200000000 ]  - [  -0.0000991500000000,  0.0002334300000000,  0.0000108500000000 ]  - [  -0.0005436100000000, -0.0002515100000000,  0.0003833700000000 ]  - [  -0.0002214000000000, -0.0001132600000000,  0.0001247400000000 ]  - [  -0.0022829900000000,  0.0020021400000000, -0.0000669500000000 ]  - [   0.0009554200000000,  0.0002097700000000,  0.0003530200000000 ]  - [   0.0002458400000000, -0.0005944900000000,  0.0000268500000000 ]  - [   0.0003014600000000, -0.0000807800000000,  0.0001907400000000 ]  - [  -0.0002579600000000, -0.0002021200000000, -0.0005728900000000 ]  - [  -0.0001102800000000, -0.0001437900000000, -0.0006549300000000 ]  - [   0.0000690300000000,  0.0001321600000000, -0.0003008700000000 ]  - [  -0.0000115200000000,  0.0002675600000000, -0.0000602800000000 ]  - [  -0.0003619700000000, -0.0001329500000000,  0.0001430700000000 ]  - [   0.0001406700000000,  0.0004067300000000,  0.0000107000000000 ]  - [  -0.0004447200000000,  0.0001085400000000,  0.0001377100000000 ]  - [   0.0000171600000000, -0.0002388900000000, -0.0000486500000000 ]  - [  -0.0001811700000000,  0.0000608300000000, -0.0003016900000000 ]  - [   0.0003766300000000,  0.0001514500000000,  0.0001382200000000 ]  - [  -0.0000857400000000, -0.0003823000000000,  0.0000070500000000 ]  - [   0.0005092900000000, -0.0000257500000000,  0.0001082100000000 ]  - [  -0.0002269500000000, -0.0000785700000000, -0.0003202600000000 ]  - [   0.0002306700000000, -0.0000261700000000, -0.0002858200000000 ]  - [   0.0002258700000000,  0.0000653000000000, -0.0003095800000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0002405400000000, -0.0005370500000000,  0.0005287100000000 ]  - [   0.0001162800000000, -0.0000412100000000,  0.0001636500000000 ]  - [  -0.0012171900000000, -0.0017992000000000,  0.0004663200000000 ]  - [  -0.0006300400000000, -0.0003128000000000,  0.0012461300000000 ]  - [   0.0002995800000000,  0.0001378700000000,  0.0000363500000000 ]  - [  -0.0003493100000000,  0.0000121700000000, -0.0001731900000000 ]  - [   0.0002442500000000, -0.0001300000000000,  0.0001395500000000 ]  - [  -0.0002490800000000,  0.0001320800000000,  0.0001309400000000 ]  - [   0.0001158800000000,  0.0004816300000000,  0.0003979600000000 ]  - [  -0.0002762300000000, -0.0000831600000000,  0.0001530600000000 ]  - [   0.0006815100000000,  0.0000096000000000, -0.0001971800000000 ]  - [  -0.0005359700000000,  0.0001954400000000, -0.0002839200000000 ]  - [   0.0001915500000000,  0.0001016200000000,  0.0001531600000000 ]  - [  -0.0001839600000000, -0.0001150400000000,  0.0001199400000000 ]  - [   0.0002142500000000, -0.0000895200000000,  0.0001499600000000 ]  - [  -0.0002124300000000,  0.0000985200000000,  0.0001387900000000 ]  - [   0.0026739100000000,  0.0009233800000000,  0.0015464500000000 ]  - [   0.0016523200000000, -0.0021726200000000,  0.0006446400000000 ]  - [   0.0161930000000000, -0.0194746100000000, -0.0388870400000000 ]  - [  -0.0007872300000000,  0.0001445900000000, -0.0019892200000000 ]  - [   0.0000279800000000, -0.0001492900000000,  0.0001304100000000 ]  - [  -0.0000225700000000,  0.0001140200000000,  0.0002019000000000 ]  - [  -0.0000278700000000,  0.0001627500000000,  0.0001667800000000 ]  - [  -0.0000079000000000,  0.0000018600000000,  0.0002695100000000 ]  - [   0.0004270700000000, -0.0009617000000000, -0.0010152400000000 ]  - [  -0.0001864300000000,  0.0003096800000000,  0.0000572900000000 ]  - [  -0.0004832500000000,  0.0004447600000000, -0.0003574800000000 ]  - [  -0.0002597600000000, -0.0002222300000000,  0.0000892700000000 ]  - [  -0.0001112400000000, -0.0003024600000000,  0.0001842700000000 ]  - [   0.0001559400000000,  0.0002972800000000,  0.0001980000000000 ]  - [  -0.0001094500000000,  0.0002992300000000,  0.0001080300000000 ]  - [   0.0001610000000000, -0.0002578200000000,  0.0001472700000000 ]  - [  -0.0154240600000000,  0.0403111900000000, -0.0474934300000000 ]  - [   0.0003541400000000,  0.0003308600000000,  0.0004517400000000 ]  - [  -0.0000104400000000,  0.0000183900000000, -0.0000069000000000 ]  - [  -0.0004075000000000,  0.0000662000000000,  0.0001817100000000 ]  - [   0.0007281600000000,  0.0003593700000000,  0.0011363800000000 ]  - [   0.0005727300000000, -0.0001872700000000,  0.0003723200000000 ]  - [   0.0000140400000000,  0.0000124700000000, -0.0001016000000000 ]  - [  -0.0001778500000000, -0.0002875900000000,  0.0002691100000000 ]  - [  -0.0042646600000000, -0.0231543400000000,  0.1019668000000000 ]  - [  -0.0040860600000000,  0.0031835100000000, -0.0034402300000000 ]  - [   0.0001053700000000,  0.0008814600000000, -0.0001953100000000 ]  - [  -0.0004922800000000,  0.0023832000000000,  0.0009270500000000 ]  - [   0.0020774300000000, -0.0043039400000000,  0.0031557500000000 ]  - [   0.0021593800000000,  0.0004227500000000, -0.0009932000000000 ]  - [   0.0006380800000000,  0.0076967300000000, -0.0037040300000000 ]  - [  -0.0004790000000000, -0.0010139500000000, -0.0001422100000000 ]  - [   0.0006602700000000, -0.0009325900000000,  0.0002677100000000 ]  - [  -0.0005937300000000, -0.0020148000000000, -0.0107950200000000 ]  - [   0.0002597000000000,  0.0005506600000000, -0.0012966900000000 ]  - [  -0.0000187300000000,  0.0002919500000000, -0.0000792100000000 ]  - [  -0.0000006000000000,  0.0002505500000000, -0.0000741900000000 ]  - [  -0.0003653800000000, -0.0001226700000000,  0.0001274600000000 ]  - [   0.0000304300000000,  0.0002968200000000, -0.0001986100000000 ]  - [  -0.0003927900000000,  0.0001806600000000,  0.0000806600000000 ]  - [   0.0000183100000000, -0.0003009100000000, -0.0000886200000000 ]  - [  -0.0001350100000000, -0.0000141000000000, -0.0002989400000000 ]  - [   0.0003693100000000,  0.0001044300000000,  0.0001278800000000 ]  - [   0.0000160500000000, -0.0003137700000000, -0.0001304600000000 ]  - [   0.0002863700000000, -0.0003024800000000,  0.0000655000000000 ]  - [  -0.0002449900000000, -0.0000783200000000, -0.0003548600000000 ]  - [   0.0000999700000000,  0.0000958100000000, -0.0003008700000000 ]  - [   0.0002587700000000,  0.0000956600000000, -0.0004003400000000 ]  - [  -0.0000062000000000,  0.0001029700000000, -0.0006304900000000 ]  - [  -0.0012344500000000, -0.0001690500000000, -0.0005280200000000 ]  - [   0.0000834600000000,  0.0002349500000000, -0.0001334900000000 ]  - [  -0.0001626300000000,  0.0004231100000000, -0.0000928100000000 ]  - [   0.0002074100000000, -0.0003561500000000, -0.0002446900000000 ]  - [   0.0019092600000000, -0.0018389700000000, -0.0005501100000000 ]  - [  -0.0002522300000000, -0.0000172100000000, -0.0000717700000000 ]  - [  -0.0002293800000000,  0.0001102500000000, -0.0001442400000000 ]  - [   0.0004004300000000, -0.0001041400000000,  0.0000922600000000 ]  - [  -0.0001125200000000,  0.0000407000000000, -0.0000634600000000 ]  - [   0.0004672200000000, -0.0000122400000000,  0.0000380400000000 ]  - [   0.0003005700000000,  0.0000257700000000, -0.0003203900000000 ]  - [   0.0000199300000000,  0.0002105100000000, -0.0000504700000000 ]  - [  -0.0003382800000000, -0.0000592000000000,  0.0001388100000000 ]  - [  -0.0001570200000000,  0.0000597100000000, -0.0001308900000000 ]  - [  -0.0002568300000000,  0.0000699700000000,  0.0001502700000000 ]  - [  -0.0000306900000000, -0.0002342500000000, -0.0000659000000000 ]  - [  -0.0001661100000000,  0.0001013700000000, -0.0003145000000000 ]  - [   0.0003255700000000,  0.0000390200000000,  0.0001445500000000 ]  - [   0.0001054300000000, -0.0000801200000000, -0.0001314100000000 ]  - [   0.0001861300000000, -0.0001542100000000,  0.0001768400000000 ]  - [  -0.0001533600000000, -0.0000753900000000, -0.0003141600000000 ]  - [   0.0001303300000000, -0.0001315300000000, -0.0003347700000000 ]  - [   0.0001444900000000,  0.0000904500000000, -0.0003196400000000 ]- atom:   42  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0015916600000000,  0.0000448400000000,  0.0003523500000000 ]  - [  -0.0000666900000000, -0.0002884700000000,  0.0001119000000000 ]  - [  -0.0008494900000000, -0.0001264500000000,  0.0001899400000000 ]  - [   0.0014599900000000,  0.0018451500000000, -0.0009283300000000 ]  - [   0.0002972100000000,  0.0000039000000000,  0.0001469800000000 ]  - [   0.0000601000000000,  0.0002212900000000,  0.0002069500000000 ]  - [   0.0002293900000000, -0.0001783900000000,  0.0001504000000000 ]  - [  -0.0001919400000000, -0.0000069600000000,  0.0001648800000000 ]  - [  -0.0002956100000000,  0.0001846600000000,  0.0001993800000000 ]  - [  -0.0004476400000000, -0.0000867500000000,  0.0000297300000000 ]  - [   0.0025900800000000,  0.0008169400000000, -0.0019538500000000 ]  - [  -0.0017095500000000, -0.0002120100000000, -0.0008080200000000 ]  - [   0.0001573300000000,  0.0000474000000000,  0.0001575900000000 ]  - [  -0.0004631800000000, -0.0002915800000000,  0.0000984600000000 ]  - [   0.0002413400000000, -0.0002076200000000,  0.0001231800000000 ]  - [  -0.0002842200000000,  0.0000805200000000,  0.0001504800000000 ]  - [   0.0139422900000000, -0.0168178500000000, -0.0040952100000000 ]  - [   0.0010009300000000, -0.0030182300000000,  0.0012829500000000 ]  - [  -0.0019725100000000,  0.0019086900000000, -0.0004675900000000 ]  - [   0.0010878400000000, -0.0000509300000000,  0.0003882000000000 ]  - [   0.0000560200000000, -0.0004084800000000,  0.0000789400000000 ]  - [   0.0003973800000000,  0.0003625900000000,  0.0002276400000000 ]  - [  -0.0000465100000000, -0.0000543700000000,  0.0001433000000000 ]  - [   0.0000384200000000, -0.0007513000000000,  0.0000429700000000 ]  - [  -0.0017114500000000, -0.0002196700000000, -0.0001109200000000 ]  - [  -0.0004652100000000,  0.0014243000000000,  0.0001867900000000 ]  - [  -0.0017448100000000, -0.0001743700000000,  0.0000867600000000 ]  - [  -0.0007155800000000, -0.0002855600000000,  0.0002001300000000 ]  - [  -0.0001747000000000, -0.0004746500000000,  0.0002201200000000 ]  - [  -0.0003244200000000, -0.0001743700000000, -0.0002244200000000 ]  - [   0.0000031700000000,  0.0002051600000000,  0.0000421700000000 ]  - [  -0.0000719500000000, -0.0001509000000000,  0.0002495700000000 ]  - [   0.0627529100000000,  0.0097581800000000,  0.0326472600000000 ]  - [  -0.0008550700000000, -0.0014733900000000, -0.0015917900000000 ]  - [   0.0001262600000000, -0.0002676800000000, -0.0001290400000000 ]  - [   0.0003790300000000,  