# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/b2e2069e-018f-42ea-8d33-61afea509303/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 H5NF2 / Pmna (53) / materials id 31043](https://mdr.nims.go.jp/datasets/49dbf932-2072-4309-8e03-f81bea99681e)

## 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: "Pmna"  number: 53  Hall_symbol: "-P 2ac 2"supercell_matrix:- [   1,   0,   0 ]- [   0,   3,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     8.349264270000001,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     3.615673530000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     8.020115040000000 ] # c  points:  - symbol: H  # 1    coordinates: [  0.342050830000000,  0.384943760000000,  0.297065120000000 ]    mass: 1.007940  - symbol: H  # 2    coordinates: [  0.157949170000000,  0.384943760000000,  0.202934880000000 ]    mass: 1.007940  - symbol: H  # 3    coordinates: [  0.157949170000000,  0.615056240000000,  0.797065120000000 ]    mass: 1.007940  - symbol: H  # 4    coordinates: [  0.342050830000000,  0.615056240000000,  0.702934880000000 ]    mass: 1.007940  - symbol: H  # 5    coordinates: [  0.657949170000000,  0.615056240000000,  0.702934880000000 ]    mass: 1.007940  - symbol: H  # 6    coordinates: [  0.842050830000000,  0.615056240000000,  0.797065120000000 ]    mass: 1.007940  - symbol: H  # 7    coordinates: [  0.842050830000000,  0.384943760000000,  0.202934880000000 ]    mass: 1.007940  - symbol: H  # 8    coordinates: [  0.657949170000000,  0.384943760000000,  0.297065120000000 ]    mass: 1.007940  - symbol: H  # 9    coordinates: [  0.205315150000000,  0.719016710000000,  0.345605470000000 ]    mass: 1.007940  - symbol: H  # 10    coordinates: [  0.294684850000000,  0.719016710000000,  0.154394530000000 ]    mass: 1.007940  - symbol: H  # 11    coordinates: [  0.294684850000000,  0.280983290000000,  0.845605470000000 ]    mass: 1.007940  - symbol: H  # 12    coordinates: [  0.205315150000000,  0.280983290000000,  0.654394530000000 ]    mass: 1.007940  - symbol: H  # 13    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 1.007940  - symbol: H  # 14    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 1.007940  - symbol: H  # 15    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 1.007940  - symbol: H  # 16    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 1.007940  - symbol: H  # 17    coordinates: [  0.794684850000000,  0.719016710000000,  0.345605470000000 ]    mass: 1.007940  - symbol: H  # 18    coordinates: [  0.705315150000000,  0.719016710000000,  0.154394530000000 ]    mass: 1.007940  - symbol: H  # 19    coordinates: [  0.705315150000000,  0.280983290000000,  0.845605470000000 ]    mass: 1.007940  - symbol: H  # 20    coordinates: [  0.794684850000000,  0.280983290000000,  0.654394530000000 ]    mass: 1.007940  - symbol: N  # 21    coordinates: [  0.750000000000000,  0.551316610000000,  0.250000000000000 ]    mass: 14.006700  - symbol: N  # 22    coordinates: [  0.750000000000000,  0.448683390000000,  0.750000000000000 ]    mass: 14.006700  - symbol: N  # 23    coordinates: [  0.250000000000000,  0.448683390000000,  0.750000000000000 ]    mass: 14.006700  - symbol: N  # 24    coordinates: [  0.250000000000000,  0.551316610000000,  0.250000000000000 ]    mass: 14.006700  - symbol: F  # 25    coordinates: [  0.362844570000000,  0.000000000000000,  0.000000000000000 ]    mass: 18.998403  - symbol: F  # 26    coordinates: [  0.137155430000000,  0.000000000000000,  0.500000000000000 ]    mass: 18.998403  - symbol: F  # 27    coordinates: [  0.637155430000000,  0.000000000000000,  0.000000000000000 ]    mass: 18.998403  - symbol: F  # 28    coordinates: [  0.862844570000000,  0.000000000000000,  0.500000000000000 ]    mass: 18.998403  - symbol: F  # 29    coordinates: [  0.000000000000000,  0.127513310000000,  0.131041430000000 ]    mass: 18.998403  - symbol: F  # 30    coordinates: [  0.500000000000000,  0.127513310000000,  0.368958570000000 ]    mass: 18.998403  - symbol: F  # 31    coordinates: [  0.500000000000000,  0.872486690000000,  0.631041430000000 ]    mass: 18.998403  - symbol: F  # 32    coordinates: [  0.000000000000000,  0.872486690000000,  0.868958570000000 ]    mass: 18.998403  reciprocal_lattice: # without 2pi  - [     0.119771032232520,     0.000000000000000,     0.000000000000000 ] # a*  - [     0.000000000000000,     0.276573642974896,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.124686490781309 ] # c*unit_cell:  lattice:  - [     8.349264270000001,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     3.615673530000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     8.020115040000000 ] # c  points:  - symbol: H  # 1    coordinates: [  0.342050830000000,  0.384943760000000,  0.297065120000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 2    coordinates: [  0.157949170000000,  0.384943760000000,  0.202934880000000 ]    mass: 1.007940    reduced_to: 2  - symbol: H  # 3    coordinates: [  0.157949170000000,  0.615056240000000,  0.797065120000000 ]    mass: 1.007940    reduced_to: 3  - symbol: H  # 4    coordinates: [  0.342050830000000,  0.615056240000000,  0.702934880000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 5    coordinates: [  0.657949170000000,  0.615056240000000,  0.702934880000000 ]    mass: 1.007940    reduced_to: 5  - symbol: H  # 6    coordinates: [  0.842050830000000,  0.615056240000000,  0.797065120000000 ]    mass: 1.007940    reduced_to: 6  - symbol: H  # 7    coordinates: [  0.842050830000000,  0.384943760000000,  0.202934880000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.657949170000000,  0.384943760000000,  0.297065120000000 ]    mass: 1.007940    reduced_to: 8  - symbol: H  # 9    coordinates: [  0.205315150000000,  0.719016710000000,  0.345605470000000 ]    mass: 1.007940    reduced_to: 9  - symbol: H  # 10    coordinates: [  0.294684850000000,  0.719016710000000,  0.154394530000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 11    coordinates: [  0.294684850000000,  0.280983290000000,  0.845605470000000 ]    mass: 1.007940    reduced_to: 11  - symbol: H  # 12    coordinates: [  0.205315150000000,  0.280983290000000,  0.654394530000000 ]    mass: 1.007940    reduced_to: 12  - symbol: H  # 13    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 1.007940    reduced_to: 14  - symbol: H  # 15    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 1.007940    reduced_to: 15  - symbol: H  # 16    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 17    coordinates: [  0.794684850000000,  0.719016710000000,  0.345605470000000 ]    mass: 1.007940    reduced_to: 17  - symbol: H  # 18    coordinates: [  0.705315150000000,  0.719016710000000,  0.154394530000000 ]    mass: 1.007940    reduced_to: 18  - symbol: H  # 19    coordinates: [  0.705315150000000,  0.280983290000000,  0.845605470000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 20    coordinates: [  0.794684850000000,  0.280983290000000,  0.654394530000000 ]    mass: 1.007940    reduced_to: 20  - symbol: N  # 21    coordinates: [  0.750000000000000,  0.551316610000000,  0.250000000000000 ]    mass: 14.006700    reduced_to: 21  - symbol: N  # 22    coordinates: [  0.750000000000000,  0.448683390000000,  0.750000000000000 ]    mass: 14.006700    reduced_to: 22  - symbol: N  # 23    coordinates: [  0.250000000000000,  0.448683390000000,  0.750000000000000 ]    mass: 14.006700    reduced_to: 23  - symbol: N  # 24    coordinates: [  0.250000000000000,  0.551316610000000,  0.250000000000000 ]    mass: 14.006700    reduced_to: 24  - symbol: F  # 25    coordinates: [  0.362844570000000,  0.000000000000000,  0.000000000000000 ]    mass: 18.998403    reduced_to: 25  - symbol: F  # 26    coordinates: [  0.137155430000000,  0.000000000000000,  0.500000000000000 ]    mass: 18.998403    reduced_to: 26  - symbol: F  # 27    coordinates: [  0.637155430000000,  