# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/b4f4a145-945d-4a2b-a82e-2357cc8ea3e0/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 BeH8SO8 / I-4c2 (120) / materials id 23996](https://mdr.nims.go.jp/datasets/ce462e24-8495-446d-b7f6-688e42d7b307)

## 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: "I-4c2"  number: 120  Hall_symbol: "I -4 -2c"primitive_matrix:- [ -0.500000000000000,  0.500000000000000,  0.500000000000000 ]- [  0.500000000000000, -0.500000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.500000000000000, -0.500000000000000 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [    -3.941002275000000,     3.941002275000000,     5.509694430000000 ] # a  - [     3.941002275000000,    -3.941002275000000,     5.509694430000000 ] # b  - [     3.941002275000000,     3.941002275000000,    -5.509694430000000 ] # c  points:  - symbol: H  # 1    coordinates: [  0.354216410000000,  0.761891100000000,  0.845413110000000 ]    mass: 1.007940  - symbol: H  # 2    coordinates: [  0.669039360000000,  0.899040440000000,  0.303965520000000 ]    mass: 1.007940  - symbol: H  # 3    coordinates: [  0.916477990000000,  0.508803300000000,  0.154586890000000 ]    mass: 1.007940  - symbol: H  # 4    coordinates: [  0.238108900000000,  0.083522010000000,  0.592325310000000 ]    mass: 1.007940  - symbol: H  # 5    coordinates: [  0.491196700000000,  0.645783590000000,  0.407674690000000 ]    mass: 1.007940  - symbol: H  # 6    coordinates: [  0.416477990000000,  0.261891100000000,  0.407674690000000 ]    mass: 1.007940  - symbol: H  # 7    coordinates: [  0.738108900000000,  0.145783590000000,  0.154586890000000 ]    mass: 1.007940  - symbol: H  # 8    coordinates: [  0.991196700000000,  0.583522010000000,  0.845413110000000 ]    mass: 1.007940  - symbol: H  # 9    coordinates: [  0.854216410000000,  0.008803300000000,  0.592325310000000 ]    mass: 1.007940  - symbol: H  # 10    coordinates: [  0.169039360000000,  0.865073840000000,  0.769998920000000 ]    mass: 1.007940  - symbol: H  # 11    coordinates: [  0.095074920000000,  0.399040440000000,  0.230001080000000 ]    mass: 1.007940  - symbol: H  # 12    coordinates: [  0.134926160000000,  0.904925080000000,  0.303965520000000 ]    mass: 1.007940  - symbol: H  # 13    coordinates: [  0.600959560000000,  0.830960640000000,  0.696034480000000 ]    mass: 1.007940  - symbol: H  # 14    coordinates: [  0.595074920000000,  0.365073840000000,  0.696034480000000 ]    mass: 1.007940  - symbol: H  # 15    coordinates: [  0.634926160000000,  0.330960640000000,  0.230001080000000 ]    mass: 1.007940  - symbol: H  # 16    coordinates: [  0.100959560000000,  0.404925080000000,  0.769998920000000 ]    mass: 1.007940  - symbol: Be # 17    coordinates: [  0.750000000000000,  0.250000000000000,  0.500000000000000 ]    mass: 9.012182  - symbol: Be # 18    coordinates: [  0.250000000000000,  0.750000000000000,  0.500000000000000 ]    mass: 9.012182  - symbol: O  # 19    coordinates: [  0.294779730000000,  0.336647150000000,  0.783711900000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.277571400000000,  0.813544640000000,  0.744382980000000 ]    mass: 15.999400  - symbol: O  # 21    coordinates: [  0.466811580000000,  0.722428600000000,  0.535973240000000 ]    mass: 15.999400  - symbol: O  # 22    coordinates: [  0.569161660000000,  0.313544640000000,  0.535973240000000 ]    mass: 15.999400  - symbol: O  # 23    coordinates: [  0.686455360000000,  0.222428600000000,  0.255617020000000 ]    mass: 15.999400  - symbol: O  # 24    coordinates: [  0.966811580000000,  0.430838340000000,  0.744382980000000 ]    mass: 15.999400  - symbol: O  # 25    coordinates: [  0.777571400000000,  0.033188420000000,  0.464026760000000 ]    mass: 15.999400  - symbol: O  # 26    coordinates: [  0.488932170000000,  0.705220270000000,  0.041867420000000 ]    mass: 15.999400  - symbol: O  # 27    coordinates: [  0.663352850000000,  0.447064750000000,  0.958132580000000 ]    mass: 15.999400  - symbol: O  # 28    coordinates: [  0.069161660000000,  0.533188420000000,  0.255617020000000 ]    mass: 15.999400  - symbol: O  # 29    coordinates: [  0.552935250000000,  0.511067830000000,  0.216288100000000 ]    mass: 15.999400  - symbol: O  # 30    coordinates: [  0.163352850000000,  0.205220270000000,  0.216288100000000 ]    mass: 15.999400  - symbol: O  # 31    coordinates: [  0.794779730000000,  0.011067830000000,  0.958132580000000 ]    mass: 15.999400  - symbol: O  # 32    coordinates: [  0.052935250000000,  0.836647150000000,  0.041867420000000 ]    mass: 15.999400  - symbol: O  # 33    coordinates: [  0.988932170000000,  0.947064750000000,  0.783711900000000 ]    mass: 15.999400  - symbol: O  # 34    coordinates: [  0.186455360000000,  0.930838340000000,  0.464026760000000 ]    mass: 15.999400  - symbol: S  # 35    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000  - symbol: S  # 36    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 32.065000  reciprocal_lattice: # without 2pi  - [     0.000000000000000,     0.126871279210312,     0.090749134339924 ] # a*  - [     0.126871279210312,     0.000000000000000,     0.090749134339924 ] # b*  - [     0.126871279210312,     0.126871279210312,     0.000000000000000 ] # c*unit_cell:  lattice:  - [     7.882004550000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     7.882004550000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.019388859999999 ] # c  points:  - symbol: H  # 1    coordinates: [  0.126543900000000,  0.718869210000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 2    coordinates: [  0.766983300000000,  0.536982220000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 2  - symbol: H  # 3    coordinates: [  0.373456100000000,  0.781130790000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 4    coordinates: [  0.718869210000000,  0.873456100000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 5    coordinates: [  0.781130790000000,  0.626543900000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 6    coordinates: [  0.626543900000000,  0.781130790000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 7    coordinates: [  0.281130790000000,  0.873456100000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.718869210000000,  0.126543900000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 9    coordinates: [  0.373456100000000,  0.218869210000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 10    coordinates: [  0.233016700000000,  0.536982220000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 11    coordinates: [  0.766983300000000,  0.463017780000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 12    coordinates: [  0.036982220000000,  0.266983300000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 13    coordinates: [  0.963017780000000,  0.733016700000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.733016700000000,  0.963017780000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 14  - symbol: H  # 15    coordinates: [  0.463017780000000,  0.766983300000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 16    coordinates: [  0.036982220000000,  0.733016700000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 17    coordinates: [  0.626543900000000,  0.218869210000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 18    coordinates: [  0.266983300000000,  0.036982220000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 2  - symbol: H  # 19    coordinates: [  0.873456100000000,  0.281130790000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 20    coordinates: [  0.218869210000000,  0.373456100000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 21    coordinates: [  0.281130790000000,  0.126543900000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 22    coordinates: [  0.126543900000000,  0.281130790000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 23    coordinates: [  0.781130790000000,  0.373456100000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 24    coordinates: [  0.218869210000000,  0.626543900000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 25    coordinates: [  0.873456100000000,  0.718869210000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 26    coordinates: [  0.733016700000000,  0.036982220000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 27    coordinates: [  0.266983300000000,  0.963017780000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 28    coordinates: [  0.536982220000000,  0.766983300000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 29    coordinates: [  0.463017780000000,  0.233016700000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 30    coordinates: [  0.233016700000000,  0.463017780000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 14  - symbol: H  # 31    coordinates: [  0.963017780000000,  0.266983300000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 32    coordinates: [  0.536982220000000,  0.233016700000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 16  - symbol: Be # 33    coordinates: [  0.500000000000000,  0.000000000000000,  0.750000000000000 ]    mass: 9.012182    reduced_to: 33  - symbol: Be # 34    coordinates: [  0.000000000000000,  0.500000000000000,  0.750000000000000 ]    mass: 9.012182    reduced_to: 34  - symbol: Be # 35    coordinates: [  0.000000000000000,  0.500000000000000,  0.250000000000000 ]    mass: 9.012182    reduced_to: 33  - symbol: Be # 36    coordinates: [  0.500000000000000,  0.000000000000000,  0.250000000000000 ]    mass: 9.012182    reduced_to: 34  - symbol: O  # 37    coordinates: [  0.912789660000000,  0.870922240000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.140178110000000,  0.604204870000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 39    coordinates: [  0.895795130000000,  0.640178110000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.640178110000000,  0.895795130000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 41    coordinates: [  0.395795130000000,  0.859821890000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.604204870000000,  0.140178110000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 43    coordinates: [  0.359821890000000,  0.104204870000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.629077760000000,  0.412789660000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 45    coordinates: [  0.870922240000000,  0.087210340000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.859821890000000,  0.395795130000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 47    coordinates: [  0.587210340000000,  0.629077760000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.629077760000000,  0.587210340000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 49    coordinates: [  0.587210340000000,  0.370922240000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 50    coordinates: [  0.912789660000000,  0.129077760000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 51    coordinates: [  0.870922240000000,  0.912789660000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 52    coordinates: [  0.104204870000000,  0.359821890000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 53    coordinates: [  0.412789660000000,  0.370922240000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 54    coordinates: [  0.640178110000000,  0.104204870000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 55    coordinates: [  0.395795130000000,  0.140178110000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 56    coordinates: [  0.140178110000000,  0.395795130000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 57    coordinates: [  0.895795130000000,  0.359821890000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 58    coordinates: [  0.104204870000000,  0.640178110000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 59    coordinates: [  0.859821890000000,  0.604204870000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 60    coordinates: [  0.129077760000000,  0.912789660000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 61    coordinates: [  0.370922240000000,  0.587210340000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 62    coordinates: [  0.359821890000000,  0.895795130000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 63    coordinates: [  0.087210340000000,  0.129077760000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 64    coordinates: [  0.129077760000000,  0.087210340000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 65    coordinates: [  0.087210340000000,  0.870922240000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 66    coordinates: [  0.412789660000000,  0.629077760000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 67    coordinates: [  0.370922240000000,  0.412789660000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 68    coordinates: [  0.604204870000000,  0.859821890000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 52  - symbol: S  # 69    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 32.065000    reduced_to: 69  - symbol: S  # 70    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 70  - symbol: S  # 71    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 69  - symbol: S  # 72    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 32.065000    reduced_to: 70supercell:  lattice:  - [     7.882004550000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     7.882004550000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    11.019388859999999 ] # c  points:  - symbol: H  # 1    coordinates: [  0.126543900000000,  0.718869210000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 2    coordinates: [  0.766983300000000,  0.536982220000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 2  - symbol: H  # 3    coordinates: [  0.373456100000000,  0.781130790000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 4    coordinates: [  0.718869210000000,  0.873456100000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 5    coordinates: [  0.781130790000000,  0.626543900000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 6    coordinates: [  0.626543900000000,  0.781130790000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 7    coordinates: [  0.281130790000000,  0.873456100000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.718869210000000,  0.126543900000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 9    coordinates: [  0.373456100000000,  0.218869210000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 10    coordinates: [  0.233016700000000,  0.536982220000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 11    coordinates: [  0.766983300000000,  0.463017780000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 12    coordinates: [  0.036982220000000,  0.266983300000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 13    coordinates: [  0.963017780000000,  0.733016700000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.733016700000000,  0.963017780000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 14  - symbol: H  # 15    coordinates: [  0.463017780000000,  0.766983300000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 16    coordinates: [  0.036982220000000,  0.733016700000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 17    coordinates: [  0.626543900000000,  0.218869210000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 18    coordinates: [  0.266983300000000,  0.036982220000000,  0.632057140000000 ]    mass: 1.007940    reduced_to: 2  - symbol: H  # 19    coordinates: [  0.873456100000000,  0.281130790000000,  0.635347200000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 20    coordinates: [  0.218869210000000,  0.373456100000000,  0.864652800000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 21    coordinates: [  0.281130790000000,  0.126543900000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 22    coordinates: [  0.126543900000000,  0.281130790000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 23    coordinates: [  0.781130790000000,  0.373456100000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 24    coordinates: [  0.218869210000000,  0.626543900000000,  0.364652800000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 25    coordinates: [  0.873456100000000,  0.718869210000000,  0.135347200000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 26    coordinates: [  0.733016700000000,  0.036982220000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 27    coordinates: [  0.266983300000000,  0.963017780000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 28    coordinates: [  0.536982220000000,  0.766983300000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 29    coordinates: [  0.463017780000000,  0.233016700000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 30    coordinates: [  0.233016700000000,  0.463017780000000,  0.132057140000000 ]    mass: 1.007940    reduced_to: 14  - symbol: H  # 31    coordinates: [  0.963017780000000,  0.266983300000000,  0.367942860000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 32    coordinates: [  0.536982220000000,  0.233016700000000,  0.867942860000000 ]    mass: 1.007940    reduced_to: 16  - symbol: Be # 33    coordinates: [  0.500000000000000,  0.000000000000000,  0.750000000000000 ]    mass: 9.012182    reduced_to: 33  - symbol: Be # 34    coordinates: [  0.000000000000000,  0.500000000000000,  0.750000000000000 ]    mass: 9.012182    reduced_to: 34  - symbol: Be # 35    coordinates: [  0.000000000000000,  0.500000000000000,  0.250000000000000 ]    mass: 9.012182    reduced_to: 33  - symbol: Be # 36    coordinates: [  0.500000000000000,  0.000000000000000,  0.250000000000000 ]    mass: 9.012182    reduced_to: 34  - symbol: O  # 37    coordinates: [  0.912789660000000,  0.870922240000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.140178110000000,  0.604204870000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 39    coordinates: [  0.895795130000000,  0.640178110000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.640178110000000,  0.895795130000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 41    coordinates: [  0.395795130000000,  0.859821890000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.604204870000000,  0.140178110000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 43    coordinates: [  0.359821890000000,  0.104204870000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.629077760000000,  0.412789660000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 45    coordinates: [  0.870922240000000,  0.087210340000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.859821890000000,  0.395795130000000,  0.673366530000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 47    coordinates: [  0.587210340000000,  0.629077760000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.629077760000000,  0.587210340000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 49    coordinates: [  0.587210340000000,  0.370922240000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 50    coordinates: [  0.912789660000000,  0.129077760000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 51    coordinates: [  0.870922240000000,  0.912789660000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 52    coordinates: [  0.104204870000000,  0.359821890000000,  0.826633470000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 53    coordinates: [  0.412789660000000,  0.370922240000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 54    coordinates: [  0.640178110000000,  0.104204870000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 55    coordinates: [  0.395795130000000,  0.140178110000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 56    coordinates: [  0.140178110000000,  0.395795130000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 57    coordinates: [  0.895795130000000,  0.359821890000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 58    coordinates: [  0.104204870000000,  0.640178110000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 59    coordinates: [  0.859821890000000,  0.604204870000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 60    coordinates: [  0.129077760000000,  0.912789660000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 61    coordinates: [  0.370922240000000,  0.587210340000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 62    coordinates: [  0.359821890000000,  0.895795130000000,  0.173366530000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 63    