0.0000949400000000, -0.0002649200000000 ]  - [  -0.0024576900000000,  0.0008745300000000, -0.0000927300000000 ]  - [  -0.0005932600000000,  0.0005710000000000, -0.0000072100000000 ]  - [  -0.0002451000000000, -0.0001720900000000, -0.0000053300000000 ]  - [  -0.0003426400000000, -0.0005924900000000,  0.0004097600000000 ]  - [   0.0035007800000000, -0.0010201100000000,  0.0036685100000000 ]  - [  -0.0922674000000000,  0.0003078700000000, -0.0330282900000000 ]  - [   0.0001913800000000,  0.0011849200000000, -0.0002265100000000 ]  - [  -0.0000314400000000, -0.0005159100000000,  0.0004353900000000 ]  - [  -0.0013888400000000,  0.0001858900000000,  0.0002095400000000 ]  - [  -0.0007681100000000,  0.0037325300000000,  0.0036438500000000 ]  - [   0.0077243100000000,  0.0039962400000000,  0.0018786200000000 ]  - [   0.0000319800000000,  0.0036207800000000,  0.0000772600000000 ]  - [   0.0000113400000000,  0.0000528500000000,  0.0001712400000000 ]  - [   0.0028403600000000, -0.0054523700000000, -0.0012967300000000 ]  - [   0.0004892000000000,  0.0003601000000000, -0.0006913700000000 ]  - [  -0.0009560600000000,  0.0008957800000000, -0.0002792700000000 ]  - [  -0.0000665500000000,  0.0004173900000000, -0.0000489900000000 ]  - [  -0.0003833900000000,  0.0000278500000000,  0.0001669800000000 ]  - [  -0.0000354300000000, -0.0001008900000000, -0.0000125100000000 ]  - [  -0.0003807600000000,  0.0003887400000000,  0.0000408400000000 ]  - [  -0.0001174300000000,  0.0000102300000000, -0.0000468600000000 ]  - [  -0.0002234200000000,  0.0001629000000000, -0.0002962200000000 ]  - [   0.0002587500000000,  0.0001457800000000,  0.0001398200000000 ]  - [  -0.0000689300000000, -0.0001997400000000, -0.0000265800000000 ]  - [   0.0000114400000000,  0.0005674600000000,  0.0005268400000000 ]  - [  -0.0002474800000000,  0.0000305300000000, -0.0003438600000000 ]  - [   0.0001962400000000, -0.0001629500000000, -0.0003397000000000 ]  - [  -0.0000424800000000,  0.0001956400000000, -0.0001955100000000 ]  - [   0.0017049500000000,  0.0001218200000000,  0.0008182600000000 ]  - [   0.0009008900000000, -0.0002492900000000,  0.0005218500000000 ]  - [  -0.0001677100000000, -0.0000549200000000, -0.0001318900000000 ]  - [  -0.0000284200000000,  0.0004253000000000,  0.0002249700000000 ]  - [   0.0011862500000000, -0.0005483300000000, -0.0006662500000000 ]  - [   0.0007545900000000, -0.0003330000000000, -0.0001052600000000 ]  - [   0.0020154800000000, -0.0005573100000000,  0.0000041000000000 ]  - [   0.0007301000000000, -0.0002786100000000, -0.0002576900000000 ]  - [   0.0005820600000000,  0.0000034100000000,  0.0000934700000000 ]  - [   0.0010394700000000,  0.0002543900000000, -0.0002890900000000 ]  - [   0.0003234600000000, -0.0014097600000000, -0.0007294700000000 ]  - [   0.0007922600000000, -0.0000897300000000, -0.0003833700000000 ]  - [   0.0000330300000000,  0.0003170900000000, -0.0000740900000000 ]  - [  -0.0002515700000000,  0.0000742500000000,  0.0001599500000000 ]  - [   0.0004464200000000,  0.0010885300000000,  0.0002450800000000 ]  - [  -0.0003796000000000,  0.0000090300000000,  0.0001636600000000 ]  - [   0.0000591600000000, -0.0002054800000000, -0.0000911200000000 ]  - [  -0.0001466000000000,  0.0001813500000000, -0.0003036100000000 ]  - [   0.0005035400000000,  0.0003973100000000,  0.0001220400000000 ]  - [   0.0001876300000000,  0.0000771200000000, -0.0001593000000000 ]  - [   0.0005808000000000, -0.0002945400000000,  0.0000519100000000 ]  - [  -0.0001133800000000,  0.0000153300000000, -0.0003036900000000 ]  - [   0.0001741200000000,  0.0000912100000000, -0.0003002500000000 ]  - [   0.0004128700000000,  0.0001738500000000, -0.0003461000000000 ]- atom:   42  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0011167800000000,  0.0001804000000000, -0.0000579000000000 ]  - [  -0.0003913200000000,  0.0000668100000000,  0.0001816600000000 ]  - [   0.0013110900000000, -0.0000895600000000,  0.0001048800000000 ]  - [  -0.0019510300000000, -0.0016257800000000,  0.0012489500000000 ]  - [   0.0001641100000000,  0.0002162800000000,  0.0001472800000000 ]  - [  -0.0005185100000000, -0.0004427000000000,  0.0000876300000000 ]  - [   0.0002304300000000, -0.0000408200000000,  0.0001434300000000 ]  - [  -0.0002724100000000,  0.0002326500000000,  0.0001295300000000 ]  - [   0.0007533100000000,  0.0000359400000000,  0.0000958500000000 ]  - [  -0.0000173400000000, -0.0001415400000000,  0.0002649500000000 ]  - [  -0.0023486900000000, -0.0011133600000000,  0.0024040200000000 ]  - [   0.0012427200000000,  0.0004328800000000,  0.0010932100000000 ]  - [   0.0003022700000000,  0.0001704400000000,  0.0001363400000000 ]  - [  -0.0000029200000000,  0.0000644000000000,  0.0001960900000000 ]  - [   0.0002229700000000, -0.0000180100000000,  0.0001710400000000 ]  - [  -0.0001796900000000,  0.0001441800000000,  0.0001436600000000 ]  - [  -0.0141758000000000,  0.0163005800000000,  0.0043802500000000 ]  - [  -0.0009071600000000,  0.0034964900000000, -0.0010348100000000 ]  - [   0.0018941400000000, -0.0013945400000000,  0.0007182400000000 ]  - [  -0.0010156100000000, -0.0004655800000000, -0.0001509000000000 ]  - [  -0.0001335000000000, -0.0000984200000000,  0.0001607400000000 ]  - [  -0.0003173300000000,  0.0001389700000000,  0.0000120100000000 ]  - [  -0.0000309800000000,  0.0005548700000000,  0.0000962300000000 ]  - [   0.0000402300000000,  0.0002434600000000,  0.0001949500000000 ]  - [   0.0016292100000000, -0.0002787800000000,  0.0003521300000000 ]  - [   0.0005416700000000, -0.0009243300000000,  0.0000492600000000 ]  - [   0.0016461500000000,  0.0006837900000000,  0.0001570600000000 ]  - [   0.0007898700000000, -0.0002200100000000,  0.0000367900000000 ]  - [   0.0000983200000000, -0.0000328800000000,  0.0000182400000000 ]  - [   0.0003979600000000,  0.0006729500000000,  0.0004611900000000 ]  - [  -0.0000806700000000,  0.0002952100000000,  0.0001973600000000 ]  - [   0.0001484100000000, -0.0003537300000000, -0.0000091200000000 ]  - [  -0.0607463700000000, -0.0091324700000000, -0.0310647100000000 ]  - [   0.0008524600000000,  0.0014600200000000,  0.0014380600000000 ]  - [  -0.0001252100000000,  0.0002640600000000, -0.0000120500000000 ]  - [  -0.0003800500000000, -0.0000985800000000,  0.0001237000000000 ]  - [   0.0024597400000000, -0.0008553300000000, -0.0000554600000000 ]  - [   0.0005927900000000, -0.0005692500000000, -0.0001331500000000 ]  - [   0.0002425700000000,  0.0001692100000000, -0.0001333600000000 ]  - [   0.0003415800000000,  0.0005864600000000, -0.0005464000000000 ]  - [  -0.0034302600000000,  0.0014563700000000, -0.0037115500000000 ]  - [   0.0896582800000000, -0.0010682700000000,  0.0312476900000000 ]  - [  -0.0002042300000000, -0.0007068600000000,  0.0001162300000000 ]  - [  -0.0006749800000000,  0.0006946400000000, -0.0001558700000000 ]  - [   0.0013855700000000, -0.0006385600000000, -0.0002997800000000 ]  - [   0.0004466400000000, -0.0035361600000000, -0.0042625800000000 ]  - [  -0.0068568400000000, -0.0037462500000000, -0.0015857700000000 ]  - [  -0.0000112300000000, -0.0040655100000000, -0.0001611600000000 ]  - [   0.0006957000000000, -0.0002302000000000,  0.0001108500000000 ]  - [  -0.0031595900000000,  0.0052496500000000,  0.0006427600000000 ]  - [  -0.0001346300000000, -0.0005165100000000,  0.0000516000000000 ]  - [   0.0013090200000000, -0.0007416900000000, -0.0003611200000000 ]  - [   0.0000804400000000,  0.0000520400000000, -0.0000624500000000 ]  - [  -0.0003233000000000, -0.0002094500000000,  0.0001126500000000 ]  - [   0.0000197700000000,  0.0005693900000000, -0.0000979600000000 ]  - [  -0.0003272000000000, -0.0002029500000000,  0.0002383600000000 ]  - [   0.0001044100000000, -0.0004753900000000, -0.0000624600000000 ]  - [  -0.0001291300000000, -0.0000032800000000, -0.0003336900000000 ]  - [   0.0004466900000000,  0.0000371200000000,  0.0001402800000000 ]  - [   0.0000853400000000, -0.0002654900000000, -0.0000862400000000 ]  - [   0.0006940600000000, -0.0007449200000000, -0.0002447200000000 ]  - [  -0.0001140800000000, -0.0001877100000000, -0.0002860800000000 ]  - [   0.0001554400000000,  0.0000024100000000, -0.0002940100000000 ]  - [   0.0004010800000000, -0.0000350100000000, -0.0004373600000000 ]  - [  -0.0016942400000000,  0.0003360600000000, -0.0009298500000000 ]  - [  -0.0016063600000000,  0.0000555900000000, -0.0002437200000000 ]  - [   0.0001519600000000,  0.0005223000000000,  0.0000182000000000 ]  - [  -0.0006735600000000, -0.0002415500000000,  0.0000553000000000 ]  - [  -0.0011930900000000,  0.0000766800000000,  0.0005580300000000 ]  - [  -0.0011046800000000,  0.0004889800000000, -0.0005204600000000 ]  - [  -0.0013166300000000,  0.0007408100000000,  0.0002680500000000 ]  - [  -0.0007127100000000, -0.0001866000000000,  0.0001432000000000 ]  - [   0.0001273200000000, -0.0001806600000000,  0.0001886300000000 ]  - [  -0.0013987500000000, -0.0004182100000000, -0.0003387500000000 ]  - [   0.0000293500000000,  0.0012554400000000,  0.0001089100000000 ]  - [  -0.0004243700000000,  0.0002483300000000, -0.0002527300000000 ]  - [  -0.0000192900000000,  0.0001553600000000, -0.0000348300000000 ]  - [  -0.0004546100000000, -0.0002503700000000,  0.0001227300000000 ]  - [  -0.0004589000000000, -0.0006153700000000, -0.0003542300000000 ]  - [  -0.0003261900000000,  0.0001725700000000,  0.0001174300000000 ]  - [  -0.0000706000000000, -0.0002652100000000, -0.0000174000000000 ]  - [  -0.0002153600000000, -0.0000213100000000, -0.0003330100000000 ]  - [   0.0002055400000000, -0.0002102900000000,  0.0001565800000000 ]  - [  -0.0001732600000000, -0.0005444200000000,  0.0000510800000000 ]  - [   0.0001271100000000,  0.0001185900000000,  0.0002313000000000 ]  - [  -0.0002413900000000, -0.0001734800000000, -0.0003341700000000 ]  - [   0.0001807400000000, -0.0002493900000000, -0.0003307100000000 ]  - [  -0.0000456000000000, -0.0000156300000000, -0.0002940700000000 ]- atom:   42  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0007974700000000,  0.0000368900000000,  0.0004841100000000 ]  - [  -0.0007787700000000, -0.0009448900000000,  0.0001744600000000 ]  - [   0.0005811500000000,  0.0015948700000000,  0.0007174000000000 ]  - [   0.0016668500000000,  0.0042161100000000, -0.0026928100000000 ]  - [   0.0002038600000000, -0.0005419200000000,  0.0001823600000000 ]  - [  -0.0000423500000000, -0.0005697700000000,  0.0002559100000000 ]  - [   0.0002025200000000, -0.0005091000000000,  0.0001325100000000 ]  - [  -0.0001791800000000, -0.0003697400000000,  0.0001975400000000 ]  - [   0.0001277700000000,  0.0002504600000000,  0.0002860800000000 ]  - [   0.0000291100000000, -0.0004133400000000,  0.0002569900000000 ]  - [   0.0017242700000000,  0.0019092500000000, -0.0007205400000000 ]  - [  -0.0008288600000000,  0.0004831500000000, -0.0003655100000000 ]  - [   0.0002775900000000, -0.0002018400000000,  0.0001188700000000 ]  - [  -0.0004145200000000, -0.0003639500000000,  0.0002295100000000 ]  - [   0.0002556200000000, -0.0005652000000000,  0.0000761600000000 ]  - [  -0.0002578200000000, -0.0002762500000000,  0.0001705200000000 ]  - [  -0.0147330300000000,  0.0529168400000000,  0.0150908700000000 ]  - [  -0.0021647200000000, -0.0001518600000000, -0.0000422900000000 ]  - [   0.0013292000000000,  0.0007437300000000,  0.0021399700000000 ]  - [   0.0018296700000000, -0.0025963600000000,  0.0001056400000000 ]  - [  -0.0001379100000000, -0.0013068200000000,  0.0001595900000000 ]  - [   0.0002434300000000, -0.0005246000000000,  0.0001458400000000 ]  - [   0.0000152600000000, -0.0007955200000000,  0.0000883300000000 ]  - [   0.0000995100000000, -0.0015492000000000,  0.0000953000000000 ]  - [  -0.0003629500000000,  0.0012925500000000,  0.0002985800000000 ]  - [   0.0005878300000000,  0.0012588200000000, -0.0011134300000000 ]  - [  -0.0016843200000000,  0.0013840400000000,  0.0007903400000000 ]  - [  -0.0008504600000000, -0.0002682400000000, -0.0002289600000000 ]  - [  -0.0001038500000000, -0.0011293500000000,  0.0001422900000000 ]  - [  -0.0004784500000000, -0.0008899100000000, -0.0005590200000000 ]  - [   0.0000887600000000, -0.0007510600000000,  0.0001192100000000 ]  - [   0.0000383400000000, -0.0008326900000000,  0.0003409100000000 ]  - [   0.0075962100000000,  0.0158435600000000,  0.0037684600000000 ]  - [  -0.0015131800000000, -0.0021483300000000, -0.0038325500000000 ]  - [  -0.0001132100000000, -0.0012002800000000, -0.0001316000000000 ]  - [   0.0007883200000000, -0.0011403400000000, -0.0005199200000000 ]  - [   0.0004742700000000,  0.0024392400000000, -0.0003234500000000 ]  - [   0.0003483500000000, -0.0005177300000000,  0.0000334800000000 ]  - [  -0.0003981600000000, -0.0011254600000000,  0.0001226500000000 ]  - [  -0.0002549100000000, -0.0010389600000000, -0.0000029300000000 ]  - [  -0.0031323400000000, -0.0015835000000000, -0.0033065500000000 ]  - [   0.0000219900000000, -0.0966137900000000, -0.0268827000000000 ]  - [   0.0004411700000000,  0.0008903700000000,  0.0000109500000000 ]  - [  -0.0006884900000000,  0.0000526900000000, -0.0001510500000000 ]  - [   0.0037924300000000,  0.0054650200000000,  0.0075502900000000 ]  - [   0.0009834200000000,  0.0019866900000000,  0.0026000700000000 ]  - [   0.0042316300000000, -0.0007041000000000,  0.0008664800000000 ]  - [   0.0022386300000000,  0.0089654700000000,  0.0022106100000000 ]  - [  -0.0003053400000000,  0.0008246500000000,  0.0004241300000000 ]  - [  -0.0037554900000000,  0.0029075700000000,  0.0008615400000000 ]  - [   0.0010538100000000, -0.0001917000000000, -0.0003616500000000 ]  - [   0.0014933100000000,  0.0039538200000000, -0.0005071000000000 ]  - [  -0.0001661900000000,  0.0010022200000000, -0.0000285400000000 ]  - [  -0.0002311300000000,  0.0006507100000000,  0.0002639600000000 ]  - [  -0.0000552800000000,  0.0006530300000000, -0.0000441800000000 ]  - [  -0.0002711200000000,  0.0008815200000000,  0.0000451600000000 ]  - [  -0.0002204000000000,  0.0005979300000000, -0.0000372300000000 ]  - [  -0.0002356200000000,  0.0006326300000000, -0.0002747000000000 ]  - [   0.0004083500000000,  0.0007487400000000,  0.0000337800000000 ]  - [   0.0000549100000000,  0.0005741000000000,  0.0000377400000000 ]  - [   0.0002078500000000,  0.0008231800000000,  0.0006182700000000 ]  - [  -0.0001554600000000,  0.0004251500000000, -0.0003613700000000 ]  - [   0.0001243700000000,  0.0002495900000000, -0.0003806700000000 ]  - [   0.0000134300000000,  0.0006075800000000, -0.0001790900000000 ]  - [   0.0007460800000000, -0.0010248700000000,  0.0000164500000000 ]  - [  -0.0005061800000000, -0.0013324600000000, -0.0000918100000000 ]  - [  -0.0001561000000000,  0.0004751600000000,  0.0001540200000000 ]  - [   0.0002514500000000,  0.0000504300000000,  0.0004544900000000 ]  - [   0.0005022400000000, -0.0011348700000000, -0.0001703900000000 ]  - [  -0.0004347600000000, -0.0005190900000000, -0.0005526200000000 ]  - [  -0.0002931000000000, -0.0011875200000000,  0.0006298600000000 ]  - [  -0.0004866500000000, -0.0004328500000000,  0.0002881900000000 ]  - [   0.0005560500000000,  0.0002354100000000,  0.0001823000000000 ]  - [   0.0003054200000000, -0.0007496700000000, -0.0002556400000000 ]  - [  -0.0019080000000000,  0.0019772300000000,  0.0004364500000000 ]  - [   0.0001834900000000, -0.0001845800000000, -0.0001078100000000 ]  - [  -0.0001340000000000,  0.0010046400000000, -0.0000924200000000 ]  - [  -0.0001877400000000,  0.0005946300000000,  0.0002421700000000 ]  - [   0.0009822700000000,  0.0019552100000000,  0.0007872700000000 ]  - [  -0.0006479300000000,  0.0008805100000000,  0.0000441700000000 ]  - [  -0.0000716200000000,  0.0003821100000000, -0.0001100700000000 ]  - [  -0.0001111700000000,  0.0005467800000000, -0.0002667700000000 ]  - [   0.0006556500000000,  0.0010826600000000,  0.0000451400000000 ]  - [   0.0001981300000000,  0.0003882100000000, -0.0000719000000000 ]  - [   0.0002604800000000,  0.0002383900000000,  0.0002006100000000 ]  - [  -0.0001978400000000,  0.0004063200000000, -0.0003738900000000 ]  - [   0.0002487900000000,  0.0003924500000000, -0.0003264100000000 ]  - [   0.0003878900000000,  0.0005094400000000, -0.0002603800000000 ]- atom:   42  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0003414600000000,  0.0001779500000000, -0.0001915200000000 ]  - [   0.0003220400000000,  0.0007274600000000,  0.0001207900000000 ]  - [  -0.0001192400000000, -0.0018123400000000, -0.0004221000000000 ]  - [  -0.0021216600000000, -0.0039413000000000,  0.0028559500000000 ]  - [   0.0002530800000000,  0.0007595700000000,  0.0001100600000000 ]  - [  -0.0004163200000000,  0.0003476800000000,  0.0000363700000000 ]  - [   0.0002543500000000,  0.0002907700000000,  0.0001606900000000 ]  - [  -0.0002793200000000,  0.0005912500000000,  0.0000954800000000 ]  - [   0.0003317200000000, -0.0000317100000000,  0.0000065300000000 ]  - [  -0.0004863700000000,  0.0001971400000000,  0.0000365700000000 ]  - [  -0.0012585200000000, -0.0021237300000000,  0.0009856900000000 ]  - [   0.0003749600000000, -0.0002654800000000,  0.0006600800000000 ]  - [   0.0001786300000000,  0.0004211200000000,  0.0001741900000000 ]  - [  -0.0000410000000000,  0.0001454000000000,  0.0000625300000000 ]  - [   0.0002015700000000,  0.0003480600000000,  0.0002170500000000 ]  - [  -0.0001992500000000,  0.0004967300000000,  0.0001224000000000 ]  - [   0.0153359200000000, -0.0558401700000000, -0.0159451100000000 ]  - [   0.0022360200000000,  0.0006580700000000,  0.0002766700000000 ]  - [  -0.0013998200000000, -0.0002494200000000, -0.0019025700000000 ]  - [  -0.0017463600000000,  0.0021096600000000,  0.0001324900000000 ]  - [   0.0000596100000000,  0.0008059800000000,  0.0000782100000000 ]  - [  -0.0001682800000000,  0.0010257100000000,  0.0000908100000000 ]  - [  -0.0000921800000000,  0.0012976600000000,  0.0001500500000000 ]  - [  -0.0000223900000000,  0.0010501600000000,  0.0001441100000000 ]  - [   0.0002869900000000, -0.0017937900000000, -0.0000579400000000 ]  - [  -0.0005122900000000, -0.0007543300000000,  0.0013515000000000 ]  - [   0.0015978800000000, -0.0008805400000000, -0.0005455600000000 ]  - [   0.0009290800000000, -0.0002327800000000,  0.0004683200000000 ]  - [   0.0000271400000000,  0.0006291900000000,  0.0000943900000000 ]  - [   0.0005601800000000,  0.0013943500000000,  0.0008028900000000 ]  - [  -0.0001664400000000,  0.0012540800000000,  0.0001188000000000 ]  - [   0.0000403600000000,  0.0003292500000000, -0.0001037900000000 ]  - [  -0.0076246100000000, -0.0159607800000000, -0.0040121300000000 ]  - [   0.0015140900000000,  0.0021431300000000,  0.0037233100000000 ]  - [   0.0001120200000000,  0.0012026400000000, -0.0000068600000000 ]  - [  -0.0007884900000000,  0.0011434100000000,  0.0003805000000000 ]  - [  -0.0004765700000000, -0.0024524200000000,  0.0001928800000000 ]  - [  -0.0003460500000000,  0.0005141900000000, -0.0001733800000000 ]  - [   0.0004001700000000,  0.0011269500000000, -0.0002631700000000 ]  - [   0.0002541900000000,  0.0010412500000000, -0.0001395900000000 ]  - [   0.0031432100000000,  0.0020533400000000,  0.0032191300000000 ]  - [  -0.0013911800000000,  0.0990261800000000,  0.0284680900000000 ]  - [  -0.0004562200000000, -0.0004265400000000, -0.0001137300000000 ]  - [  -0.0000254400000000,  0.0001284000000000,  0.0004295300000000 ]  - [  -0.0037794800000000, -0.0059085500000000, -0.0075521600000000 ]  - [  -0.0013471200000000, -0.0018527300000000, -0.0032760100000000 ]  - [  -0.0035027500000000,  0.0008770600000000, -0.0005949900000000 ]  - [  -0.0022658800000000, -0.0095808400000000, -0.0023094200000000 ]  - [   0.0010159200000000, -0.0010030200000000, -0.0001430700000000 ]  - [   0.0034262500000000, -0.0030917200000000, -0.0015261200000000 ]  - [  -0.0007018700000000,  0.0000248000000000, -0.0002734400000000 ]  - [  -0.0011067100000000, -0.0037330400000000, -0.0001571600000000 ]  - [   0.0001770300000000, -0.0005327200000000, -0.0000702200000000 ]  - [  -0.0004803800000000, -0.0008311300000000,  0.0000147400000000 ]  - [   0.0000419600000000, -0.0001827000000000, -0.0000578700000000 ]  - [  -0.0004392000000000, -0.0007069800000000,  0.0002354200000000 ]  - [   0.0002102500000000, -0.0010681800000000, -0.0000618300000000 ]  - [  -0.0001233300000000, -0.0004699200000000, -0.0003630500000000 ]  - [   0.0003035000000000, -0.0005689900000000,  0.0002437100000000 ]  - [  -0.0000427300000000, -0.0010426200000000, -0.0001405200000000 ]  - [   0.0005050300000000, -0.0010006000000000, -0.0003416500000000 ]  - [  -0.0002049900000000, -0.0005915600000000, -0.0002813100000000 ]  - [   0.0002301400000000, -0.0004144000000000, -0.0002557400000000 ]  - [   