0.000000000000000,  0.000000000000000 ]    mass: 18.998403    reduced_to: 27  - symbol: F  # 28    coordinates: [  0.862844570000000,  0.000000000000000,  0.500000000000000 ]    mass: 18.998403    reduced_to: 28  - symbol: F  # 29    coordinates: [  0.000000000000000,  0.127513310000000,  0.131041430000000 ]    mass: 18.998403    reduced_to: 29  - symbol: F  # 30    coordinates: [  0.500000000000000,  0.127513310000000,  0.368958570000000 ]    mass: 18.998403    reduced_to: 30  - symbol: F  # 31    coordinates: [  0.500000000000000,  0.872486690000000,  0.631041430000000 ]    mass: 18.998403    reduced_to: 31  - symbol: F  # 32    coordinates: [  0.000000000000000,  0.872486690000000,  0.868958570000000 ]    mass: 18.998403    reduced_to: 32supercell:  lattice:  - [     8.349264270000001,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    10.847020590000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     8.020115040000000 ] # c  points:  - symbol: H  # 1    coordinates: [  0.342050830000000,  0.128314586666667,  0.297065120000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 2    coordinates: [  0.342050830000000,  0.461647920000000,  0.297065120000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 3    coordinates: [  0.342050830000000,  0.794981253333333,  0.297065120000000 ]    mass: 1.007940    reduced_to: 1  - symbol: H  # 4    coordinates: [  0.157949170000000,  0.128314586666667,  0.202934880000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 5    coordinates: [  0.157949170000000,  0.461647920000000,  0.202934880000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 6    coordinates: [  0.157949170000000,  0.794981253333333,  0.202934880000000 ]    mass: 1.007940    reduced_to: 4  - symbol: H  # 7    coordinates: [  0.157949170000000,  0.205018746666667,  0.797065120000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 8    coordinates: [  0.157949170000000,  0.538352080000000,  0.797065120000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 9    coordinates: [  0.157949170000000,  0.871685413333333,  0.797065120000000 ]    mass: 1.007940    reduced_to: 7  - symbol: H  # 10    coordinates: [  0.342050830000000,  0.205018746666667,  0.702934880000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 11    coordinates: [  0.342050830000000,  0.538352080000000,  0.702934880000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 12    coordinates: [  0.342050830000000,  0.871685413333333,  0.702934880000000 ]    mass: 1.007940    reduced_to: 10  - symbol: H  # 13    coordinates: [  0.657949170000000,  0.205018746666667,  0.702934880000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 14    coordinates: [  0.657949170000000,  0.538352080000000,  0.702934880000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 15    coordinates: [  0.657949170000000,  0.871685413333333,  0.702934880000000 ]    mass: 1.007940    reduced_to: 13  - symbol: H  # 16    coordinates: [  0.842050830000000,  0.205018746666667,  0.797065120000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 17    coordinates: [  0.842050830000000,  0.538352080000000,  0.797065120000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 18    coordinates: [  0.842050830000000,  0.871685413333333,  0.797065120000000 ]    mass: 1.007940    reduced_to: 16  - symbol: H  # 19    coordinates: [  0.842050830000000,  0.128314586666667,  0.202934880000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 20    coordinates: [  0.842050830000000,  0.461647920000000,  0.202934880000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 21    coordinates: [  0.842050830000000,  0.794981253333333,  0.202934880000000 ]    mass: 1.007940    reduced_to: 19  - symbol: H  # 22    coordinates: [  0.657949170000000,  0.128314586666667,  0.297065120000000 ]    mass: 1.007940    reduced_to: 22  - symbol: H  # 23    coordinates: [  0.657949170000000,  0.461647920000000,  0.297065120000000 ]    mass: 1.007940    reduced_to: 22  - symbol: H  # 24    coordinates: [  0.657949170000000,  0.794981253333333,  0.297065120000000 ]    mass: 1.007940    reduced_to: 22  - symbol: H  # 25    coordinates: [  0.205315150000000,  0.239672236666667,  0.345605470000000 ]    mass: 1.007940    reduced_to: 25  - symbol: H  # 26    coordinates: [  0.205315150000000,  0.573005570000000,  0.345605470000000 ]    mass: 1.007940    reduced_to: 25  - symbol: H  # 27    coordinates: [  0.205315150000000,  0.906338903333333,  0.345605470000000 ]    mass: 1.007940    reduced_to: 25  - symbol: H  # 28    coordinates: [  0.294684850000000,  0.239672236666667,  0.154394530000000 ]    mass: 1.007940    reduced_to: 28  - symbol: H  # 29    coordinates: [  0.294684850000000,  0.573005570000000,  0.154394530000000 ]    mass: 1.007940    reduced_to: 28  - symbol: H  # 30    coordinates: [  0.294684850000000,  0.906338903333333,  0.154394530000000 ]    mass: 1.007940    reduced_to: 28  - symbol: H  # 31    coordinates: [  0.294684850000000,  0.093661096666667,  0.845605470000000 ]    mass: 1.007940    reduced_to: 31  - symbol: H  # 32    coordinates: [  0.294684850000000,  0.426994430000000,  0.845605470000000 ]    mass: 1.007940    reduced_to: 31  - symbol: H  # 33    coordinates: [  0.294684850000000,  0.760327763333333,  0.845605470000000 ]    mass: 1.007940    reduced_to: 31  - symbol: H  # 34    coordinates: [  0.205315150000000,  0.093661096666667,  0.654394530000000 ]    mass: 1.007940    reduced_to: 34  - symbol: H  # 35    coordinates: [  0.205315150000000,  0.426994430000000,  0.654394530000000 ]    mass: 1.007940    reduced_to: 34  - symbol: H  # 36    coordinates: [  0.205315150000000,  0.760327763333333,  0.654394530000000 ]    mass: 1.007940    reduced_to: 34  - symbol: H  # 37    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 1.007940    reduced_to: 37  - symbol: H  # 38    coordinates: [  0.000000000000000,  0.333333333333333,  0.500000000000000 ]    mass: 1.007940    reduced_to: 37  - symbol: H  # 39    coordinates: [  0.000000000000000,  0.666666666666667,  0.500000000000000 ]    mass: 1.007940    reduced_to: 37  - symbol: H  # 40    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 1.007940    reduced_to: 40  - symbol: H  # 41    coordinates: [  0.500000000000000,  0.333333333333333,  0.000000000000000 ]    mass: 1.007940    reduced_to: 40  - symbol: H  # 42    coordinates: [  0.500000000000000,  0.666666666666667,  0.000000000000000 ]    mass: 1.007940    reduced_to: 40  - symbol: H  # 43    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 1.007940    reduced_to: 43  - symbol: H  # 44    coordinates: [  0.500000000000000,  0.333333333333333,  0.500000000000000 ]    mass: 1.007940    reduced_to: 43  - symbol: H  # 45    coordinates: [  0.500000000000000,  0.666666666666667,  0.500000000000000 ]    mass: 1.007940    reduced_to: 43  - symbol: H  # 46    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 1.007940    reduced_to: 46  - symbol: H  # 47    coordinates: [  0.000000000000000,  0.333333333333333,  0.000000000000000 ]    mass: 1.007940    reduced_to: 46  - symbol: H  # 48    coordinates: [  0.000000000000000,  0.666666666666667,  0.000000000000000 ]    mass: 1.007940    reduced_to: 46  - symbol: H  # 49    coordinates: [  0.794684850000000,  0.239672236666667,  0.345605470000000 ]    mass: 1.007940    reduced_to: 49  - symbol: H  # 50    coordinates: [  0.794684850000000,  0.573005570000000,  0.345605470000000 ]    mass: 1.007940    reduced_to: 49  - symbol: H  # 51    coordinates: [  0.794684850000000,  0.906338903333333,  0.345605470000000 ]    mass: 1.007940    reduced_to: 49  - symbol: H  # 52    coordinates: [  0.705315150000000,  0.239672236666667,  0.154394530000000 ]    mass: 1.007940    reduced_to: 52  - symbol: H  # 53    coordinates: [  0.705315150000000,  0.573005570000000,  0.154394530000000 ]    mass: 1.007940    reduced_to: 52  - symbol: H  # 54    coordinates: [  