coordinates: [  0.087210340000000,  0.129077760000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 64    coordinates: [  0.129077760000000,  0.087210340000000,  0.076142510000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 65    coordinates: [  0.087210340000000,  0.870922240000000,  0.923857490000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 66    coordinates: [  0.412789660000000,  0.629077760000000,  0.423857490000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 67    coordinates: [  0.370922240000000,  0.412789660000000,  0.576142510000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 68    coordinates: [  0.604204870000000,  0.859821890000000,  0.326633470000000 ]    mass: 15.999400    reduced_to: 52  - symbol: S  # 69    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 32.065000    reduced_to: 69  - symbol: S  # 70    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 70  - symbol: S  # 71    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 69  - symbol: S  # 72    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 32.065000    reduced_to: 70displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0484931500000000,  0.0390767700000000,  0.0000224300000000 ]  - [  -0.0000828200000000, -0.0002112000000000, -0.0000467600000000 ]  - [  -0.0000939800000000, -0.0000109400000000, -0.0000741700000000 ]  - [   0.0006349400000000, -0.0000519800000000,  0.0004059600000000 ]  - [   0.0007566500000000,  0.0000055800000000,  0.0000792400000000 ]  - [   0.0009343600000000,  0.0000102200000000, -0.0000819200000000 ]  - [  -0.0006277200000000,  0.0003450200000000,  0.0010025500000000 ]  - [   0.0001560800000000,  0.0000296200000000,  0.0001221800000000 ]  - [  -0.0000666100000000,  0.0000403000000000, -0.0001844000000000 ]  - [  -0.0004335100000000, -0.0198109000000000,  0.0135726300000000 ]  - [   0.0003060500000000,  0.0007954600000000, -0.0001652100000000 ]  - [  -0.0007631000000000, -0.0005354000000000,  0.0000873300000000 ]  - [  -0.0002480000000000, -0.0000135700000000, -0.0007628000000000 ]  - [   0.0008627900000000,  0.0001397600000000, -0.0001833700000000 ]  - [   0.0009002100000000, -0.0007677300000000,  0.0005524000000000 ]  - [  -0.0007546300000000,  0.0004759200000000,  0.0007095600000000 ]  - [   0.0000975600000000, -0.0000083400000000, -0.0000857500000000 ]  - [  -0.0016438900000000,  0.0000792900000000, -0.0012774200000000 ]  - [  -0.0001478600000000, -0.0004221300000000, -0.0002467200000000 ]  - [   0.0003443100000000, -0.0000037800000000,  0.0001783200000000 ]  - [  -0.0003755300000000,  0.0000522000000000,  0.0002816900000000 ]  - [   0.0000678200000000, -0.0000282300000000, -0.0000728200000000 ]  - [   0.0001579800000000, -0.0000387800000000,  0.0001013500000000 ]  - [  -0.0005133500000000, -0.0000027200000000, -0.0002853700000000 ]  - [  -0.0000718900000000, -0.0000086600000000, -0.0000999200000000 ]  - [   0.0002337800000000, -0.0002748000000000, -0.0000511200000000 ]  - [  -0.0002585900000000,  0.0002904900000000, -0.0000437300000000 ]  - [   0.0000378200000000,  0.0001175100000000, -0.0001513600000000 ]  - [   0.0002632200000000,  0.0001398400000000,  0.0000562300000000 ]  - [   0.0001145200000000,  0.0002321700000000, -0.0000276100000000 ]  - [   0.0004680700000000, -0.0004653300000000,  0.0002463700000000 ]  - [  -0.0002550400000000,  0.0002278200000000,  0.0000945700000000 ]  - [   0.0011254500000000,  0.0009157500000000, -0.0003379100000000 ]  - [  -0.0054267000000000,  0.0067090600000000, -0.0007230100000000 ]  - [  -0.0000696500000000,  0.0000402700000000,  0.0002960600000000 ]  - [   0.0000575700000000,  0.0000374800000000,  0.0000872000000000 ]  - [  -0.0000964200000000,  0.0010285800000000, -0.0004160300000000 ]  - [   0.0421581300000000, -0.0283727600000000, -0.0109010700000000 ]  - [  -0.0002222800000000, -0.0007769900000000,  0.0010795000000000 ]  - [  -0.0011908200000000,  0.0000878200000000,  0.0004582300000000 ]  - [  -0.0008282500000000, -0.0005369800000000, -0.0014118900000000 ]  - [  -0.0002795100000000, -0.0001860400000000, -0.0001962000000000 ]  - [   0.0007346900000000, -0.0000290300000000,  0.0009602200000000 ]  - [  -0.0003633700000000, -0.0000360200000000, -0.0003621600000000 ]  - [   0.0006528900000000,  0.0003936700000000,  0.0000339100000000 ]  - [   0.0014561700000000,  0.0001133800000000,  0.0005146600000000 ]  - [  -0.0003822900000000,  0.0000703400000000,  0.0000243400000000 ]  - [  -0.0010037400000000,  0.0001029400000000, -0.0003069200000000 ]  - [  -0.0000490500000000,  0.0005892700000000,  0.0000145800000000 ]  - [  -0.0000002900000000,  0.0000453700000000,  0.0000776300000000 ]  - [   0.0002972300000000, -0.0000090500000000, -0.0003524200000000 ]  - [   0.0003405000000000,  0.0009947900000000, -0.0014212600000000 ]  - [  -0.0002738300000000,  0.0001335000000000,  0.0000262100000000 ]  - [  -0.0000876400000000, -0.0000338500000000,  0.0001631500000000 ]  - [   0.0002162500000000, -0.0000322900000000, -0.0002971400000000 ]  - [   0.0000551000000000,  0.0000297100000000,  0.0001156300000000 ]  - [  -0.0001377900000000,  0.0001724100000000, -0.0004302300000000 ]  - [   0.0004703600000000, -0.0002152600000000, -0.0004822300000000 ]  - [  -0.0000288900000000, -0.0000493800000000,  0.0001447900000000 ]  - [   0.0060462300000000,  0.0063079800000000, -0.0017776200000000 ]  - [   0.0001946100000000,  0.0001207500000000, -0.0002651400000000 ]  - [   0.0000660600000000,  0.0000071600000000,  0.0001518800000000 ]  - [  -0.0000985900000000,  0.0008618600000000, -0.0004968500000000 ]  - [  -0.0001507900000000,  0.0001532500000000, -0.0002361500000000 ]  - [   0.0006194000000000,  0.0003329800000000,  0.0002184200000000 ]  - [  -0.0009364900000000,  0.0005799700000000,  0.0005026000000000 ]  - [   0.0015241300000000, -0.0001349500000000, -0.0016248200000000 ]  - [  -0.0005189200000000, -0.0001424700000000, -0.0002717700000000 ]  - [   0.0017179100000000, -0.0021224300000000,  0.0003816800000000 ]  - [   0.0001585300000000, -0.0000390300000000,  0.0003796000000000 ]  - [  -0.0000391500000000, -0.0002037200000000,  0.0001360400000000 ]  - [   0.0027867500000000, -0.0063115200000000,  0.0028721700000000 ]- atom:    1  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0496918500000000, -0.0414640100000000,  0.0009747700000000 ]  - [  -0.0003400000000000, -0.0003646100000000, -0.0001500800000000 ]  - [  -0.0000548800000000, -0.0000838100000000, -0.0002012300000000 ]  - [  -0.0005345900000000, -0.0000956500000000, -0.0001294900000000 ]  - [  -0.0008575300000000,  0.0001425600000000,  0.0001976700000000 ]  - [  -0.0007851700000000, -0.0001040000000000, -0.0001947000000000 ]  - [   0.0005203500000000, -0.0004936400000000, -0.0007264200000000 ]  - [  -0.0000575800000000,  0.0001187100000000,  0.0001561100000000 ]  - [  -0.0000853900000000,  0.0000528700000000, -0.0000881300000000 ]  - [   0.0007242400000000,  0.0188090700000000, -0.0139280800000000 ]  - [  -0.0007327600000000, -0.0002260300000000, -0.0000311700000000 ]  - [   0.0001983600000000,  0.0001172600000000,  0.0001120700000000 ]  - [   0.0008383400000000,  0.0004432200000000,  0.0009634900000000 ]  - [  -0.0004333000000000,  0.0004481800000000, -0.0000208200000000 ]  - [  -0.0003204700000000,  0.0003399100000000, -0.0003501400000000 ]  - [   0.0001840400000000, -0.0000547200000000, -0.0005070500000000 ]  - [   0.0000510000000000,  0.0001024900000000, -0.0001896100000000 ]  - [   0.0012020300000000, -0.0006491000000000,  0.0010816000000000 ]  - [   0.0000061600000000,  0.0003200900000000, -0.0000336400000000 ]  - [  -0.0002583100000000, -0.0001407500000000,  0.0000880700000000 ]  - [   0.0002736900000000,  0.0000959100000000, -0.0000032800000000 ]  - [   0.0000805900000000, -0.0000665100000000, -0.0002034100000000 ]  - [  -0.0002471400000000, -0.0001101800000000,  0.0001711600000000 ]  - [   0.0005950800000000,  0.0001519600000000,  0.0005631000000000 ]  - [  -0.0000758600000000,  0.0001038200000000, -0.0001755300000000 ]  - [   0.0001910900000000, -0.0003014000000000, -0.0001464300000000 ]  - [  -0.0001670000000000,  0.0002866700000000, -0.0001536800000000 ]  - [  -0.0006113500000000, -0.0005379600000000,  0.0003449400000000 ]  - [   0.0003099300000000,  0.0002802700000000,  0.0001385800000000 ]  - [   0.0003072800000000,  0.0003428100000000, -0.0001695000000000 ]  - [   0.0001157000000000,  0.0000340900000000, -0.0000457500000000 ]  - [  -0.0003234300000000,  0.0001981400000000,  0.0001045800000000 ]  - [  -0.0011258800000000, -0.0009010400000000,  0.0003445100000000 ]  - [   0.0055174100000000, -0.0067874000000000,  0.0008105300000000 ]  - [   0.0000730300000000, -0.0000384900000000, -0.0002934400000000 ]  - [  -0.0000587700000000, -0.0000362900000000, -0.0000893200000000 ]  - [  -0.0001399000000000, -0.0006448000000000,  0.0007603900000000 ]  - [  -0.0431925700000000,  0.0312210800000000,  0.0101899600000000 ]  - [   0.0003071500000000,  0.0006833300000000, -0.0015968900000000 ]  - [   0.0010910500000000, -0.0000075600000000,  0.0000409400000000 ]  - [   0.0009215200000000,  0.0006310700000000,  0.0008976100000000 ]  - [   0.0001872700000000,  0.0000841100000000, -0.0003043300000000 ]  - [  -0.0006261500000000, -0.0000653000000000, -0.0004606700000000 ]  - [  -0.0000294800000000, -0.0001737900000000,  0.0000106500000000 ]  - [  -0.0002835500000000, -0.0001814800000000, -0.0003773400000000 ]  - [  -0.0013518100000000,  0.0000034200000000, -0.0000201900000000 ]  - [   0.0006004700000000, -0.0004566100000000,  0.0003206900000000 ]  - [   0.0006154100000000,  0.0001199300000000, -0.0000359200000000 ]  - [   0.0002584400000000, -0.0001889000000000,  0.0003424700000000 ]  - [  -0.0002194600000000, -0.0004456900000000,  0.0002768000000000 ]  - [   0.0000950000000000, -0.0002043600000000,  0.0000021400000000 ]  - [  -0.0004571700000000, -0.0009347700000000,  0.0009562900000000 ]  - [   0.0000672500000000,  0.0002601500000000,  0.0003260100000000 ]  - [  -0.0000116300000000, -0.0000567800000000,  0.0003366900000000 ]  - [  -0.0001196900000000, -0.0000639900000000, -0.0001987400000000 ]  - [  -0.0001527600000000,  0.0000615200000000,  0.0003817000000000 ]  - [   0.0002206700000000, -0.0000695500000000, -0.0000701400000000 ]  - [  -0.0005589900000000,  0.0001169000000000, -0.0000234200000000 ]  - [   0.0001256100000000, -0.0000417000000000,  0.0003532400000000 ]  - [  -0.0065449800000000, -0.0065256800000000,  0.0014374000000000 ]  - [   0.0002024300000000,  0.0000930600000000, -0.0000868000000000 ]  - [   0.0000339700000000,  0.0000837300000000,  0.0003482300000000 ]  - [   0.0003000600000000, -0.0012243800000000,  0.0008092600000000 ]  - [  -0.0002417700000000,  0.0000591800000000, -0.0001132500000000 ]  - [  -0.0004077200000000,  0.0000570700000000,  0.0001339300000000 ]  - [   0.0007270000000000, -0.0009684900000000, -0.0001408300000000 ]  - [  -0.0011278800000000, -0.0000572600000000,  0.0012858400000000 ]  - [   0.0004240100000000,  0.0002384700000000, -0.0002255900000000 ]  - [  -0.0017145900000000,  0.0021021100000000, -0.0004027800000000 ]  - [  -0.0001671700000000,  0.0000290200000000, -0.0003768100000000 ]  - [   0.0000419500000000,  0.0002081000000000, -0.0001401200000000 ]  - [  -0.0026827300000000,  0.0063264400000000, -0.0028567000000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0386102600000000, -0.2821022400000000,  0.1110935600000000 ]  - [  -0.0005067800000000, -0.0004936000000000, -0.0004311800000000 ]  - [  -0.0000368400000000, -0.0005996400000000, -0.0004170100000000 ]  - [  -0.0022420200000000, -0.0004019100000000, -0.0008676100000000 ]  - [   0.0011603000000000,  0.0003778600000000, -0.0000426800000000 ]  - [   0.0000153500000000, -0.0014952400000000, -0.0003493800000000 ]  - [   0.0000185500000000, -0.0006576900000000,  0.0005070500000000 ]  - [   0.0002058700000000,  0.0001813100000000,  0.0002414600000000 ]  - [  -0.0000691200000000,  0.0029650700000000, -0.0009292700000000 ]  - [  -0.0069285500000000,  0.0153629200000000, -0.0017596400000000 ]  - [   0.0009128800000000,  0.0000763000000000,  0.0001532500000000 ]  - [   0.0012152000000000,  0.0012993800000000, -0.0002428400000000 ]  - [  -0.0001763900000000, -0.0017118300000000, -0.0006372100000000 ]  - [  -0.0019249200000000, -0.0010978700000000,  0.0011699500000000 ]  - [   0.0002767100000000, -0.0010676800000000, -0.0000642700000000 ]  - [   0.0009826300000000, -0.0026667900000000, -0.0009390800000000 ]  - [   0.0000176100000000,  0.0005493600000000, -0.0004285500000000 ]  - [   0.0061260500000000,  0.0044747000000000,  0.0035157800000000 ]  - [  -0.0004476400000000,  0.0041302400000000,  0.0016558900000000 ]  - [  -0.0011595000000000,  0.0007396600000000, -0.0010689200000000 ]  - [   0.0022440300000000,  0.0006650000000000, -0.0011525500000000 ]  - [   0.0000543300000000,  0.0000366700000000, -0.0005230700000000 ]  - [  -0.0009831600000000,  0.0001299900000000,  0.0007001500000000 ]  - [   0.0004192800000000, -0.0004833300000000,  0.0011271400000000 ]  - [  -0.0000170100000000,  0.0000003000000000, -0.0004397300000000 ]  - [   0.0003466000000000, -0.0004587000000000, -0.0004018300000000 ]  - [  -0.0003424200000000,  0.0004318400000000, -0.0004130200000000 ]  - [  -0.0009127700000000, -0.0014922700000000,  0.0006300900000000 ]  - [   0.0008786800000000,  0.0013767500000000,  0.0006595900000000 ]  - [   0.0005246500000000,  0.0005681000000000, -0.0004360000000000 ]  - [  -0.0020935000000000,  0.0031736600000000, -0.0012975200000000 ]  - [  -0.0005836800000000,  0.0008696200000000,  0.0003162600000000 ]  - [   0.0008155600000000, -0.0005210100000000,  0.0019249700000000 ]  - [   0.0105282100000000,  0.0085235000000000, -0.0078238700000000 ]  - [   0.0003354400000000,  0.0004595300000000, -0.0005556700000000 ]  - [   0.0001161700000000, -0.0000821300000000, -0.0010171200000000 ]  - [   0.0055874700000000,  0.0027794300000000,  0.0055986700000000 ]  - [  -0.0419919200000000,  0.2764136100000000, -0.1127642800000000 ]  - [  -0.0028113100000000,  0.0012386400000000,  0.0020764900000000 ]  - [   0.0009401700000000,  0.0016118000000000, -0.0006769400000000 ]  - [   0.0001667800000000,  0.0016407900000000, -0.0007918800000000 ]  - [  -0.0003204500000000, -0.0006358000000000, -0.0008445900000000 ]  - [  -0.0035535000000000, -0.0035791000000000, -0.0018843800000000 ]  - [   0.0003463400000000, -0.0003642500000000,  0.0006095300000000 ]  - [   0.0075691100000000, -0.0047290400000000, -0.0014415700000000 ]  - [  -0.0028872100000000, -0.0043091700000000, -0.0008361900000000 ]  - [  -0.0005581800000000, -0.0001549200000000,  0.0009186700000000 ]  - [   0.0001184900000000,  0.0011533900000000, -0.0009551900000000 ]  - [   0.0017795200000000, -0.0010308000000000, -0.0020158700000000 ]  - [  -0.0006290600000000, -0.0013319400000000,  0.0007607200000000 ]  - [   0.0000135900000000, -0.0002385900000000,  0.0005382600000000 ]  - [  -0.0011905700000000, -0.0047622200000000,  0.0028680500000000 ]  - [   0.0008874400000000,  0.0000929400000000,  0.0011272700000000 ]  - [  -0.0001803500000000, -0.0002704200000000,  0.0008076400000000 ]  - [  -0.0014796700000000, -0.0008176300000000,  0.0003822400000000 ]  - [  -0.0003097900000000, -0.0002032300000000,  0.0008620500000000 ]  - [   0.0017105600000000, -0.0022793900000000,  0.0004367600000000 ]  - [  -0.0009970800000000,  0.0015559200000000, -0.0005138300000000 ]  - [   0.0001815700000000, -0.0000239100000000,  0.0008272900000000 ]  - [   0.0141613900000000, -0.0147611800000000,  0.0148926700000000 ]  - [  -0.0001148800000000,  0.0003329300000000,  0.0006050500000000 ]  - [   0.0001752700000000,  0.0003624000000000,  0.0008407700000000 ]  - [   0.0029805100000000, -0.0093340300000000,  0.0090545300000000 ]  - [   0.0000424900000000,  0.0001573600000000,  0.0005532700000000 ]  - [   0.0004117900000000,  0.0010820500000000,  0.0003614400000000 ]  - [   0.0004403400000000,  0.0011382100000000, -0.0015273400000000 ]  - [   0.0056804500000000, -0.0032957600000000, -0.0037605700000000 ]  - [   0.0015679300000000,  0.0008604500000000,  0.0002797300000000 ]  - [  -0.0046352000000000, -0.0015878200000000,  0.0054662100000000 ]  - [  -0.0005253300000000, -0.0000958600000000, -0.0021608300000000 ]  - [  -0.0002524100000000,  0.0003011000000000, -0.0013188600000000 ]  - [  -0.0297043400000000,  0.0120241600000000, -0.0198321400000000 ]- atom:    1  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0420402300000000,  0.3029119500000000, -0.1237986000000000 ]  - [   0.0000742500000000, -0.0000888100000000,  0.0002237600000000 ]  - [  -0.0001101300000000,  0.0004920800000000,  0.0001321700000000 ]  - [   0.0022874500000000,  0.0002470100000000,  0.0011220600000000 ]  - [  -0.0012277100000000, -0.0002245100000000,  0.0003150800000000 ]  - [   0.0001298100000000,  0.0013772600000000,  0.0000737100000000 ]  - [  -0.0001153100000000,  0.0004895100000000, -0.0002393600000000 ]  - [  -0.0001062300000000, -0.0000319200000000,  0.0000384300000000 ]  - [  -0.0000818600000000, -0.0028174100000000,  0.0006425800000000 ]  - [   0.0072652600000000, -0.0161418600000000,  0.0019485200000000 ]  - [  -0.0013259000000000,  0.0004940900000000, -0.0003430100000000 ]  - [  -0.0017574000000000, -0.0016874700000000,  0.0004388600000000 ]  - [   0.0007537200000000,  0.0021038600000000,  0.0008024800000000 ]  - [   0.0022999800000000,  0.0016377000000000, -0.0013349700000000 ]  - [   0.0002922600000000,  0.0006353000000000,  0.0002529700000000 ]  - [  -0.0015343100000000,  0.0030405700000000,  0.0011142300000000 ]  - [   0.0001288900000000, -0.0004425400000000,  0.0001444500000000 ]  - [  -0.0064139500000000, -0.0049540000000000, -0.0036340600000000 ]  - [   0.0002946500000000, -0.0041472500000000, -0.0018969500000000 ]  - [   0.0012287000000000, -0.0008750700000000,  0.0013202700000000 ]  - [  -0.0022853600000000, -0.0005047300000000,  0.0013991300000000 ]  - [   0.0000930000000000, -0.0001351500000000,  0.0002349400000000 ]  - [   0.0008638900000000, -0.0002751400000000, -0.0004122300000000 ]  - [  -0.0003079700000000,  0.0006248000000000, -0.0008378400000000 ]  - [  -0.0001297000000000,  0.0000982600000000,  0.0001536700000000 ]  - [   0.0000828300000000, -0.0001237700000000,  0.0001947600000000 ]  - [  -0.0000868800000000,  0.0001496900000000,  0.0002050700000000 ]  - [   0.0003248900000000,  0.0010453300000000, -0.0004221600000000 ]  - [  -0.0002904100000000, -0.0009298300000000, -0.0004505900000000 ]  - [  -0.0000914100000000,  0.0000162400000000,  0.0002280900000000 ]  - [   0.0026148400000000, -0.0035239700000000,  0.0014618800000000 ]  - [   0.0000011200000000, -0.0004333100000000, -0.0001134700000000 ]  - [  -0.0008098000000000,  0.0004940900000000, -0.0018782500000000 ]  - [  -0.0102313600000000, -0.0084027700000000,  0.0076933800000000 ]  - [  -0.0003306000000000, -0.0004519000000000,  0.0005282800000000 ]  - [  -0.0001135700000000,  0.0000793600000000,  0.0009896900000000 ]  - [  -0.0056762300000000, -0.0023361800000000, -0.0051381100000000 ]  - [   0.0451929400000000, -0.2965120400000000,  0.1249963100000000 ]  - [   0.0028397100000000, -0.0013247600000000, -0.0025329100000000 ]  - [  -0.0010145900000000, -0.0014848200000000,  0.0011487100000000 ]  - [  -0.0000553900000000, -0.0015005800000000,  0.0002935800000000 ]  - [   0.0002244000000000,  0.0005286400000000,  0.0003333300000000 ]  - [   0.0035793900000000,  0.0034225400000000,  0.0023341100000000 ]  - [  -0.0007242000000000,  0.0001444600000000, -0.0009379700000000 ]  - [  -0.0070249600000000,  0.0048487800000000,  0.0010577800000000 ]  - [   0.0029278300000000,  0.0043326800000000,  0.0012987500000000 ]  - [   0.0007587400000000, -0.0002420300000000, -0.0005462800000000 ]  - [  -0.0005019100000000, -0.0009244400000000,  0.0005838400000000 ]  - [  -0.0015284700000000,  0.0013955300000000,  0.0023184600000000 ]  - [   0.0004003600000000,  0.0009191200000000, -0.0003943900000000 ]  - [   0.0003675300000000,  0.0000231400000000, -0.0008649900000000 ]  - [   0.0010667300000000,  0.0047640200000000, -0.0032945600000000 ]  - [  -0.0010810800000000,  0.0002943200000000, -0.0007561300000000 ]  - [   0.0000757200000000,  0.0001747700000000, -0.0002919800000000 ]  - [   0.0015371200000000,  0.0007042300000000, -0.0008635300000000 ]  - [   0.0002015600000000,  0.0002932400000000, -0.0003441500000000 ]  - [  -0.0015786400000000,  0.0023301300000000, -0.0009146000000000 ]  - [   0.0008840000000000, -0.0016280000000000,  0.0000233800000000 ]  - [  -0.0000756800000000, -0.0000701400000000, -0.0003093200000000 ]  - [  -0.0141183500000000,  0.0139998000000000, -0.0147071100000000 ]  - [   0.0004971600000000, -0.0001157700000000, -0.0009332400000000 ]  - [  -0.0000717300000000, -0.0002634900000000, -0.0003234400000000 ]  - [  -0.0026890900000000,  0.0087401500000000, -0.0085121100000000 ]  - [  -0.0004245600000000,  0.0000651700000000, -0.0008771900000000 ]  - [  -0.0002017100000000, -0.0006628600000000,  0.0000101400000000 ]  - [  -0.0006515000000000, -0.0015052700000000,  0.0018432800000000 ]  - [  -0.0051814600000000,  0.0030310000000000,  0.0033208000000000 ]  - [  -0.0016265200000000, -0.0007456800000000, -0.0007664600000000 ]  - [   0.0045607700000000,  0.0015581000000000, -0.0053550900000000 ]  - [   0.0005167200000000,  0.0001010800000000,  0.0021031400000000 ]  - [   0.0002593200000000, -0.0003122800000000,  0.0012660700000000 ]  - [   0.0289905800000000, -0.0117882400000000,  0.0194349300000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0004217700000000,  0.1189522400000000, -0.0855356500000000 ]  - [   0.0000721200000000, -0.0000442000000000,  0.0002218000000000 ]  - [  -0.0001372800000000,  0.0002253100000000,  0.0002241000000000 ]  - [   0.0013196100000000,  0.0000677300000000,  0.0006953500000000 ]  - [  -0.0012448700000000,  0.0000293800000000,  0.0002567100000000 ]  - [   0.0001308500000000,  0.0001610800000000, -0.0004660000000000 ]  - [   0.0003286900000000,  0.0007948500000000,  0.0014125100000000 ]  - [  -0.0000528500000000,  0.0000915700000000,  0.0000709700000000 ]  - [  -0.0000268600000000, -0.0007326800000000, -0.0000433200000000 ]  - [   0.0054349900000000,  0.0123171800000000, -0.0107862200000000 ]  - [  -0.0004662000000000,  0.0006007100000000, -0.0005661900000000 ]  - [  -0.0002219400000000, -0.0004566200000000,  0.0000857000000000 ]  - [  -0.0002500400000000,  0.0006132700000000,  0.0019246900000000 ]  - [   0.0013169900000000,  0.0012608900000000, -0.0010878800000000 ]  - [   0.0008671900000000, -0.0006484100000000,  0.0006129500000000 ]  - [  -0.0002511200000000,  0.0006096300000000,  0.0015852000000000 ]  - [   0.0001259500000000, -0.0002375800000000,  0.0000884000000000 ]  - [  -0.0035164000000000, -0.0018060700000000, -0.0029036100000000 ]  - [   0.0000319700000000, -0.0018148200000000, -0.0009872900000000 ]  - [   0.0002214300000000, -0.0001331700000000,  0.0002496700000000 ]  - [  -0.0010411000000000, -0.0001928200000000,  0.0006961200000000 ]  - [   0.0001392800000000,  0.0003314900000000,  0.0002125100000000 ]  - [   0.0005073900000000, -0.0001083800000000, -0.0000194200000000 ]  - [  -0.0009292600000000,  0.0004953500000000,  0.0006964000000000 ]  - [  -0.0001121600000000, -0.0002488400000000,  0.0003084800000000 ]  - [  -0.0000819800000000, -0.0000045200000000,  0.0002617500000000 ]  - [   0.0000528700000000,  0.0000530100000000,  0.0003200400000000 ]  - [  -0.0002784100000000,  0.0000003200000000,  0.0000751300000000 ]  - [   0.0000835400000000, -0.0001771800000000, -0.0000969500000000 ]  - [  -0.0001191300000000,  0.0000452100000000,  0.0002619600000000 ]  - [   0.0010863800000000, -0.0013159400000000,  0.0006270300000000 ]  - [  -0.0002354700000000,  0.0001014600000000,  0.0000548500000000 ]  - [   0.0005493900000000,  0.0012922600000000, -0.0015468800000000 ]  - [  -0.0007671800000000, -0.0049763000000000,  0.0037865100000000 ]  - [   0.0004207900000000,  0.0005840000000000,  0.0013321900000000 ]  - [  -0.0000216800000000, -0.0001262100000000,  0.0009062000000000 ]  - [  -0.0023291000000000,  0.0006664100000000, -0.0018066600000000 ]  - [  -0.0024901800000000, -0.1377180900000000,  0.0867139600000000 ]  - [   0.0022483900000000,  0.0004855100000000, -0.0016833400000000 ]  - [  -0.0007398200000000, -0.0006855600000000,  0.0012781700000000 ]  - [  -0.0014590700000000, -0.0010329900000000, -0.0009154300000000 ]  - [  -0.0000614500000000, -0.0001532700000000,  0.0000669200000000 ]  - [   0.0020271900000000,  0.0009906900000000,  0.0019920900000000 ]  - [  -0.0005475800000000,  0.0001954200000000, -0.0008654800000000 ]  - [  -0.0040269700000000,  0.0024609500000000,  0.0010274600000000 ]  - [   0.0017113700000000,  0.0017203700000000,  0.0010844400000000 ]  - [   0.0006652400000000,  0.0005311500000000, -0.0007804600000000 ]  - [  -0.0002705200000000, -0.0004411700000000,  0.0007488400000000 ]  - [  -0.0007456000000000,  0.0002851900000000,  0.0015646200000000 ]  - [   0.0001760300000000, -0.0005350100000000, -0.0000970900000000 ]  - [   0.0009412800000000, -0.0001671900000000, -0.0012250700000000 ]  - [  -0.0008472300000000, -0.0002701700000000, -0.0003535400000000 ]  - [  -0.0002653800000000,  0.0003190800000000, -0.0002571000000000 ]  - [   0.0001583900000000,  0.0000279500000000, -0.0003029200000000 ]  - [   0.0007019800000000,  0.0002320100000000, -0.0006495900000000 ]  - [   0.0001831800000000, -0.0002213100000000, -0.0004686900000000 ]  - [  -0.0007433200000000,  0.0006198000000000, -0.0007236900000000 ]  - [   0.0001689400000000, -0.0008346800000000, -0.0016424900000000 ]  - [  -0.0002978400000000, -0.0000022200000000, -0.0005053700000000 ]  - [  -0.0046912600000000,  0.0115333600000000, -0.0010029300000000 ]  - [   0.0005773000000000,  0.0001126900000000, -0.0009319100000000 ]  - [  -0.0000860900000000,  0.0000160400000000, -0.0004262500000000 ]  - [  -0.0004480900000000,  0.0026114400000000, -0.0030466800000000 ]  - [  -0.0005513500000000, -0.0006335600000000, -0.0012556300000000 ]  - [   0.0008527600000000, -0.0013841600000000, -0.0016419200000000 ]  - [   0.0010657800000000, -0.0017091400000000,  0.0011790500000000 ]  - [  -0.0042700800000000,  0.0009626500000000,  0.0033927300000000 ]  - [  -0.0008045200000000, -0.0000296200000000, -0.0007779000000000 ]  - [   0.0009210600000000,  0.0031454900000000, -0.0042343400000000 ]  - [  -0.0002240300000000, -0.0008127900000000,  0.0017964000000000 ]  - [  -0.0012676500000000,  0.0020637800000000,  0.0025392800000000 ]  - [   0.0122545300000000, -0.0079522000000000,  0.0092827400000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0005375800000000, -0.1155970000000000,  0.0866644300000000 ]  - [  -0.0004984700000000, -0.0005344700000000, -0.0004209500000000 ]  - [  -0.0000101200000000, -0.0003232500000000, -0.0005013600000000 ]  - [  -0.0012310100000000, -0.0002171600000000, -0.0004209900000000 ]  - [   0.0011460400000000,  0.0001196500000000,  0.0000201700000000 ]  - [   0.0000181000000000, -0.0002615600000000,  0.0001886300000000 ]  - [  -0.0004160700000000, -0.0009340900000000, -0.0011244000000000 ]  - [   0.0001485900000000,  0.0000575900000000,  0.0002045200000000 ]  - [  -0.0001230500000000,  0.0008389900000000, -0.0002332200000000 ]  - [  -0.0048940300000000, -0.0127052300000000,  0.0107064700000000 ]  - [   0.0000540700000000, -0.0000271800000000,  0.0003710100000000 ]  - [  -0.0003381000000000,  0.0000476000000000,  0.0001137100000000 ]  - [   0.0008072800000000, -0.0001946100000000, -0.0017110100000000 ]  - [  -0.0008962100000000, -0.0006905500000000,  0.0008952900000000 ]  - [  -0.0002857300000000,  0.0002175100000000, -0.0004125400000000 ]  - [  -0.0003322700000000, -0.0001851800000000, -0.0013997900000000 ]  - [   0.0000220300000000,  0.0003348200000000, -0.0003654600000000 ]  - [   0.0031227700000000,  0.0012360200000000,  0.0027211400000000 ]  - [  -0.0001812200000000,  0.0017384300000000,  0.0007195900000000 ]  - [  -0.0001378500000000, -0.0000146600000000,  0.0000132600000000 ]  - [   0.0009477100000000,  0.0003426900000000, -0.0004203000000000 ]  - [   0.0000086400000000, -0.0004259500000000, -0.0004899100000000 ]  - [  -0.0006060400000000, -0.0000385600000000,  0.0002982600000000 ]  - [   0.0010369200000000, -0.0003531200000000, -0.0004236100000000 ]  - [  -0.0000365500000000,  0.0003440400000000, -0.0005854900000000 ]  - [   0.0005047600000000, -0.0005705300000000, -0.0004594500000000 ]  - [  -0.0004773500000000,  0.0005247700000000, -0.0005180900000000 ]  - [  -0.0002993800000000, -0.0004281000000000,  0.0001250300000000 ]  - [   0.0004953300000000,  0.0006055800000000,  0.0002975900000000 ]  - [   0.0005444900000000,  0.0005311900000000, -0.0004617600000000 ]  - [  -0.0005097300000000,  0.0008941800000000, -0.0004289900000000 ]  - [  -0.0003420000000000,  0.0003254900000000,  0.0001431700000000 ]  - [  -0.0005433300000000, -0.0012893200000000,  0.0015415300000000 ]  - [   0.0008279000000000,  0.0048842300000000, -0.0038903700000000 ]  - [  -0.0004264700000000, -0.0005923400000000, -0.0013361300000000 ]  - [   0.0000224500000000,  0.0001278600000000, -0.0009072900000000 ]  - [   0.0021352700000000, -0.0002804300000000,  0.0021654300000000 ]  - [   0.0023108500000000,  0.1344985900000000, -0.0875940400000000 ]  - [  -0.0021380200000000, -0.0005687100000000,  0.0011903700000000 ]  - [   0.0006385600000000,  0.0007847100000000, -0.0007782300000000 ]  - [   0.0015376400000000,  0.0011301100000000,  0.0004126300000000 ]  - [  -0.0000341600000000,  0.0000485300000000, -0.0005651500000000 ]  - [  -0.0019425800000000, -0.0010963800000000, -0.0014991500000000 ]  - [   0.0001573300000000, -0.0004053300000000,  0.0005180000000000 ]  - [   0.0044506200000000, -0.0022667800000000, -0.0013835200000000 ]  - [  -0.0016336100000000, -0.0016476700000000, -0.0005891000000000 ]  - [  -0.0004499900000000, -0.0009168600000000,  0.0011312900000000 ]  - [  -0.0001288300000000,  0.0006560900000000, -0.0011103600000000 ]  - [   0.0009620700000000,  0.0001036800000000, -0.0012235800000000 ]  - [  -0.0003906600000000,  0.0001232700000000,  0.0004572000000000 ]  - [  -0.0005424100000000, -0.0000493800000000,  0.0008723300000000 ]  - [   0.0007327700000000,  0.0003157700000000, -0.0000915500000000 ]  - [   0.0000603100000000,  0.0000757700000000,  0.0006156600000000 ]  - [  -0.0002586600000000, -0.0001225000000000,  0.0008040900000000 ]  - [  -0.0006112800000000, -0.0003355100000000,  0.0001496100000000 ]  - [  -0.0002847800000000,  0.0003157000000000,  0.0009705900000000 ]  - [   0.0008385700000000, -0.0005186800000000,  0.0002200000000000 ]  - [  -0.0002615700000000,  0.0007415300000000,  0.0011507100000000 ]  - [   0.0004015000000000, -0.0000884800000000,  0.0010081200000000 ]  - [   0.0043357700000000, -0.0120109500000000,  0.0006329900000000 ]  - [  -0.0001865400000000,  0.0001038500000000,  0.0005843200000000 ]  - [   0.0001857200000000,  0.0000770200000000,  0.0009283300000000 ]  - [   0.0006585200000000, -0.0029925600000000,  0.0033898100000000 ]  - [   0.0001604800000000,  0.0008396200000000,  0.0009045500000000 ]  - [  -0.0006286900000000,  0.0017627500000000,  0.0019795700000000 ]  - [  -0.0012882900000000,  0.0013282500000000, -0.0008419700000000 ]  - [   0.0046518100000000, -0.0011775700000000, -0.0037522400000000 ]  - [   0.0007161800000000,  0.0001326400000000,  0.0002766900000000 ]  - [  -0.0009264100000000, -0.0031506000000000,  0.0042710600000000 ]  - [   0.0002200300000000,  0.0008003500000000, -0.0018076200000000 ]  - [   0.0012503500000000, -0.0020335500000000, -0.0025379500000000 ]  - [  -0.0123575200000000,  0.0080359300000000, -0.0093715800000000 ]- atom:    2  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0002016600000000, -0.0002393600000000,  0.0001442900000000 ]  - [  -0.1847125100000000, -0.1044988100000000, -0.1053000800000000 ]  - [   0.0005710100000000, -0.0021442000000000, -0.0012350800000000 ]  - [  -0.0007999300000000,  0.0004743000000000,  0.0005660800000000 ]  - [  -0.0028881200000000, -0.0001885700000000,  0.0005346100000000 ]  - [   0.0000281300000000,  0.0000769800000000,  0.0001240300000000 ]  - [   0.0010974600000000, -0.0001435300000000, -0.0002504600000000 ]  - [  -0.0012121200000000,  0.0003985600000000, -0.0000746500000000 ]  - [  -0.0000524800000000, -0.0000809800000000,  0.0001523100000000 ]  - [   0.0003645600000000, -0.0003007900000000,  0.0001557500000000 ]  - [  -0.0003318400000000,  0.0001766600000000,  0.0001535100000000 ]  - [   0.0002153300000000,  0.0003398900000000, -0.0005063200000000 ]  - [   0.0002397200000000,  0.0002083600000000, -0.0006978400000000 ]  - [  -0.0002966100000000,  0.0000248100000000,  0.0002413500000000 ]  - [   0.0017612700000000, -0.0021786600000000,  0.0011863800000000 ]  - [  -0.0000504100000000,  0.0011827800000000,  0.0014736000000000 ]  - [  -0.0013369400000000,  0.0062704400000000, -0.0034257100000000 ]  - [   0.0003469000000000,  0.0000850200000000,  0.0002477500000000 ]  - [  -0.0001697100000000,  0.0002565200000000,  0.0001905700000000 ]  - [   0.0033762300000000,  0.0001737600000000,  0.0012349300000000 ]  - [   0.0005986000000000,  0.0000586700000000,  0.0000272600000000 ]  - [   0.0005942900000000, -0.0011712800000000, -0.0003972400000000 ]  - [  -0.0019478800000000, -0.0002950400000000,  0.0005311300000000 ]  - [   0.0015257500000000, -0.0002481700000000,  0.0003923100000000 ]  - [  -0.0006432800000000,  0.0070649100000000, -0.0052497700000000 ]  - [  -0.0019507900000000,  0.0010119300000000,  0.0007128800000000 ]  - [   0.0008019900000000,  0.0000351500000000,  0.0001150300000000 ]  - [  -0.0004607600000000, -0.0004586600000000,  0.0000117800000000 ]  - [   0.0003031800000000,  0.0002589300000000, -0.0002170800000000 ]  - [   0.0041674200000000,  0.0025201900000000, -0.0020111600000000 ]  - [   0.0014326000000000, -0.0011867900000000,  0.0003790000000000 ]  - [  -0.0013249100000000,  0.0021766900000000,  0.0017070700000000 ]  - [   0.0000607100000000,  0.0002503600000000,  0.0011559200000000 ]  - [   0.0003170900000000, -0.0005049400000000,  0.0002277400000000 ]  - [   0.0140374400000000, -0.0037152700000000,  0.0102886800000000 ]  - [   0.0002740000000000,  0.0007997400000000, -0.0013666100000000 ]  - [  -0.0001705200000000, -0.0009006300000000, -0.0010547600000000 ]  - [  -0.0002753000000000,  0.0001825900000000, -0.0001769200000000 ]  - [   0.0013395600000000,  0.0001483300000000,  0.0002946400000000 ]  - [   0.0003969500000000, -0.0000294700000000, -0.0003418100000000 ]  - [  -0.0013239100000000,  0.0012492700000000, -0.0009647600000000 ]  - [   0.0009923200000000, -0.0013276700000000, -0.0011763100000000 ]  - [  -0.0004026100000000, -0.0001374600000000, -0.0003783900000000 ]  - [  -0.0147126200000000, -0.0040681900000000, -0.0145148100000000 ]  - [   0.0006678800000000, -0.0003144000000000, -0.0010537200000000 ]  - [   0.0001392000000000,  0.0000268100000000, -0.0002416600000000 ]  - [  -0.0001745100000000,  0.0054506800000000, -0.0050198800000000 ]  - [  -0.0001997800000000,  0.0001699100000000, -0.0007036600000000 ]  - [   0.0007778700000000,  0.0002396500000000,  0.0001943800000000 ]  - [   0.0002057300000000, -0.0019590300000000,  0.0020728200000000 ]  - [  -0.0008013400000000, -0.0059277400000000,  0.0031123900000000 ]  - [  -0.0023429500000000, -0.0001923700000000, -0.0005864100000000 ]  - [  -0.0082374300000000, -0.0006490400000000, -0.0072618000000000 ]  - [   0.0015128900000000, -0.0040563800000000,  0.0018861600000000 ]  - [  -0.0004684700000000, -0.0000959200000000,  0.0002422300000000 ]  - [  -0.0054930900000000,  0.0010146500000000,  0.0011771000000000 ]  - [   0.0000195000000000,  0.0029891600000000, -0.0027578300000000 ]  - [  -0.0034510200000000, -0.0004754300000000, -0.0022297000000000 ]  - [   0.1777884700000000,  0.1131310800000000,  0.1061960300000000 ]  - [  -0.0008833300000000, -0.0000199600000000, -0.0010655700000000 ]  - [  -0.0068675800000000,  0.0032678700000000,  0.0009447600000000 ]  - [  -0.0008238000000000,  0.0010640000000000,  0.0009696100000000 ]  - [  -0.0005434300000000,  0.0003047100000000, -0.0005161000000000 ]  - [  -0.0014206900000000,  0.0000733000000000,  0.0003144200000000 ]  - [  -0.0009716300000000,  0.0002423500000000,  0.0013297500000000 ]  - [  -0.0009227300000000,  0.0002067300000000, -0.0001855900000000 ]  - [   0.0002652600000000,  0.0001191900000000, -0.0007134000000000 ]  - [   0.0010039800000000, -0.0005376600000000, -0.0000134300000000 ]  - [  -0.0000009500000000, -0.0005621700000000,  0.0008001900000000 ]  - [   0.0274446100000000, -0.0184683100000000,  0.0218883900000000 ]  - [   0.0033031100000000,  0.0025792200000000, -0.0039365500000000 ]  - [   0.0004932900000000,  0.0007727500000000,  0.0022482100000000 ]- atom:    2  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000555900000000,  0.0003418600000000, -0.0004268300000000 ]  - [   0.1770484000000000,  0.0951761700000000,  0.0975502100000000 ]  - [  -0.0007248500000000,  0.0020805600000000,  0.0009779700000000 ]  - [   0.0009037700000000, -0.0006327800000000, -0.0002983800000000 ]  - [   0.0028196100000000,  0.0003422300000000, -0.0002612000000000 ]  - [   0.0001195500000000, -0.0001787600000000, -0.0004067600000000 ]  - [  -0.0012085600000000, -0.0000031400000000,  0.0005314600000000 ]  - [   0.0013256200000000, -0.0002567300000000,  0.0003528100000000 ]  - [  -0.0000947900000000,  0.0001830200000000, -0.0004350400000000 ]  - [   0.0000617000000000, -0.0002786700000000, -0.0003603800000000 ]  - [  -0.0000953200000000,  0.0004054200000000, -0.0003582300000000 ]  - [  -0.0007996300000000, -0.0007774900000000,  0.0007095200000000 ]  - [   0.0003393000000000,  0.0002228400000000,  0.0009037600000000 ]  - [   0.0007290900000000,  0.0005568600000000, -0.0004455000000000 ]  - [  -0.0012026500000000,  0.0017796000000000, -0.0010025500000000 ]  - [  -0.0005249400000000, -0.0007794300000000, -0.0013037700000000 ]  - [   0.0015088900000000, -0.0062693400000000,  0.0032133400000000 ]  - [  -0.0007805900000000, -0.0006689800000000, -0.0004518200000000 ]  - [   0.0000234700000000, -0.0003598700000000, -0.0004735700000000 ]  - [  -0.0033209400000000, -0.0003258400000000, -0.0009759800000000 ]  - [  -0.0007046400000000,  0.0000878100000000,  0.0002526500000000 ]  - [  -0.0004444700000000,  0.0010672000000000,  0.0001227900000000 ]  - [   0.0018676900000000,  0.0001621000000000, -0.0002751400000000 ]  - [  -0.0014602500000000,  0.0004040500000000, -0.0001105000000000 ]  - [   0.0005142800000000, -0.0071252800000000,  0.0050774000000000 ]  - [   0.0024038000000000, -0.0016112200000000, -0.0009215200000000 ]  - [  -0.0012363200000000,  0.0005402000000000, -0.0003115900000000 ]  - [  -0.0001091600000000,  0.0000348500000000,  0.0001814100000000 ]  - [   0.0002778900000000,  0.0001691900000000,  0.0004220000000000 ]  - [  -0.0037805400000000, -0.0019574900000000,  0.0018337100000000 ]  - [  -0.0008710400000000,  0.0007754500000000, -0.0001853400000000 ]  - [   0.0007621800000000, -0.0017816100000000, -0.0015350000000000 ]  - [  -0.0000622900000000, -0.0002560400000000, -0.0011761200000000 ]  - [  -0.0003206300000000,  0.0005127600000000, -0.0002442400000000 ]  - [  -0.0140955000000000,  0.0039416600000000, -0.0102013000000000 ]  - [  -0.0002732800000000, -0.0008231100000000,  0.0013916700000000 ]  - [  -0.0000380100000000,  0.0013178400000000,  0.0014300400000000 ]  - [   0.0001706200000000, -0.0002817500000000,  0.0006968800000000 ]  - [  -0.0012577200000000, -0.0002598400000000, -0.0008006100000000 ]  - [  -0.0005076000000000,  0.0001280300000000,  0.0008609900000000 ]  - [   0.0014366000000000, -0.0011594500000000,  0.0004661200000000 ]  - [  -0.0011013300000000,  0.0012435100000000,  0.0006853400000000 ]  - [   0.0005135300000000,  0.0000430900000000,  0.0008990000000000 ]  - [   0.0146204200000000,  0.0041750800000000,  0.0145703600000000 ]  - [  -0.0002785700000000,  0.0005329300000000,  0.0007169800000000 ]  - [  -0.0000338100000000,  0.0000694200000000,  0.0007614500000000 ]  - [   0.0003790000000000, -0.0059383000000000,  0.0054457400000000 ]  - [  -0.0001907900000000,  0.0000408100000000,  0.0003665000000000 ]  - [  -0.0005792800000000,  0.0001514000000000,  0.0001649400000000 ]  - [  -0.0004218400000000,  0.0015973600000000, -0.0017489600000000 ]  - [   0.0012154700000000,  0.0057956300000000, -0.0035144000000000 ]  - [   0.0022766500000000,  0.0003026300000000,  0.0000896200000000 ]  - [   0.0081419600000000,  0.0010388600000000,  0.0077093200000000 ]  - [  -0.0016379000000000,  0.0040266200000000, -0.0014098700000000 ]  - [   0.0005679000000000, -0.0000051000000000, -0.0007596400000000 ]  - [   0.0054110800000000, -0.0009289600000000, -0.0007049100000000 ]  - [   0.0000913400000000, -0.0029315900000000,  0.0022681200000000 ]  - [   0.0034495500000000,  0.0003650000000000,  0.0017876800000000 ]  - [  -0.1705245800000000, -0.1049920800000000, -0.0985237900000000 ]  - [   0.0004991700000000, -0.0001906700000000,  0.0007290600000000 ]  - [   0.0073602300000000, -0.0031075100000000, -0.0013041300000000 ]  - [   0.0009357900000000, -0.0009794000000000, -0.0004772300000000 ]  - [   0.0007661000000000, -0.0007054800000000,  0.0008790700000000 ]  - [   0.0010449800000000,  0.0001511700000000, -0.0006725800000000 ]  - [   0.0011973700000000,  0.0001501400000000, -0.0009943300000000 ]  - [   0.0007288100000000, -0.0006131100000000,  0.0005523500000000 ]  - [   0.0001220800000000, -0.0003377300000000,  0.0003770000000000 ]  - [  -0.0011171400000000,  0.0006630900000000, -0.0004923800000000 ]  - [   0.0000036400000000,  0.0005739300000000, -0.0008323400000000 ]  - [  -0.0279230900000000,  0.0187887500000000, -0.0222973900000000 ]  - [  -0.0033567100000000, -0.0026304500000000,  0.0040048100000000 ]  - [  -0.0005031600000000, -0.0007919200000000, -0.0022887500000000 ]- atom:    2  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0001501900000000, -0.0001530800000000,  0.0001054700000000 ]  - [  -0.1027860200000000, -0.1265930200000000, -0.0498381500000000 ]  - [  -0.0002314200000000, -0.0014087800000000, -0.0011079300000000 ]  - [   0.0000610800000000,  0.0005326200000000,  0.0007126700000000 ]  - [  -0.0012953400000000, -0.0003957600000000,  0.0000970300000000 ]  - [   0.0000722500000000,  0.0000908700000000,  0.0000960600000000 ]  - [   0.0005319000000000, -0.0000973500000000, -0.0000659700000000 ]  - [  -0.0005666000000000,  0.0003972000000000,  0.0001283400000000 ]  - [  -0.0000872400000000, -0.0001177000000000,  0.0001431200000000 ]  - [   0.0002236600000000, -0.0002868900000000,  0.0001774100000000 ]  - [  -0.0000985900000000,  0.0000489100000000,  0.0001468200000000 ]  - [  -0.0001162400000000,  0.0002936600000000, -0.0000785500000000 ]  - [   0.0003306400000000,  0.0001613500000000, -0.0004311500000000 ]  - [  -0.0000513400000000,  0.0001722100000000,  0.0001563000000000 ]  - [   0.0010587100000000, -0.0012486800000000,  0.0006103900000000 ]  - [  -0.0004970600000000,  0.0013573000000000,  0.0012821400000000 ]  - [   0.0004274700000000,  0.0047386800000000, -0.0016564700000000 ]  - [   0.0001618500000000,  0.0000172300000000,  0.0001609100000000 ]  - [  -0.0001289800000000,  0.0002258100000000,  0.0001031700000000 ]  - [   0.0023869900000000,  0.0001011900000000,  0.0009318300000000 ]  - [   0.0002413400000000,  0.0001080300000000,  0.0000852200000000 ]  - [  -0.0004358900000000, -0.0002530800000000, -0.0004503500000000 ]  - [  -0.0005098800000000, -0.0006112500000000, -0.0003918300000000 ]  - [   0.0015253400000000, -0.0004051200000000,  0.0000802400000000 ]  - [   0.0195819400000000,  0.0159488000000000,  0.0124690300000000 ]  - [  -0.0010909200000000,  0.0012439400000000,  0.0005275400000000 ]  - [   0.0000369100000000,  0.0005198200000000, -0.0002622300000000 ]  - [  -0.0008104600000000, -0.0003904400000000,  0.0006383900000000 ]  - [   0.0003292900000000,  0.0002265800000000, -0.0001814100000000 ]  - [   0.0024356600000000,  0.0009598100000000, -0.0010643500000000 ]  - [   0.0004928500000000,  0.0000260400000000,  0.0002004900000000 ]  - [  -0.0010589300000000,  0.0016851800000000,  0.0012597100000000 ]  - [   0.0001089200000000,  0.0004229600000000,  0.0008428900000000 ]  - [   0.0002471800000000, -0.0006498600000000,  0.0005784700000000 ]  - [   0.0017675800000000, -0.0134129500000000,  0.0022399400000000 ]  - [   0.0000826400000000,  0.0018298800000000, -0.0012449700000000 ]  - [  -0.0003656300000000, -0.0010219400000000, -0.0009143100000000 ]  - [  -0.0001138600000000,  0.0001922200000000, -0.0001831400000000 ]  - [   0.0005685700000000,  0.0003649000000000, -0.0000042300000000 ]  - [   0.0001903900000000, -0.0001178000000000, -0.0002124500000000 ]  - [  -0.0007093500000000,  0.0006427800000000, -0.0006396300000000 ]  - [   0.0005289800000000, -0.0011078100000000, -0.0010066700000000 ]  - [  -0.0002409300000000, -0.0001524100000000, -0.0002666700000000 ]  - [  -0.0159363100000000,  0.0111587000000000, -0.0109268200000000 ]  - [   0.0004807800000000, -0.0003939500000000, -0.0008343600000000 ]  - [  -0.0000385800000000,  0.0001165800000000, -0.0002246500000000 ]  - [   0.0007590400000000,  0.0056795000000000, -0.0032134800000000 ]  - [  -0.0004156400000000,  0.0003200700000000, -0.0007639800000000 ]  - [   0.0001304000000000,  0.0006533700000000,  0.0002442000000000 ]  - [   0.0004189700000000, -0.0020024200000000,  0.0013492800000000 ]  - [  -0.0010504400000000, -0.0034279400000000,  0.0012262900000000 ]  - [  -0.0015918900000000, -0.0000777100000000, -0.0008290400000000 ]  - [  -0.0064618600000000,  0.0001385800000000, -0.0064625800000000 ]  - [   0.0003181600000000, -0.0033777900000000,  0.0012610600000000 ]  - [  -0.0001614800000000, -0.0003266700000000,  0.0001341800000000 ]  - [  -0.0023639600000000,  0.0022439700000000,  0.0013669200000000 ]  - [   0.0008130300000000,  0.0019477000000000, -0.0000874400000000 ]  - [  -0.0041650900000000, -0.0000503000000000, -0.0035130500000000 ]  - [   0.0973566800000000,  0.1188163000000000,  0.0446567300000000 ]  - [  -0.0006703100000000, -0.0002478100000000, -0.0007966900000000 ]  - [  -0.0048571100000000,  0.0047434300000000,  0.0010839800000000 ]  - [  -0.0000986600000000,  0.0002946200000000,  0.0010167200000000 ]  - [  -0.0001931900000000, -0.0004616000000000, -0.0000067800000000 ]  - [  -0.0008724500000000, -0.0005548600000000,  0.0002738200000000 ]  - [  -0.0004259400000000, -0.0001434500000000,  0.0009441200000000 ]  - [  -0.0009485400000000,  0.0006424800000000, -0.0007180200000000 ]  - [   0.0003110200000000,  0.0003193700000000, -0.0007446400000000 ]  - [   0.0008023200000000, -0.0013113400000000, -0.0008280900000000 ]  - [   0.0003592200000000, -0.0014858600000000,  0.0013180500000000 ]  - [   0.0137148300000000, -0.0217835600000000,  0.0130319900000000 ]  - [   0.0017685800000000,  0.0032800100000000, -0.0033065200000000 ]  - [   0.0006707800000000,  0.0014065700000000,  0.0015756800000000 ]- atom:    2  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000033600000000,  0.0002516600000000, -0.0003850400000000 ]  - [   0.0967728600000000,  0.1248893200000000,  0.0465163200000000 ]  - [   0.0000769000000000,  0.0013278300000000,  0.0008434700000000 ]  - [   0.0000447600000000, -0.0006875300000000, -0.0004394100000000 ]  - [   0.0012219300000000,  0.0005433500000000,  0.0001772300000000 ]  - [   0.0000758700000000, -0.0001902600000000, -0.0003758500000000 ]  - [  -0.0006368400000000, -0.0000504900000000,  0.0003451800000000 ]  - [   0.0006707000000000, -0.0002515600000000,  0.0001485900000000 ]  - [  -0.0000606200000000,  0.0002169700000000, -0.0004231500000000 ]  - [   0.0002010100000000, -0.0002908100000000, -0.0003790100000000 ]  - [  -0.0003270100000000,  0.0005306400000000, -0.0003481800000000 ]  - [  -0.0004627400000000, -0.0007214300000000,  0.0002794800000000 ]  - [   0.0002467700000000,  0.0002610300000000,  0.0006350000000000 ]  - [   0.0004802300000000,  0.0004068800000000, -0.0003575100000000 ]  - [  -0.0004934100000000,  0.0008385900000000, -0.0004216500000000 ]  - [  -0.0000814500000000, -0.0009468600000000, -0.0011064400000000 ]  - [  -0.0003013700000000, -0.0046896400000000,  0.0013852400000000 ]  - [  -0.0005918100000000, -0.0005981500000000, -0.0003622300000000 ]  - [  -0.0000182800000000, -0.0003253400000000, -0.0003830000000000 ]  - [  -0.0023215100000000, -0.0002512300000000, -0.0006650000000000 ]  - [  -0.0003431300000000,  0.0000395200000000,  0.0001927100000000 ]  - [   0.0005855500000000,  0.0001648700000000,  0.0001771700000000 ]  - [   0.0004204800000000,  0.0004754800000000,  0.0006664800000000 ]  - [  -0.0014478600000000,  0.0005563800000000,  0.0001972000000000 ]  - [  -0.0190436900000000, -0.0155585600000000, -0.0125533800000000 ]  - [   0.0015321700000000, -0.0018332000000000, -0.0007314600000000 ]  - [  -0.0004680500000000,  0.0000557600000000,  0.0000652100000000 ]  - [   0.0002343700000000, -0.0000380200000000, -0.0004411600000000 ]  - [   0.0002487400000000,  0.0002007600000000,  0.0003832400000000 ]  - [  -0.0020422300000000, -0.0003951200000000,  0.0008807000000000 ]  - [   0.0000773200000000, -0.0004481500000000, -0.0000032000000000 ]  - [   0.0004931700000000, -0.0012788700000000, -0.0010749900000000 ]  - [  -0.0001098900000000, -0.0004262300000000, -0.0008550700000000 ]  - [  -0.0002506200000000,  0.0006565100000000, -0.0005832900000000 ]  - [  -0.0019304000000000,  0.0135209300000000, -0.0023463200000000 ]  - [  -0.0000908700000000, -0.0018397400000000,  0.0012633200000000 ]  - [   0.0001544600000000,  0.0014318000000000,  0.0012823200000000 ]  - [   0.0000122300000000, -0.0002885200000000,  0.0006928800000000 ]  - [  -0.0004843800000000, -0.0004672900000000, -0.0005044500000000 ]  - [  -0.0002967400000000,  0.0002140200000000,  0.0007220700000000 ]  - [   0.0008139100000000, -0.0005483800000000,  0.0001413700000000 ]  - [  -0.0006318800000000,  0.0010171500000000,  0.0005139100000000 ]  - [   0.0003469800000000,  0.0000589000000000,  0.0007778300000000 ]  - [   0.0158211900000000, -0.0116938500000000,  0.0107980700000000 ]  - [  -0.0000900200000000,  0.0006110500000000,  0.0004916100000000 ]  - [   0.0001408100000000, -0.0000230600000000,  0.0007334500000000 ]  - [  -0.0005365400000000, -0.0061112700000000,  0.0036013000000000 ]  - [   0.0000247500000000, -0.0001086400000000,  0.0004208400000000 ]  - [   0.0000764600000000, -0.0002644600000000,  0.0001116000000000 ]  - [  -0.0006388300000000,  0.0016280700000000, -0.0010093000000000 ]  - [   0.0014250700000000,  0.0032603400000000, -0.0016056400000000 ]  - [   0.0015171700000000,  0.0001800300000000,  0.0003292200000000 ]  - [   0.0063180100000000,  0.0002615600000000,  0.0068793000000000 ]  - [  -0.0004191900000000,  0.0033115200000000, -0.0007650800000000 ]  - [   0.0002603300000000,  0.0002239000000000, -0.0006421000000000 ]  - [   0.0022966400000000, -0.0021641500000000, -0.0008737300000000 ]  - [  -0.0007203700000000, -0.0018855000000000, -0.0004006300000000 ]  - [   0.0041228500000000, -0.0000558200000000,  0.0030470100000000 ]  - [  -0.0925553000000000, -0.1179359800000000, -0.0413845700000000 ]  - [   0.0002830200000000,  0.0000376000000000,  0.0004533700000000 ]  - [   0.0053105600000000, -0.0045792500000000, -0.0014521500000000 ]  - [   0.0002099200000000, -0.0002053200000000, -0.0005225200000000 ]  - [   0.0004117600000000,  0.0000679700000000,  0.0003634900000000 ]  - [   0.0004819400000000,  0.0007685400000000, -0.0006291200000000 ]  - [   0.0006419400000000,  0.0005410600000000, -0.0005985300000000 ]  - [   0.0007487700000000, -0.0010420500000000,  0.0010798800000000 ]  - [   0.0000779200000000, -0.0005371900000000,  0.0004021100000000 ]  - [  -0.0009039500000000,  0.0014232500000000,  0.0003169500000000 ]  - [  -0.0003588300000000,  0.0014947500000000, -0.0013379500000000 ]  - [  -0.0137638400000000,  0.0220022400000000, -0.0130848900000000 ]  - [  -0.0017754200000000, -0.0033149500000000,  0.0033303300000000 ]  - [  -0.0006791100000000, -0.0014233700000000, -0.0015994300000000 ]- atom:    2  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0001256700000000, -0.0002785400000000,  0.0001822600000000 ]  - [  -0.1032128600000000, -0.0494868800000000, -0.0941144500000000 ]  - [   0.0000071400000000, -0.0012987900000000, -0.0011277300000000 ]  - [   0.0002103800000000,  0.0003776300000000,  0.0006506500000000 ]  - [  -0.0010709200000000, -0.0005306600000000,  0.0016240000000000 ]  - [   0.0001290400000000,  0.0002610600000000,  0.0002804300000000 ]  - [   0.0005043200000000, -0.0001150000000000, -0.0000573400000000 ]  - [  -0.0004757400000000,  0.0003211200000000,  0.0001144300000000 ]  - [  -0.0001218600000000, -0.0002499200000000,  0.0002225400000000 ]  - [  -0.0000461400000000, -0.0000100900000000,  0.0003007200000000 ]  - [   0.0000435400000000,  0.0000411000000000,  0.0003898100000000 ]  - [  -0.0001098500000000,  0.0003943100000000, -0.0000192300000000 ]  - [  -0.0002420800000000, -0.0005851900000000, -0.0002561200000000 ]  - [  -0.0001299200000000,  0.0000321200000000,  0.0002443900000000 ]  - [   0.0014512900000000, -0.0018271500000000,  0.0009363800000000 ]  - [  -0.0003875700000000,  0.0004891100000000,  0.0003943300000000 ]  - [  -0.0010968200000000,  0.0036093200000000, -0.0029433500000000 ]  - [   0.0001362100000000, -0.0000275900000000,  0.0002086300000000 ]  - [  -0.0001446300000000,  0.0002823200000000,  0.0002232600000000 ]  - [   0.0014268900000000,  0.0000721800000000,  0.0006667700000000 ]  - [   0.0001649700000000,  0.0000791700000000,  0.0000937200000000 ]  - [   0.0000059500000000, -0.0002910500000000, -0.0006060400000000 ]  - [  -0.0007668900000000, -0.0009447400000000,  0.0019664400000000 ]  - [   0.0003799000000000,  0.0000884500000000,  0.0001255700000000 ]  - [  -0.0139445200000000, -0.0018165200000000, -0.0108315800000000 ]  - [  -0.0006005000000000,  0.0003376100000000,  0.0000951300000000 ]  - [  -0.0000010900000000,  0.0004521000000000, -0.0002694600000000 ]  - [  -0.0008302500000000, -0.0001265300000000,  0.0006603400000000 ]  - [   0.0000046000000000, -0.0001085600000000, -0.0001141200000000 ]  - [   0.0021248900000000,  0.0012569700000000, -0.0012004800000000 ]  - [   0.0014871600000000, -0.0016062200000000,  0.0004057800000000 ]  - [  -0.0008043800000000,  0.0013051500000000,  0.0009384200000000 ]  - [   0.0000417100000000,  0.0000503000000000,  0.0010527200000000 ]  - [  -0.0002872500000000,  0.0002111400000000,  0.0013090300000000 ]  - [   0.0080571800000000, -0.0000811800000000,  0.0044430200000000 ]  - [  -0.0002749400000000,  0.0009255900000000, -0.0012887300000000 ]  - [  -0.0003491500000000, -0.0003001800000000, -0.0006005100000000 ]  - [   0.0002137900000000,  0.0000268100000000, -0.0004542700000000 ]  - [   0.0010655300000000,  0.0004783700000000, -0.0011838500000000 ]  - [   0.0001903900000000, -0.0000404500000000, -0.0004335500000000 ]  - [  -0.0008327100000000,  0.0010643700000000, -0.0009076800000000 ]  - [   0.0003937100000000, -0.0008151000000000, -0.0008945200000000 ]  - [  -0.0002229700000000,  0.0000339000000000, -0.0003799100000000 ]  - [  -0.0140137300000000, -0.0041136700000000,  0.0006995900000000 ]  - [   0.0005559400000000, -0.0000931400000000, -0.0009438700000000 ]  - [  -0.0001130400000000, -0.0001184400000000, -0.0005639100000000 ]  - [  -0.0020174800000000,  0.0022233800000000, -0.0024855700000000 ]  - [  -0.0005089300000000, -0.0001738900000000, -0.0011779200000000 ]  - [   0.0011897900000000,  0.0000058600000000, -0.0011371200000000 ]  - [   0.0001171500000000, -0.0018312600000000,  0.0015645100000000 ]  - [  -0.0003314700000000, -0.0043415300000000,  0.0028635700000000 ]  - [  -0.0008696100000000, -0.0003187600000000, -0.0007560200000000 ]  - [  -0.0032808600000000, -0.0003946300000000, -0.0035389900000000 ]  - [   0.0007555000000000, -0.0024637200000000,  0.0018104100000000 ]  - [   0.0000832100000000, -0.0000098800000000,  0.0001626600000000 ]  - [  -0.0022796400000000,  0.0008605500000000,  0.0015090900000000 ]  - [  -0.0016187200000000,  0.0026478000000000, -0.0022880600000000 ]  - [  -0.0001224200000000, -0.0005291500000000, -0.0009638300000000 ]  - [   0.1155081200000000,  0.0598136500000000,  0.0931128100000000 ]  - [  -0.0006714400000000,  0.0001507000000000, -0.0010229400000000 ]  - [  -0.0041888700000000,  0.0030219200000000,  0.0016833900000000 ]  - [  -0.0000089300000000,  0.0005289600000000,  0.0010889700000000 ]  - [  -0.0003348000000000,  0.0006812000000000, -0.0006525900000000 ]  - [  -0.0005579800000000, -0.0000863800000000,  0.0004916100000000 ]  - [  -0.0003348700000000,  0.0005420400000000,  0.0011907000000000 ]  - [  -0.0000515800000000,  0.0000196800000000, -0.0005900900000000 ]  - [   0.0008670800000000,  0.0000819100000000, -0.0012461300000000 ]  - [   0.0006427900000000, -0.0011535300000000, -0.0006290200000000 ]  - [  -0.0007441400000000,  0.0005141200000000,  0.0028080600000000 ]  - [   0.0180413300000000, -0.0089299100000000,  0.0106676900000000 ]  - [   0.0020239400000000,  0.0018169700000000, -0.0035113900000000 ]  - [   0.0000524500000000, -0.0000007600000000,  0.0020085000000000 ]- atom:    2  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000221400000000,  0.0003765600000000, -0.0004606700000000 ]  - [   0.0994961300000000,  0.0468416700000000,  0.0948115500000000 ]  - [  -0.0001552500000000,  0.0012060300000000,  0.0008554100000000 ]  - [  -0.0001076300000000, -0.0005245600000000, -0.0003743700000000 ]  - [   0.0009811300000000,  0.0006859800000000, -0.0013610000000000 ]  - [   0.0000188000000000, -0.0003571300000000, -0.0005578000000000 ]  - [  -0.0006070200000000, -0.0000325200000000,  0.0003373200000000 ]  - [   0.0005776500000000, -0.0001752200000000,  0.0001643100000000 ]  - [  -0.0000263400000000,  0.0003466600000000, -0.0004988400000000 ]  - [   0.0004697700000000, -0.0005667200000000, -0.0004992000000000 ]  - [  -0.0004680900000000,  0.0005363400000000, -0.0005882900000000 ]  - [  -0.0004686800000000, -0.0008224600000000,  0.0002200500000000 ]  - [   0.0008249500000000,  0.0010174000000000,  0.0004602400000000 ]  - [   0.0005568600000000,  0.0005462100000000, -0.0004434800000000 ]  - [  -0.0008825700000000,  0.0014140200000000, -0.0007433700000000 ]  - [  -0.0001835300000000, -0.0000760300000000, -0.0002160500000000 ]  - [   0.0012620100000000, -0.0035404100000000,  0.0026813100000000 ]  - [  -0.0005631700000000, -0.0005508900000000, -0.0004075800000000 ]  - [  -0.0000024900000000, -0.0003820500000000, -0.0005005800000000 ]  - [  -0.0013311500000000, -0.0002198800000000, -0.0003891700000000 ]  - [  -0.0002644100000000,  0.0000687900000000,  0.0001825900000000 ]  - [   0.0001398400000000,  0.0002048200000000,  0.0003310800000000 ]  - [   0.0006737300000000,  0.0007819000000000, -0.0016687900000000 ]  - [  -0.0003025300000000,  0.0000634400000000,  0.0001540100000000 ]  - [   0.0135574800000000,  0.0018889600000000,  0.0106609500000000 ]  - [   0.0010341500000000, -0.0009214500000000, -0.0002974200000000 ]  - [  -0.0004280000000000,  0.0001249300000000,  0.0000718300000000 ]  - [   0.0002496300000000, -0.0002952300000000, -0.0004603200000000 ]  - [   0.0005690300000000,  0.0005298200000000,  0.0003115300000000 ]  - [  -0.0017198500000000, -0.0006880000000000,  0.0010115000000000 ]  - [  -0.0009018500000000,  0.0011721600000000, -0.0002047000000000 ]  - [   0.0002268500000000, -0.0008829500000000, -0.0007413800000000 ]  - [  -0.0000419600000000, -0.0000493300000000, -0.0010543500000000 ]  - [   0.0002928200000000, -0.0002150200000000, -0.0013114700000000 ]  - [  -0.0079784300000000,  0.0001757500000000, -0.0045553000000000 ]  - [   0.0002703400000000, -0.0009319800000000,  0.0012860300000000 ]  - [   0.0001350100000000,  0.0007051700000000,  0.0009635000000000 ]  - [  -0.0003177100000000, -0.0001221400000000,  0.0009618600000000 ]  - [  -0.0009801000000000, -0.0005869600000000,  0.0006827200000000 ]  - [  -0.0002947800000000,  0.0001340700000000,  0.0009396100000000 ]  - [   0.0009353100000000, -0.0009679500000000,  0.0004040900000000 ]  - [  -0.0004912100000000,  0.0007141000000000,  0.0003911700000000 ]  - [   0.0003276100000000, -0.0001282500000000,  0.0008867200000000 ]  - [   0.0138675400000000,  0.0040672800000000, -0.0011358300000000 ]  - [  -0.0001632300000000,  0.0003087900000000,  0.0005961200000000 ]  - [   0.0002140000000000,  0.0002154400000000,  0.0010697200000000 ]  - [   0.0022585200000000, -0.0026317200000000,  0.0028448900000000 ]  - [   0.0001186500000000,  0.0003829500000000,  0.0008275100000000 ]  - [  -0.0009689700000000,  0.0003851200000000,  0.0014782400000000 ]  - [  -0.0003331000000000,  0.0014455900000000, -0.0012222300000000 ]  - [   0.0007336000000000,  0.0041335700000000, -0.0032289400000000 ]  - [   0.0007739400000000,  0.0004247100000000,  0.0002470400000000 ]  - [   0.0030537300000000,  0.0007839400000000,  0.0038792400000000 ]  - [  -0.0008678400000000,  0.0023894900000000, -0.0013094100000000 ]  - [   0.0000167200000000, -0.0000905800000000, -0.0006653400000000 ]  - [   0.0022064100000000, -0.0007812000000000, -0.0010056000000000 ]  - [   0.0016819300000000, -0.0025272600000000,  0.0017814700000000 ]  - [   0.0000890900000000,  0.0004234300000000,  0.0005119200000000 ]  - [  -0.1121220900000000, -0.0580567500000000, -0.0934067200000000 ]  - [   0.0002797500000000, -0.0003597000000000,  0.0006736400000000 ]  - [   0.0046111100000000, -0.0028270200000000, -0.0020479400000000 ]  - [   0.0001169600000000, -0.0004335600000000, -0.0005853300000000 ]  - [   