0.0003495700000000, -0.0004431100000000, -0.0004629500000000 ]  - [  -0.0007524600000000,  0.0014862400000000, -0.0001311700000000 ]  - [  -0.0002082700000000,  0.0011583800000000,  0.0003684000000000 ]  - [   0.0001433000000000, -0.0000119800000000, -0.0002558900000000 ]  - [  -0.0009620400000000,  0.0001319400000000, -0.0001793900000000 ]  - [  -0.0005136400000000,  0.0006681500000000,  0.0000680500000000 ]  - [   0.0000727400000000,  0.0006864300000000, -0.0000899100000000 ]  - [   0.0010117700000000,  0.0013687600000000, -0.0003525700000000 ]  - [   0.0004968600000000, -0.0000354500000000, -0.0003879600000000 ]  - [   0.0001549500000000, -0.0004143600000000,  0.0000970200000000 ]  - [  -0.0006591300000000,  0.0005855400000000, -0.0003815400000000 ]  - [   0.0022315400000000, -0.0021119900000000, -0.0010706200000000 ]  - [   0.0001782600000000,  0.0003473200000000, -0.0005317100000000 ]  - [   0.0001459100000000, -0.0005396500000000, -0.0000082400000000 ]  - [  -0.0005224500000000, -0.0007779600000000,  0.0000358200000000 ]  - [  -0.0010073800000000, -0.0015070000000000, -0.0008967700000000 ]  - [  -0.0000633200000000, -0.0007024600000000,  0.0002329300000000 ]  - [   0.0000598000000000, -0.0008511300000000,  0.0000088100000000 ]  - [  -0.0002403200000000, -0.0003808700000000, -0.0003692800000000 ]  - [   0.0000542200000000, -0.0009060500000000,  0.0002314500000000 ]  - [  -0.0001832000000000, -0.0008549900000000, -0.0000307500000000 ]  - [   0.0004496800000000, -0.0004139900000000,  0.0000799400000000 ]  - [  -0.0001628900000000, -0.0005707800000000, -0.0002619200000000 ]  - [   0.0001024800000000, -0.0005588300000000, -0.0003092100000000 ]  - [  -0.0000253400000000, -0.0003457200000000, -0.0003804700000000 ]- atom:   42  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0009771300000000,  0.0000126200000000, -0.0000110500000000 ]  - [  -0.0005428200000000, -0.0005982500000000,  0.0000761400000000 ]  - [   0.0002525500000000, -0.0003660000000000, -0.0009952900000000 ]  - [  -0.0006656200000000, -0.0014443200000000,  0.0036759200000000 ]  - [   0.0001961200000000,  0.0000426800000000,  0.0002320600000000 ]  - [  -0.0001630200000000, -0.0002557700000000,  0.0002614300000000 ]  - [   0.0002267800000000, -0.0001742500000000,  0.0001459000000000 ]  - [  -0.0002381300000000,  0.0000366500000000,  0.0001518100000000 ]  - [   0.0000719600000000,  0.0001181400000000,  0.0001910400000000 ]  - [  -0.0001960100000000, -0.0001636300000000,  0.0001760100000000 ]  - [  -0.0026928900000000, -0.0009355300000000,  0.0043316200000000 ]  - [  -0.0002053700000000,  0.0002135300000000,  0.0002337600000000 ]  - [   0.0002494100000000,  0.0000721000000000,  0.0001412400000000 ]  - [  -0.0002917300000000, -0.0002243600000000,  0.0000904700000000 ]  - [   0.0002373000000000, -0.0001899700000000,  0.0001483100000000 ]  - [  -0.0002396500000000,  0.0000539100000000,  0.0001491100000000 ]  - [  -0.0030460600000000,  0.0144523200000000,  0.0090089900000000 ]  - [   0.0000278100000000,  0.0006674400000000, -0.0000965600000000 ]  - [  -0.0008593300000000,  0.0018732500000000,  0.0032621400000000 ]  - [   0.0009637000000000, -0.0013612800000000,  0.0013950100000000 ]  - [  -0.0000688800000000, -0.0004590100000000,  0.0000964500000000 ]  - [   0.0000860000000000,  0.0001551100000000,  0.0001115700000000 ]  - [  -0.0000448300000000,  0.0001164100000000,  0.0000880900000000 ]  - [   0.0000501700000000, -0.0005770200000000,  0.0000311300000000 ]  - [  -0.0007271700000000,  0.0000371000000000,  0.0001868200000000 ]  - [   0.0001893800000000,  0.0006051200000000, -0.0001040400000000 ]  - [  -0.0019172900000000,  0.0002772600000000,  0.0005563800000000 ]  - [  -0.0003340200000000, -0.0002284700000000,  0.0000954800000000 ]  - [  -0.0000306100000000, -0.0003829000000000,  0.0001196600000000 ]  - [   0.0000006800000000,  0.0000512800000000,  0.0001901600000000 ]  - [   0.0000135700000000,  0.0001084300000000,  0.0001149100000000 ]  - [   0.0000304100000000, -0.0003472700000000,  0.0001609300000000 ]  - [   0.0319558400000000,  0.0058242000000000,  0.0298084100000000 ]  - [  -0.0000422300000000, -0.0005957300000000,  0.0006592200000000 ]  - [  -0.0000105700000000, -0.0002069800000000, -0.0001127000000000 ]  - [   0.0004006100000000, -0.0001214400000000, -0.0004002100000000 ]  - [  -0.0003446300000000,  0.0011018100000000, -0.0006633100000000 ]  - [  -0.0000882000000000, -0.0000035900000000, -0.0001783500000000 ]  - [  -0.0000267500000000, -0.0001792900000000, -0.0000602800000000 ]  - [  -0.0000114600000000, -0.0001688900000000, -0.0000937800000000 ]  - [   0.0067257100000000, -0.0020044100000000,  0.0035221600000000 ]  - [  -0.0328931500000000, -0.0279103000000000, -0.0611393800000000 ]  - [   0.0000038700000000,  0.0002615400000000, -0.0000951900000000 ]  - [  -0.0002741700000000, -0.0002261700000000, -0.0000437400000000 ]  - [   0.0027515800000000,  0.0057558800000000,  0.0037987100000000 ]  - [   0.0023165800000000,  0.0057852700000000,  0.0055854200000000 ]  - [  -0.0013825000000000, -0.0006466700000000, -0.0011290000000000 ]  - [  -0.0007013900000000, -0.0008950200000000, -0.0008488800000000 ]  - [  -0.0000332300000000,  0.0003930300000000,  0.0000823400000000 ]  - [  -0.0025198300000000,  0.0024281100000000, -0.0007725500000000 ]  - [   0.0005248500000000, -0.0000694200000000, -0.0002933300000000 ]  - [  -0.0000554100000000, -0.0008228800000000, -0.0005099800000000 ]  - [  -0.0000243200000000,  0.0003640300000000, -0.0000485600000000 ]  - [  -0.0003290000000000,  0.0000401700000000,  0.0001718200000000 ]  - [  -0.0000164600000000,  0.0002913900000000, -0.0000107900000000 ]  - [  -0.0003336000000000,  0.0001839600000000,  0.0001507100000000 ]  - [  -0.0000561800000000, -0.0000571400000000, -0.0000435700000000 ]  - [  -0.0002096000000000,  0.0002106000000000, -0.0003065900000000 ]  - [   0.0003573000000000,  0.0001959100000000,  0.0001283400000000 ]  - [  -0.0000042300000000, -0.0001083800000000,  0.0000059900000000 ]  - [   0.0003243500000000,  0.0001967500000000,  0.0000833600000000 ]  - [  -0.0001614200000000,  0.0000059300000000, -0.0003029200000000 ]  - [   0.0001886500000000, -0.0000599000000000, -0.0003236200000000 ]  - [   0.0001333800000000,  0.0001612400000000, -0.0002778300000000 ]  - [   0.0013288100000000,  0.0000561700000000,  0.0006091300000000 ]  - [   0.0000248600000000, -0.0003182600000000,  0.0003852200000000 ]  - [  -0.0001106900000000,  0.0001503500000000,  0.0000154200000000 ]  - [  -0.0000607500000000,  0.0003747700000000, -0.0000402400000000 ]  - [   0.0000376800000000, -0.0005288200000000,  0.0001507000000000 ]  - [   0.0003155000000000, -0.0002289000000000, -0.0007111700000000 ]  - [   0.0004868900000000, -0.0003997000000000,  0.0007943300000000 ]  - [   0.0000556200000000, -0.0004271400000000,  0.0001820100000000 ]  - [   0.0004446100000000, -0.0000300100000000,  0.0001428900000000 ]  - [   0.0003066800000000, -0.0002318700000000, -0.0001846400000000 ]  - [  -0.0005340100000000,  0.0003296600000000, -0.0005380900000000 ]  - [   0.0002745100000000, -0.0000451100000000, -0.0002827000000000 ]  - [  -0.0000205600000000,  0.0003570800000000, -0.0000592100000000 ]  - [  -0.0003369300000000,  0.0000170800000000,  0.0001584400000000 ]  - [  -0.0000445600000000,  0.0002406200000000, -0.0001809700000000 ]  - [  -0.0004553400000000,  0.0001857700000000,  0.0001499600000000 ]  - [  -0.0000253500000000, -0.0001331900000000, -0.0000645500000000 ]  - [  -0.0001833700000000,  0.0001414500000000, -0.0003006100000000 ]  - [   0.0003747300000000,  0.0001836700000000,  0.0001088700000000 ]  - [   0.0000203600000000, -0.0001632100000000, -0.0000634600000000 ]  - [   0.0004029600000000, -0.0000466700000000,  0.0001446000000000 ]  - [  -0.0001934300000000, -0.0000165700000000, -0.0003186000000000 ]  - [   0.0002057600000000,  0.0000509700000000, -0.0003223200000000 ]  - [   0.0002120800000000,  0.0001729300000000, -0.0003325200000000 ]- atom:   42  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0005133900000000,  0.0002081300000000,  0.0003043000000000 ]  - [   0.0000798900000000,  0.0003745200000000,  0.0002159200000000 ]  - [   0.0002071300000000,  0.0001466500000000,  0.0012849200000000 ]  - [   0.0001805500000000,  0.0018392500000000, -0.0035869200000000 ]  - [   0.0002640300000000,  0.0001777700000000,  0.0000621100000000 ]  - [  -0.0002951500000000,  0.0000342600000000,  0.0000326300000000 ]  - [   0.0002333900000000, -0.0000467800000000,  0.0001467900000000 ]  - [  -0.0002217400000000,  0.0001825700000000,  0.0001408300000000 ]  - [   0.0003903300000000,  0.0001066800000000,  0.0001018400000000 ]  - [  -0.0002627800000000, -0.0000595200000000,  0.0001180400000000 ]  - [   0.0030444800000000,  0.0006910000000000, -0.0040173700000000 ]  - [  -0.0002506900000000,  0.0000052300000000,  0.0000621200000000 ]  - [   0.0002114000000000,  0.0001497600000000,  0.0001516400000000 ]  - [  -0.0001674500000000,  0.0000046500000000,  0.0002029700000000 ]  - [   0.0002235300000000, -0.0000329200000000,  0.0001451300000000 ]  - [  -0.0002192700000000,  0.0001658900000000,  0.0001437200000000 ]  - [   0.0029608800000000, -0.0151177900000000, -0.0086790900000000 ]  - [   0.0000500800000000, -0.0001615800000000,  0.0003370500000000 ]  - [   0.0007823900000000, -0.0013636700000000, -0.0029961700000000 ]  - [  -0.0008802400000000,  0.0008422700000000, -0.0011438200000000 ]  - [  -0.0000120000000000, -0.0000476900000000,  0.0001458000000000 ]  - [  -0.0000043500000000,  0.0003456300000000,  0.0001300600000000 ]  - [  -0.0000345900000000,  0.0003850700000000,  0.0001530900000000 ]  - [   0.0000300500000000,  0.0000710900000000,  0.0002117900000000 ]  - [   0.0006442900000000, -0.0005348200000000,  0.0000539100000000 ]  - [  -0.0001052100000000, -0.0001006600000000,  0.0003412600000000 ]  - [   0.0018347000000000,  0.0002293200000000, -0.0003080900000000 ]  - [   0.0004139200000000, -0.0002755600000000,  0.0001450100000000 ]  - [  -0.0000489600000000, -0.0001211100000000,  0.0001220200000000 ]  - [   0.0000778600000000,  0.0004482900000000,  0.0000497900000000 ]  - [  -0.0000928400000000,  0.0003920100000000,  0.0001270000000000 ]  - [   0.0000490500000000, -0.0001555900000000,  0.0000827000000000 ]  - [  -0.0310356900000000, -0.0055107300000000, -0.0296560500000000 ]  - [   0.0000320400000000,  0.0005872600000000, -0.0008217400000000 ]  - [   0.0000097000000000,  0.0002048300000000, -0.0000262700000000 ]  - [  -0.0003982900000000,  0.0001178400000000,  0.0002558800000000 ]  - [   0.0003484200000000, -0.0011064700000000,  0.0005282400000000 ]  - [   0.0000888800000000,  0.0000052300000000,  0.0000373200000000 ]  - [   0.0000247000000000,  0.0001779200000000, -0.0000784200000000 ]  - [   0.0000114200000000,  0.0001672700000000, -0.0000462200000000 ]  - [  -0.0066360700000000,  0.0024238000000000, -0.0035927500000000 ]  - [   0.0313635500000000,  0.0274156300000000,  0.0611649300000000 ]  - [  -0.0000141200000000,  0.0002065600000000, -0.0000115300000000 ]  - [  -0.0004406500000000,  0.0003973200000000,  0.0003265100000000 ]  - [  -0.0027310900000000, -0.0061219700000000, -0.0038349900000000 ]  - [  -0.0026986900000000, -0.0056711400000000, -0.0062857400000000 ]  - [   0.0020810100000000,  0.0008107100000000,  0.0014058400000000 ]  - [   0.0007300800000000,  0.0004820500000000,  0.0007467300000000 ]  - [   0.0007376400000000, -0.0005667600000000,  0.0002000500000000 ]  - [   0.0021505300000000, -0.0025812700000000,  0.0001394300000000 ]  - [  -0.0001646200000000, -0.0000884700000000, -0.0003520300000000 ]  - [   0.0003937300000000,  0.0009613400000000, -0.0001268900000000 ]  - [   0.0000332700000000,  0.0001059000000000, -0.0000578700000000 ]  - [  -0.0003833100000000, -0.0002193900000000,  0.0001093800000000 ]  - [  -0.0000013100000000,  0.0001688300000000, -0.0001019100000000 ]  - [  -0.0003776600000000, -0.0000081900000000,  0.0001339400000000 ]  - [   0.0000454800000000, -0.0004085500000000, -0.0000634300000000 ]  - [  -0.0001506400000000, -0.0000533600000000, -0.0003285800000000 ]  - [   0.0003529000000000, -0.0000075700000000,  0.0001492000000000 ]  - [   0.0000184600000000, -0.0003533900000000, -0.0001158300000000 ]  - [   0.0003859900000000, -0.0003698000000000,  0.0002007200000000 ]  - [  -0.0002014900000000, -0.0001627600000000, -0.0003418600000000 ]  - [   0.0001530200000000, -0.0001010700000000, -0.0003055600000000 ]  - [   0.0002338800000000, -0.0000037200000000, -0.0003621500000000 ]  - [  -0.0013342700000000,  0.0003989700000000, -0.0007234300000000 ]  - [  -0.0007400800000000,  0.0001371400000000, -0.0001065900000000 ]  - [   0.0000939700000000,  0.0003131600000000, -0.0001257600000000 ]  - [  -0.0006479400000000, -0.0001992300000000,  0.0003242100000000 ]  - [  -0.0000542200000000,  0.0000656000000000, -0.0002608800000000 ]  - [  -0.0006596900000000,  0.0003887900000000,  0.0000706300000000 ]  - [   0.0002204400000000,  0.0005843700000000, -0.0005164600000000 ]  - [  -0.0000415700000000, -0.0000391900000000, -0.0002896600000000 ]  - [   0.0002682300000000, -0.0001513500000000,  0.0001362200000000 ]  - [  -0.0006663000000000,  0.0000733800000000, -0.0004575900000000 ]  - [   0.0008808700000000, -0.0004809700000000, -0.0000901300000000 ]  - [   0.0000846600000000,  0.0002020500000000, -0.0003487600000000 ]  - [   0.0000349700000000,  0.0001065000000000, -0.0000509300000000 ]  - [  -0.0003743200000000, -0.0001927800000000,  0.0001251600000000 ]  - [   0.0000346600000000,  0.0002293500000000,  0.0000773200000000 ]  - [  -0.0002556600000000, -0.0000001600000000,  0.0001302800000000 ]  - [   0.0000152600000000, -0.0003340700000000, -0.0000407700000000 ]  - [  -0.0001649300000000,  0.0000198300000000, -0.0003430900000000 ]  - [   0.0003393000000000, -0.0000030700000000,  0.0001719300000000 ]  - [  -0.0000090800000000, -0.0003046200000000, -0.0000419200000000 ]  - [   0.0003082500000000, -0.0001280900000000,  0.0001401200000000 ]  - [  -0.0001561000000000, -0.0001427200000000, -0.0003160800000000 ]  - [   0.0001456200000000, -0.0002100300000000, -0.0003185800000000 ]  - [   0.0001475800000000, -0.0000130700000000, -0.0003145500000000 ]- atom:   46  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0041401700000000, -0.0049435900000000, -0.0010063200000000 ]  - [  -0.0002897800000000, -0.0002139900000000,  0.0001372700000000 ]  - [  -0.0008031200000000, -0.0007395700000000,  0.0004616900000000 ]  - [   0.0005115100000000, -0.0004715900000000,  0.0002198500000000 ]  - [   0.0002388900000000,  0.0000782800000000,  0.0001671000000000 ]  - [  -0.0002829800000000,  0.0003170900000000,  0.0002047500000000 ]  - [   0.0001933700000000, -0.0000913800000000,  0.0001563600000000 ]  - [  -0.0001126500000000,  0.0000934900000000,  0.0001436700000000 ]  - [  -0.0008160400000000,  0.0001416500000000,  0.0002415500000000 ]  - [  -0.0001800500000000, -0.0000338700000000,  0.0001743600000000 ]  - [   0.0012797200000000,  0.0004000900000000, -0.0000020900000000 ]  - [  -0.0006880800000000,  0.0001861200000000,  0.0000614900000000 ]  - [   0.0002277000000000,  0.0001537800000000,  0.0001235500000000 ]  - [  -0.0002965900000000, -0.0006294400000000, -0.0003124300000000 ]  - [   0.0002628300000000, -0.0001317600000000,  0.0001352400000000 ]  - [  -0.0003545000000000,  0.0000932300000000,  0.0000923500000000 ]  - [   0.0159882300000000, -0.0001167600000000,  0.0234882900000000 ]  - [  -0.0000439900000000, -0.0004614700000000,  0.0003896500000000 ]  - [  -0.0017891800000000,  0.0011941900000000, -0.0034423400000000 ]  - [   0.0007332400000000, -0.0007897400000000,  0.0003762300000000 ]  - [  -0.0000169500000000, -0.0002263500000000,  0.0001022500000000 ]  - [   0.0000209400000000,  0.0004326100000000,  0.0001819300000000 ]  - [  -0.0001092100000000,  0.0002522400000000,  0.0001695400000000 ]  - [   0.0004510000000000,  0.0004135600000000,  0.0006562100000000 ]  - [  -0.0032533900000000, -0.0001278900000000,  0.0005095800000000 ]  - [   0.0002145000000000,  0.0013307100000000, -0.0004311900000000 ]  - [   0.0793182800000000,  0.0154833700000000, -0.0159237400000000 ]  - [  -0.0006784500000000,  0.0001112300000000, -0.0001671400000000 ]  - [  -0.0000559200000000, -0.0002723000000000,  0.0001167800000000 ]  - [   0.0001945000000000, -0.0001767700000000,  0.0001532200000000 ]  - [   0.0000210600000000,  0.0002693500000000,  0.0001034300000000 ]  - [  -0.0002325100000000, -0.0003444700000000,  0.0002861000000000 ]  - [  -0.0003688400000000, -0.0016791200000000,  0.0002393700000000 ]  - [   0.0036448500000000, -0.0004304600000000,  0.0016622500000000 ]  - [  -0.0000122000000000,  0.0001200500000000,  0.0000873300000000 ]  - [   0.0002760000000000,  0.0001136100000000, -0.0003079900000000 ]  - [  -0.0012440700000000,  0.0031321200000000, -0.0023490300000000 ]  - [  -0.0015817700000000,  0.0002160100000000, -0.0005651900000000 ]  - [  -0.0000236800000000, -0.0000752500000000, -0.0000510700000000 ]  - [  -0.0002890000000000, -0.0000817100000000,  0.0001231200000000 ]  - [   0.0045666700000000,  0.0021082200000000, -0.0024214100000000 ]  - [  -0.0009828700000000,  0.0010644000000000,  0.0026378600000000 ]  - [   0.0001685700000000,  0.0004824000000000, -0.0000993600000000 ]  - [   0.0008671100000000, -0.0003960400000000,  0.0006325800000000 ]  - [  -0.0001692400000000,  0.0006595900000000,  0.0000085700000000 ]  - [  -0.1300577500000000, -0.0126072900000000, -0.0140127600000000 ]  - [   0.0006580900000000,  0.0009625300000000, -0.0001957000000000 ]  - [  -0.0011755600000000, -0.0004942400000000,  0.0003575900000000 ]  - [   0.0001333400000000,  0.0000753600000000,  0.0001902300000000 ]  - [   0.0083575600000000, -0.0005881900000000,  0.0089326400000000 ]  - [   0.0005632400000000, -0.0000045400000000, -0.0004764800000000 ]  - [   0.0000966400000000,  0.0003556500000000, -0.0003435500000000 ]  - [   0.0000511200000000,  0.0001525800000000, -0.0000911200000000 ]  - [  -0.0004014500000000, -0.0001478500000000,  0.0001184500000000 ]  - [   0.0002244400000000, -0.0000399600000000,  0.0000577300000000 ]  - [  -0.0002825600000000,  0.0001048200000000,  0.0001293500000000 ]  - [   0.0000367000000000, -0.0005159700000000, -0.0001382400000000 ]  - [  -0.0002255400000000,  0.0000877000000000, -0.0003263800000000 ]  - [   0.0003647900000000,  0.0000330800000000,  0.0001368500000000 ]  - [  -0.0000663800000000, -0.0002834200000000, -0.0000066500000000 ]  - [  -0.0007808200000000, -0.0013799800000000,  0.0003708400000000 ]  - [  -0.0001833400000000, -0.0000783300000000, -0.0003188900000000 ]  - [   0.0003980800000000, -0.0001665400000000, -0.0003592100000000 ]  - [   0.0000975300000000, -0.0000711500000000, -0.0003274100000000 ]  - [   0.0057697500000000, -0.0030108700000000, -0.0021292200000000 ]  - [   0.0005739200000000, -0.0003386700000000,  0.0006434200000000 ]  - [  -0.0001843000000000, -0.0000704700000000,  0.0000267300000000 ]  - [   0.0026324000000000,  0.0036474900000000, -0.0021801900000000 ]  - [   0.0005387800000000, -0.0010601100000000,  0.0002308100000000 ]  - [   0.0038093100000000, -0.0000822500000000,  0.0012952800000000 ]  - [   0.0004939300000000, -0.0019732900000000,  0.0008525700000000 ]  - [   0.0008432500000000,  0.0000876700000000, -0.0001311600000000 ]  - [   0.0005809200000000, -0.0002970100000000,  0.0001122200000000 ]  - [   0.0082438400000000,  0.0006627800000000,  0.0022086200000000 ]  - [  -0.0002377100000000, -0.0001148500000000, -0.0000984600000000 ]  - [   0.0004293100000000, -0.0002451500000000, -0.0002190900000000 ]  - [  -0.0000051000000000,  0.0002661300000000, -0.0000624700000000 ]  - [  -0.0003184600000000, -0.0000209900000000,  0.0001422600000000 ]  - [  -0.0005153200000000,  0.0005026000000000, -0.0002517100000000 ]  - [  -0.0004135600000000,  0.0000632300000000,  0.0001609200000000 ]  - [   0.0000022400000000, -0.0001913600000000, -0.0001112500000000 ]  - [  -0.0001261900000000,  0.0000567300000000, -0.0003123300000000 ]  - [   0.0003448500000000,  0.0001574900000000,  0.0001206500000000 ]  - [   0.0000726100000000, -0.0002086000000000, -0.0000980800000000 ]  - [   0.0009579000000000, -0.0000969200000000,  0.0000508400000000 ]  - [  -0.0001788200000000, -0.0000803200000000, -0.0003157200000000 ]  - [  -0.0001963900000000,  0.0000724500000000, -0.0003276400000000 ]  - [   0.0004305900000000,  0.0004661300000000, -0.0004684900000000 ]- atom:   46  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0036193000000000,  0.0050005800000000,  0.0012314200000000 ]  - [  -0.0001688600000000, -0.0000054300000000,  0.0001581900000000 ]  - [   