0.705315150000000,  0.906338903333333,  0.154394530000000 ]    mass: 1.007940    reduced_to: 52  - symbol: H  # 55    coordinates: [  0.705315150000000,  0.093661096666667,  0.845605470000000 ]    mass: 1.007940    reduced_to: 55  - symbol: H  # 56    coordinates: [  0.705315150000000,  0.426994430000000,  0.845605470000000 ]    mass: 1.007940    reduced_to: 55  - symbol: H  # 57    coordinates: [  0.705315150000000,  0.760327763333333,  0.845605470000000 ]    mass: 1.007940    reduced_to: 55  - symbol: H  # 58    coordinates: [  0.794684850000000,  0.093661096666667,  0.654394530000000 ]    mass: 1.007940    reduced_to: 58  - symbol: H  # 59    coordinates: [  0.794684850000000,  0.426994430000000,  0.654394530000000 ]    mass: 1.007940    reduced_to: 58  - symbol: H  # 60    coordinates: [  0.794684850000000,  0.760327763333333,  0.654394530000000 ]    mass: 1.007940    reduced_to: 58  - symbol: N  # 61    coordinates: [  0.750000000000000,  0.183772203333333,  0.250000000000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 62    coordinates: [  0.750000000000000,  0.517105536666667,  0.250000000000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 63    coordinates: [  0.750000000000000,  0.850438870000000,  0.250000000000000 ]    mass: 14.006700    reduced_to: 61  - symbol: N  # 64    coordinates: [  0.750000000000000,  0.149561130000000,  0.750000000000000 ]    mass: 14.006700    reduced_to: 64  - symbol: N  # 65    coordinates: [  0.750000000000000,  0.482894463333333,  0.750000000000000 ]    mass: 14.006700    reduced_to: 64  - symbol: N  # 66    coordinates: [  0.750000000000000,  0.816227796666667,  0.750000000000000 ]    mass: 14.006700    reduced_to: 64  - symbol: N  # 67    coordinates: [  0.250000000000000,  0.149561130000000,  0.750000000000000 ]    mass: 14.006700    reduced_to: 67  - symbol: N  # 68    coordinates: [  0.250000000000000,  0.482894463333333,  0.750000000000000 ]    mass: 14.006700    reduced_to: 67  - symbol: N  # 69    coordinates: [  0.250000000000000,  0.816227796666667,  0.750000000000000 ]    mass: 14.006700    reduced_to: 67  - symbol: N  # 70    coordinates: [  0.250000000000000,  0.183772203333333,  0.250000000000000 ]    mass: 14.006700    reduced_to: 70  - symbol: N  # 71    coordinates: [  0.250000000000000,  0.517105536666667,  0.250000000000000 ]    mass: 14.006700    reduced_to: 70  - symbol: N  # 72    coordinates: [  0.250000000000000,  0.850438870000000,  0.250000000000000 ]    mass: 14.006700    reduced_to: 70  - symbol: F  # 73    coordinates: [  0.362844570000000,  0.000000000000000,  0.000000000000000 ]    mass: 18.998403    reduced_to: 73  - symbol: F  # 74    coordinates: [  0.362844570000000,  0.333333333333333,  0.000000000000000 ]    mass: 18.998403    reduced_to: 73  - symbol: F  # 75    coordinates: [  0.362844570000000,  0.666666666666667,  0.000000000000000 ]    mass: 18.998403    reduced_to: 73  - symbol: F  # 76    coordinates: [  0.137155430000000,  0.000000000000000,  0.500000000000000 ]    mass: 18.998403    reduced_to: 76  - symbol: F  # 77    coordinates: [  0.137155430000000,  0.333333333333333,  0.500000000000000 ]    mass: 18.998403    reduced_to: 76  - symbol: F  # 78    coordinates: [  0.137155430000000,  0.666666666666667,  0.500000000000000 ]    mass: 18.998403    reduced_to: 76  - symbol: F  # 79    coordinates: [  0.637155430000000,  0.000000000000000,  0.000000000000000 ]    mass: 18.998403    reduced_to: 79  - symbol: F  # 80    coordinates: [  0.637155430000000,  0.333333333333333,  0.000000000000000 ]    mass: 18.998403    reduced_to: 79  - symbol: F  # 81    coordinates: [  0.637155430000000,  0.666666666666667,  0.000000000000000 ]    mass: 18.998403    reduced_to: 79  - symbol: F  # 82    coordinates: [  0.862844570000000,  0.000000000000000,  0.500000000000000 ]    mass: 18.998403    reduced_to: 82  - symbol: F  # 83    coordinates: [  0.862844570000000,  0.333333333333333,  0.500000000000000 ]    mass: 18.998403    reduced_to: 82  - symbol: F  # 84    coordinates: [  0.862844570000000,  0.666666666666667,  0.500000000000000 ]    mass: 18.998403    reduced_to: 82  - symbol: F  # 85    coordinates: [  0.000000000000000,  0.042504436666667,  0.131041430000000 ]    mass: 18.998403    reduced_to: 85  - symbol: F  # 86    coordinates: [  0.000000000000000,  0.375837770000000,  0.131041430000000 ]    mass: 18.998403    reduced_to: 85  - symbol: F  # 87    coordinates: [  0.000000000000000,  0.709171103333333,  0.131041430000000 ]    mass: 18.998403    reduced_to: 85  - symbol: F  # 88    coordinates: [  0.500000000000000,  0.042504436666667,  0.368958570000000 ]    mass: 18.998403    reduced_to: 88  - symbol: F  # 89    coordinates: [  0.500000000000000,  0.375837770000000,  0.368958570000000 ]    mass: 18.998403    reduced_to: 88  - symbol: F  # 90    coordinates: [  0.500000000000000,  0.709171103333333,  0.368958570000000 ]    mass: 18.998403    reduced_to: 88  - symbol: F  # 91    coordinates: [  0.500000000000000,  0.290828896666667,  0.631041430000000 ]    mass: 18.998403    reduced_to: 91  - symbol: F  # 92    coordinates: [  0.500000000000000,  0.624162230000000,  0.631041430000000 ]    mass: 18.998403    reduced_to: 91  - symbol: F  # 93    coordinates: [  0.500000000000000,  0.957495563333333,  0.631041430000000 ]    mass: 18.998403    reduced_to: 91  - symbol: F  # 94    coordinates: [  0.000000000000000,  0.290828896666667,  0.868958570000000 ]    mass: 18.998403    reduced_to: 94  - symbol: F  # 95    coordinates: [  0.000000000000000,  0.624162230000000,  0.868958570000000 ]    mass: 18.998403    reduced_to: 94  - symbol: F  # 96    coordinates: [  0.000000000000000,  0.957495563333333,  0.868958570000000 ]    mass: 18.998403    reduced_to: 94displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.1998201300000000,  0.1114088500000000, -0.0688248200000000 ]  - [  -0.0002753800000000, -0.0007336000000000, -0.0001220900000000 ]  - [  -0.0002751900000000, -0.0008744500000000, -0.0001291500000000 ]  - [   0.0157855300000000, -0.0122748400000000,  0.0065674100000000 ]  - [  -0.0001786500000000, -0.0011867500000000, -0.0001417100000000 ]  - [  -0.0001793900000000, -0.0005284600000000, -0.0001516700000000 ]  - [  -0.0002766300000000,  0.0006005400000000,  0.0003797500000000 ]  - [  -0.0001655600000000,  0.0002804500000000,  0.0001076700000000 ]  - [  -0.0005072800000000,  0.0007408700000000,  0.0001878100000000 ]  - [  -0.0003198900000000,  0.0005393800000000,  0.0000250800000000 ]  - [   0.0000193500000000,  0.0002486700000000, -0.0000307500000000 ]  - [  -0.0009665300000000, -0.0002727800000000,  0.0003384800000000 ]  - [  -0.0003241400000000,  0.0008188600000000,  0.0000862700000000 ]  - [  -0.0002781200000000,  0.0003663200000000, -0.0001166400000000 ]  - [   0.0006715300000000, -0.0002828700000000,  0.0003382800000000 ]  - [   0.0009045700000000,  0.0008456900000000,  0.0003449500000000 ]  - [   0.0004220800000000,  0.0003991000000000,  0.0001960700000000 ]  - [   0.0007340000000000,  0.0007148900000000,  0.0002890000000000 ]  - [   0.0015792800000000, -0.0012819800000000, -0.0006334400000000 ]  - [   0.0008433900000000, -0.0007356100000000, -0.0003818200000000 ]  - [   0.0008419900000000, -0.0007341300000000, -0.0003760800000000 ]  - [   0.0047351100000000,  0.0020956600000000, -0.0015674500000000 ]  - [  -0.0003410600000000, -0.0003874000000000,  0.0001499500000000 ]  - [  -0.0003383700000000, -0.0011258900000000,  0.0001167000000000 ]  - [   0.0080202200000000, -0.0054402900000000,  0.0007968300000000 ]  - [   0.0002666300000000, -0.0003773100000000, -0.0001485100000000 ]  - [  -0.0003429400000000,  0.0012221100000000,  0.0000482600000000 ]  - [  -0.0149750600000000,  0.0058544900000000, -0.0007800000000000 ]  - [  -0.0003116500000000, -0.0004065300000000,  0.0001560300000000 ]  - [  -0.0009753700000000,  0.0003179800000000,  0.0000112900000000 ]  - [  -0.0005457600000000,  