0.0005463900000000, -0.0010668700000000,  0.0010034800000000 ]  - [   0.0001678400000000,  0.0002953400000000, -0.0008487100000000 ]  - [   0.0005498100000000, -0.0001540100000000, -0.0008483000000000 ]  - [  -0.0001435300000000, -0.0004213500000000,  0.0009483500000000 ]  - [  -0.0004703100000000, -0.0002975200000000,  0.0008943000000000 ]  - [  -0.0007373100000000,  0.0012527200000000,  0.0001242700000000 ]  - [   0.0007265900000000, -0.0004965300000000, -0.0028018900000000 ]  - [  -0.0182223400000000,  0.0089753800000000, -0.0107267000000000 ]  - [  -0.0020297400000000, -0.0018231700000000,  0.0035362100000000 ]  - [  -0.0000586100000000, -0.0000141700000000, -0.0020187200000000 ]- atom:   33  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0011993200000000,  0.0008550800000000,  0.0004088200000000 ]  - [  -0.0001515300000000, -0.0001793400000000, -0.0000575200000000 ]  - [  -0.0001453000000000,  0.0002863600000000, -0.0005628900000000 ]  - [   0.0005001300000000, -0.0001139200000000, -0.0004507800000000 ]  - [  -0.0005580500000000, -0.0008368400000000,  0.0014307500000000 ]  - [  -0.0053718800000000, -0.0104507800000000, -0.0009458600000000 ]  - [   0.0083969800000000,  0.0065879400000000, -0.0047191200000000 ]  - [   0.0085295200000000,  0.0069096000000000,  0.0051418000000000 ]  - [  -0.0055717300000000, -0.0103081400000000,  0.0006494000000000 ]  - [   0.0004867500000000, -0.0003748500000000,  0.0001742900000000 ]  - [   0.0000604700000000,  0.0002014500000000, -0.0003712000000000 ]  - [   0.0015444400000000,  0.0006003700000000, -0.0008282300000000 ]  - [   0.0021252200000000,  0.0010225000000000,  0.0010294800000000 ]  - [   0.0143527200000000,  0.0020922200000000, -0.0082164600000000 ]  - [  -0.0131671000000000,  0.0036194200000000, -0.0000382200000000 ]  - [   0.0001378700000000, -0.0000431200000000,  0.0000475600000000 ]  - [   0.0000025000000000,  0.0003798200000000,  0.0002842400000000 ]  - [   0.0137804100000000,  0.0016055800000000,  0.0078202700000000 ]  - [   0.0010518900000000,  0.0007701200000000, -0.0006841800000000 ]  - [  -0.0004572800000000, -0.0009799000000000, -0.0011506600000000 ]  - [   0.0004112800000000,  0.0000350900000000,  0.0007256000000000 ]  - [   0.0001325400000000, -0.0001616000000000, -0.0001598600000000 ]  - [  -0.0001286000000000, -0.0000373000000000,  0.0000106900000000 ]  - [  -0.0000333300000000,  0.0001110600000000,  0.0002646200000000 ]  - [  -0.0000162700000000, -0.0000681800000000, -0.0001156600000000 ]  - [   0.0005285200000000, -0.0005357300000000,  0.0001911500000000 ]  - [   0.0001091900000000,  0.0000381900000000, -0.0003889000000000 ]  - [  -0.0009408300000000, -0.0007200700000000, -0.0001141200000000 ]  - [  -0.0003655700000000, -0.0002978200000000,  0.0003120200000000 ]  - [   0.0002745200000000,  0.0003980000000000, -0.0001412800000000 ]  - [   0.0007115800000000, -0.0004634500000000,  0.0001473600000000 ]  - [  -0.0137663200000000,  0.0040377000000000,  0.0002189600000000 ]  - [  -0.1966519300000000,  0.0000136600000000,  0.0009526800000000 ]  - [   0.0037100200000000, -0.0000443600000000, -0.0000003800000000 ]  - [   0.0003398100000000,  0.0000001400000000, -0.0000013700000000 ]  - [  -0.0010760600000000,  0.0001160200000000, -0.0000021900000000 ]  - [  -0.0033737100000000,  0.0004529700000000, -0.0003552000000000 ]  - [  -0.0019497900000000, -0.0011051800000000,  0.0000281400000000 ]  - [  -0.0018605700000000,  0.0007681400000000, -0.0014461900000000 ]  - [   0.0522562200000000, -0.0170944200000000, -0.0261368300000000 ]  - [   0.0447164100000000,  0.0151403200000000, -0.0184487400000000 ]  - [   0.0451728000000000,  0.0158884200000000,  0.0186421400000000 ]  - [   0.0507438000000000, -0.0157348900000000,  0.0250668500000000 ]  - [   0.0003157200000000, -0.0017678600000000,  0.0003845800000000 ]  - [  -0.0084849400000000, -0.0001363700000000,  0.0044333000000000 ]  - [  -0.0018492700000000, -0.0010189400000000,  0.0004660000000000 ]  - [   0.0037609800000000, -0.0055876000000000,  0.0026340600000000 ]  - [   0.0043436300000000,  0.0074720300000000,  0.0037468600000000 ]  - [   0.0020148900000000,  0.0014446200000000,  0.0009185600000000 ]  - [  -0.0052088900000000,  0.0013652600000000, -0.0021269200000000 ]  - [  -0.0015657600000000,  0.0005907200000000,  0.0002405300000000 ]  - [  -0.0019502600000000,  0.0008592700000000,  0.0009440100000000 ]  - [   0.0035461000000000, -0.0052104700000000, -0.0022930400000000 ]  - [   0.0000827000000000,  0.0000073400000000, -0.0001696100000000 ]  - [   0.0004268900000000,  0.0001499400000000, -0.0007328500000000 ]  - [  -0.0002134900000000,  0.0000889500000000,  0.0003079200000000 ]  - [  -0.0002087800000000,  0.0001888500000000, -0.0002728000000000 ]  - [  -0.0003004900000000,  0.0000935100000000, -0.0002228900000000 ]  - [  -0.0001138300000000, -0.0000002500000000,  0.0001898500000000 ]  - [  -0.0088648600000000, -0.0003576000000000, -0.0047626400000000 ]  - [   0.0007074800000000, -0.0015580400000000, -0.0007331000000000 ]  - [   0.0001777600000000,  0.0000983500000000,  0.0006715300000000 ]  - [  -0.0031666900000000,  0.0000537600000000,  0.0007149800000000 ]  - [  -0.0019594200000000,  0.0008041300000000, -0.0005916600000000 ]  - [  -0.0050080700000000,  0.0017613600000000,  0.0024696700000000 ]  - [   0.0018003200000000,  0.0010508500000000, -0.0005677800000000 ]  - [   0.0047287800000000,  0.0072385800000000, -0.0040865200000000 ]  - [   0.0003394700000000,  0.0002463800000000,  0.0002376200000000 ]  - [  -0.0111333200000000, -0.0046805200000000, -0.0000026500000000 ]  - [   0.0015641200000000,  0.0063900900000000,  0.0000004500000000 ]  - [   0.0065833100000000, -0.0058558900000000,  0.0000071500000000 ]  - [   0.0139468700000000, -0.0061107400000000, -0.0000156000000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0002689800000000,  0.0019541800000000, -0.0016823200000000 ]  - [   0.0009499700000000,  0.0005570700000000,  0.0009524400000000 ]  - [  -0.0003684600000000,  0.0004847400000000,  0.0011934900000000 ]  - [   0.0005992200000000,  0.0002213700000000,  0.0014751300000000 ]  - [   0.0018488300000000,  0.0004137600000000, -0.0014060500000000 ]  - [  -0.0006349400000000,  0.0076737900000000,  0.0036856000000000 ]  - [  -0.0078433000000000, -0.0008997100000000,  0.0039912500000000 ]  - [   0.0078433000000000,  0.0008997100000000,  0.0039912500000000 ]  - [   0.0006349400000000, -0.0076737900000000,  0.0036856000000000 ]  - [   0.0015945300000000, -0.0015458900000000, -0.0013866900000000 ]  - [  -0.0015945300000000,  0.0015458900000000, -0.0013866900000000 ]  - [   0.0009627300000000,  0.0011636900000000, -0.0011879000000000 ]  - [  -0.0009627300000000, -0.0011636900000000, -0.0011879000000000 ]  - [  -0.0099600300000000, -0.0020325300000000,  0.0043941400000000 ]  - [   0.0025534900000000, -0.0105292500000000,  0.0046047300000000 ]  - [  -0.0011411700000000,  0.0013821400000000,  0.0011549700000000 ]  - [   0.0003684600000000, -0.0004847400000000,  0.0011934900000000 ]  - [   0.0099600300000000,  0.0020325300000000,  0.0043941400000000 ]  - [   0.0002689800000000, -0.0019541800000000, -0.0016823200000000 ]  - [  -0.0018488300000000, -0.0004137600000000, -0.0014060500000000 ]  - [  -0.0005992200000000, -0.0002213700000000,  0.0014751300000000 ]  - [   0.0001607900000000,  0.0009504000000000,  0.0007665900000000 ]  - [  -0.0010568500000000,  0.0000161800000000,  0.0010472300000000 ]  - [   0.0010568500000000, -0.0000161800000000,  0.0010472300000000 ]  - [  -0.0001607900000000, -0.0009504000000000,  0.0007665900000000 ]  - [  -0.0000165200000000,  0.0002885900000000,  0.0012097300000000 ]  - [   0.0000165200000000, -0.0002885900000000,  0.0012097300000000 ]  - [  -0.0008732800000000, -0.0004552700000000,  0.0014108200000000 ]  - [   0.0008732800000000,  0.0004552700000000,  0.0014108200000000 ]  - [  -0.0009499700000000, -0.0005570700000000,  0.0009524400000000 ]  - [   0.0011411700000000, -0.0013821400000000,  0.0011549700000000 ]  - [  -0.0025534900000000,  0.0105292500000000,  0.0046047300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1672449600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0032222100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0028782300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049136000000000 ]  - [  -0.0007123800000000, -0.0009857600000000, -0.0025432400000000 ]  - [  -0.0004138100000000, -0.0001940500000000,  0.0029263100000000 ]  - [  -0.0000860800000000,  0.0002947900000000,  0.0023958100000000 ]  - [  -0.0241415600000000,  0.0181116400000000,  0.0360190100000000 ]  - [  -0.0188036200000000, -0.0250151500000000,  0.0359977500000000 ]  - [   0.0188036200000000,  0.0250151500000000,  0.0359977500000000 ]  - [   0.0241415600000000, -0.0181116400000000,  0.0360190100000000 ]  - [  -0.0013821900000000,  0.0005017200000000, -0.0028920700000000 ]  - [   0.0037903800000000,  0.0024128500000000, -0.0025933900000000 ]  - [   0.0004138100000000,  0.0001940500000000,  0.0029263100000000 ]  - [  -0.0021976000000000,  0.0033948800000000, -0.0022331000000000 ]  - [  -0.0003037000000000, -0.0037094100000000, -0.0016765700000000 ]  - [   0.0005445100000000, -0.0005454300000000, -0.0020156500000000 ]  - [  -0.0039099100000000, -0.0000988100000000, -0.0013107700000000 ]  - [   0.0009327800000000,  0.0003357400000000, -0.0023612300000000 ]  - [   0.0000860800000000, -0.0002947900000000,  0.0023958100000000 ]  - [   0.0021976000000000, -0.0033948800000000, -0.0022331000000000 ]  - [   0.0003331900000000,  0.0002391000000000, -0.0025225000000000 ]  - [   0.0003504500000000, -0.0004579200000000, -0.0030531400000000 ]  - [   0.0007403500000000, -0.0001782700000000, -0.0015022900000000 ]  - [   0.0002849100000000,  0.0008600900000000, -0.0020368100000000 ]  - [  -0.0002849100000000, -0.0008600900000000, -0.0020368100000000 ]  - [  -0.0007403500000000,  0.0001782700000000, -0.0015022900000000 ]  - [  -0.0037903800000000, -0.0024128500000000, -0.0025933900000000 ]  - [   0.0013821900000000, -0.0005017200000000, -0.0028920700000000 ]  - [  -0.0003331900000000, -0.0002391000000000, -0.0025225000000000 ]  - [   0.0007123800000000,  0.0009857600000000, -0.0025432400000000 ]  - [  -0.0009327800000000, -0.0003357400000000, -0.0023612300000000 ]  - [   0.0039099100000000,  0.0000988100000000, -0.0013107700000000 ]  - [  -0.0005445100000000,  0.0005454300000000, -0.0020156500000000 ]  - [   0.0003037000000000,  0.0037094100000000, -0.0016765700000000 ]  - [  -0.0003504500000000,  0.0004579200000000, -0.0030531400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038203300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0067078900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0037896500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0067148600000000 ]- atom:   37  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000982500000000,  0.0056838800000000, -0.0023677200000000 ]  - [  -0.0002755400000000, -0.0005450400000000, -0.0003374000000000 ]  - [  -0.0005637500000000, -0.0007024700000000, -0.0006904200000000 ]  - [  -0.0143952900000000, -0.0063904000000000, -0.0116370100000000 ]  - [   0.0001746900000000,  0.0000603100000000,  0.0001435200000000 ]  - [  -0.0007561200000000, -0.0005967900000000,  0.0010288700000000 ]  - [  -0.0000027800000000, -0.0000268500000000, -0.0005990700000000 ]  - [  -0.0000826000000000,  0.0001709700000000,  0.0001996100000000 ]  - [  -0.0002262300000000, -0.0016005800000000,  0.0007121900000000 ]  - [  -0.0008683700000000,  0.0002428300000000,  0.0003404700000000 ]  - [   0.0000911600000000, -0.0002327300000000,  0.0001179800000000 ]  - [   0.0001392900000000,  0.0000148300000000, -0.0000888700000000 ]  - [   0.0005047300000000,  0.0002783600000000, -0.0001787400000000 ]  - [  -0.0000951100000000,  0.0009093200000000,  0.0020458500000000 ]  - [  -0.0002134300000000,  0.0002106500000000, -0.0001016600000000 ]  - [   0.0112370000000000,  0.0041604600000000,  0.0041086900000000 ]  - [  -0.0000953600000000,  0.0010281500000000, -0.0002983700000000 ]  - [  -0.0084154200000000, -0.0066930300000000, -0.0032627300000000 ]  - [  -0.0002744200000000,  0.0028254000000000,  0.0004281900000000 ]  - [  -0.0002045600000000, -0.0001425900000000, -0.0001618700000000 ]  - [  -0.0048222100000000, -0.0002150700000000,  0.0024933200000000 ]  - [   0.0001839900000000,  0.0004678000000000,  0.0001465500000000 ]  - [   0.0009884900000000, -0.0000800000000000, -0.0004114200000000 ]  - [  -0.0031087700000000,  0.0000391000000000, -0.0009277900000000 ]  - [   0.0004369900000000, -0.0002605800000000, -0.0008712900000000 ]  - [   0.0008875200000000, -0.0003152700000000, -0.0011727300000000 ]  - [  -0.0010339400000000,  0.0011323400000000, -0.0000510400000000 ]  - [  -0.0036283200000000, -0.0060553300000000,  0.0043186300000000 ]  - [  -0.0003716800000000,  0.0001732500000000, -0.0000916500000000 ]  - [  -0.0004424500000000, -0.0000141400000000,  0.0003431000000000 ]  - [   0.0049490000000000, -0.0033904600000000,  0.0030206300000000 ]  - [  -0.0004328400000000,  0.0001291100000000, -0.0001549500000000 ]  - [  -0.0032729600000000,  0.0016598200000000, -0.0006055700000000 ]  - [   0.0019144500000000,  0.0007023000000000, -0.0004357100000000 ]  - [   0.0036460800000000,  0.0002528700000000,  0.0023066200000000 ]  - [  -0.0050908100000000,  0.0073228200000000, -0.0037934200000000 ]  - [  -0.1847062700000000, -0.0994369700000000, -0.0994465100000000 ]  - [  -0.0000650600000000, -0.0033308500000000,  0.0015019900000000 ]  - [  -0.0005953300000000, -0.0001174000000000, -0.0001288300000000 ]  - [   0.0012284300000000, -0.0007713500000000, -0.0014413100000000 ]  - [   0.0009451300000000, -0.0004298600000000,  0.0004763100000000 ]  - [   0.0008229400000000, -0.0001796300000000,  0.0000725300000000 ]  - [   0.0059648800000000,  0.0037701500000000,  0.0025805600000000 ]  - [   0.0002557200000000, -0.0005855400000000,  0.0004746400000000 ]  - [  -0.0125228600000000, -0.0177340700000000, -0.0173434700000000 ]  - [  -0.0004959800000000, -0.0017760700000000, -0.0005205600000000 ]  - [   0.0003483200000000, -0.0004462400000000,  0.0005692200000000 ]  - [   0.0018303300000000,  0.0020698200000000, -0.0003026900000000 ]  - [   0.0004988900000000,  0.0006996700000000,  0.0001727700000000 ]  - [  -0.0003905800000000, -0.0005537700000000,  0.0007341700000000 ]  - [  -0.0010555300000000, -0.0003653500000000,  0.0010396000000000 ]  - [  -0.0004728200000000, -0.0001406200000000,  0.0002089800000000 ]  - [   0.0002946900000000,  0.0004627000000000,  0.0006571500000000 ]  - [   0.0000337400000000, -0.0018835700000000,  0.0017113500000000 ]  - [   0.0041061800000000, -0.0016047500000000, -0.0015671200000000 ]  - [   0.0000695100000000, -0.0006709900000000, -0.0009839900000000 ]  - [  -0.0033555500000000,  0.0019961200000000, -0.0017587700000000 ]  - [   0.0048335100000000, -0.0148002000000000, -0.0093581400000000 ]  - [  -0.0012115700000000,  0.0011108900000000,  0.0005154000000000 ]  - [   0.0197936700000000,  0.0177450400000000,  0.0344895100000000 ]  - [   0.0006780400000000,  0.0005837300000000,  0.0000779600000000 ]  - [   0.0029767700000000, -0.0007005400000000,  0.0017794100000000 ]  - [   0.0019323200000000,  0.0264529100000000,  0.0060105500000000 ]  - [  -0.0001402700000000, -0.0005474900000000, -0.0000105300000000 ]  - [  -0.0006224300000000,  0.0004262600000000,  0.0011126000000000 ]  - [   0.0033485600000000,  0.0028394600000000, -0.0015308700000000 ]  - [   0.0027201600000000,  0.0020823800000000, -0.0018570100000000 ]  - [   0.0319326300000000,  0.0032295800000000,  0.0142062700000000 ]  - [  -0.0038934700000000, -0.0038457000000000,  0.0014441500000000 ]  - [  -0.0008262900000000, -0.0000522500000000, -0.0011626000000000 ]  - [   0.0018613100000000,  0.0003266500000000, -0.0017748400000000 ]  - [   0.1472996000000000,  0.0859746000000000,  0.0758373300000000 ]- atom:   37  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000566300000000, -0.0055828100000000,  0.0021011300000000 ]  - [  -0.0001441600000000, -0.0000259500000000,  0.0001437100000000 ]  - [   0.0004197300000000,  0.0006129300000000,  0.0004215300000000 ]  - [   0.0143568600000000,  0.0064446400000000,  0.0118977400000000 ]  - [  -0.0002745500000000,  0.0000880200000000,  0.0001361300000000 ]  - [   0.0009086900000000,  0.0004997000000000, -0.0013198100000000 ]  - [  -0.0000944500000000, -0.0001210500000000,  0.0008752900000000 ]  - [   0.0001789700000000, -0.0000240100000000,  0.0000829400000000 ]  - [   0.0000803500000000,  0.0017034000000000, -0.0009907500000000 ]  - [   0.0012988000000000, -0.0008219400000000, -0.0005402400000000 ]  - [  -0.0005337500000000,  0.0008210900000000, -0.0003279900000000 ]  - [  -0.0007170700000000, -0.0004417800000000,  0.0002914800000000 ]  - [   0.0000757000000000,  0.0001488500000000,  0.0003790800000000 ]  - [   0.0004560900000000, -0.0003887100000000, -0.0022265400000000 ]  - [   0.0007917400000000, -0.0006369100000000,  0.0003016000000000 ]  - [  -0.0116047500000000, -0.0040829900000000, -0.0040735600000000 ]  - [   0.0002454400000000, -0.0009389100000000,  0.0000242900000000 ]  - [   0.0079666200000000,  0.0060902200000000,  0.0030756400000000 ]  - [   0.0001231200000000, -0.0028406200000000, -0.0006742000000000 ]  - [   0.0003059400000000, -0.0000049100000000,  0.0004403800000000 ]  - [   0.0047590400000000,  0.0003612900000000, -0.0022367100000000 ]  - [  -0.0000350600000000, -0.0005626100000000, -0.0004231500000000 ]  - [  -0.0010874200000000, -0.0000639100000000,  0.0006834800000000 ]  - [   0.0032161700000000,  0.0001177700000000,  0.0012102600000000 ]  - [  -0.0005899000000000,  0.0003537900000000,  0.0006067600000000 ]  - [  -0.0004695600000000, -0.0002617000000000,  0.0009830300000000 ]  - [   0.0006173000000000, -0.0005641300000000, -0.0001459900000000 ]  - [   0.0030611100000000,  0.0056694000000000, -0.0041581400000000 ]  - [   0.0009485700000000,  0.0002488900000000,  0.0002879900000000 ]  - [   0.0008682900000000,  0.0005915300000000, -0.0005408200000000 ]  - [  -0.0043745000000000,  0.0029850300000000, -0.0028292700000000 ]  - [  -0.0001469800000000,  0.0002993700000000,  0.0003562300000000 ]  - [   0.0032673700000000, -0.0016658700000000,  0.0006130100000000 ]  - [  -0.0019002200000000, -0.0006921100000000,  0.0004511600000000 ]  - [  -0.0036601400000000, -0.0002414100000000, -0.0023125000000000 ]  - [   0.0051250500000000, -0.0073876000000000,  0.0038198700000000 ]  - [   0.1840783100000000,  0.0965600700000000,  0.0972160800000000 ]  - [  -0.0000408700000000,  0.0032356800000000, -0.0010023300000000 ]  - [   0.0006860600000000,  0.0000131000000000, -0.0003821700000000 ]  - [  -0.0013008400000000,  0.0008921100000000,  0.0019436600000000 ]  - [  -0.0008510200000000,  0.0005317500000000, -0.0009829500000000 ]  - [  -0.0009103400000000,  0.0000803100000000, -0.0005801000000000 ]  - [  -0.0058484500000000, -0.0038466200000000, -0.0020733500000000 ]  - [  -0.0006554000000000,  0.0003757400000000, -0.0008332500000000 ]  - [   0.0129270900000000,  0.0177825000000000,  0.0168806100000000 ]  - [   0.0006002800000000,  0.0018147700000000,  0.0010037400000000 ]  - [  -0.0001330300000000,  0.0000540900000000, -0.0002257000000000 ]  - [  -0.0022184100000000, -0.0018692200000000, -0.0000318700000000 ]  - [  -0.0002830600000000, -0.0003115600000000,  0.0001837600000000 ]  - [   0.0001752500000000,  0.0001663200000000, -0.0003956800000000 ]  - [   0.0014595200000000,  0.0001603500000000, -0.0014015900000000 ]  - [   0.0003763300000000,  0.0002402200000000, -0.0007197300000000 ]  - [  -0.0005103600000000, -0.0000753000000000, -0.0003155100000000 ]  - [  -0.0001300200000000,  0.0018073000000000, -0.0012194000000000 ]  - [  -0.0040441700000000,  0.0015231600000000,  0.0010810700000000 ]  - [  -0.0001675200000000,  0.0007589700000000,  0.0014850700000000 ]  - [   0.0034480300000000, -0.0019069900000000,  0.0012616700000000 ]  - [  -0.0049243500000000,  0.0145703200000000,  0.0087659300000000 ]  - [   0.0013138900000000, -0.0012131100000000, -0.0000253900000000 ]  - [  -0.0198498000000000, -0.0177758100000000, -0.0340477300000000 ]  - [  -0.0002827200000000, -0.0003772800000000, -0.0004351500000000 ]  - [  -0.0029042000000000,  0.0008000200000000, -0.0012938700000000 ]  - [  -0.0017740700000000, -0.0264235900000000, -0.0056466600000000 ]  - [  -0.0002593700000000,  0.0007638200000000, -0.0003445500000000 ]  - [   0.0008355500000000, -0.0000340400000000, -0.0007688100000000 ]  - [  -0.0035725300000000, -0.0032649700000000,  0.0019039200000000 ]  - [  -0.0023361000000000, -0.0023077800000000,  0.0015190800000000 ]  - [  -0.0327503900000000, -0.0032331600000000, -0.0150970400000000 ]  - [   0.0038882100000000,  0.0038739600000000, -0.0014739400000000 ]  - [   0.0008292600000000,  0.0000559600000000,  0.0011811700000000 ]  - [  -0.0018644700000000, -0.0003378600000000,  0.0017949300000000 ]  - [  -0.1465013700000000, -0.0827692100000000, -0.0733069700000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0009081100000000,  0.0025858400000000,  0.0003383200000000 ]  - [  -0.0013199200000000, -0.0015139800000000, -0.0005986900000000 ]  - [   0.0001875000000000, -0.0000058800000000, -0.0008598600000000 ]  - [  -0.0140877500000000,  0.0060939400000000, -0.0044058100000000 ]  - [   0.0002584400000000,  0.0000699000000000, -0.0002459400000000 ]  - [  -0.0007012100000000,  0.0012661400000000,  0.0013781200000000 ]  - [   0.0001845300000000, -0.0000290000000000, -0.0002175900000000 ]  - [  -0.0001278600000000,  0.0001750200000000, -0.0006071600000000 ]  - [  -0.0004644900000000, -0.0011558800000000, -0.0000558700000000 ]  - [   0.0001685600000000, -0.0006347600000000,  0.0002444800000000 ]  - [   0.0015661900000000, -0.0015239200000000,  0.0015363300000000 ]  - [  -0.0001727700000000, -0.0001409100000000, -0.0005715600000000 ]  - [   0.0000673000000000,  0.0002070500000000, -0.0002160600000000 ]  - [   0.0059193200000000,  0.0061991200000000, -0.0025251700000000 ]  - [   0.0000044000000000,  0.0002588200000000, -0.0002613300000000 ]  - [   0.0156041200000000, -0.0144786600000000, -0.0138377600000000 ]  - [   0.0000108000000000, -0.0000513400000000, -0.0000139300000000 ]  - [  -0.0010292100000000, -0.0003248900000000, -0.0006765300000000 ]  - [   0.0009704700000000, -0.0091128700000000, -0.0029431900000000 ]  - [  -0.0004880300000000, -0.0002409200000000, -0.0002154000000000 ]  - [  -0.0073767800000000,  0.0005498200000000,  0.0043976400000000 ]  - [  -0.0001704600000000, -0.0011695800000000,  0.0001950600000000 ]  - [   0.0002630100000000, -0.0008818300000000,  0.0000685100000000 ]  - [   0.0054805000000000,  0.0013878900000000,  0.0045934300000000 ]  - [  -0.0002120700000000,  0.0009168000000000, -0.0017066400000000 ]  - [   0.0001675500000000,  0.0001710900000000, -0.0002894900000000 ]  - [  -0.0006222700000000,  0.0011312700000000, -0.0003171800000000 ]  - [  -0.0015285100000000, -0.0012333700000000,  0.0006438700000000 ]  - [  -0.0003903400000000, -0.0010203500000000, -0.0002643000000000 ]  - [   0.0007137900000000,  0.0000221500000000, -0.0009677200000000 ]  - [   0.0053897800000000, -0.0073395000000000,  0.0045114500000000 ]  - [   0.0001883100000000, -0.0004784600000000, -0.0003775200000000 ]  - [   0.0002610900000000,  0.0005091500000000, -0.0011821900000000 ]  - [  -0.0012523100000000, -0.0017654900000000, -0.0007460500000000 ]  - [  -0.0053869600000000, -0.0086700300000000, -0.0035800700000000 ]  - [  -0.0015765300000000,  0.0045500900000000, -0.0001031200000000 ]  - [  -0.1015663800000000, -0.2539694700000000, -0.1546456800000000 ]  - [  -0.0000904100000000, -0.0007574000000000, -0.0002005600000000 ]  - [   0.0000926500000000,  0.0004112000000000,  0.0003291400000000 ]  - [  -0.0027878500000000, -0.0035138100000000,  0.0011094200000000 ]  - [  -0.0001347800000000, -0.0004874600000000,  0.0004552500000000 ]  - [  -0.0003664100000000,  0.0002458300000000,  0.0007352400000000 ]  - [   0.0003705800000000,  0.0002241200000000,  0.0005026100000000 ]  - [   0.0005128700000000,  0.0003735000000000,  0.0007339200000000 ]  - [   0.0023605200000000,  0.0200862000000000,  0.0316424400000000 ]  - [  -0.0009663000000000,  0.0063555600000000,  0.0015719500000000 ]  - [  -0.0001448300000000, -0.0005258200000000,  0.0010668100000000 ]  - [  -0.0000883400000000,  0.0021292700000000, -0.0021146700000000 ]  - [  -0.0004028900000000,  0.0026468000000000,  0.0002889800000000 ]  - [   0.0002550800000000, -0.0010891100000000,  0.0017009400000000 ]  - [  -0.0003425900000000, -0.0013624100000000,  0.0012522900000000 ]  - [   0.0004008300000000,  0.0003592900000000,  0.0006099700000000 ]  - [   0.0001645900000000,  0.0010760600000000,  0.0012844700000000 ]  - [   0.0000935300000000, -0.0009422700000000,  0.0001131700000000 ]  - [   0.0049667600000000, -0.0007059000000000, -0.0028029700000000 ]  - [  -0.0001213900000000,  0.0033774400000000,  0.0016568700000000 ]  - [  -0.0011425200000000,  0.0063588600000000, -0.0028810700000000 ]  - [  -0.0242504600000000,  0.0282884700000000,  0.0172953100000000 ]  - [   0.0016995400000000,  0.0015055000000000,  0.0023474400000000 ]  - [  -0.0024958200000000, -0.0129317500000000, -0.0023080900000000 ]  - [  -0.0005109900000000,  0.0005617700000000,  0.0009836500000000 ]  - [   0.0003488900000000, -0.0013717800000000,  0.0010533400000000 ]  - [   0.0269333300000000,  0.0253615100000000,  0.0079131600000000 ]  - [   0.0002709500000000,  0.0001613200000000,  0.0005691400000000 ]  - [  -0.0001247300000000,  0.0002209200000000,  0.0012006300000000 ]  - [  -0.0031521400000000,  0.0027489100000000, -0.0030552000000000 ]  - [   0.0016221900000000,  0.0024222700000000, -0.0013930000000000 ]  - [   0.0112772400000000, -0.0039234200000000,  0.0044109700000000 ]  - [   0.0000959200000000, -0.0069900900000000,  0.0029385300000000 ]  - [   0.0002561100000000, -0.0007243700000000, -0.0025303800000000 ]  - [   0.0003755500000000,  0.0014846500000000, -0.0029989500000000 ]  - [   0.0851854000000000,  0.2085731100000000,  0.1110438900000000 ]- atom:   37  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0007633500000000, -0.0025326400000000, -0.0006034500000000 ]  - [   0.0008978600000000,  0.0009392500000000,  0.0004031900000000 ]  - [  -0.0003389300000000, -0.0000937000000000,  0.0005838800000000 ]  - [   0.0141754800000000, -0.0065001400000000,  0.0046134800000000 ]  - [  -0.0003549700000000,  0.0000778800000000,  0.0005210400000000 ]  - [   0.0008485400000000, -0.0013711100000000, -0.0016527500000000 ]  - [  -0.0002823400000000, -0.0001196500000000,  0.0004969700000000 ]  - [   0.0002257700000000, -0.0000263300000000,  0.0008793300000000 ]  - [   0.0003120300000000,  0.0012659400000000, -0.0002314300000000 ]  - [   0.0002576700000000,  0.0000544300000000, -0.0004464100000000 ]  - [  -0.0019868300000000,  0.0021014700000000, -0.0017351200000000 ]  - [  -0.0004052700000000, -0.0002827600000000,  0.0007674100000000 ]  - [   0.0005075700000000,  0.0002155900000000,  0.0004136000000000 ]  - [  -0.0054722700000000, -0.0055949100000000,  0.0023345500000000 ]  - [   0.0005752500000000, -0.0006878200000000,  0.0004600700000000 ]  - [  -0.0161453200000000,  0.0148516100000000,  0.0140357200000000 ]  - [   0.0001366800000000,  0.0001521000000000, -0.0002613200000000 ]  - [   0.0006601100000000, -0.0001986600000000,  0.0005058800000000 ]  - [  -0.0011172700000000,  0.0089661900000000,  0.0026659700000000 ]  - [   0.0005838400000000,  0.0000935400000000,  0.0004924200000000 ]  - [   0.0072217700000000, -0.0003847500000000, -0.0040837400000000 ]  - [   0.0003204000000000,  0.0010817400000000, -0.0004671600000000 ]  - [  -0.0003536100000000,  0.0007364500000000,  0.0002059800000000 ]  - [  -0.0053842000000000, -0.0012634300000000, -0.0043319600000000 ]  - [   0.0000641400000000, -0.0008272100000000,  0.0014356000000000 ]  - [   0.0002555700000000, -0.0007465300000000,  0.0000862700000000 ]  - [   0.0001973100000000, -0.0005523100000000,  0.0001203800000000 ]  - [   0.0009500400000000,  0.0007854300000000, -0.0004244400000000 ]  - [   0.0009596400000000,  0.0014431000000000,  0.0004578100000000 ]  - [  -0.0002963900000000,  0.0005519000000000,  0.0007775700000000 ]  - [  -0.0047806200000000,  0.0068900200000000, -0.0042912400000000 ]  - [  -0.0007649900000000,  0.0009043600000000,  0.0005757700000000 ]  - [  -0.0002467800000000, -0.0005132500000000,  0.0011919900000000 ]  - [   0.0012438400000000,  0.0017601800000000,  0.0007413900000000 ]  - [   0.0054110300000000,  0.0086791700000000,  0.0035930200000000 ]  - [   0.0015500100000000, -0.0045214600000000,  0.0000936200000000 ]  - [   0.0945065900000000,  0.2476589000000000,  0.1476632600000000 ]  - [  -0.0000031300000000,  0.0006886700000000,  0.0007057000000000 ]  - [  -0.0000016500000000, -0.0005049400000000, -0.0008339300000000 ]  - [   0.0026691200000000,  0.0035944500000000, -0.0006004600000000 ]  - [   0.0002207400000000,  0.0005894200000000, -0.0009663900000000 ]  - [   0.0002692900000000, -0.0003451200000000, -0.0012401600000000 ]  - [  -0.0003133500000000, -0.0003495100000000, -0.0000135600000000 ]  - [  -0.0009129000000000, -0.0005864500000000, -0.0010877400000000 ]  - [  -0.0020172400000000, -0.0195548400000000, -0.0312442900000000 ]  - [   0.0010603500000000, -0.0062338600000000, -0.0010563900000000 ]  - [   0.0003570600000000,  0.0001295300000000, -0.0007158600000000 ]  - [  -0.0003158400000000, -0.0019162800000000,  0.0017656200000000 ]  - [   0.0006103600000000, -0.0022449600000000,  0.0000659900000000 ]  - [  -0.0004666500000000,  0.0006861000000000, -0.0013452600000000 ]  - [   0.0007396800000000,  0.0011527100000000, -0.0016001100000000 ]  - [  -0.0004883600000000, -0.0002620800000000, -0.0011162300000000 ]  - [  -0.0003750400000000, -0.0006784000000000, -0.0009330600000000 ]  - [  -0.0001837300000000,  0.0008452300000000,  0.0003952200000000 ]  - [  -0.0048293200000000,  0.0005996400000000,  0.0022779700000000 ]  - [   0.0000261900000000, -0.0032991600000000, -0.0011687600000000 ]  - [   0.0012081300000000, -0.0062522200000000,  0.0023634900000000 ]  - [   0.0245756900000000, -0.0287579200000000, -0.0181340800000000 ]  - [  -0.0016112100000000, -0.0015927900000000, -0.0018520300000000 ]  - [   0.0018837900000000,  0.0125156800000000,  0.0017689800000000 ]  - [   0.0009157600000000, -0.0003495700000000, -0.0013399300000000 ]  - [  -0.0002455700000000,  0.0014593200000000, -0.0005456800000000 ]  - [  -0.0259488000000000, -0.0251131400000000, -0.0074670600000000 ]  - [  -0.0006730100000000,  0.0000421300000000, -0.0009227200000000 ]  - [   0.0003362500000000,  0.0001768700000000, -0.0008498600000000 ]  - [   0.0029518400000000, -0.0031325500000000,  0.0034055600000000 ]  - [  -0.0012255700000000, -0.0026357000000000,  0.0010450400000000 ]  - [  -0.0112927700000000,  0.0041025900000000, -0.0048829700000000 ]  - [  -0.0000879800000000,  0.0069810600000000, -0.0029393700000000 ]  - [  -0.0002607600000000,  0.0007253900000000,  0.0025357700000000 ]  - [  -0.0003718700000000, -0.0014757500000000,  0.0029952000000000 ]  - [  -0.0793674900000000, -0.2019961400000000, -0.1040557800000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0005125800000000,  0.0054289100000000, -0.0021279300000000 ]  - [  -0.0014553000000000, -0.0013868700000000, -0.0008799200000000 ]  - [   0.0000742100000000, -0.0007808300000000, -0.0010927600000000 ]  - [  -0.0146954600000000, -0.0017164100000000, -0.0006593100000000 ]  - [   0.0007205100000000,  0.0001628200000000, -0.0006211800000000 ]  - [   0.0003923100000000,  0.0016346200000000,  0.0008720300000000 ]  - [   0.0006649100000000, -0.0001349600000000, -0.0009431100000000 ]  - [  -0.0006516000000000,  0.0002509300000000, -0.0009115500000000 ]  - [   0.0000928100000000, -0.0021177900000000,  0.0012565300000000 ]  - [  -0.0009487600000000,  0.0004823000000000,  0.0009197600000000 ]  - [   0.0016992600000000, -0.0008914900000000,  0.0012944400000000 ]  - [   0.0002836100000000,  0.0003313800000000, -0.0009723800000000 ]  - [  -0.0003032900000000, -0.0003215700000000, -0.0009044100000000 ]  - [   0.0054540800000000,  0.0037097600000000, -0.0027653300000000 ]  - [  -0.0003745900000000,  0.0006734200000000, -0.0006722900000000 ]  - [   0.0105363700000000, -0.0143519400000000,  0.0009888700000000 ]  - [  -0.0000756000000000,  0.0009889500000000, -0.0005738600000000 ]  - [  -0.0077226000000000, -0.0069934600000000, -0.0038274100000000 ]  - [   0.0005792200000000, -0.0088726600000000, -0.0033766700000000 ]  - [  -0.0007250000000000, -0.0002604800000000, -0.0005546900000000 ]  - [  -0.0012734400000000, -0.0001357700000000,  0.0013292000000000 ]  - [  -0.0000263700000000, -0.0006291300000000, -0.0004165900000000 ]  - [  -0.0008224900000000, -0.0002087800000000,  0.0010712700000000 ]  - [   0.0036006700000000,  0.0015245800000000,  0.0037113700000000 ]  - [  -0.0001154800000000,  0.0002281700000000, -0.0019470800000000 ]  - [   0.0002006100000000, -0.0002243400000000, -0.0014033500000000 ]  - [  -0.0005833100000000,  0.0011873400000000, -0.0008677700000000 ]  - [  -0.0017053600000000, -0.0035270600000000,  0.0031454100000000 ]  - [   0.0007449800000000,  0.0007099800000000,  0.0007718200000000 ]  - [   0.0009113400000000,  0.0004750500000000, -0.0009270300000000 ]  - [   0.0015350000000000, -0.0013177300000000,  0.0019490400000000 ]  - [   0.0003364500000000, -0.0006856100000000, -0.0007509100000000 ]  - [  -0.0005370800000000,  0.0005602500000000, -0.0027204800000000 ]  - [  -0.0007464900000000, -0.0004186900000000, -0.0021910000000000 ]  - [  -0.0024686600000000, -0.0045935800000000, -0.0024146600000000 ]  - [  -0.0022929400000000,  0.0039096900000000, -0.0014957400000000 ]  - [  -0.1005279000000000, -0.1539093400000000, -0.1936274700000000 ]  - [   0.0007864200000000, -0.0028967500000000,  0.0009780100000000 ]  - [  -0.0000937400000000,  0.0005001800000000,  0.0013853800000000 ]  - [  -0.0026043900000000, -0.0023255900000000,  0.0014209900000000 ]  - [  -0.0000608400000000, -0.0007686500000000,  0.0014874100000000 ]  - [   0.0002679400000000,  0.0005234800000000,  0.0015521100000000 ]  - [   0.0050911700000000,  0.0045458900000000,  0.0026763100000000 ]  - [   0.0009636800000000, -0.0003630000000000,  0.0016117500000000 ]  - [   0.0021983600000000,  0.0347725100000000,  0.0168567400000000 ]  - [  -0.0008886400000000,  0.0059596200000000,  0.0020865900000000 ]  - [  -0.0002937600000000, -0.0010932800000000,  0.0019664100000000 ]  - [  -0.0021422300000000, -0.0000321500000000, -0.0031171500000000 ]  - [   0.0001103100000000,  0.0003070600000000, -0.0017764700000000 ]  - [   0.0004613500000000, -0.0017233400000000,  0.0029305600000000 ]  - [  -0.0012280700000000, -0.0013267100000000,  0.0033157700000000 ]  - [   0.0002786800000000, -0.0002234300000000,  0.0012906600000000 ]  - [   0.0003828400000000,  0.0013100400000000,  0.0020254200000000 ]  - [   0.0003405500000000, -0.0013603000000000,  0.0015150800000000 ]  - [   0.0012632600000000, -0.0011776700000000, -0.0015450900000000 ]  - [  -0.0004615700000000,  0.0016244800000000,  0.0016536000000000 ]  - [   0.0004560600000000,  0.0019418100000000, -0.0018060600000000 ]  - [  -0.0156621500000000,  0.0194684100000000,  0.0046904800000000 ]  - [   0.0011904400000000,  0.0013652000000000,  0.0022604800000000 ]  - [   0.0316244900000000,  0.0171327800000000,  0.0168527000000000 ]  - [  -0.0007143400000000,  0.0007600800000000,  0.0016126400000000 ]  - [   0.0007769500000000, -0.0005990400000000,  0.0018355600000000 ]  - [  -0.0058104200000000, -0.0080222100000000, -0.0150536100000000 ]  - [   0.0005498000000000,  0.0002760600000000,  0.0021161800000000 ]  - [  -0.0008355200000000,  0.0012261100000000,  0.0028489000000000 ]  - [  -0.0018247400000000,  0.0030296700000000, -0.0041773000000000 ]  - [   0.0014187900000000,  0.0015832400000000, -0.0029009800000000 ]  - [   0.0190809800000000,  0.0018483700000000,  0.0033363700000000 ]  - [   0.0013877300000000, -0.0031415800000000,  0.0068243100000000 ]  - [  -0.0000560200000000, -0.0002744300000000, -0.0045113400000000 ]  - [   0.0012988800000000,  0.0011649200000000, -0.0072493900000000 ]  - [   0.0734857000000000,  0.1072085600000000,  0.1673421400000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0006657900000000, -0.0053107100000000,  0.0018487400000000 ]  - [   0.0010297500000000,  0.0008102500000000,  0.0006816800000000 ]  - [  -0.0002220600000000,  0.0006852900000000,  0.0008167400000000 ]  - [   0.0148947700000000,  0.0014963000000000,  0.0009721900000000 ]  - [  -0.0008186000000000, -0.0000154400000000,  0.0008976100000000 ]  - [  -0.0002496300000000, -0.0017328900000000, -0.0011438700000000 ]  - [  -0.0007647000000000, -0.0000123800000000,  0.0012192100000000 ]  - [   0.0007510600000000, -0.0001030800000000,  0.0011879200000000 ]  - [  -0.0002366100000000,  0.0022137700000000, -0.0015271100000000 ]  - [   0.0013740800000000, -0.0010575900000000, -0.0011156300000000 ]  - [  -0.0021211000000000,  0.0014639000000000, -0.0014884700000000 ]  - [  -0.0008629300000000, -0.0007591000000000,  0.0011700800000000 ]  - [   0.0008816200000000,  0.0007489600000000,  0.0011033500000000 ]  - [  -0.0050127100000000, -0.0031074400000000,  0.0025686400000000 ]  - [   0.0009519700000000, -0.0010986300000000,  0.0008704100000000 ]  - [  -0.0111822600000000,  0.0147252000000000, -0.0008503400000000 ]  - [   0.0002240000000000, -0.0008952700000000,  0.0002967200000000 ]  - [   0.0072499900000000,  0.0063511600000000,  0.0035944500000000 ]  - [  -0.0007283600000000,  0.0086971200000000,  0.0030644400000000 ]  - [   0.0008233300000000,  0.0001122300000000,  0.0008313100000000 ]  - [   0.0012295300000000,  0.0002771500000000, -0.0010838700000000 ]  - [   0.0001731000000000,  0.0005282500000000,  0.0001356200000000 ]  - [   0.0007202000000000,  0.0000609100000000, -0.0007907400000000 ]  - [  -0.0034836200000000, -0.0013853400000000, -0.0034361700000000 ]  - [  -0.0000312200000000, -0.0001256800000000,  0.0016718700000000 ]  - [   0.0002284100000000, -0.0003554800000000,  0.0012099000000000 ]  - [   0.0001560300000000, -0.0006114500000000,  0.0006686800000000 ]  - [   0.0011291600000000,  0.0031022000000000, -0.0029497400000000 ]  - [  -0.0001620100000000, -0.0002798200000000, -0.0005710600000000 ]  - [  -0.0004843400000000,  0.0001037800000000,  0.0007270600000000 ]  - [  -0.0010033600000000,  0.0009333400000000, -0.0017840600000000 ]  - [  -0.0009139600000000,  0.0011103000000000,  0.0009482300000000 ]  - [   0.0005327200000000, -0.0005574500000000,  0.0027205900000000 ]  - [   0.0007404400000000,  0.0004142400000000,  0.0021926500000000 ]  - [   0.0024584600000000,  0.0046012000000000,  0.0024037900000000 ]  - [   0.0023028300000000, -0.0039236500000000,  0.0014863300000000 ]  - [   0.0961535800000000,  0.1483485100000000,  0.1904707600000000 ]  - [  -0.0008895800000000,  0.0027946400000000, -0.0004689800000000 ]  - [   0.0001877000000000, -0.0006011400000000, -0.0018951500000000 ]  - [   0.0025004700000000,  0.0024109900000000, -0.0009142000000000 ]  - [   0.0001564500000000,  0.0008704700000000, -0.0019970600000000 ]  - [  -0.0003624200000000, -0.0006263900000000, -0.0020586300000000 ]  - [  -0.0049490400000000, -0.0046011000000000, -0.0021409300000000 ]  - [  -0.0013634300000000,  0.0001548000000000, -0.0019656000000000 ]  - [  -0.0018846600000000, -0.0337579600000000, -0.0168661500000000 ]  - [   0.0009881100000000, -0.0058071800000000, -0.0015543900000000 ]  - [   0.0005053800000000,  0.0006946300000000, -0.0016141000000000 ]  - [   0.0017467100000000,  0.0002468500000000,  0.0027644200000000 ]  - [   0.0000999600000000,  0.0000847800000000,  0.0021265600000000 ]  - [  -0.0006721400000000,  0.0013274900000000, -0.0025807600000000 ]  - [   0.0016294000000000,  0.0011192200000000, -0.0036810400000000 ]  - [  -0.0003708600000000,  0.0003274400000000, -0.0018009400000000 ]  - [  -0.0005938900000000, -0.0009124000000000, -0.0016733000000000 ]  - [  -0.0004470900000000,  0.0012743000000000, -0.0010118700000000 ]  - [  -0.0012049600000000,  0.0010836000000000,  0.0010627400000000 ]  - [   0.0003614300000000, -0.0015316200000000, -0.0011462100000000 ]  - [  -0.0003403400000000, -0.0018655600000000,  0.0013205500000000 ]  - [   0.0156947300000000, -0.0196900900000000, -0.0051618200000000 ]  - [  -0.0010878100000000, -0.0014630000000000, -0.0017585800000000 ]  - [  -0.0312546600000000, -0.0171022300000000, -0.0168701900000000 ]  - [   0.0011121100000000, -0.0005520400000000, -0.0019650900000000 ]  - [  -0.0006783200000000,  0.0006928900000000, -0.0013324200000000 ]  - [   0.0058456200000000,  0.0073565300000000,  0.0152989200000000 ]  - [  -0.0009462100000000, -0.0000624000000000, -0.0024703700000000 ]  - [   0.0010490700000000, -0.0008295100000000, -0.0024994300000000 ]  - [   0.0016105400000000, -0.0034313400000000,  0.0045323000000000 ]  - [  -0.0010275800000000, -0.0018002500000000,  0.0025474400000000 ]  - [  -0.0193589100000000, -0.0017401300000000, -0.0038621500000000 ]  - [  -0.0013851500000000,  0.0031507600000000, -0.0068305100000000 ]  - [   0.0000575400000000,  0.0002745600000000,  0.0045084000000000 ]  - [  -0.0013075700000000, -0.0011712000000000,  0.0072585000000000 ]  - [  -0.0698139800000000, -0.1017710800000000, -0.1643178600000000 ]- atom:   38  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0432321300000000, -0.0447339000000000, -0.0019949300000000 ]  - [  -0.0004365100000000, -0.0003516800000000,  0.0001650300000000 ]  - [  -0.0000581900000000,  0.0000740600000000, -0.0000024000000000 ]  - [  -0.0007175600000000, -0.0000908100000000, -0.0001467600000000 ]  - [  -0.0048096600000000, -0.0008859000000000, -0.0001435500000000 ]  - [  -0.0010687300000000, -0.0010253700000000, -0.0008241700000000 ]  - [   0.0015291200000000, -0.0006576900000000, -0.0009432500000000 ]  - [  -0.0005350000000000, -0.0000600400000000,  0.0002376300000000 ]  - [   0.0006020400000000,  0.0036083200000000, -0.0021154200000000 ]  - [   0.1777388100000000, -0.0996212800000000, -0.1178493100000000 ]  - [  -0.0056548300000000,  0.0026219600000000, -0.0023412200000000 ]  - [  -0.0002815000000000, -0.0006241600000000,  0.0005775000000000 ]  - [   0.0021960000000000,  0.0031650300000000,  0.0026839600000000 ]  - [  -0.0006730000000000,  0.0001285200000000, -0.0000320300000000 ]  - [  -0.0010816700000000,  0.0003846400000000, -0.0011088700000000 ]  - [   0.0001287000000000,  0.0000051900000000, -0.0004350300000000 ]  - [   0.0000360000000000, -0.0000785000000000,  0.0000700300000000 ]  - [   0.0013779400000000,  0.0000882700000000,  0.0007210200000000 ]  - [   0.0013206700000000, -0.0029501500000000, -0.0018012700000000 ]  - [   0.0013261500000000,  0.0006596000000000, -0.0004007800000000 ]  - [   0.0007595600000000,  0.0002653500000000,  0.0000547600000000 ]  - [   0.0001781700000000,  0.0002081400000000,  0.0000954400000000 ]  - [  -0.0023487800000000,  0.0000466500000000,  0.0007072800000000 ]  - [   0.0016410500000000, -0.0000915000000000,  0.0009257800000000 ]  - [  -0.0001519100000000, -0.0000810800000000,  0.0002113400000000 ]  - [  -0.0002457800000000,  0.0000058900000000,  0.0001758100000000 ]  - [   0.0002397800000000,  0.0000447400000000,  0.0001429600000000 ]  - [  -0.0013497300000000, -0.0014972900000000,  0.0008647300000000 ]  - [   0.0008821800000000,  0.0014145600000000,  0.0011142500000000 ]  - [   0.0003002000000000,  0.0001994300000000,  0.0000629700000000 ]  - [   0.0001536200000000,  0.0000418500000000, -0.0002743600000000 ]  - [  -0.0005640900000000,  0.0002599800000000,  0.0000595700000000 ]  - [  -0.0018984200000000, -0.0008211300000000, -0.0003497700000000 ]  - [   0.0508042000000000,  0.0147317900000000, -0.0237063300000000 ]  - [   0.0001302100000000, -0.0001966800000000,  0.0003917000000000 ]  - [  -0.0001629200000000,  0.0001396100000000,  0.0007968800000000 ]  - [  -0.0001035300000000,  0.0001593100000000,  0.0010235700000000 ]  - [  -0.3099305400000000,  0.1410994400000000,  0.1702549400000000 ]  - [   0.0152143400000000, -0.0006317100000000, -0.0134589700000000 ]  - [   0.0015293000000000,  0.0004550800000000,  0.0005960900000000 ]  - [   0.0013680700000000,  0.0018579600000000,  0.0020145900000000 ]  - [   0.0010358700000000,  0.0004840100000000, -0.0001472400000000 ]  - [  -0.0007426000000000, -0.0021433600000000,  0.0010295600000000 ]  - [   0.0001181300000000,  0.0000829100000000, -0.0004450500000000 ]  - [  -0.0004350600000000,  0.0016575700000000,  0.0009466700000000 ]  - [   0.0119309300000000,  0.0114797100000000,  0.0010298700000000 ]  - [   0.0030417800000000,  0.0000994400000000, -0.0005439200000000 ]  - [   0.0060968500000000,  0.0020453600000000,  0.0017183100000000 ]  - [   0.0059990000000000, -0.0001533700000000, -0.0048336000000000 ]  - [   0.0000098600000000, -0.0001286100000000, -0.0002312900000000 ]  - [   0.0004920400000000, -0.0002362700000000, -0.0007478900000000 ]  - [  -0.0036146000000000,  0.0006295600000000, -0.0001278500000000 ]  - [  -0.0000198400000000,  0.0003331300000000,  0.0005769600000000 ]  - [   0.0003431000000000, -0.0000905900000000, -0.0002024900000000 ]  - [  -0.0005560000000000, -0.0008168800000000, -0.0008796400000000 ]  - [  -0.0001698400000000, -0.0000027400000000, -0.0001592200000000 ]  - [   0.0014326000000000, -0.0000429200000000, -0.0004083300000000 ]  - [  -0.0011311900000000,  0.0001310600000000, -0.0002378700000000 ]  - [   0.0001601600000000,  0.0001265500000000, -0.0002527900000000 ]  - [  -0.0041608800000000, -0.0034537000000000,  0.0016869900000000 ]  - [   0.0006511200000000,  0.0001721700000000, -0.0007204200000000 ]  - [  -0.0002643800000000,  0.0000336500000000, -0.0001267000000000 ]  - [  -0.0004331300000000, -0.0012301700000000,  0.0011355300000000 ]  - [  -0.0007329100000000, -0.0003748900000000, -0.0009915700000000 ]  - [  -0.0011537800000000, -0.0014586000000000, -0.0009623300000000 ]  - [   0.0011605200000000,  0.0025189800000000, -0.0023749600000000 ]  - [   0.0286853700000000, -0.0148678300000000, -0.0197649000000000 ]  - [   0.0009189300000000,  0.0008189200000000, -0.0007454000000000 ]  - [  -0.0176810400000000, -0.0145924200000000,  0.0111285300000000 ]  - [  -0.0013049400000000, -0.0012178500000000,  0.0004096400000000 ]  - [  -0.0002010400000000,  0.0009901700000000,  0.0017866000000000 ]  - [  -0.0000909400000000,  0.0019404800000000, -0.0025646600000000 ]- atom:   38  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0421086500000000,  0.0423390100000000,  0.0028094500000000 ]  - [   0.0000082800000000, -0.0002275800000000, -0.0003681900000000 ]  - [  -0.0000892700000000, -0.0001744400000000, -0.0002776500000000 ]  - [   0.0008034900000000, -0.0000589400000000,  0.0004193500000000 ]  - [   0.0047152500000000,  0.0010430600000000,  0.0004455200000000 ]  - [   0.0012130600000000,  0.0009310500000000,  0.0005555000000000 ]  - [  -0.0016133300000000,  0.0005113900000000,  0.0012226600000000 ]  - [   0.0006306900000000,  0.0002089900000000,  0.0000386400000000 ]  - [  -0.0007586600000000, -0.0035255600000000,  0.0018553900000000 ]  - [  -0.1705641400000000,  0.0904178000000000,  0.1099182000000000 ]  - [   0.0052507500000000, -0.0020397200000000,  0.0021479400000000 ]  - [  -0.0002881200000000,  0.0002164700000000, -0.0003743300000000 ]  - [  -0.0016361700000000, -0.0027556400000000, -0.0024899900000000 ]  - [   0.0010846300000000,  0.0004362500000000, -0.0001547800000000 ]  - [   0.0016544500000000, -0.0008164700000000,  0.0012983500000000 ]  - [  -0.0007036300000000,  0.0004130100000000,  0.0006274900000000 ]  - [   0.0001111500000000,  0.0001788300000000, -0.0003503600000000 ]  - [  -0.0017715600000000, -0.0006483500000000, -0.0008993200000000 ]  - [  -0.0014874500000000,  0.0028654300000000,  0.0015449300000000 ]  - [  -0.0012362400000000, -0.0008000800000000,  0.0006564500000000 ]  - [  -0.0008456500000000, -0.0001156900000000,  0.0002154500000000 ]  - [  -0.0000306800000000, -0.0003047200000000, -0.0003759000000000 ]  - [   0.0022617700000000, -0.0001954200000000, -0.0004328200000000 ]  - [  -0.0015432400000000,  0.0002406300000000, -0.0006518300000000 ]  - [   0.0000035200000000,  0.0001776300000000, -0.0004912800000000 ]  - [   0.0006714800000000, -0.0005841800000000, -0.0003764500000000 ]  - [  -0.0006661300000000,  0.0005338700000000, -0.0003438600000000 ]  - [   0.0007752300000000,  0.0010745900000000, -0.0006673000000000 ]  - [  -0.0003091900000000, -0.0009949200000000, -0.0009209600000000 ]  - [   0.0001282300000000,  0.0003808200000000, -0.0002657500000000 ]  - [   0.0004107900000000, -0.0004526200000000,  0.0004661700000000 ]  - [  -0.0000152000000000,  0.0001693100000000,  0.0001408800000000 ]  - [   0.0019005700000000,  0.0008061100000000,  0.0003650700000000 ]  - [  -0.0521907200000000, -0.0163118600000000,  0.0254686900000000 ]  - [  -0.0001308200000000,  0.0001990200000000, -0.0004063300000000 ]  - [   0.0001644100000000, -0.0001424300000000, -0.0008087000000000 ]  - [  -0.0000830200000000,  0.0002435900000000, -0.0006550100000000 ]  - [   0.3038439300000000, -0.1280470500000000, -0.1652615100000000 ]  - [  -0.0153284100000000,  0.0005421800000000,  0.0131985700000000 ]  - [  -0.0016219200000000, -0.0003551700000000, -0.0001085000000000 ]  - [  -0.0012734800000000, -0.0017274600000000, -0.0024997900000000 ]  - [  -0.0011293800000000, -0.0005857800000000, -0.0003550500000000 ]  - [   0.0008254600000000,  0.0020527100000000, -0.0005516200000000 ]  - [  -0.0005042600000000, -0.0002989300000000,  0.0001081300000000 ]  - [   0.0008683700000000, -0.0014671800000000, -0.0013140500000000 ]  - [  -0.0119305800000000, -0.0115640200000000, -0.0005287400000000 ]  - [  -0.0028385000000000, -0.0004951900000000,  0.0009089900000000 ]  - [  -0.0065140800000000, -0.0018555400000000, -0.0020882600000000 ]  - [  -0.0058106000000000,  0.0005275600000000,  0.0052034600000000 ]  - [  -0.0002269200000000, -0.0002782200000000,  0.0005913700000000 ]  - [  -0.0000992700000000,  0.0000224400000000,  0.0004039500000000 ]  - [   0.0035059100000000, -0.0005455200000000, -0.0003514200000000 ]  - [  -0.0001851300000000,  0.0000557900000000, -0.0002132300000000 ]  - [  -0.0004448700000000, -0.0000024200000000,  0.0007103300000000 ]  - [   0.0006429700000000,  0.0007213100000000,  0.0003907300000000 ]  - [   0.0000661100000000,  0.0000962600000000,  0.0006675100000000 ]  - [  -0.0013400500000000,  0.0001325900000000, -0.0000817300000000 ]  - [   0.0010383600000000, -0.0002267500000000, -0.0002523400000000 ]  - [  -0.0000573300000000, -0.0002189500000000,  0.0007621300000000 ]  - [   0.0038671200000000,  0.0030040000000000, -0.0019008600000000 ]  - [  -0.0002663100000000,  0.0000435700000000,  0.0003839500000000 ]  - [   0.0003645900000000,  0.0000613400000000,  0.0006349600000000 ]  - [   0.0006672900000000,  0.0008005400000000, -0.0007438100000000 ]  - [   0.0003443600000000,  0.0005881100000000,  0.0006497600000000 ]  - [   0.0013715200000000,  0.0018538700000000,  0.0013153600000000 ]  - [  -0.0013742300000000, -0.0029334500000000,  0.0027264000000000 ]  - [  -0.0283641300000000,  0.0144956400000000,  0.0193984900000000 ]  - [  -0.0010063800000000, -0.0007193900000000,  0.0002510300000000 ]  - [   0.0177744000000000,  0.0147474600000000, -0.0111719900000000 ]  - [   0.0013033700000000,  0.0012213600000000, -0.0004479400000000 ]  - [   0.0001945700000000, -0.0009825400000000, -0.0018048800000000 ]  - [  -0.0000784100000000, -0.0019013700000000,  0.0024852400000000 ]- atom:   38  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0314312700000000,  0.2962851400000000, -0.1426021300000000 ]  - [   0.0000199800000000, -0.0000476900000000, -0.0000256400000000 ]  - [  -0.0001125500000000,  0.0002652000000000, -0.0001080900000000 ]  - [   0.0015574800000000,  0.0000936100000000,  0.0007950200000000 ]  - [   0.0010803100000000,  0.0004645800000000,  0.0009319500000000 ]  - [   0.0000262900000000,  0.0015061400000000,  0.0006006500000000 ]  - [   0.0000602800000000, -0.0009546300000000, -0.0013717200000000 ]  - [  -0.0002228300000000, -0.0001597800000000,  0.0001516400000000 ]  - [  -0.0000970200000000, -0.0034684300000000,  0.0009149900000000 ]  - [  -0.1062782200000000,  0.1177881600000000,  0.0573532800000000 ]  - [  -0.0011871100000000,  0.0024884900000000, -0.0009152600000000 ]  - [  -0.0044292200000000, -0.0036680000000000,  0.0002206300000000 ]  - [   0.0010630700000000,  0.0001837300000000, -0.0015653800000000 ]  - [   0.0012333400000000,  0.0005340200000000, -0.0005777400000000 ]  - [  -0.0005686800000000,  0.0008544300000000, -0.0005945000000000 ]  - [  -0.0008140800000000,  0.0015107200000000,  0.0011233200000000 ]  - [   0.0000858000000000, -0.0001749100000000, -0.0000633000000000 ]  - [  -0.0042516900000000, -0.0036364900000000, -0.0025206700000000 ]  - [  -0.0000106600000000, -0.0043691400000000, -0.0018247400000000 ]  - [   0.0028731200000000, -0.0003414700000000,  0.0023301700000000 ]  - [  -0.0016449300000000, -0.0003980800000000,  0.0008974700000000 ]  - [   0.0000899200000000, -0.0002987900000000,  0.0001287400000000 ]  - [   0.0016039600000000, -0.0002543000000000, -0.0006552400000000 ]  - [  -0.0008962600000000,  0.0005900600000000, -0.0000772100000000 ]  - [  -0.0000698800000000,  0.0000728700000000, -0.0000958000000000 ]  - [   0.0003048600000000, -0.0003954800000000, -0.0000197400000000 ]  - [  -0.0001354100000000,  0.0001232600000000, -0.0000139000000000 ]  - [   0.0002946900000000,  0.0008382000000000, -0.0003445000000000 ]  - [  -0.0004761300000000, -0.0011729600000000, -0.0007886200000000 ]  - [   0.0001913300000000,  0.0003585800000000,  0.0000669300000000 ]  - [   0.0018413400000000, -0.0025199200000000,  0.0009209400000000 ]  - [  -0.0000765800000000, -0.0003069900000000,  0.0001326400000000 ]  - [  -0.0010660000000000, -0.0019168500000000, -0.0001345800000000 ]  - [   0.0159327300000000,  0.0447739800000000, -0.0181049500000000 ]  - [   0.0000543600000000,  0.0003858100000000,  0.0002914900000000 ]  - [  -0.0000438900000000, -0.0002566500000000,  0.0002277600000000 ]  - [  -0.0033863800000000, -0.0005221400000000, -0.0026691400000000 ]  - [   0.1342289200000000, -0.5153551600000000,  0.1148105900000000 ]  - [  -0.0068347700000000, -0.0036284200000000,  0.0048707900000000 ]  - [  -0.0004544300000000, -0.0005846600000000,  0.0001869700000000 ]  - [   0.0020474600000000,  0.0013802200000000,  0.0015971800000000 ]  - [   0.0005043900000000,  0.0010349700000000, -0.0001275600000000 ]  - [   0.0021481600000000,  0.0038776600000000,  0.0010739000000000 ]  - [  -0.0006408200000000, -0.0005312200000000, -0.0004984900000000 ]  - [  -0.0046977400000000,  0.0041831100000000,  0.0010546600000000 ]  - [   0.0115153400000000,  0.0054433100000000,  0.0003943900000000 ]  - [  -0.0006445500000000, -0.0016165000000000,  0.0008252000000000 ]  - [  -0.0013865100000000, -0.0033098100000000,  0.0002160100000000 ]  - [  -0.0037217000000000,  0.0004796500000000,  0.0047677200000000 ]  - [   0.0006045900000000,  0.0031416800000000, -0.0013992800000000 ]  - [  -0.0001250600000000,  0.0007619700000000, -0.0004867400000000 ]  - [   0.0068074100000000,  0.0152278700000000, -0.0142840500000000 ]  - [  -0.0019521000000000, -0.0006980400000000, -0.0011421800000000 ]  - [  -0.0000965400000000,  0.0002050300000000,  0.0001466700000000 ]  - [   0.0012103900000000,  0.0009155900000000, -0.0002676700000000 ]  - [  -0.0000019200000000,  0.0000533200000000, -0.0000802100000000 ]  - [  -0.0017508800000000,  0.0014351200000000, -0.0003130400000000 ]  - [   0.0006319800000000, -0.0011363000000000, -0.0006069300000000 ]  - [  -0.0001220000000000, -0.0002268900000000,  0.0000582000000000 ]  - [  -0.0114461200000000,  0.0323023100000000, -0.0194327200000000 ]  - [   0.0001489900000000, -0.0005360900000000, -0.0003149700000000 ]  - [   0.0000384300000000,  0.0000145200000000,  0.0001123200000000 ]  - [  -0.0016811900000000,  0.0060995700000000, -0.0057052900000000 ]  - [  -0.0003721900000000,  0.0010080800000000, -0.0002788900000000 ]  - [  -0.0010631800000000,  0.0017531800000000,  0.0016026500000000 ]  - [   0.0007303800000000, -0.0037700000000000,  0.0025539200000000 ]  - [  -0.0242709600000000,  0.0047924700000000,  0.0155395100000000 ]  - [  -0.0012111600000000, -0.0005506900000000, -0.0004404800000000 ]  - [   0.0075118400000000,  0.0128000600000000, -0.0097170600000000 ]  - [   0.0012507900000000,  0.0028418600000000,  0.0007533100000000 ]  - [   0.0022024800000000, -0.0040168800000000,  0.0004326900000000 ]  - [   0.0197782100000000, -0.0080452000000000,  0.0120841000000000 ]- atom:   38  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0282700200000000, -0.2766337700000000,  0.1299625400000000 ]  - [  -0.0004441800000000, -0.0005286400000000, -0.0001746400000000 ]  - [  -0.0000355600000000, -0.0003602200000000, -0.0001705400000000 ]  - [  -0.0014605400000000, -0.0002418200000000, -0.0005187100000000 ]  - [  -0.0011768100000000, -0.0003328900000000, -0.0006462300000000 ]  - [   0.0001215500000000, -0.0015892500000000, -0.0008694700000000 ]  - [  -0.0001620500000000,  0.0007961700000000,  0.0016267900000000 ]  - [   0.0003217900000000,  0.0003072000000000,  0.0001259600000000 ]  - [  -0.0000606400000000,  0.0035329000000000, -0.0011716900000000 ]  - [   0.1117213700000000, -0.1189562400000000, -0.0605427600000000 ]  - [   0.0007571800000000, -0.0019197800000000,  0.0007283600000000 ]  - [   0.0038585300000000,  0.0032338000000000,  0.0000094000000000 ]  - [  -0.0004702600000000,  0.0002548000000000,  0.0017351200000000 ]  - [  -0.0008114100000000,  0.0000341000000000,  0.0003864500000000 ]  - [   0.0011382100000000, -0.0012662500000000,  0.0007855800000000 ]  - [   0.0002389700000000, -0.0010870600000000, -0.0009239400000000 ]  - [   0.0000623500000000,  0.0002710400000000, -0.0002152800000000 ]  - [   0.0038325300000000,  0.0030535900000000,  0.0023342400000000 ]  - [  -0.0001206400000000,  0.0042744400000000,  0.0015434400000000 ]  - [  -0.0027774200000000,  0.0001890200000000, -0.0020540600000000 ]  - [   0.0015509600000000,  0.0005456600000000, -0.0006239700000000 ]  - [   0.0000576800000000,  0.0001987600000000, -0.0004098300000000 ]  - [  -0.0016845400000000,  0.0001046900000000,  0.0009261400000000 ]  - [   0.0009840400000000, -0.0004388500000000,  0.0003527900000000 ]  - [  -0.0000773200000000,  0.0000270900000000, -0.0001836800000000 ]  - [   0.0001237800000000, -0.0001842900000000, -0.0001818700000000 ]  - [  -0.0002925800000000,  0.0004560500000000, -0.0001883400000000 ]  - [  -0.0008659000000000, -0.0012547100000000,  0.0005387700000000 ]  - [   0.0010470600000000,  0.0015876400000000,  0.0009778900000000 ]  - [   0.0002335200000000,  0.0002196500000000, -0.0002668100000000 ]  - [  -0.0012683500000000,  0.0021012700000000, -0.0007244300000000 ]  - [  -0.0004987900000000,  0.0007291100000000,  0.0000657500000000 ]  - [   0.0010582800000000,  0.0018945500000000,  0.0001472600000000 ]  - [  -0.0168804000000000, -0.0451088800000000,  0.0188103600000000 ]  - [  -0.0000512900000000, -0.0003804900000000, -0.0002996900000000 ]  - [   0.0000449900000000,  0.0002532500000000, -0.0002377400000000 ]  - [   0.0031770000000000,  0.0009220900000000,  0.0030196300000000 ]  - [  -0.1349162400000000,  0.4965566200000000, -0.0998710400000000 ]  - [   0.0069458400000000,  0.0034950600000000, -0.0053741900000000 ]  - [   0.0003573200000000,  0.0006787800000000,  0.0003031600000000 ]  - [  -0.0019240100000000, -0.0012623700000000, -0.0020755000000000 ]  - [  -0.0005975000000000, -0.0011282900000000, -0.0003745400000000 ]  - [  -0.0020496200000000, -0.0039464700000000, -0.0005910200000000 ]  - [   0.0002484000000000,  0.0003172100000000,  0.0001522700000000 ]  - [   0.0050960400000000, -0.0039641700000000, -0.0014114100000000 ]  - [  -0.0115292900000000, -0.0053288700000000,  0.0001232600000000 ]  - [   0.0008577700000000,  0.0012166500000000, -0.0004691600000000 ]  - [   0.0009676000000000,  0.0034979600000000, -0.0005769300000000 ]  - [   0.0038981100000000, -0.0000966400000000, -0.0043816800000000 ]  - [  -0.0008270800000000, -0.0035347200000000,  0.0017542900000000 ]  - [   0.0005087900000000, -0.0009735200000000,  0.0001465400000000 ]  - [  -0.0069757900000000, -0.0153162800000000,  0.0140348400000000 ]  - [   0.0017373800000000,  0.0010894300000000,  0.0014907600000000 ]  - [  -0.0000066100000000, -0.0002942900000000,  0.0003596300000000 ]  - [  -0.0011167400000000, -0.0010079500000000, -0.0002238200000000 ]  - [  -0.0000991700000000,  0.0000432700000000,  0.0005848900000000 ]  - [   0.0018351200000000, -0.0013388800000000, -0.0001814000000000 ]  - [  -0.0007212200000000,  0.0010356100000000,  0.0001075200000000 ]  - [   0.0002218600000000,  0.0001318300000000,  0.0004467100000000 ]  - [   0.0111320300000000, -0.0323775300000000,  0.0190116300000000 ]  - [   0.0002427100000000,  0.0007474500000000, -0.0000319600000000 ]  - [   0.0000642200000000,  0.0000784900000000,  0.0003943100000000 ]  - [   0.0019124300000000, -0.0064880900000000,  0.0060585400000000 ]  - [  -0.0000158400000000, -0.0007861000000000, -0.0000593600000000 ]  - [   0.0012633400000000, -0.0013470600000000, -0.0012292800000000 ]  - [  -0.0009379000000000,  0.0033433400000000, -0.0021861900000000 ]  - [   0.0245513700000000, -0.0049654900000000, -0.0158160400000000 ]  - [   0.0011156000000000,  0.0006472800000000, -0.0000569600000000 ]  - [  -0.0073875600000000, -0.0126311000000000,  0.0096138200000000 ]  - [  -0.0012454800000000, -0.0028317300000000, -0.0007624200000000 ]  - [  -0.0021868700000000,  0.0039985200000000, -0.0004612100000000 ]  - [  -0.0198801800000000,  0.0080383100000000, -0.0121208700000000 ]- atom:   38  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0103569200000000, -0.1169323300000000,  0.0878093300000000 ]  - [  -0.0006488800000000, -0.0007271500000000, -0.0008075300000000 ]  - [   0.0000247500000000, -0.0006321000000000, -0.0008169600000000 ]  - [  -0.0005750400000000, -0.0001234900000000, -0.0002629400000000 ]  - [   0.0030316500000000,  0.0012673900000000,  0.0000143300000000 ]  - [   0.0002841700000000,  0.0008656300000000,  0.0008901500000000 ]  - [  -0.0005977900000000, -0.0012282500000000, -0.0005197700000000 ]  - [   0.0006424000000000,  0.0000182400000000,  0.0004591500000000 ]  - [  -0.0007873000000000, -0.0020671200000000,  0.0016131400000000 ]  - [  -0.1001936600000000,  0.0417296200000000,  0.0936610800000000 ]  - [   0.0007294000000000, -0.0008272300000000,  0.0011566300000000 ]  - [   0.0029963000000000,  0.0017931200000000, -0.0006336400000000 ]  - [   0.0004457700000000, -0.0023054300000000, -0.0019387500000000 ]  - [  -0.0005107100000000, -0.0004815800000000,  0.0007395100000000 ]  - [  -0.0002792200000000, -0.0004561600000000, -0.0002732100000000 ]  - [  -0.0005335200000000,  0.0007498800000000, -0.0008326600000000 ]  - [  -0.0000134000000000,  0.0005994700000000, -0.0006937800000000 ]  - [   0.0014398500000000,  0.0007271000000000,  0.0014652900000000 ]  - [  -0.0003351000000000,  0.0010165700000000,  0.0006937400000000 ]  - [  -0.0022593600000000,  0.0012677300000000, -0.0012981000000000 ]  - [   0.0004761700000000,  0.0000974500000000, -0.0003921500000000 ]  - [  -0.0000598400000000, -0.0006518800000000, -0.0008601100000000 ]  - [   0.0006361800000000, -0.0002544400000000, -0.0003372500000000 ]  - [   0.0003060300000000,  0.0003027200000000, -0.0012523000000000 ]  - [   0.0000316600000000,  0.0006171500000000, -0.0008964800000000 ]  - [   0.0008531200000000, -0.0008130100000000, -0.0007331700000000 ]  - [  -0.0008155200000000,  0.0007576500000000, -0.0007860600000000 ]  - [   0.0004726800000000,  0.0007191500000000, -0.0005465800000000 ]  - [  -0.0001038600000000, -0.0005064100000000, -0.0005623000000000 ]  - [   0.0007137600000000,  0.0007692100000000, -0.0009153700000000 ]  - [  -0.0002936600000000,  0.0001317300000000, -0.0004056100000000 ]  - [  -0.0006803000000000,  0.0007165100000000,  0.0005162600000000 ]  - [  -0.0002149900000000, -0.0011952100000000,  0.0026640600000000 ]  - [  -0.0262344100000000, -0.0190394000000000,  0.0361969800000000 ]  - [  -0.0004155800000000, -0.0004792200000000, -0.0027835800000000 ]  - [   0.0000600700000000, -0.0000267600000000, -0.0017716400000000 ]  - [   0.0011485500000000, -0.0002520300000000,  0.0009053400000000 ]  - [   0.1664244100000000,  0.1069510100000000, -0.2313370900000000 ]  - [  -0.0142112200000000, -0.0001665300000000,  0.0071198400000000 ]  - [   0.0002950300000000,  0.0001092200000000, -0.0013320900000000 ]  - [   0.0018866800000000,  0.0023109100000000, -0.0003806100000000 ]  - [  -0.0001746500000000, -0.0001561200000000, -0.0011877300000000 ]  - [  -0.0007374900000000,  0.0007839300000000, -0.0021474200000000 ]  - [   0.0006642500000000, -0.0005672200000000,  0.0013713200000000 ]  - [   0.0027373900000000, -0.0012144900000000, -0.0014711600000000 ]  - [  -0.0006869700000000, -0.0000502500000000, -0.0048458500000000 ]  - [  -0.0014380700000000, -0.0009973500000000,  0.0017580700000000 ]  - [  -0.0028225200000000, -0.0014112200000000, -0.0017303700000000 ]  - [  -0.0022360400000000,  0.0004442100000000,  0.0026018100000000 ]  - [  -0.0013427700000000, -0.0016146800000000,  0.0015748300000000 ]  - [  -0.0007895100000000, -0.0004288000000000,  0.0016304600000000 ]  - [  -0.0052042400000000, -0.0133712200000000,  0.0071218500000000 ]  - [   0.0013642800000000,  0.0000550100000000,  0.0014365600000000 ]  - [  -0.0005084100000000, -0.0001551500000000,  0.0013495000000000 ]  - [  -0.0001408600000000,  0.0004470200000000,  0.0007733900000000 ]  - [  -0.0004638800000000,  0.0003804700000000,  0.0017861900000000 ]  - [  -0.0000197900000000, -0.0001144100000000,  0.0010178500000000 ]  - [   0.0003073100000000, -0.0000581700000000,  0.0020896800000000 ]  - [   0.0005564100000000, -0.0002444000000000,  0.0017307100000000 ]  - [   0.0044920300000000, -0.0148047300000000,  0.0034873700000000 ]  - [  -0.0003822400000000,  0.0002298900000000,  0.0014663400000000 ]  - [   0.0004331300000000,  0.0001912500000000,  0.0014528200000000 ]  - [   0.0008819800000000, -0.0015148200000000,  0.0020064100000000 ]  - [   0.0005148800000000,  0.0008344300000000,  0.0015704700000000 ]  - [  -0.0001653500000000,  0.0023028700000000,  0.0021867000000000 ]  - [  -0.0017903600000000, -0.0010621900000000,  0.0013505000000000 ]  - [  -0.0176056300000000,  0.0089440500000000,  0.0048415600000000 ]  - [  -0.0000290600000000, -0.0005810400000000,  0.0007702800000000 ]  - [   0.0094378000000000,  0.0068256700000000, -0.0050537800000000 ]  - [  -0.0005224300000000,  0.0007046800000000, -0.0038055800000000 ]  - [   0.0006033500000000, -0.0010038900000000, -0.0042071200000000 ]  - [  -0.0077108700000000,  0.0028549300000000, -0.0034607700000000 ]- atom:   38  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0107220300000000,  0.1204882500000000, -0.0864868100000000 ]  - [   0.0002231200000000,  0.0001492500000000,  0.0006065000000000 ]  - [  -0.0001726700000000,  0.0005296800000000,  0.0005381900000000 ]  - [   0.0006736400000000, -0.0000248300000000,  0.0005393000000000 ]  - [  -0.0031285600000000, -0.0011090100000000,  0.0002713200000000 ]  - [  -0.0001332300000000, -0.0009598900000000, -0.0011642700000000 ]  - [   0.0004885300000000,  0.0010793200000000,  0.0008031600000000 ]  - [  -0.0005371900000000,  0.0001281100000000, -0.0001779000000000 ]  - [   0.0006331100000000,  0.0021504600000000, -0.0018766400000000 ]  - [   0.1043874100000000, -0.0442905000000000, -0.0928461900000000 ]  - [  -0.0011511900000000,  0.0014108300000000, -0.0013575900000000 ]  - [  -0.0035608200000000, -0.0022231200000000,  0.0008397600000000 ]  - [   0.0001294000000000,  0.0027194600000000,  0.0021283700000000 ]  - [   0.0009355600000000,  0.0010557100000000, -0.0009350100000000 ]  - [   0.0008623000000000,  0.0000230700000000,  0.0004778000000000 ]  - [  -0.0000334100000000, -0.0003452100000000,  0.0010381600000000 ]  - [   0.0001605900000000, -0.0004974800000000,  0.0004138900000000 ]  - [  -0.0018552000000000, -0.0012969400000000, -0.0016543200000000 ]  - [   0.0001993400000000, -0.0011149900000000, -0.0009768700000000 ]  - [   0.0023474000000000, -0.0014101100000000,  0.0015703800000000 ]  - [  -0.0005734800000000,  0.0000504600000000,  0.0006661300000000 ]  - [   0.0002067600000000,  0.0005521400000000,  0.0005792400000000 ]  - [  -0.0007176800000000,  0.0001068700000000,  0.0006100700000000 ]  - [  -0.0002294000000000, -0.0001572500000000,  0.0015447000000000 ]  - [  -0.0001776300000000, -0.0005174600000000,  0.0006172700000000 ]  - [  -0.0004230300000000,  0.0002319200000000,  0.0005317600000000 ]  - [   0.0003854800000000, -0.0001773600000000,  0.0005848500000000 ]  - [  -0.0010491600000000, -0.0011444900000000,  0.0007440000000000 ]  - [   0.0006776300000000,  0.0009263100000000,  0.0007542000000000 ]  - [  -0.0002875000000000, -0.0001887400000000,  0.0007151500000000 ]  - [   0.0008649600000000, -0.0005449700000000,  0.0006017700000000 ]  - [   0.0000981300000000, -0.0002853800000000, -0.0003130000000000 ]  - [   0.0002224600000000,  0.0011946400000000, -0.0026532900000000 ]  - [   0.0249537400000000,  0.0180498700000000, -0.0358158900000000 ]  - [   0.0004253700000000,  0.0004928800000000,  0.0027875700000000 ]  - [  -0.0000592300000000,  0.0000229600000000,  0.0017622900000000 ]  - [  -0.0013480900000000,  0.0006670300000000, -0.0005341400000000 ]  - [  -0.1689298900000000, -0.1074042200000000,  0.2284359600000000 ]  - [   0.0141062300000000,  0.0000553800000000, -0.0075291400000000 ]  - [  -0.0004058000000000, -0.0000098300000000,  0.0018351200000000 ]  - [  -0.0017860100000000, -0.0021980700000000, -0.0001464200000000 ]  - [   0.0000733500000000,  0.0000468200000000,  0.0006696500000000 ]  - [   0.0008401800000000, -0.0008777900000000,  0.0026428500000000 ]  - [  -0.0010597000000000,  0.0003567400000000, -0.0017185600000000 ]  - [  -0.0023318100000000,  0.0014239300000000,  0.0011203900000000 ]  - [   0.0008651900000000,  0.0002154200000000,  0.0053476900000000 ]  - [   0.0016376600000000,  0.0006031400000000, -0.0014027700000000 ]  - [   0.0024105800000000,  0.0016019500000000,  0.0013812600000000 ]  - [   0.0024104800000000, -0.0000617500000000, -0.0022093000000000 ]  - [   0.0011228200000000,  0.0012116900000000, -0.0012176300000000 ]  - [   0.0011835000000000,  0.0002204700000000, -0.0019775200000000 ]  - [   0.0050439000000000,  0.0132893800000000, -0.0075273800000000 ]  - [  -0.0015683300000000,  0.0003356200000000, -0.0010833000000000 ]  - [   0.0003976800000000,  0.0000579500000000, -0.0008323200000000 ]  - [   0.0002401400000000, -0.0005490900000000, -0.0012761100000000 ]  - [   0.0003556400000000, -0.0002851700000000, -0.0012721900000000 ]  - [   0.0001084400000000,  0.0002104200000000, -0.0015252600000000 ]  - [  -0.0004047900000000, -0.0000421600000000, -0.0026250000000000 ]  - [  -0.0004524200000000,  0.0001444000000000, -0.0012160200000000 ]  - [  -0.0048169700000000,  0.0145051800000000, -0.0037287900000000 ]  - [   0.0007786500000000, -0.0000200900000000, -0.0018129200000000 ]  - [  -0.0003221200000000, -0.0000902300000000, -0.0009370500000000 ]  - [  -0.0006515200000000,  0.0011003700000000, -0.0016272500000000 ]  - [  -0.0009065700000000, -0.0006216100000000, -0.0019136600000000 ]  - [   0.0003778300000000, -0.0018983900000000, -0.0018256600000000 ]  - [   0.0016039200000000,  0.0006350100000000, -0.0009776100000000 ]  - [   0.0178344900000000, -0.0091688000000000, -0.0050281000000000 ]  - [  -0.0000701200000000,  0.0006892300000000, -0.0012787500000000 ]  - [  -0.0093587900000000, -0.0066683000000000,  0.0049427400000000 ]  - [   0.0005181000000000, -0.0007011700000000,  0.0037980600000000 ]  - [  -0.0006005900000000,  0.0010019600000000,  0.0041940400000000 ]  - [   0.0075971700000000, -0.0028498400000000,  0.0033870800000000 ]- atom:   69  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0017904200000000, -0.0045252900000000,  0.0007816700000000 ]  - [  -0.0002237300000000,  0.0000657600000000, -0.0008366900000000 ]  - [  -0.0001124700000000, -0.0003037300000000,  0.0011230500000000 ]  - [  -0.0015395600000000,  0.0020411500000000, -0.0030124400000000 ]  - [   0.0002484900000000,  0.0002802500000000,  0.0021847300000000 ]  - [   0.0028049300000000,  0.0292312900000000,  0.0121541600000000 ]  - [  -0.0001385200000000, -0.0001071300000000, -0.0006700200000000 ]  - [  -0.0000586000000000,  0.0000390100000000,  0.0009429600000000 ]  - [   0.0026638000000000,  0.0294591000000000, -0.0124564600000000 ]  - [   0.0278657500000000, -0.0139961100000000, -0.0181228000000000 ]  - [   0.0274998100000000, -0.0134839300000000,  0.0181406000000000 ]  - [   0.0011253900000000,  0.0005675900000000,  0.0000937600000000 ]  - [   0.0017044700000000,  0.0009968700000000,  0.0001071800000000 ]  - [   0.0035235100000000,  0.0020529900000000, -0.0021182700000000 ]  - [  -0.0012018900000000,  0.0003554400000000,  0.0005998100000000 ]  - [   0.0030008600000000, -0.0023747200000000, -0.0017162200000000 ]  - [   0.0000313200000000, -0.0002077100000000, -0.0013950000000000 ]  - [   0.0031362500000000,  0.0014903700000000,  0.0019353400000000 ]  - [   0.0016416200000000, -0.0046705600000000, -0.0010660300000000 ]  - [   0.0003644500000000,  0.0001315000000000, -0.0019123400000000 ]  - [  -0.0016060100000000,  0.0021831600000000,  0.0032832200000000 ]  - [   0.0002382400000000,  0.0004694000000000, -0.0003616700000000 ]  - [   0.0118807100000000, -0.0064101400000000, -0.0079216200000000 ]  - [   0.0119305800000000, -0.0062279800000000,  0.0080658500000000 ]  - [   0.0000872800000000,  0.0005726300000000,  0.0000823400000000 ]  - [   0.0007047100000000, -0.0009614300000000, -0.0001530500000000 ]  - [   0.0002916700000000, -0.0003884000000000, -0.0000420100000000 ]  - [  -0.0222201800000000, -0.0188630300000000,  0.0090728700000000 ]  - [  -0.0215644000000000, -0.0183940300000000, -0.0088323900000000 ]  - [   0.0002190400000000,  0.0006520700000000,  0.0006340600000000 ]  - [   0.0035938800000000, -0.0028350800000000,  0.0019239500000000 ]  - [  -0.0017782600000000,  0.0007802700000000, -0.0004108200000000 ]  - [  -0.0111321900000000,  0.0058556800000000, -0.0000125100000000 ]  - [   0.0139457400000000,  0.0063897800000000,  0.0000377600000000 ]  - [   0.0065822900000000,  0.0046799400000000, -0.0000346200000000 ]  - [   0.0015644800000000, -0.0061106900000000,  0.0000081400000000 ]  - [  -0.0039903000000000,  0.0002744600000000,  0.0015571500000000 ]  - [  -0.0177870300000000,  0.0073942100000000,  0.0096241100000000 ]  - [  -0.0039507800000000, -0.0010419600000000, -0.0012613600000000 ]  - [  -0.0000383900000000, -0.0197018400000000, -0.0073714200000000 ]  - [   0.0028760000000000, -0.0011730000000000,  0.0004597500000000 ]  - [   0.0027970400000000, -0.0012655700000000, -0.0009457000000000 ]  - [   0.0000244000000000, -0.0199552600000000,  0.0079352000000000 ]  - [   0.0012910600000000, -0.0004382500000000,  0.0009951300000000 ]  - [  -0.0067816100000000,  0.0039804900000000,  0.0029658400000000 ]  - [  -0.0176670500000000,  0.0075061300000000, -0.0091715800000000 ]  - [   0.0019737700000000,  0.0001778700000000, -0.0011235100000000 ]  - [   0.2085703000000000,  0.0876229200000000,  0.1080647200000000 ]  - [   0.1474761100000000, -0.0837753000000000, -0.0728624100000000 ]  - [  -0.0009316900000000, -0.0004527400000000,  0.0001183700000000 ]  - [  -0.0005264900000000, -0.0001634600000000,  0.0001004100000000 ]  - [  -0.0040629300000000, -0.0009307600000000,  0.0007448900000000 ]  - [   0.0017521900000000,  0.0005695300000000,  0.0014835500000000 ]  - [  -0.0002414200000000,  0.0021490200000000,  0.0008488600000000 ]  - [   0.0127143900000000,  0.0145773900000000,  0.0064671100000000 ]  - [  -0.0013648100000000, -0.0012001700000000, -0.0002603200000000 ]  - [  -0.0080045600000000,  0.0019785200000000,  0.0026265100000000 ]  - [  -0.0080780000000000,  0.0018637500000000, -0.0030776400000000 ]  - [  -0.0012431800000000, -0.0012963800000000,  0.0007815200000000 ]  - [  -0.0071897800000000,  0.0037402300000000, -0.0033269600000000 ]  - [   0.0016699900000000, -0.0002270100000000, -0.0013419100000000 ]  - [  -0.0001553800000000,  0.0022400600000000, -0.0003555800000000 ]  - [  -0.0037915200000000, -0.0000921400000000, -0.0012146900000000 ]  - [  -0.0009221700000000,  0.0000557100000000, -0.0004478000000000 ]  - [  -0.0007242200000000, -0.0000639100000000,  0.0002327500000000 ]  - [   0.1463305500000000, -0.0807137200000000,  0.0704198300000000 ]  - [   0.2020066500000000,  0.0812047200000000, -0.1009779600000000 ]  - [   0.0127158600000000,  0.0147623400000000, -0.0070283100000000 ]  - [  -0.7327090900000000, -0.0000723100000000, -0.0047601500000000 ]  - [  -0.0053382400000000, -0.0010685900000000, -0.0000087400000000 ]  - [   0.0014448700000000,  0.0000002300000000, -0.0000033100000000 ]  - [   0.0149915700000000, -0.0048994900000000,  0.0000171800000000 ]- atom:   69  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0004680700000000,  0.0054772500000000, -0.0044078300000000 ]  - [   0.0006153000000000,  0.0010458300000000,  0.0027047100000000 ]  - [  -0.0002147200000000,  0.0012545800000000,  0.0023984200000000 ]  - [  -0.0053539300000000,  0.0003150000000000, -0.0040991300000000 ]  - [  -0.0013404600000000, -0.0000628100000000,  0.0026811500000000 ]  - [   0.0029558800000000,  0.0195695600000000,  0.0091324300000000 ]  - [  -0.0021914200000000,  0.0003054400000000,  0.0019434800000000 ]  - [   0.0021914200000000, -0.0003054400000000,  0.0019434800000000 ]  - [  -0.0029558800000000, -0.0195695600000000,  0.0091324300000000 ]  - [  -0.0219214500000000,  0.0127608300000000,  0.0105429600000000 ]  - [   0.0219214500000000, -0.0127608300000000,  0.0105429600000000 ]  - [  -0.0018812700000000, -0.0024894600000000,  0.0021160500000000 ]  - [   0.0018812700000000,  0.0024894600000000,  0.0021160500000000 ]  - [   0.0041935500000000,  0.0036119500000000, -0.0036346500000000 ]  - [   0.0016171900000000, -0.0010253200000000,  0.0029084400000000 ]  - [   0.0030309100000000, -0.0037550000000000, -0.0034148400000000 ]  - [   0.0002147200000000, -0.0012545800000000,  0.0023984200000000 ]  - [  -0.0041935500000000, -0.0036119500000000, -0.0036346500000000 ]  - [  -0.0004680700000000, -0.0054772500000000, -0.0044078300000000 ]  - [   0.0013404600000000,  0.0000628100000000,  0.0026811500000000 ]  - [   0.0053539300000000, -0.0003150000000000, -0.0040991300000000 ]  - [   0.0004522300000000,  0.0020830300000000,  0.0016631200000000 ]  - [  -0.0196867800000000,  0.0027717800000000,  0.0095193200000000 ]  - [   0.0196867800000000, -0.0027717800000000,  0.0095193200000000 ]  - [  -0.0004522300000000, -0.0020830300000000,  0.0016631200000000 ]  - [  -0.0020553600000000,  0.0013008100000000,  0.0019143100000000 ]  - [   0.0020553600000000, -0.0013008100000000,  0.0019143100000000 ]  - [  -0.0133486400000000, -0.0222535000000000,  0.0108479300000000 ]  - [   0.0133486400000000,  0.0222535000000000,  0.0108479300000000 ]  - [  -0.0006153000000000, -0.0010458300000000,  0.0027047100000000 ]  - [  -0.0030309100000000,  0.0037550000000000, -0.0034148400000000 ]  - [  -0.0016171900000000,  0.0010253200000000,  0.0029084400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0037844500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0066989900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038257300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0067233600000000 ]  - [   0.0013627700000000,  0.0031465800000000,  0.0070221300000000 ]  - [   0.0110796100000000, -0.0097076500000000, -0.0046871600000000 ]  - [   0.0004928700000000, -0.0018564500000000, -0.0044650200000000 ]  - [  -0.0025889500000000, -0.0120145700000000, -0.0031120200000000 ]  - [   0.0008137300000000,  0.0004758000000000, -0.0040648800000000 ]  - [  -0.0008137300000000, -0.0004758000000000, -0.0040648800000000 ]  - [   0.0025889500000000,  0.0120145700000000, -0.0031120200000000 ]  - [  -0.0032098600000000,  0.0016906200000000, -0.0074467600000000 ]  - [  -0.0027472900000000,  0.0015691000000000,  0.0066704300000000 ]  - [  -0.0110796100000000,  0.0097076500000000, -0.0046871600000000 ]  - [   0.0018944900000000,  0.0028029100000000, -0.0070988700000000 ]  - [   0.1102489700000000,  0.0766884200000000,  0.1672590900000000 ]  - [  -0.0725063500000000,  0.1048333700000000,  0.1644405500000000 ]  - [  -0.0012828300000000,  0.0023439700000000, -0.0043466400000000 ]  - [   0.0027406100000000,  0.0010754400000000, -0.0047099100000000 ]  - [  -0.0004928700000000,  0.0018564500000000, -0.0044650200000000 ]  - [  -0.0018944900000000, -0.0028029100000000, -0.0070988700000000 ]  - [   0.0017402400000000,  0.0004044500000000, -0.0039723300000000 ]  - [  -0.0096271300000000, -0.0112145400000000, -0.0052728200000000 ]  - [   0.0003857400000000, -0.0007057400000000, -0.0035751300000000 ]  - [   0.0121879100000000, -0.0024639600000000, -0.0037003200000000 ]  - [  -0.0121879100000000,  0.0024639600000000, -0.0037003200000000 ]  - [  -0.0003857400000000,  0.0007057400000000, -0.0035751300000000 ]  - [   0.0027472900000000, -0.0015691000000000,  0.0066704300000000 ]  - [   0.0032098600000000, -0.0016906200000000, -0.0074467600000000 ]  - [  -0.0017402400000000, -0.0004044500000000, -0.0039723300000000 ]  - [  -0.0013627700000000, -0.0031465800000000,  0.0070221300000000 ]  - [  -0.0027406100000000, -0.0010754400000000, -0.0047099100000000 ]  - [   0.0012828300000000, -0.0023439700000000, -0.0043466400000000 ]  - [   0.0725063500000000, -0.1048333700000000,  0.1644405500000000 ]  - [  -0.1102489700000000, -0.0766884200000000,  0.1672590900000000 ]  - [   0.0096271300000000,  0.0112145400000000, -0.0052728200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.7015647100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0190777600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0112674200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0133254400000000 ]