0.0012690000000000,  0.0005182400000000, -0.0001636700000000 ]  - [  -0.0009740700000000,  0.0007023700000000,  0.0000744900000000 ]  - [   0.0002218000000000,  0.0001435300000000,  0.0001280300000000 ]  - [  -0.0001728900000000, -0.0005369500000000,  0.0000895000000000 ]  - [   0.0002671100000000, -0.0001300900000000,  0.0001385400000000 ]  - [  -0.0003470700000000,  0.0001272500000000,  0.0001506400000000 ]  - [   0.0012785300000000,  0.0000802400000000,  0.0000538100000000 ]  - [  -0.0002806400000000, -0.0001865400000000,  0.0001205000000000 ]  - [  -0.0008253800000000, -0.0006279800000000,  0.0003032800000000 ]  - [   0.0002319000000000,  0.0000318600000000,  0.0002333300000000 ]  - [   0.0002351000000000,  0.0000695100000000,  0.0001720600000000 ]  - [  -0.0001639100000000,  0.0004120200000000,  0.0006094500000000 ]  - [   0.0001987600000000, -0.0000919400000000,  0.0001597700000000 ]  - [  -0.0001052500000000,  0.0001286000000000,  0.0002023400000000 ]  - [  -0.0161391600000000, -0.0003921200000000, -0.0227850800000000 ]  - [   0.0001246400000000,  0.0009667400000000, -0.0001504500000000 ]  - [   0.0017395200000000, -0.0006965500000000,  0.0036660200000000 ]  - [  -0.0006614000000000,  0.0002930600000000, -0.0001393200000000 ]  - [  -0.0000582300000000, -0.0002772200000000,  0.0001342900000000 ]  - [   0.0000583400000000,  0.0000715900000000,  0.0000569700000000 ]  - [   0.0000314900000000,  0.0002511600000000,  0.0000701700000000 ]  - [  -0.0003776100000000, -0.0009228800000000, -0.0004226500000000 ]  - [   0.0031869100000000, -0.0003760200000000, -0.0002811800000000 ]  - [  -0.0001411400000000, -0.0008345900000000,  0.0006733100000000 ]  - [  -0.0832402700000000, -0.0158338700000000,  0.0169662800000000 ]  - [   0.0007604100000000, -0.0006183700000000,  0.0004098200000000 ]  - [  -0.0000218900000000, -0.0002307100000000,  0.0001229000000000 ]  - [  -0.0001207000000000,  0.0006824600000000,  0.0000845400000000 ]  - [  -0.0000967800000000,  0.0002347600000000,  0.0001354200000000 ]  - [   0.0003091000000000, -0.0001562900000000, -0.0000474100000000 ]  - [   0.0004030100000000,  0.0016879900000000, -0.0003810400000000 ]  - [  -0.0036671600000000,  0.0004169200000000, -0.0018036700000000 ]  - [   0.0000136700000000, -0.0001212800000000, -0.0002271900000000 ]  - [  -0.0002785800000000, -0.0001134600000000,  0.0001721900000000 ]  - [   0.0012449600000000, -0.0031586300000000,  0.0022339800000000 ]  - [   0.0015855500000000, -0.0002125300000000,  0.0004296900000000 ]  - [   0.0000229600000000,  0.0000764600000000, -0.0000848300000000 ]  - [   0.0002902800000000,  0.0000815800000000, -0.0002617900000000 ]  - [  -0.0044852900000000, -0.0016036700000000,  0.0022722000000000 ]  - [   0.0002307800000000, -0.0012617200000000, -0.0023950100000000 ]  - [  -0.0001842100000000, -0.0000116200000000, -0.0000043100000000 ]  - [  -0.0015865200000000,  0.0005735200000000, -0.0003519900000000 ]  - [   0.0001513300000000, -0.0011448300000000, -0.0001166100000000 ]  - [   0.1336607300000000,  0.0138156000000000,  0.0121923100000000 ]  - [   0.0000482600000000, -0.0007869900000000,  0.0004738200000000 ]  - [   0.0011872400000000,  0.0000403000000000, -0.0004662700000000 ]  - [   0.0005786100000000, -0.0002523400000000,  0.0000874500000000 ]  - [  -0.0085980000000000,  0.0004114300000000, -0.0094972700000000 ]  - [  -0.0002143300000000, -0.0001525300000000, -0.0001630000000000 ]  - [   0.0002595100000000, -0.0002019600000000, -0.0002966300000000 ]  - [  -0.0000392700000000,  0.0003212300000000, -0.0000102500000000 ]  - [  -0.0003084700000000, -0.0000325900000000,  0.0001584500000000 ]  - [  -0.0002388700000000,  0.0005120000000000, -0.0001598500000000 ]  - [  -0.0004306300000000,  0.0000671600000000,  0.0001500400000000 ]  - [  -0.0000508000000000,  0.0000473800000000,  0.0000355200000000 ]  - [  -0.0001264900000000,  0.0000687000000000, -0.0003076400000000 ]  - [   0.0003438600000000,  0.0001413000000000,  0.0001420300000000 ]  - [   0.0000821900000000, -0.0001870900000000, -0.0000996100000000 ]  - [   0.0014885600000000,  0.0012240300000000, -0.0001001500000000 ]  - [  -0.0001811400000000, -0.0000771700000000, -0.0003256100000000 ]  - [  -0.0000404000000000,  0.0000091900000000, -0.0002804200000000 ]  - [   0.0002546000000000,  0.0002290400000000, -0.0003111000000000 ]  - [  -0.0058594300000000,  0.0035365900000000,  0.0020919300000000 ]  - [  -0.0012900000000000,  0.0001668300000000, -0.0003654000000000 ]  - [   0.0001705800000000,  0.0005436400000000, -0.0001319600000000 ]  - [  -0.0033901600000000, -0.0035442400000000,  0.0024933500000000 ]  - [  -0.0005554800000000,  0.0005965300000000, -0.0003363500000000 ]  - [  -0.0041642800000000,  0.0002413800000000, -0.0019384000000000 ]  - [   0.0002214700000000,  0.0021715000000000, -0.0005833700000000 ]  - [  -0.0008329700000000, -0.0005618200000000,  0.0000303800000000 ]  - [   0.0001288300000000,  0.0001251400000000,  0.0001661700000000 ]  - [  -0.0087213500000000, -0.0008451100000000, -0.0029332600000000 ]  - [   0.0005927200000000, -0.0000422000000000, -0.0005403100000000 ]  - [  -0.0000706600000000,  0.0004037600000000, -0.0004245100000000 ]  - [   0.0000187800000000,  0.0002059200000000, -0.0000407300000000 ]  - [  -0.0003936800000000, -0.0001538600000000,  0.0001363200000000 ]  - [   0.0005088100000000, -0.0000267400000000,  0.0001529300000000 ]  - [  -0.0002961900000000,  0.0001127200000000,  0.0001176600000000 ]  - [  -0.0000162500000000, -0.0002823500000000,  0.0000066900000000 ]  - [  -0.0002229000000000,  0.0001013800000000, -0.0003307400000000 ]  - [   0.0003687300000000,  0.0000132100000000,  0.0001596600000000 ]  - [  -0.0000589300000000, -0.0002638800000000, -0.0000029400000000 ]  - [  -0.0002500400000000, -0.0000823500000000,  0.0002285100000000 ]  - [  -0.0001748700000000, -0.0000775400000000, -0.0003258100000000 ]  - [   0.0005550700000000, -0.0002294700000000, -0.0003176500000000 ]  - [  -0.0000818200000000, -0.0003108900000000, -0.0001709100000000 ]- atom:   46  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0037268900000000,  0.0105099700000000,  0.0033612300000000 ]  - [  -0.0003340900000000, -0.0004506100000000,  0.0001052800000000 ]  - [   0.0002377700000000,  0.0003199500000000,  0.0000308600000000 ]  - [  -0.0003007900000000, -0.0014159200000000, -0.0002490500000000 ]  - [   0.0002133100000000, -0.0001908300000000,  0.0001761300000000 ]  - [   0.0003599400000000, -0.0000403000000000,  0.0003809200000000 ]  - [   0.0002371300000000, -0.0003609900000000,  0.0001518200000000 ]  - [  -0.0002602200000000, -0.0001835400000000,  0.0001965300000000 ]  - [  -0.0004021300000000,  0.0010057200000000,  0.0004847100000000 ]  - [  -0.0001685400000000, -0.0003912900000000,  0.0001390500000000 ]  - [   0.0004754400000000,  0.0007060000000000,  0.0000367900000000 ]  - [  -0.0001812100000000,  0.0001550100000000,  0.0000534700000000 ]  - [   0.0002512200000000, -0.0001708400000000,  0.0001520300000000 ]  - [  -0.0005578500000000, -0.0003543400000000, -0.0001930900000000 ]  - [   0.0002149400000000, -0.0004227800000000,  0.0001336500000000 ]  - [  -0.0002895400000000, -0.0001015200000000,  0.0001309500000000 ]  - [   0.0007172600000000,  0.0052044100000000,  0.0001419800000000 ]  - [  -0.0002941300000000,  0.0000145500000000, -0.0000130600000000 ]  - [   0.0001070700000000,  0.0012583700000000,  0.0005479200000000 ]  - [   0.0002059400000000, -0.0011731300000000,  0.0002735400000000 ]  - [  -0.0001014900000000, -0.0009784300000000,  0.0001619100000000 ]  - [   0.0005084700000000,  0.0000329100000000,  0.0002620500000000 ]  - [   0.0000485500000000, -0.0003880500000000,  0.0000066200000000 ]  - [  -0.0001832400000000, -0.0019458900000000, -0.0008330900000000 ]  - [  -0.0001804400000000,  0.0007075400000000,  0.0001173900000000 ]  - [  -0.0002087500000000, -0.0010231600000000,  0.0003750900000000 ]  - [   0.0157979800000000,  0.0098049000000000, -0.0025108800000000 ]  - [   0.0001734400000000, -0.0007118700000000, -0.0000290000000000 ]  - [  -0.0000651700000000, -0.0008541500000000,  0.0001528400000000 ]  - [  -0.0002061100000000, -0.0006513100000000,  0.0002618800000000 ]  - [  -0.0000127300000000, -0.0004191400000000,  0.0001129900000000 ]  - [  -0.0000169000000000, -0.0002286100000000,  0.0005343000000000 ]  - [  -0.0033736900000000,  0.0008797600000000, -0.0006090900000000 ]  - [  -0.0001915100000000, -0.0013072900000000,  0.0025807800000000 ]  - [   0.0001205400000000, -0.0009083900000000, -0.0004736400000000 ]  - [   0.0001444900000000, -0.0008666400000000, -0.0000389200000000 ]  - [   0.0013609500000000, -0.0003279000000000,  0.0002490600000000 ]  - [  -0.0000904700000000,  0.0007078700000000,  0.0001994500000000 ]  - [  -0.0002268800000000, -0.0007021600000000,  0.0000702900000000 ]  - [   0.0001632200000000, -0.0007265000000000, -0.0000831200000000 ]  - [   0.0015555500000000, -0.0005228500000000, -0.0004067500000000 ]  - [   0.0032886300000000,  0.0018308400000000,  0.0058791500000000 ]  - [   0.0000658000000000,  0.0006239900000000, -0.0000732500000000 ]  - [  -0.0006846300000000, -0.0005778900000000,  0.0002913300000000 ]  - [   0.0005722600000000,  0.0009835200000000,  0.0005682200000000 ]  - [  -0.0135514200000000, -0.0323717700000000, -0.0045398100000000 ]  - [   0.0007865200000000, -0.0000145300000000,  0.0001271000000000 ]  - [  -0.0004134800000000, -0.0001253400000000, -0.0019491100000000 ]  - [   0.0002345000000000,  0.0004357700000000,  0.0002200900000000 ]  - [  -0.0009342400000000, -0.0016548700000000, -0.0004754900000000 ]  - [   0.0002463900000000,  0.0000662300000000, -0.0002987900000000 ]  - [   0.0003320700000000,  0.0003653000000000, -0.0002574200000000 ]  - [  -0.0001949300000000,  0.0008369700000000,  0.0000368000000000 ]  - [  -0.0002665500000000,  0.0004618900000000,  0.0002706500000000 ]  - [  -0.0001688800000000,  0.0000231000000000, -0.0000057700000000 ]  - [  -0.0004428000000000,  0.0005781500000000,  0.0000759800000000 ]  - [  -0.0003248800000000,  0.0008183600000000,  0.0001137300000000 ]  - [  -0.0001697700000000,  0.0004297600000000, -0.0002780300000000 ]  - [   0.0002655000000000,  0.0004235700000000,  0.0001176000000000 ]  - [   0.0001349700000000,  0.0003273800000000, -0.0000600200000000 ]  - [  -0.0004609800000000,  