0.0006667400000000,  0.0002606600000000 ]  - [   0.0000486400000000, -0.0002782200000000,  0.0006441200000000 ]  - [  -0.0001156000000000, -0.0000341600000000,  0.0002331300000000 ]  - [  -0.0001855300000000,  0.0002517000000000, -0.0008196000000000 ]  - [  -0.0001537300000000, -0.0002745100000000, -0.0005898900000000 ]  - [   0.0000520300000000,  0.0000080100000000, -0.0002795200000000 ]  - [   0.0030020000000000,  0.0001559300000000, -0.0001352800000000 ]  - [   0.0022834900000000, -0.0000639600000000, -0.0000838700000000 ]  - [   0.0004056200000000, -0.0000598600000000, -0.0000006500000000 ]  - [  -0.0015596000000000, -0.0002000400000000, -0.0007343500000000 ]  - [  -0.0025490500000000,  0.0002486000000000, -0.0001952200000000 ]  - [  -0.0003906100000000, -0.0001350000000000, -0.0000180500000000 ]  - [  -0.0023281400000000, -0.0049468200000000,  0.0138448200000000 ]  - [  -0.0003202000000000,  0.0007230900000000, -0.0000872400000000 ]  - [  -0.0000346400000000, -0.0004121400000000,  0.0004349600000000 ]  - [   0.0001160700000000,  0.0007054300000000,  0.0012377900000000 ]  - [   0.0004480300000000, -0.0000105500000000,  0.0006435200000000 ]  - [   0.0000313100000000, -0.0001696400000000, -0.0001636600000000 ]  - [   0.0003792100000000,  0.0005139300000000,  0.0008078200000000 ]  - [  -0.0001344300000000, -0.0002768600000000,  0.0000338300000000 ]  - [   0.0006891900000000, -0.0002196000000000,  0.0002201600000000 ]  - [   0.0000103200000000,  0.0006097600000000, -0.0008622000000000 ]  - [   0.0001931000000000, -0.0002913100000000, -0.0000262800000000 ]  - [   0.0006125200000000, -0.0004287800000000, -0.0005393000000000 ]  - [   0.0003830500000000,  0.0003947800000000, -0.0000584300000000 ]  - [   0.0001806100000000,  0.0001366200000000,  0.0001316200000000 ]  - [   0.0000752100000000, -0.0000910300000000,  0.0002249500000000 ]  - [   0.0002920600000000,  0.0001905500000000,  0.0001019800000000 ]  - [  -0.0000376800000000,  0.0000839800000000, -0.0001449400000000 ]  - [  -0.0000167500000000, -0.0000874500000000, -0.0002441600000000 ]  - [  -0.0020607500000000, -0.0007984800000000,  0.0008673900000000 ]  - [  -0.0002229400000000,  0.0005198300000000,  0.0000905500000000 ]  - [  -0.0007126600000000,  0.0007851700000000,  0.0002283100000000 ]  - [  -0.0004306900000000, -0.0006962500000000, -0.0000932000000000 ]  - [  -0.0001118000000000, -0.0002288500000000, -0.0000131200000000 ]  - [  -0.0005773900000000,  0.0000632900000000, -0.0002193800000000 ]  - [   0.0004571700000000, -0.0006266800000000,  0.0000634300000000 ]  - [   0.0000942900000000,  0.0001895700000000, -0.0000433700000000 ]  - [   0.0006255600000000,  0.0000110400000000, -0.0001736600000000 ]  - [   0.1915620800000000, -0.1075516100000000,  0.0676081800000000 ]  - [   0.0001805400000000,  0.0007370000000000,  0.0000945300000000 ]  - [   0.0006369400000000,  0.0000927000000000,  0.0001155100000000 ]  - [   0.0014787300000000, -0.0007171600000000, -0.0002546600000000 ]  - [   0.0025784700000000,  0.0019427000000000, -0.0026412400000000 ]  - [  -0.0000463300000000,  0.0003421800000000, -0.0001906500000000 ]  - [  -0.0014112000000000, -0.0015253400000000,  0.0013574200000000 ]  - [  -0.0014276600000000,  0.0016431900000000,  0.0018490700000000 ]  - [   0.0001431300000000,  0.0002854800000000,  0.0002088900000000 ]  - [   0.0007302300000000,  0.0000735700000000,  0.0006807700000000 ]  - [   0.0017714900000000, -0.0005034100000000,  0.0004200700000000 ]  - [   0.0005401000000000,  0.0003102800000000, -0.0000742700000000 ]  - [  -0.0025986800000000, -0.0000775700000000, -0.0002008700000000 ]  - [  -0.0018784900000000, -0.0003479600000000, -0.0002981700000000 ]  - [  -0.0006474900000000,  0.0002690800000000,  0.0000889300000000 ]  - [  -0.0022954300000000, -0.0005235800000000, -0.0010868300000000 ]  - [  -0.0011044700000000,  0.0006364800000000, -0.0004175300000000 ]  - [  -0.0003428900000000,  0.0003665900000000,  0.0000425100000000 ]  - [  -0.0012801700000000,  0.0062455700000000, -0.0094506200000000 ]  - [   0.0007872500000000, -0.0005755400000000,  0.0004257400000000 ]  - [   0.0003403900000000,  0.0006872300000000,  0.0000675800000000 ]  - [   0.0005042900000000, -0.0007026800000000, -0.0004862400000000 ]  - [   0.0001630200000000,  0.0003719300000000, -0.0004812600000000 ]  - [   0.0006779300000000,  0.0035146100000000, -0.0079311200000000 ]  - [  -0.0005332900000000, -0.0002983100000000, -0.0003679400000000 ]  - [  -0.0001620600000000,  0.0002058300000000,  0.0002342200000000 ]  - [  -0.0002302800000000, -0.0006400200000000, -0.0005913600000000 ]- atom:    1  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.2075740200000000, -0.1206515100000000,  0.0744290600000000 ]  - [   0.0009652400000000, -0.0002422900000000,  0.0004682900000000 ]  - [   0.0009651400000000, -0.0001009500000000,  0.0004749400000000 ]  - [  -0.0167943500000000,  0.0116056200000000, -0.0071563700000000 ]  - [  -0.0005176000000000,  0.0002063700000000, -0.0002053000000000 ]  - [  -0.0005179000000000, -0.0004429100000000, -0.0001969000000000 ]  - [  -0.0004180400000000,  0.0003687100000000, -0.0000280800000000 ]  - [  -0.0005286900000000,  0.0006847900000000,  0.0002404700000000 ]  - [  -0.0001912100000000,  0.0002317900000000,  0.0001629200000000 ]  - [   0.0010064800000000,  0.0004298000000000, -0.0003738600000000 ]  - [   0.0006734100000000,  0.0007163000000000, -0.0003162700000000 ]  - [   0.0016398300000000,  0.0012268500000000, -0.0006756200000000 ]  - [  -0.0003729600000000,  0.0001562200000000, -0.0004310300000000 ]  - [  -0.0004152900000000,  0.0005981400000000, -0.0002301600000000 ]  - [  -0.0013450700000000,  0.0012344200000000, -0.0006743400000000 ]  - [  -0.0001996500000000,  0.0001285900000000,  0.0000061700000000 ]  - [   0.0002731900000000,  0.0005657000000000,  0.0001517200000000 ]  - [  -0.0000353800000000,  0.0002551600000000,  0.0000604400000000 ]  - [  -0.0008619300000000,  0.0003042600000000,  0.0002784400000000 ]  - [  -0.0001375800000000, -0.0002384500000000,  0.0000296000000000 ]  - [  -0.0001392600000000, -0.0002379900000000,  0.0000249500000000 ]  - [  -0.0053356600000000, -0.0030187000000000,  0.0018847000000000 ]  - [  -0.0003586100000000, -0.0005827200000000,  0.0002000300000000 ]  - [  -0.0003557100000000,  0.0001472900000000,  0.0002295800000000 ]  - [  -0.0077724300000000,  0.0052569600000000, -0.0007532700000000 ]  - [   0.0000497100000000,  0.0001192200000000,  0.0003207000000000 ]  - [   0.0006529900000000, -0.0014721100000000,  0.0001270400000000 ]  - [   0.0148708700000000, -0.0063739900000000,  0.0007496500000000 ]  - [  -0.0000055900000000,  0.0001488200000000, -0.0003279000000000 ]  - [   0.0006599100000000, -0.0005538500000000, -0.0001973300000000 ]  - [   0.0002271000000000, -0.0004085200000000, -0.0000757600000000 ]  - [  -0.0003591900000000,  0.0005217600000000, -0.0004563300000000 ]  - [  -0.0001967400000000,  0.0002821000000000, -0.0000517500000000 ]  - [   0.0005016600000000,  0.0000125600000000,  0.0006462800000000 ]  - [   0.0004600800000000,  0.0005136500000000,  0.0003979500000000 ]  - [   0.0002601100000000,  0.0002392100000000,  0.0000988000000000 ]  - [  -0.0029893000000000, -0.0001527200000000,  0.0001333200000000 ]  - [  -0.0022415300000000,  0.0000618100000000,  0.0000791700000000 ]  - [  -0.0003991400000000,  0.0000576600000000,  0.0000007200000000 ]  - [   0.0015224700000000,  0.0002028700000000,  0.0007295400000000 ]  - [   0.0025187200000000, -0.0002509200000000,  0.0001986700000000 ]  - [   0.0003843800000000,  0.0001327200000000,  0.0000177900000000 ]  - [   0.0022652700000000,  0.0048703500000000, -0.0135493500000000 ]  - [   0.0003097900000000, -0.0007156800000000,  0.0000742100000000 ]  - [   0.0000342000000000,  0.0004027400000000, -0.0004246900000000 ]  - [  -0.0001136900000000, -0.0006937500000000, -0.0012158700000000 ]  - [  -0.0004408500000000,  