0.0037251700000000, -0.0007474700000000 ]  - [  -0.0001759300000000,  0.0002461100000000, -0.0003441600000000 ]  - [   0.0000873300000000, -0.0000378800000000, -0.0004006900000000 ]  - [  -0.0000987700000000,  0.0003658900000000, -0.0001862300000000 ]  - [  -0.0039083500000000,  0.0008332000000000,  0.0018651500000000 ]  - [  -0.0007597000000000, -0.0006970600000000, -0.0001690100000000 ]  - [   0.0001157400000000,  0.0008500000000000, -0.0000734500000000 ]  - [   0.0049886100000000,  0.0030849000000000, -0.0023591200000000 ]  - [  -0.0002340200000000, -0.0000394000000000,  0.0000118800000000 ]  - [  -0.0003366700000000, -0.0004572900000000, -0.0004673800000000 ]  - [  -0.0009955200000000,  0.0021500200000000, -0.0002712400000000 ]  - [   0.0000091700000000, -0.0008936100000000,  0.0000628200000000 ]  - [   0.0002552800000000,  0.0003395600000000,  0.0002336300000000 ]  - [   0.0003263700000000, -0.0016536200000000, -0.0005807500000000 ]  - [   0.0001386600000000,  0.0003066000000000, -0.0004119300000000 ]  - [  -0.0002097000000000,  0.0005542500000000, -0.0003533600000000 ]  - [  -0.0000621200000000,  0.0007115000000000, -0.0000784700000000 ]  - [  -0.0002475400000000,  0.0003726700000000,  0.0001996300000000 ]  - [   0.0001596300000000,  0.0005729300000000, -0.0002709700000000 ]  - [  -0.0004564600000000,  0.0005989200000000,  0.0000533400000000 ]  - [  -0.0000081400000000,  0.0000644100000000, -0.0001099400000000 ]  - [  -0.0001977900000000,  0.0003877000000000, -0.0002794000000000 ]  - [   0.0005177700000000,  0.0005685100000000,  0.0000066000000000 ]  - [   0.0000853100000000,  0.0002267300000000, -0.0000589000000000 ]  - [   0.0005188000000000, -0.0003538000000000,  0.0000152300000000 ]  - [  -0.0001786700000000,  0.0002455900000000, -0.0003575900000000 ]  - [   0.0003256700000000,  0.0004262700000000, -0.0003247100000000 ]  - [   0.0005065000000000,  0.0005527500000000, -0.0005083200000000 ]- atom:   46  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0044341900000000, -0.0105581300000000, -0.0032499000000000 ]  - [  -0.0001217900000000,  0.0002359300000000,  0.0001891000000000 ]  - [   0.0002176600000000, -0.0005332800000000,  0.0002601300000000 ]  - [  -0.0001579900000000,  0.0016227000000000,  0.0005384500000000 ]  - [   0.0002435700000000,  0.0004056000000000,  0.0001177200000000 ]  - [  -0.0008199500000000, -0.0001795500000000, -0.0000884700000000 ]  - [   0.0002221500000000,  0.0001417500000000,  0.0001418800000000 ]  - [  -0.0001990400000000,  0.0004016200000000,  0.0000967900000000 ]  - [   0.0008615700000000, -0.0007882300000000, -0.0001904200000000 ]  - [  -0.0002863700000000,  0.0001773300000000,  0.0001550300000000 ]  - [  -0.0000180800000000, -0.0009239500000000,  0.0002543800000000 ]  - [  -0.0002764700000000,  0.0000623800000000,  0.0002392700000000 ]  - [   0.0002042200000000,  0.0003852700000000,  0.0001418500000000 ]  - [   0.0000986500000000,  0.0001353600000000,  0.0004854900000000 ]  - [   0.0002475900000000,  0.0002020400000000,  0.0001602900000000 ]  - [  -0.0001706100000000,  0.0003198800000000,  0.0001620900000000 ]  - [  -0.0008876900000000, -0.0057158200000000, -0.0002601200000000 ]  - [   0.0003702100000000,  0.0004883200000000,  0.0002493300000000 ]  - [  -0.0001873700000000, -0.0007503600000000, -0.0002989000000000 ]  - [  -0.0001270300000000,  0.0006687400000000, -0.0000352400000000 ]  - [   0.0000260800000000,  0.0004736800000000,  0.0000748400000000 ]  - [  -0.0004334800000000,  0.0004690000000000, -0.0000251600000000 ]  - [  -0.0001250800000000,  0.0008913200000000,  0.0002297800000000 ]  - [   0.0002652400000000,  0.0014461200000000,  0.0010783600000000 ]  - [   0.0000991400000000, -0.0012120400000000,  0.0001212100000000 ]  - [   0.0002778600000000,  0.0015242700000000, -0.0001386200000000 ]  - [  -0.0156904900000000, -0.0090637400000000,  0.0026527300000000 ]  - [  -0.0000985100000000,  0.0002097400000000,  0.0002621000000000 ]  - [  -0.0000115900000000,  0.0003501100000000,  0.0000832700000000 ]  - [   0.0002815300000000,  0.0011532400000000, -0.0000261600000000 ]  - [  -0.0000628800000000,  0.0009223700000000,  0.0001239500000000 ]  - [   0.0000920500000000, -0.0002771400000000, -0.0002980500000000 ]  - [   0.0033821000000000, -0.0008845000000000,  0.0004821700000000 ]  - [   0.0002029700000000,  0.0012920100000000, -0.0027253000000000 ]  - [  -0.0001222900000000,  0.0009089700000000,  0.0003362600000000 ]  - [  -0.0001441700000000,  0.0008669500000000, -0.0001008100000000 ]  - [  -0.0013595400000000,  0.0003432900000000, -0.0004035700000000 ]  - [   0.0000904500000000, -0.0007096700000000, -0.0003404800000000 ]  - [   0.0002268100000000,  0.0007018100000000, -0.0002107800000000 ]  - [  -0.0001649200000000,  0.0007262400000000, -0.0000575500000000 ]  - [  -0.0015242400000000,  0.0010007200000000,  0.0002838300000000 ]  - [  -0.0039886800000000, -0.0020052800000000, -0.0055724900000000 ]  - [  -0.0000819400000000, -0.0001531700000000, -0.0000427200000000 ]  - [  -0.0000222500000000,  0.0007582800000000, -0.0000080300000000 ]  - [  -0.0005830700000000, -0.0014513900000000, -0.0006756300000000 ]  - [   0.0128621100000000,  0.0326138900000000,  0.0045052400000000 ]  - [  -0.0000806600000000,  0.0001998300000000,  0.0001512400000000 ]  - [   0.0004090200000000, -0.0003321500000000,  0.0018436100000000 ]  - [   0.0004724200000000, -0.0006093100000000,  0.0000640300000000 ]  - [   0.0005721300000000,  0.0015016300000000, -0.0001683400000000 ]  - [   0.0001008400000000, -0.0002191100000000, -0.0003299400000000 ]  - [   0.0000356000000000, -0.0002158300000000, -0.0003810200000000 ]  - [   0.0002076200000000, -0.0003641400000000, -0.0001463000000000 ]  - [  -0.0004403300000000, -0.0006383300000000,  0.0000133800000000 ]  - [   0.0001557000000000,  0.0004507100000000, -0.0001043700000000 ]  - [  -0.0002638800000000, -0.0004035400000000,  0.0002085400000000 ]  - [   0.0003128200000000, -0.0012934900000000, -0.0002273700000000 ]  - [  -0.0001939100000000, -0.0002800000000000, -0.0003566800000000 ]  - [   0.0004405600000000, -0.0002439100000000,  0.0001646900000000 ]  - [  -0.0001233200000000, -0.0008033000000000, -0.0000495100000000 ]  - [   0.0011850800000000, -0.0039605900000000,  0.0010404200000000 ]  - [  -0.0001819100000000, -0.0003981700000000, -0.0002941400000000 ]  - [   0.0002679700000000, -0.0001160300000000, -0.0002320300000000 ]  - [   0.0004557300000000, -0.0002132800000000, -0.0004473100000000 ]  - [   0.0039290200000000, -0.0003805300000000, -0.0019655000000000 ]  - [   0.0000545100000000,  0.0005067000000000,  0.0004512600000000 ]  - [  -0.0001318700000000, -0.0003795900000000, -0.0000423500000000 ]  - [  -0.0057259500000000, -0.0029217800000000,  0.0026614700000000 ]  - [   0.0002272100000000, -0.0004405400000000, -0.0001143100000000 ]  - [  -0.0000152700000000,  0.0006068300000000, -0.0001602300000000 ]  - [   0.0016811600000000, -0.0019373000000000,  0.0005457300000000 ]  - [   0.0000080600000000,  0.0004255400000000, -0.0001778500000000 ]  - [   0.0004531700000000, -0.0005129900000000,  0.0000522300000000 ]  - [  -0.0006853700000000,  0.0015048400000000, -0.0000494700000000 ]  - [   0.0002073100000000, -0.0004601500000000, -0.0002152500000000 ]  - [   0.0005758000000000, -0.0004021600000000, -0.0002871700000000 ]  - [   0.0000764000000000, -0.0002422400000000, -0.0000345800000000 ]  - [  -0.0004582200000000, -0.0005548800000000,  0.0000825800000000 ]  - [  -0.0001763800000000, -0.0001018900000000,  0.0001528000000000 ]  - [  -0.0002497300000000, -0.0004166100000000,  0.0002280800000000 ]  - [  -0.0000032500000000, -0.0005381700000000,  0.0000006400000000 ]  - [  -0.0001520000000000, -0.0002350600000000, -0.0003482900000000 ]  - [   0.0001874000000000, -0.0003822800000000,  0.0002736000000000 ]  - [  -0.0000694300000000, -0.0006963200000000, -0.0000547000000000 ]  - [   0.0001883400000000,  0.0001803300000000,  0.0002707500000000 ]  - [  -0.0001832800000000, -0.0003972700000000, -0.0002700200000000 ]  - [   0.0000279800000000, -0.0005767400000000, -0.0002992900000000 ]  - [  -0.0001377300000000, -0.0004014300000000, -0.0001262300000000 ]- atom:   46  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0016122500000000,  0.0038411300000000,  0.0007725400000000 ]  - [  -0.0003123200000000, -0.0002379500000000,  0.0001422100000000 ]  - [   0.0000286900000000, -0.0001635900000000,  0.0002856700000000 ]  - [  -0.0000199000000000,  0.0002830000000000,  0.0005561400000000 ]  - [   0.0002316900000000,  0.0000600700000000,  0.0001633500000000 ]  - [  -0.0002581500000000, -0.0000915300000000,  0.0001574000000000 ]  - [   0.0002342500000000, -0.0001518400000000,  0.0001445800000000 ]  - [  -0.0002488600000000,  0.0000895000000000,  0.0001483800000000 ]  - [   0.0001417000000000, -0.0000051900000000, -0.0001365100000000 ]  - [  -0.0002163300000000, -0.0001377500000000,  0.0001613400000000 ]  - [  -0.0002241000000000,  0.0007717800000000, -0.0018360100000000 ]  - [  -0.0003578000000000,  0.0001534800000000,  0.0000467700000000 ]  - [   0.0002362400000000,  0.0001080500000000,  0.0001529600000000 ]  - [  -0.0002213800000000, -0.0003420000000000,  0.0002533300000000 ]  - [   0.0002407400000000, -0.0001489200000000,  0.0001529600000000 ]  - [  -0.0002313500000000,  0.0000926300000000,  0.0001627800000000 ]  - [   0.0254197500000000, -0.0009596600000000,  0.0757576600000000 ]  - [  -0.0001297200000000,  0.0001010100000000,  0.0001615500000000 ]  - [  -0.0008308700000000,  0.0002657300000000, -0.0004491300000000 ]  - [   0.0003232500000000, -0.0007697100000000,  0.0002475000000000 ]  - [  -0.0000359100000000, -0.0003232600000000,  0.0000982600000000 ]  - [  -0.0000179600000000,  0.0001544300000000,  0.0001056600000000 ]  - [  -0.0000381200000000,  0.0001689400000000,  0.0001234500000000 ]  - [   0.0000022500000000, -0.0003419100000000,  0.0002193100000000 ]  - [  -0.0027009600000000,  0.0007813800000000,  0.0016438700000000 ]  - [   0.0002229200000000,  0.0008358800000000, -0.0004435600000000 ]  - [  -0.0179963100000000, -0.0020206000000000,  0.0102650500000000 ]  - [  -0.0001394000000000, -0.0001965200000000,  0.0002494300000000 ]  - [  -0.0000455500000000, -0.0003169300000000,  0.0001223200000000 ]  - [   0.0000530800000000,  0.0002488400000000,  