0.0000101600000000, -0.0006248500000000 ]  - [  -0.0000309500000000,  0.0001653600000000,  0.0001591700000000 ]  - [  -0.0006831600000000, -0.0007541100000000, -0.0006186000000000 ]  - [  -0.0001800500000000,  0.0000206600000000,  0.0001408100000000 ]  - [  -0.0009904100000000, -0.0000347600000000, -0.0000430000000000 ]  - [   0.0002982800000000, -0.0008489500000000,  0.0006718100000000 ]  - [   0.0001223600000000,  0.0000353500000000, -0.0001485400000000 ]  - [  -0.0002922000000000,  0.0001743500000000,  0.0003524500000000 ]  - [  -0.0000657900000000, -0.0001384500000000,  0.0002348200000000 ]  - [   0.0001336100000000,  0.0001139500000000,  0.0000472600000000 ]  - [   0.0002384000000000,  0.0003409000000000, -0.0000473200000000 ]  - [  -0.0006004000000000,  0.0000657600000000, -0.0002730700000000 ]  - [  -0.0002745500000000,  0.0001660000000000, -0.0000340400000000 ]  - [  -0.0002963700000000,  0.0003367000000000,  0.0000667900000000 ]  - [   0.0020271600000000,  0.0013986000000000, -0.0008545000000000 ]  - [   0.0002203400000000,  0.0001061200000000, -0.0000891400000000 ]  - [   0.0007011300000000, -0.0001593800000000, -0.0002226600000000 ]  - [   0.0004248400000000,  0.0000690000000000,  0.0000902200000000 ]  - [   0.0001108600000000, -0.0003866200000000,  0.0000126200000000 ]  - [   0.0005674100000000, -0.0006754500000000,  0.0002145800000000 ]  - [  -0.0004534400000000,  0.0000000400000000, -0.0000681400000000 ]  - [  -0.0000917500000000, -0.0007978100000000,  0.0000452600000000 ]  - [  -0.0006155900000000, -0.0006232600000000,  0.0001683500000000 ]  - [  -0.1984194400000000,  0.1161256900000000, -0.0724676600000000 ]  - [  -0.0001774900000000, -0.0001085000000000, -0.0000941500000000 ]  - [  -0.0006314600000000,  0.0005263700000000, -0.0001105900000000 ]  - [  -0.0021314300000000,  0.0006951900000000,  0.0002422200000000 ]  - [  -0.0032393200000000, -0.0019292700000000,  0.0026300700000000 ]  - [  -0.0006211400000000, -0.0003349700000000,  0.0001872900000000 ]  - [   0.0020832400000000,  0.0015226500000000, -0.0013660100000000 ]  - [   0.0020754700000000, -0.0016123800000000, -0.0018056300000000 ]  - [   0.0005256900000000, -0.0002778100000000, -0.0002052700000000 ]  - [  -0.0000435800000000, -0.0000760900000000, -0.0006703100000000 ]  - [  -0.0010819100000000,  0.0004978500000000, -0.0004162200000000 ]  - [   0.0001332200000000, -0.0003034600000000,  0.0000715300000000 ]  - [   0.0019063600000000,  0.0000735900000000,  0.0001974600000000 ]  - [   0.0011779800000000,  0.0003429700000000,  0.0002955300000000 ]  - [  -0.0000271500000000, -0.0002622700000000, -0.0000858200000000 ]  - [   0.0022568800000000,  0.0006233900000000,  0.0007764100000000 ]  - [   0.0010843200000000, -0.0004786100000000,  0.0001096000000000 ]  - [   0.0003384300000000, -0.0002218600000000, -0.0003357200000000 ]  - [   0.0012609800000000, -0.0058930300000000,  0.0094506400000000 ]  - [  -0.0007672000000000,  0.0007174900000000, -0.0001202700000000 ]  - [  -0.0003363100000000, -0.0005343500000000,  0.0002258300000000 ]  - [  -0.0004928800000000,  0.0005528900000000,  0.0001921400000000 ]  - [  -0.0001593300000000, -0.0004984000000000,  0.0001788800000000 ]  - [  -0.0006633700000000, -0.0035868700000000,  0.0074752900000000 ]  - [   0.0005245400000000,  0.0001553200000000,  0.0006521400000000 ]  - [   0.0001583700000000, -0.0003361100000000,  0.0000656500000000 ]  - [   0.0002256000000000,  0.0004910700000000,  0.0008717100000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.1192488500000000, -0.1494005500000000,  0.0586260700000000 ]  - [  -0.0000438100000000,  0.0002651000000000, -0.0000180300000000 ]  - [   0.0001036100000000,  0.0002596500000000,  0.0000642900000000 ]  - [   0.0117086500000000, -0.0185158200000000,  0.0057397100000000 ]  - [  -0.0003056700000000, -0.0001850600000000, -0.0001499200000000 ]  - [   0.0003437400000000, -0.0001800600000000,  0.0001687700000000 ]  - [  -0.0002309600000000,  0.0003105800000000, -0.0000663200000000 ]  - [  -0.0005498600000000,  0.0007478600000000,  0.0002546000000000 ]  - [  -0.0000939900000000,  0.0002889300000000,  0.0000711400000000 ]  - [   0.0002892500000000,  0.0000692300000000,  0.0001184700000000 ]  - [   0.0005810100000000,  0.0007977000000000, -0.0002527700000000 ]  - [   0.0010935500000000,  0.0010427600000000, -0.0005958600000000 ]  - [  -0.0000160700000000, -0.0000342900000000, -0.0001305200000000 ]  - [  -0.0004627300000000,  0.0007222400000000, -0.0002132000000000 ]  - [  -0.0011013700000000,  0.0010415200000000, -0.0005692700000000 ]  - [  -0.0000080700000000,  0.0002046100000000,  0.0000121900000000 ]  - [   0.0004307900000000,  0.0006751400000000,  0.0002118400000000 ]  - [   0.0001175000000000,  0.0003120600000000,  0.0000616600000000 ]  - [  -0.0004418700000000, -0.0004371900000000, -0.0000243800000000 ]  - [   0.0001042100000000, -0.0003053000000000, -0.0000694900000000 ]  - [   0.0000993900000000, -0.0003019400000000, -0.0000307000000000 ]  - [  -0.0028941500000000, -0.0037000100000000,  0.0019682800000000 ]  - [   0.0002906300000000,  0.0000042000000000, -0.0001216300000000 ]  - [  -0.0004435600000000,  0.0000018900000000,  0.0002044600000000 ]  - [  -0.0115791700000000,  0.0108143800000000, -0.0063076300000000 ]  - [   0.0000540200000000,  0.0002877800000000,  0.0003432300000000 ]  - [   0.0014184100000000,  0.0005746000000000, -0.0003404500000000 ]  - [  -0.0123775200000000,  0.0107269200000000, -0.0052335000000000 ]  - [  -0.0000078800000000,  0.0002918800000000, -0.0003260900000000 ]  - [   0.0002776800000000,  0.0005757700000000,  0.0011628400000000 ]  - [   0.0002951400000000, -0.0006073200000000,  0.0002615300000000 ]  - [  -0.0003702400000000,  0.0005014300000000, -0.0003469200000000 ]  - [  -0.0002441400000000,  0.0003881700000000, -0.0000266400000000 ]  - [   0.0001098200000000, -0.0006481000000000, -0.0004849900000000 ]  - [   0.0003008100000000,  0.0004670700000000,  0.0003365900000000 ]  - [   0.0002574600000000,  0.0004000500000000,  0.0000189300000000 ]  - [   0.0003943500000000, -0.0002611600000000,  0.0002225200000000 ]  - [  -0.0014068900000000,  0.0000178500000000,  0.0000818000000000 ]  - [   0.0000036900000000,  0.0001459300000000, -0.0000261000000000 ]  - [  -0.0003512400000000, -0.0001624700000000,  0.0005138800000000 ]  - [   0.0012438800000000,  0.0001819400000000, -0.0003830600000000 ]  - [  -0.0000031000000000,  0.0001925700000000,  0.0000380900000000 ]  - [   0.0008706300000000,  0.0036494500000000, -0.0086358300000000 ]  - [   0.0006123400000000, -0.0000597200000000,  0.0017119500000000 ]  - [   0.0000057100000000,  0.0006068500000000, -0.0006989900000000 ]  - [   0.0001224600000000, -0.0008106700000000, -0.0016230500000000 ]  - [  -0.0002516200000000,  0.0001470200000000, -0.0004989000000000 ]  - [  -0.0000095800000000,  0.0003332200000000,  0.0004742400000000 ]  - [  -0.0003513600000000, -0.0004316700000000, -0.0001687500000000 ]  - [  -0.0000910500000000,  0.0001685400000000,  0.0002807800000000 ]  - [  -0.0006533700000000, -0.0000334400000000,  0.0001345800000000 ]  - [   0.0007271500000000, -0.0004058600000000,  0.0000631800000000 ]  - [   0.0000565500000000,  0.0001757200000000, -0.0002666600000000 ]  - [  -0.0002175700000000, -0.0000355500000000,  0.0002724200000000 ]  - [  -0.0000665300000000, -0.0002291100000000,  0.0002349800000000 ]  - [   0.0002476600000000,  0.0002792000000000, -0.0000746100000000 ]  - [   0.0002284300000000,  0.0003439500000000, -0.0000383800000000 ]  - [  -0.0003089000000000, -0.0002033300000000, -0.0004524700000000 ]  - [  -0.0001994300000000,  0.0002428900000000,  0.0000549500000000 ]  - [  -0.0002415600000000,  0.0003542500000000,  0.0000322800000000 ]  - [   0.0012414200000000,  0.0017694700000000, -0.0007659600000000 ]  - [  -0.0001496000000000, -0.0001791100000000,  0.0000788600000000 ]  - [   0.0004757000000000, -0.0000010800000000, -0.0002247100000000 ]  - [   0.0001321800000000,  0.0002486500000000,  0.0000683500000000 ]  - [  -0.0000040700000000, -0.0005757000000000,  0.0000154900000000 ]  - [   0.0003983700000000, -0.0006307200000000,  0.0001885700000000 ]  - [  -0.0001717200000000,  0.0004602700000000,  0.0000197100000000 ]  - [   0.0000159800000000, -0.0008130100000000,  0.0000258000000000 ]  - [  -0.0004082200000000, -0.0006611600000000,  0.0001894800000000 ]  - [  -0.1144840100000000,  0.1416524100000000, -0.0563540900000000 ]  - [   0.0000862800000000, -0.0002634800000000,  0.0000475500000000 ]  - [  -0.0007602800000000, -0.0002375400000000, -0.0003700300000000 ]  - [  -0.0006591000000000,  0.0009206100000000, -0.0009800300000000 ]  - [  -0.0007528200000000, -0.0011244800000000,  0.0012543100000000 ]  - [  -0.0003619900000000, -0.0005535800000000,  0.0001212300000000 ]  - [  -0.0004409200000000,  0.0009418400000000,  0.0003549800000000 ]  - [   0.0016075000000000, -0.0010358700000000, -0.0008035600000000 ]  - [   0.0003212000000000, -0.0005368100000000, -0.0001297200000000 ]  - [   0.0007828000000000,  0.0003152200000000, -0.0004225900000000 ]  - [  -0.0004964900000000,  0.0000635500000000,  0.0000994700000000 ]  - [   0.0003590600000000, -0.0004162600000000,  0.0001209600000000 ]  - [  -0.0002107400000000,  0.0002867200000000,  0.0001240700000000 ]  - [   0.0005330700000000,  0.0001305500000000,  0.0000114900000000 ]  - [  -0.0003195600000000, -0.0003969800000000, -0.0001302000000000 ]  - [   0.0023478500000000,  0.0030964500000000,  0.0014306300000000 ]  - [   0.0003482400000000, -0.0004742200000000,  0.0000333800000000 ]  - [  -0.0001852400000000, -0.0005507000000000, -0.0006121300000000 ]  - [   0.0057356500000000,  0.0014524700000000,  0.0057055300000000 ]  - [  -0.0010608200000000, -0.0014031200000000, -0.0006261400000000 ]  - [   0.0001580900000000, -0.0008494500000000,  0.0005420900000000 ]  - [  -0.0004449200000000,  0.0005461700000000, -0.0011196000000000 ]  - [  -0.0000575200000000, -0.0007215800000000,  0.0002720000000000 ]  - [  -0.0001849100000000, -0.0023030400000000,  0.0046278300000000 ]  - [   0.0002627900000000,  0.0001014400000000,  0.0006020400000000 ]  - [   0.0000584500000000, -0.0005230800000000, -0.0001433400000000 ]  - [  -0.0000258000000000,  0.0006028800000000,  0.0011831300000000 ]- atom:    1  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.1127230800000000,  0.1466739000000000, -0.0554278300000000 ]  - [   0.0007293400000000, -0.0012316300000000,  0.0003609900000000 ]  - [   0.0005955600000000, -0.0012378700000000,  0.0002855000000000 ]  - [  -0.0121705900000000,  0.0173621500000000, -0.0059737100000000 ]  - [  -0.0003910000000000, -0.0007967700000000, -0.0001987100000000 ]  - [  -0.0010502700000000, -0.0007925400000000, -0.0005221700000000 ]  - [  -0.0004628400000000,  0.0006576500000000,  0.0004168500000000 ]  - [  -0.0001460800000000,  0.0002189600000000,  0.0000941000000000 ]  - [  -0.0006034800000000,  0.0006817700000000,  0.0002773900000000 ]  - [   0.0003987300000000,  0.0008952800000000, -0.0004654900000000 ]  - [   0.0001138300000000,  0.0001694800000000, -0.0000949100000000 ]  - [  -0.0004058300000000, -0.0000790800000000,  0.0002524300000000 ]  - [  -0.0006786700000000,  0.0010036800000000, -0.0002151900000000 ]  - [  -0.0002309300000000,  0.0002435900000000, -0.0001335700000000 ]  - [   0.0004158300000000, -0.0000808200000000,  0.0002269300000000 ]  - [   0.0007090000000000,  0.0007670000000000,  0.0003375400000000 ]  - [   0.0002642200000000,  0.0002904600000000,  0.0001357900000000 ]  - [   0.0005773900000000,  0.0006556000000000,  0.0002858500000000 ]  - [   0.0011445900000000, -0.0005305400000000, -0.0003251000000000 ]  - [   0.0006000700000000, -0.0006694400000000, -0.0002825600000000 ]  - [   0.0005978400000000, -0.0006673700000000, -0.0003183600000000 ]  - [   0.0022198800000000,  0.0027642500000000, -0.0016458900000000 ]  - [  -0.0009821900000000, -0.0009698600000000,  0.0004673000000000 ]  - [  -0.0002494600000000, -0.0009734800000000,  0.0001427200000000 ]  - [   0.0115984600000000, -0.0109650600000000,  0.0063839200000000 ]  - [   0.0002618800000000, -0.0005438900000000, -0.0001690100000000 ]  - [  -0.0011274400000000, -0.0008287200000000,  0.0005310100000000 ]  - [   0.0118015800000000, -0.0108785600000000,  0.0048899500000000 ]  - [  -0.0003078100000000, -0.0005482300000000,  0.0001521400000000 ]  - [  -0.0005953000000000, -0.0008291100000000, -0.0013674000000000 ]  - [  -0.0006127700000000,  0.0008666600000000, -0.0000829000000000 ]  - [   0.0000594100000000, -0.0002575200000000,  0.0005337000000000 ]  - [  -0.0000690600000000, -0.0001387200000000,  0.0002050100000000 ]  - [   0.0002070200000000,  0.0009082100000000,  0.0003058300000000 ]  - [   0.0000071400000000, -0.0002244800000000, -0.0005235500000000 ]  - [   0.0000553300000000, -0.0001506600000000, -0.0001971600000000 ]  - [  -0.0003861000000000,  0.0002641200000000, -0.0002252100000000 ]  - [   0.0014285200000000, -0.0000210700000000, -0.0000865500000000 ]  - [  -0.0000012000000000, -0.0001472900000000,  0.0000264200000000 ]  - [   0.0003417900000000,  0.0001682100000000, -0.0005162800000000 ]  - [  -0.0012659500000000, -0.0001829200000000,  0.0003808300000000 ]  - [   0.0000008300000000, -0.0001940900000000, -0.0000386500000000 ]  - [  -0.0008872500000000, -0.0036990800000000,  0.0087345600000000 ]  - [  -0.0006106100000000,  0.0000597200000000, -0.0016983500000000 ]  - [  -0.0000058900000000, -0.0006121500000000,  0.0007079000000000 ]  - [  -0.0001203800000000,  0.0008156000000000,  0.0016254400000000 ]  - [   0.0002577800000000, -0.0001461400000000,  0.0005135000000000 ]  - [   0.0000099100000000, -0.0003375000000000, -0.0004806100000000 ]  - [   0.0000437700000000,  0.0001836100000000,  0.0003494000000000 ]  - [  -0.0002232000000000, -0.0004227000000000, -0.0001047200000000 ]  - [   0.0003450600000000, -0.0002185200000000,  0.0000439800000000 ]  - [  -0.0004175000000000,  0.0001564300000000, -0.0002459000000000 ]  - [   0.0002581100000000, -0.0004298400000000,  0.0000905000000000 ]  - [   0.0005342400000000, -0.0002160800000000, -0.0004548300000000 ]  - [   0.0003816400000000,  0.0004833600000000, -0.0000582800000000 ]  - [   0.0000663600000000, -0.0000292700000000,  0.0002537500000000 ]  - [   0.0000866300000000, -0.0000912300000000,  0.0002133900000000 ]  - [  -0.0000023300000000,  0.0004573200000000,  0.0002778600000000 ]  - [  -0.0001129900000000,  0.0000071900000000, -0.0002330800000000 ]  - [  -0.0000730400000000, -0.0001019300000000, -0.0002073500000000 ]  - [  -0.0012546000000000, -0.0011657000000000,  0.0007769700000000 ]  - [   0.0001442900000000,  0.0008017800000000, -0.0000758200000000 ]  - [  -0.0004804200000000,  0.0006209200000000,  0.0002266700000000 ]  - [  -0.0001359900000000, -0.0008714400000000, -0.0000700400000000 ]  - [   0.0000034300000000, -0.0000403300000000, -0.0000164400000000 ]  - [  -0.0004022000000000,  0.0000136100000000, -0.0001904500000000 ]  - [   0.0001739300000000, -0.0010842600000000, -0.0000211000000000 ]  - [  -0.0000141700000000,  0.0002017400000000, -0.0000253000000000 ]  - [   0.0004120300000000,  0.0000440800000000, -0.0001912400000000 ]  - [   0.1091358100000000, -0.1392114100000000,  0.0537267500000000 ]  - [  -0.0000827900000000,  0.0008896000000000, -0.0000458700000000 ]  - [   0.0007728300000000,  0.0008562700000000,  0.0003768800000000 ]  - [  -0.0000079200000000, -0.0009442700000000,  0.0009806600000000 ]  - [   0.0001096000000000,  0.0011436100000000, -0.0012743800000000 ]  - [  -0.0003073900000000,  0.0005588500000000, -0.0001214700000000 ]  - [   0.0011112100000000, -0.0009649500000000, -0.0003499300000000 ]  - [  -0.0009398800000000,  0.0010565400000000,  0.0008344200000000 ]  - [   0.0003491400000000,  0.0005421000000000,  0.0001300900000000 ]  - [  -0.0001057200000000, -0.0003206100000000,  0.0004264300000000 ]  - [   