0.0001603900000000 ]  - [  -0.0000215000000000,  0.0002012200000000,  0.0001050900000000 ]  - [   0.0000872000000000, -0.0005270300000000, -0.0000253200000000 ]  - [  -0.0028983800000000,  0.0006765800000000, -0.0012832500000000 ]  - [   0.0004177100000000,  0.0012506300000000,  0.0019940800000000 ]  - [  -0.0000300300000000, -0.0000805400000000, -0.0000363800000000 ]  - [   0.0001586400000000, -0.0000316600000000, -0.0002472600000000 ]  - [  -0.0002690100000000, -0.0008755300000000,  0.0016873600000000 ]  - [  -0.0002496800000000, -0.0002091300000000, -0.0001105200000000 ]  - [   0.0000171200000000, -0.0000919900000000, -0.0001191400000000 ]  - [  -0.0000382100000000, -0.0000884600000000, -0.0000523600000000 ]  - [  -0.0013697500000000, -0.0005891900000000,  0.0006111200000000 ]  - [   0.0036150300000000,  0.0028808600000000,  0.0061087800000000 ]  - [   0.0000648700000000,  0.0003273400000000, -0.0000501200000000 ]  - [  -0.0003318000000000,  0.0000303200000000,  0.0002710200000000 ]  - [   0.0004277300000000,  0.0007135400000000,  0.0009237600000000 ]  - [  -0.0142084200000000, -0.0044740700000000, -0.1093996100000000 ]  - [   0.0007322100000000,  0.0001332700000000,  0.0001617000000000 ]  - [   0.0016917900000000, -0.0018798100000000,  0.0104212800000000 ]  - [   0.0002382000000000,  0.0000434100000000,  0.0001711400000000 ]  - [   0.0023816700000000,  0.0001860200000000,  0.0015462000000000 ]  - [   0.0003502600000000, -0.0000973700000000, -0.0003616400000000 ]  - [   0.0001848500000000,  0.0002186600000000, -0.0002551200000000 ]  - [  -0.0000014900000000,  0.0002889300000000, -0.0000601800000000 ]  - [  -0.0003441300000000, -0.0000540400000000,  0.0001459600000000 ]  - [   0.0000568200000000,  0.0003173200000000, -0.0000454300000000 ]  - [  -0.0003420900000000,  0.0001448200000000,  0.0001340600000000 ]  - [   0.0000062700000000, -0.0002247400000000, -0.0000730500000000 ]  - [  -0.0001911000000000,  0.0001233500000000, -0.0003016100000000 ]  - [   0.0003797300000000,  0.0001588900000000,  0.0001251300000000 ]  - [  -0.0000222000000000, -0.0002091700000000, -0.0000214300000000 ]  - [   0.0003260400000000, -0.0002704000000000, -0.0000694100000000 ]  - [  -0.0001886300000000, -0.0000402000000000, -0.0003199300000000 ]  - [   0.0002231800000000,  0.0000014100000000, -0.0002979800000000 ]  - [   0.0002145600000000,  0.0001414000000000, -0.0002612700000000 ]  - [  -0.0033642400000000,  0.0019136000000000,  0.0001861200000000 ]  - [  -0.0001532800000000, -0.0003281600000000, -0.0002584800000000 ]  - [  -0.0001020600000000,  0.0000715300000000,  0.0000315200000000 ]  - [  -0.0013252900000000, -0.0010972000000000, -0.0003425000000000 ]  - [   0.0001120900000000, -0.0002077500000000, -0.0004037100000000 ]  - [   0.0014352500000000, -0.0000665900000000,  0.0004758800000000 ]  - [   0.0007806700000000, -0.0006660700000000, -0.0000879000000000 ]  - [   0.0005055200000000, -0.0000042400000000, -0.0003146900000000 ]  - [   0.0003892400000000, -0.0000368600000000,  0.0001163500000000 ]  - [   0.0090169400000000,  0.0000709500000000,  0.0015591800000000 ]  - [  -0.0000328000000000,  0.0000134100000000, -0.0002232800000000 ]  - [   0.0003332900000000, -0.0001064700000000, -0.0002538800000000 ]  - [  -0.0000112700000000,  0.0002900000000000, -0.0000476500000000 ]  - [  -0.0003477900000000, -0.0000447400000000,  0.0001512600000000 ]  - [  -0.0000945600000000,  0.0002672700000000, -0.0002985900000000 ]  - [  -0.0003876200000000,  0.0001379700000000,  0.0001501400000000 ]  - [  -0.0000409200000000, -0.0001286400000000, -0.0000293800000000 ]  - [  -0.0001679500000000,  0.0001205100000000, -0.0003099200000000 ]  - [   0.0003427600000000,  0.0001009600000000,  0.0001308000000000 ]  - [   0.0000319300000000, -0.0001854200000000, -0.0000599800000000 ]  - [   0.0004254800000000,  0.0001194000000000,  0.0001655900000000 ]  - [  -0.0001856900000000, -0.0000575600000000, -0.0003135600000000 ]  - [   0.0001896500000000, -0.0000714000000000, -0.0003678000000000 ]  - [   0.0000858800000000,  0.0000523900000000, -0.0002608500000000 ]- atom:   46  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0021152800000000, -0.0036615500000000, -0.0004619600000000 ]  - [  -0.0001478200000000,  0.0000120700000000,  0.0001521400000000 ]  - [   0.0004290700000000, -0.0000548000000000,  0.0000073500000000 ]  - [  -0.0004352300000000, -0.0000576100000000, -0.0002599900000000 ]  - [   0.0002286400000000,  0.0001615000000000,  0.0001312400000000 ]  - [  -0.0002048800000000, -0.0001323800000000,  0.0001372100000000 ]  - [   0.0002314800000000, -0.0000768100000000,  0.0001498100000000 ]  - [  -0.0002193300000000,  0.0001388200000000,  0.0001452300000000 ]  - [   0.0003166900000000,  0.0002272500000000,  0.0004307900000000 ]  - [  -0.0002400400000000, -0.0000819200000000,  0.0001323400000000 ]  - [   0.0007103300000000, -0.0010027300000000,  0.0021454900000000 ]  - [  -0.0001060800000000,  0.0000712600000000,  0.0002470500000000 ]  - [   0.0002278800000000,  0.0001179300000000,  0.0001417700000000 ]  - [  -0.0002380100000000,  0.0001206900000000,  0.0000384100000000 ]  - [   0.0002292100000000, -0.0000862600000000,  0.0001427800000000 ]  - [  -0.0002402000000000,  0.0001403000000000,  0.0001314800000000 ]  - [  -0.0239244200000000,  0.0005148500000000, -0.0724091100000000 ]  - [   0.0002058700000000,  0.0003991800000000,  0.0000800400000000 ]  - [   0.0007483500000000,  0.0002419500000000,  0.0007084600000000 ]  - [  -0.0002427600000000,  0.0002603100000000, -0.0000099800000000 ]  - [  -0.0000399700000000, -0.0001806500000000,  0.0001377000000000 ]  - [   0.0000918800000000,  0.0003475300000000,  0.0001302300000000 ]  - [  -0.0000405200000000,  0.0003319300000000,  0.0001169400000000 ]  - [   0.0000804300000000, -0.0001588000000000,  0.0000190700000000 ]  - [   0.0026177600000000, -0.0012841900000000, -0.0014061200000000 ]  - [  -0.0001431500000000, -0.0003281500000000,  0.0006802400000000 ]  - [   0.0180773000000000,  0.0025500500000000, -0.0101838900000000 ]  - [   0.0002108400000000, -0.0003068200000000, -0.0000129000000000 ]  - [  -0.0000313700000000, -0.0001861000000000,  0.0001149200000000 ]  - [   0.0000247100000000,  0.0002526100000000,  0.0000775300000000 ]  - [  -0.0000541800000000,  0.0003010200000000,  0.0001321400000000 ]  - [  -0.0000100000000000,  0.0000225600000000,  0.0002646000000000 ]  - [   0.0028781500000000, -0.0006679000000000,  0.0011418500000000 ]  - [  -0.0003945900000000, -0.0012402400000000, -0.0021214600000000 ]  - [   0.0000296800000000,  0.0000798600000000, -0.0001003100000000 ]  - [  -0.0001565200000000,  0.0000323600000000,  0.0001079400000000 ]  - [   0.0002609000000000,  0.0008849800000000, -0.0018255200000000 ]  - [   0.0002478100000000,  0.0002074700000000, -0.0000281700000000 ]  - [  -0.0000161100000000,  0.0000906700000000, -0.0000185400000000 ]  - [   0.0000358700000000,  0.0000867300000000, -0.0000842200000000 ]  - [   0.0013915000000000,  0.0010527700000000, -0.0007254600000000 ]  - [  -0.0042739600000000, -0.0029866400000000, -0.0057632800000000 ]  - [  -0.0000772600000000,  0.0001459000000000, -0.0000557500000000 ]  - [  -0.0003763600000000,  0.0001479100000000,  0.0000041700000000 ]  - [  -0.0004423400000000, -0.0011674000000000, -0.0010193600000000 ]  - [   0.0120428400000000,  0.0045656100000000,  0.1056772000000000 ]  - [  -0.0000205300000000,  0.0000439500000000,  0.0001152500000000 ]  - [  -0.0016919700000000,  0.0013271900000000, -0.0104509600000000 ]  - [   0.0004679500000000, -0.0002221200000000,  0.0001022700000000 ]  - [  -0.0027391300000000, -0.0003483800000000, -0.0022015800000000 ]  - [   0.0000219700000000, -0.0000631000000000, -0.0002770400000000 ]  - [   0.0001668800000000, -0.0000515800000000, -0.0003727500000000 ]  - [   0.0000132600000000,  0.0001850700000000, -0.0000427600000000 ]  - [  -0.0003650500000000, -0.0001295400000000,  0.0001272400000000 ]  - [  -0.0000723100000000,  0.0001509400000000, -0.0000631000000000 ]  - [  -0.0003659800000000,  0.0000298000000000,  0.0001442800000000 ]  - [  -0.0000201200000000, -0.0002457000000000, -0.0000312000000000 ]  - [  -0.0001658000000000,  0.0000402900000000, -0.0003234600000000 ]  - [   0.0003295300000000,  0.0000225300000000,  0.0001483900000000 ]  - [   0.0000378700000000, -0.0002571900000000, -0.0000868500000000 ]  - [   0.0003838200000000,  0.0000886400000000,  0.0003295200000000 ]  - [  -0.0001828300000000, -0.0001216200000000, -0.0003205800000000 ]  - [   0.0001322500000000, -0.0001657700000000, -0.0003310100000000 ]  - [   0.0001520500000000,  0.0000193700000000, -0.0003765000000000 ]  - [   0.0033637100000000, -0.0014346400000000, -0.0002932300000000 ]  - [  -0.0005540900000000,  0.0001466800000000,  0.0005319500000000 ]  - [   0.0000856500000000,  0.0003949800000000, -0.0001360100000000 ]  - [   0.0006228200000000,  0.0012823500000000,  0.0005893500000000 ]  - [  -0.0001283900000000, -0.0002601200000000,  0.0002952100000000 ]  - [  -0.0017913600000000,  0.0002317000000000, -0.0011154600000000 ]  - [  -0.0000701500000000,  0.0008307600000000,  0.0003696400000000 ]  - [  -0.0004903500000000, -0.0004633400000000,  0.0002098900000000 ]  - [   0.0003205200000000, -0.0001450900000000,  0.0001559600000000 ]  - [  -0.0093995900000000, -0.0002304800000000, -0.0021805600000000 ]  - [   0.0003968900000000, -0.0001743800000000, -0.0004120800000000 ]  - [   0.0000212800000000,  0.0002688800000000, -0.0003729200000000 ]  - [   0.0000269900000000,  0.0001784100000000, -0.0000595400000000 ]  - [  -0.0003610900000000, -0.0001348700000000,  0.0001233800000000 ]  - [   0.0000739900000000,  0.0001986300000000,  0.0001848300000000 ]  - [  -0.0003200300000000,  0.0000432500000000,  0.0001254700000000 ]  - [   0.0000263800000000, -0.0003414200000000, -0.0000747500000000 ]  - [  -0.0001813500000000,  0.0000443600000000, -0.0003213500000000 ]  - [   0.0003650900000000,  0.0000780600000000,  0.0001441900000000 ]  - [  -0.0000159300000000, -0.0002833100000000, -0.0000454200000000 ]  - [   0.0002840800000000, -0.0002940700000000,  0.0001104600000000 ]  - [  -0.0001785400000000, -0.0001053700000000, -0.0003191600000000 ]  - [   0.0001642300000000, -0.0000910700000000, -0.0002632200000000 ]  - [   0.0002799900000000,  0.0001121900000000, -0.0003759100000000 ]