0.0011810500000000, -0.0000640100000000, -0.0000980600000000 ]  - [   0.0003112000000000,  0.0004197800000000, -0.0001219200000000 ]  - [  -0.0004735500000000, -0.0002902900000000, -0.0001260600000000 ]  - [  -0.0012198300000000, -0.0001306300000000, -0.0000108500000000 ]  - [  -0.0003514600000000,  0.0004002400000000,  0.0001313600000000 ]  - [  -0.0023405600000000, -0.0029515600000000, -0.0017210000000000 ]  - [  -0.0003672700000000,  0.0006295700000000, -0.0003384500000000 ]  - [   0.0001878300000000,  0.0006957300000000,  0.0003201400000000 ]  - [  -0.0058964400000000, -0.0013642300000000, -0.0055181500000000 ]  - [   0.0010558400000000,  0.0015272200000000,  0.0009178700000000 ]  - [  -0.0001598400000000,  0.0009974000000000, -0.0002501700000000 ]  - [   0.0004494200000000, -0.0006841000000000,  0.0008138000000000 ]  - [   0.0000600100000000,  0.0005903900000000, -0.0005730000000000 ]  - [   0.0001906700000000,  0.0021859400000000, -0.0049714800000000 ]  - [  -0.0002688200000000, -0.0002431300000000, -0.0003142300000000 ]  - [  -0.0000610000000000,  0.0003913200000000,  0.0004438600000000 ]  - [   0.0000230800000000, -0.0007457900000000, -0.0008896500000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0706103900000000,  0.0560213200000000, -0.0911726400000000 ]  - [   0.0000446300000000, -0.0005955600000000,  0.0000217100000000 ]  - [   0.0000517200000000, -0.0006734500000000,  0.0000221400000000 ]  - [   0.0064584500000000, -0.0062906000000000,  0.0053436500000000 ]  - [  -0.0003248200000000, -0.0008325200000000, -0.0000809700000000 ]  - [  -0.0003153000000000, -0.0005086400000000, -0.0000803100000000 ]  - [  -0.0005539100000000,  0.0007272200000000,  0.0002162600000000 ]  - [  -0.0002827300000000,  0.0004041800000000,  0.0001575900000000 ]  - [  -0.0003617400000000,  0.0005870600000000,  0.0003719100000000 ]  - [   0.0001482100000000,  0.0007779300000000,  0.0004972900000000 ]  - [   0.0002062700000000,  0.0004058300000000, -0.0000966000000000 ]  - [  -0.0001600200000000,  0.0000582900000000,  0.0003089300000000 ]  - [  -0.0000872500000000,  0.0005258400000000,  0.0000965500000000 ]  - [  -0.0002904600000000,  0.0004437200000000, -0.0001347900000000 ]  - [   0.0001621400000000,  0.0000831700000000,  0.0001953600000000 ]  - [   0.0005181300000000,  0.0006473700000000,  0.0002529600000000 ]  - [   0.0003695500000000,  0.0004452600000000,  0.0001873800000000 ]  - [   0.0004607300000000,  0.0005948000000000,  0.0002982800000000 ]  - [   0.0008074700000000, -0.0006338100000000, -0.0003029900000000 ]  - [   0.0005505200000000, -0.0006291200000000, -0.0002600600000000 ]  - [   0.0005539600000000, -0.0005903100000000, -0.0002590800000000 ]  - [   0.0013776500000000,  0.0013297100000000, -0.0015434700000000 ]  - [  -0.0002921000000000, -0.0004533100000000,  0.0001128200000000 ]  - [  -0.0003222900000000, -0.0007788000000000,  0.0001122800000000 ]  - [  -0.0182799600000000,  0.0117198400000000, -0.0146183900000000 ]  - [   0.0002093700000000, -0.0002732400000000, -0.0000525500000000 ]  - [   0.0000242600000000, -0.0005947600000000, -0.0007681300000000 ]  - [   0.0181939100000000, -0.0113078900000000,  0.0077102100000000 ]  - [  -0.0002131100000000, -0.0002328600000000,  0.0000205800000000 ]  - [   0.0000131200000000,  0.0011922300000000, -0.0005815100000000 ]  - [   0.0002524400000000, -0.0004110600000000,  0.0011684200000000 ]  - [  -0.0000580300000000, -0.0000256500000000,  0.0004144500000000 ]  - [  -0.0000805100000000,  0.0001074600000000,  0.0002465900000000 ]  - [  -0.0002956800000000,  0.0002971300000000,  0.0007820400000000 ]  - [  -0.0001113400000000, -0.0000951700000000, -0.0004233800000000 ]  - [   0.0001259900000000, -0.0000098700000000, -0.0001281100000000 ]  - [  -0.0008596800000000,  0.0001960800000000, -0.0001773100000000 ]  - [   0.0009671200000000, -0.0001203300000000, -0.0002370700000000 ]  - [   0.0001325200000000, -0.0000718000000000, -0.0000046800000000 ]  - [  -0.0022233100000000,  0.0005487700000000,  0.0004670200000000 ]  - [  -0.0006391200000000, -0.0003832300000000,  0.0003442200000000 ]  - [  -0.0001632700000000, -0.0000155200000000, -0.0000025500000000 ]  - [   0.0010471800000000, -0.0026807900000000,  0.0048897500000000 ]  - [   0.0001869500000000,  0.0010325900000000, -0.0006441600000000 ]  - [  -0.0000087700000000, -0.0001923500000000,  0.0001661200000000 ]  - [   0.0000956700000000,  0.0003459900000000,  0.0007853500000000 ]  - [   0.0000257600000000,  0.0002004400000000,  0.0005488800000000 ]  - [   0.0000122800000000, -0.0000669200000000, -0.0000476100000000 ]  - [   0.0001419700000000,  0.0000229800000000,  0.0001543700000000 ]  - [  -0.0001596700000000, -0.0002215300000000,  0.0000272000000000 ]  - [   0.0001548800000000, -0.0003292600000000, -0.0000628400000000 ]  - [  -0.0002879400000000, -0.0001141700000000, -0.0002749800000000 ]  - [   0.0001663300000000, -0.0002050400000000, -0.0000687800000000 ]  - [   0.0001634000000000,  0.0000196600000000, -0.0006112900000000 ]  - [   0.0000580400000000,  0.0000207900000000,  0.0004208000000000 ]  - [   0.0001262500000000,  0.0000600100000000,  0.0002567200000000 ]  - [   0.0000862400000000,  0.0000532800000000,  0.0002003000000000 ]  - [  -0.0000454700000000,  0.0003063900000000,  0.0001538000000000 ]  - [  -0.0000638800000000,  0.0001029500000000, -0.0001525900000000 ]  - [  -0.0001153800000000,  0.0000112700000000, -0.0001331000000000 ]  - [  -0.0008760400000000, -0.0004188500000000,  0.0007078800000000 ]  - [  -0.0001086700000000,  0.0004116900000000,  0.0000761300000000 ]  - [  -0.0002745200000000,  0.0005192500000000,  0.0003194500000000 ]  - [  -0.0001575800000000, -0.0004126200000000, -0.0002915200000000 ]  - [  -0.0000543300000000, -0.0002429400000000, -0.0000603700000000 ]  - [  -0.0002512800000000, -0.0001246800000000, -0.0002106600000000 ]  - [   0.0001134100000000, -0.0003569500000000, -0.0007121200000000 ]  - [   0.0001073000000000, -0.0000514600000000,  0.0000096000000000 ]  - [   0.0001796300000000, -0.0001509200000000, -0.0003052400000000 ]  - [   0.0693938800000000, -0.0543205800000000,  0.0869792700000000 ]  - [   0.0001057400000000,  0.0005163000000000,  0.0000315100000000 ]  - [   0.0001289400000000,  0.0002172900000000,  0.0004313100000000 ]  - [   0.0004145700000000, -0.0013798900000000, -0.0017976100000000 ]  - [  -0.0007381800000000,  0.0005757700000000, -0.0005341700000000 ]  - [  -0.0002499500000000,  0.0001151600000000, -0.0001158900000000 ]  - [   0.0014292200000000,  0.0002639700000000,  0.0002138900000000 ]  - [  -0.0001273300000000,  0.0013187600000000,  0.0027656900000000 ]  - [   0.0002558400000000,  0.0001932800000000,  0.0001109700000000 ]  - [   0.0015452000000000, -0.0002558600000000, -0.0000071200000000 ]  - [   0.0007650400000000,  0.0000999000000000, -0.0001082300000000 ]  - [   0.0004430100000000,  0.0001140100000000, -0.0000529200000000 ]  - [  -0.0000509600000000, -0.0000899000000000, -0.0000173400000000 ]  - [  -0.0009606600000000, -0.0000653500000000,  0.0000518400000000 ]  - [  -0.0004288500000000,  0.0001623400000000,  0.0000547100000000 ]  - [  -0.0009419900000000, -0.0002911200000000, -0.0007428500000000 ]  - [  -0.0003650600000000,  0.0003377400000000, -0.0006683700000000 ]  - [  -0.0001467500000000,  0.0001993600000000, -0.0000640900000000 ]  - [  -0.0056809400000000,  0.0031809000000000,  0.0027279500000000 ]  - [   0.0001826600000000, -0.0002952400000000,  0.0009268800000000 ]  - [   0.0001372200000000,  0.0003589700000000,  0.0001655900000000 ]  - [  -0.0002291400000000, -0.0008718000000000, -0.0003912100000000 ]  - [   0.0000548400000000,  0.0001168600000000, -0.0002932400000000 ]  - [  -0.0001558400000000,  0.0013121500000000, -0.0027071200000000 ]  - [  -0.0000062900000000, -0.0003571400000000, -0.0002331500000000 ]  - [  -0.0000560300000000,  0.0000481500000000,  0.0001579100000000 ]  - [  -0.0000830800000000, -0.0003285800000000, -0.0004493300000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0725346100000000, -0.0579889600000000,  0.0903481500000000 ]  - [   0.0006493800000000, -0.0003752200000000,  0.0003244100000000 ]  - [   0.0006425800000000, -0.0002948400000000,  0.0003248500000000 ]  - [  -0.0072624600000000,  0.0054236300000000, -0.0056583600000000 ]  - [  -0.0003707100000000, -0.0001424500000000, -0.0002681700000000 ]  - [  -0.0003791700000000, -0.0004601300000000, -0.0002674500000000 ]  - [  -0.0001463900000000,  0.0002442900000000,  0.0001354700000000 ]  - [  -0.0004157100000000,  0.0005651200000000,  0.0001924700000000 ]  - [  -0.0003369900000000,  0.0003812400000000, -0.0000232800000000 ]  - [   0.0005474500000000,  0.0001941100000000, -0.0008376300000000 ]  - [   0.0004919900000000,  0.0005641000000000, -0.0002532200000000 ]  - [   0.0008543000000000,  0.0009069600000000, -0.0006572000000000 ]  - [  -0.0006044500000000,  0.0004410800000000, -0.0004429200000000 ]  - [  -0.0004040800000000,  0.0005235200000000, -0.0002129400000000 ]  - [  -0.0008512600000000,  0.0008800400000000, -0.0005407000000000 ]  - [   0.0001793100000000,  0.0003220100000000,  0.0000968400000000 ]  - [   0.0003253200000000,  0.0005214700000000,  0.0001606900000000 ]  - [   0.0002329700000000,  0.0003713700000000,  0.0000486100000000 ]  - [  -0.0001038700000000, -0.0003337100000000, -0.0000464600000000 ]  - [   0.0001495200000000, -0.0003421000000000, -0.0000902200000000 ]  - [   0.0001424100000000, -0.0003771900000000, -0.0000892900000000 ]  - [  -0.0020749000000000, -0.0022850200000000,  0.0018887600000000 ]  - [  -0.0004049200000000, -0.0005156800000000,  0.0002360000000000 ]  - [  -0.0003724000000000, -0.0001899100000000,  0.0002355300000000 ]  - [   0.0187412700000000, -0.0119859400000000,  0.0148886300000000 ]  - [   0.0001064500000000,  0.0000203800000000,  0.0002266300000000 ]  - [   0.0002944100000000,  0.0003535000000000,  0.0009374200000000 ]  - [  -0.0187068200000000,  0.0113785400000000, -0.0079471100000000 ]  - [  -0.0001024800000000, -0.0000207500000000, -0.0001945800000000 ]  - [  -0.0003336600000000, -0.0014472600000000,  0.0004190200000000 ]  - [  -0.0005702000000000,  0.0006657500000000, -0.0009976600000000 ]  - [  -0.0002552000000000,  0.0002740700000000, -0.0002320500000000 ]  - [  -0.0002331600000000,  0.0001418900000000, -0.0000678300000000 ]  - [   0.0006014700000000, -0.0000499800000000, -0.0009528900000000 ]  - [   0.0004250900000000,  0.0003465000000000,  0.0002449800000000 ]  - [   0.0001872800000000,  0.0002601600000000, -0.0000509200000000 ]  - [   0.0008518700000000, -0.0001933900000000,  0.0001748100000000 ]  - [  -0.0009750100000000,  0.0001195900000000,  0.0002342700000000 ]  - [  -0.0001307200000000,  0.0000717700000000,  0.0000044600000000 ]  - [   0.0022464200000000, -0.0005551300000000, -0.0004718800000000 ]  - [   0.0006364800000000,  0.0003862500000000, -0.0003434600000000 ]  - [   0.0001617200000000,  0.0000148000000000,  0.0000029400000000 ]  - [  -0.0010074700000000,  0.0026536500000000, -0.0048958700000000 ]  - [  -0.0001860700000000, -0.0010234300000000,  0.0006233800000000 ]  - [   0.0000087800000000,  0.0001917100000000, -0.0001663400000000 ]  - [  -0.0000974800000000, -0.0003377900000000, -0.0007661700000000 ]  - [  -0.0000206700000000, -0.0002006300000000, -0.0005327300000000 ]  - [  -0.0000123000000000,  0.0000667500000000,  0.0000493500000000 ]  - [  -0.0004556800000000, -0.0002756600000000,  0.0000203200000000 ]  - [  -0.0001551300000000, -0.0000315500000000,  0.0001483900000000 ]  - [  -0.0004667500000000,  0.0000783000000000,  0.0002401200000000 ]  - [   0.0006022100000000, -0.0001372100000000,  0.0001002100000000 ]  - [   0.0001486300000000, -0.0000481000000000, -0.0001066300000000 ]  - [   0.0001541100000000, -0.0002736600000000,  0.0004359500000000 ]  - [   0.0002588700000000,  0.0002331300000000, -0.0002454100000000 ]  - [   0.0001885800000000,  0.0001915500000000, -0.0000786400000000 ]  - [   0.0002295600000000,  0.0002002200000000, -0.0000259300000000 ]  - [  -0.0002677200000000, -0.0000552700000000, -0.0003320200000000 ]  - [  -0.0002502700000000,  0.0001492400000000, -0.0000240600000000 ]  - [  -0.0001999800000000,  0.0002423700000000, -0.0000414800000000 ]  - [   0.0008729300000000,  0.0010334500000000, -0.0007066500000000 ]  - [   0.0001072300000000,  0.0002095500000000, -0.0000750600000000 ]  - [   0.0002712800000000,  0.0000999100000000, -0.0003194300000000 ]  - [   0.0001545100000000, -0.0002063800000000,  0.0002915700000000 ]  - [   0.0000541100000000, -0.0003751500000000,  0.0000596900000000 ]  - [   0.0002494600000000, -0.0004931000000000,  0.0002104200000000 ]  - [  -0.0001087000000000, -0.0002629500000000,  0.0007105500000000 ]  - [  -0.0001072900000000, -0.0005672800000000, -0.0000109900000000 ]  - [  -0.0001781700000000, -0.0004663000000000,  0.0003060800000000 ]  - [  -0.0704139500000000,  0.0555201900000000, -0.0859983400000000 ]  - [  -0.0001052100000000,  0.0001060300000000, -0.0000301300000000 ]  - [  -0.0001291200000000,  0.0003998600000000, -0.0004331500000000 ]  - [  -0.0010963400000000,  0.0014025900000000,  0.0018118800000000 ]  - [   0.0000770300000000, -0.0005805100000000,  0.0005258000000000 ]  - [  -0.0004231400000000, -0.0001131000000000,  0.0001138600000000 ]  - [  -0.0007457300000000, -0.0002642700000000, -0.0001970800000000 ]  - [   0.0008180900000000, -0.0013403300000000, -0.0027863900000000 ]  - [   0.0004172300000000, -0.0001919800000000, -0.0001086600000000 ]  - [  -0.0008855300000000,  0.0002565100000000,  0.0000079800000000 ]  - [  -0.0000906700000000, -0.0001005800000000,  0.0001056700000000 ]  - [   0.0002285300000000, -0.0001123200000000,  0.0000513100000000 ]  - [  -0.0006228700000000,  0.0000882600000000,  0.0000190100000000 ]  - [   0.0002917300000000,  0.0000664200000000, -0.0000487800000000 ]  - [  -0.0002425200000000, -0.0001613100000000, -0.0000528600000000 ]  - [   0.0009252700000000,  0.0004069300000000,  0.0004298100000000 ]  - [   0.0003524800000000, -0.0001861000000000,  0.0003657400000000 ]  - [   0.0001450400000000, -0.0000616400000000, -0.0002343200000000 ]  - [   0.0055950400000000, -0.0029989700000000, -0.0023112500000000 ]  - [  -0.0001777000000000,  0.0004400400000000, -0.0006192200000000 ]  - [  -0.0001358000000000, -0.0002193200000000,  0.0001323100000000 ]  - [   0.0002239600000000,  0.0007224700000000,  0.0000978200000000 ]  - [  -0.0000541400000000, -0.0002542400000000,  0.0000003000000000 ]  - [   0.0001490200000000, -0.0014494700000000,  0.0024226900000000 ]  - [   0.0000061100000000,  0.0002155300000000,  0.0005183500000000 ]  - [   0.0000552700000000, -0.0001857000000000,  0.0001369700000000 ]  - [   0.0000835700000000,  0.0001850900000000,  0.0007333200000000 ]- atom:   25  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0082747200000000, -0.0122357500000000, -0.0184323800000000 ]  - [  -0.0001589500000000,  0.0007916700000000,  0.0000350000000000 ]  - [   0.0004550500000000, -0.0005872300000000,  0.0002249400000000 ]  - [  -0.0153181400000000,  0.0116104500000000,  0.0183459100000000 ]  - [  -0.0011596000000000, -0.0009242500000000,  0.0000027700000000 ]  - [  -0.0004995800000000, -0.0006335300000000, -0.0002285400000000 ]  - [  -0.0007307900000000,  0.0009358800000000, -0.0002378200000000 ]  - [  -0.0001454200000000,  0.0002700700000000,  0.0000757300000000 ]  - [  -0.0003067800000000,  0.0003970800000000,  0.0000977200000000 ]  - [  -0.0000013300000000,  0.0005288700000000,  0.0002771100000000 ]  - [   0.0000420400000000,  0.0003385800000000,  0.0000934200000000 ]  - [   0.0002437200000000,  0.0003838200000000, -0.0001432300000000 ]  - [   0.0001000200000000,  0.0003286800000000, -0.0000611500000000 ]  - [  -0.0002289400000000,  0.0004406900000000, -0.0000803600000000 ]  - [  -0.0002066500000000,  0.0003987700000000, -0.0001305500000000 ]  - [   0.0005720100000000,  0.0007076100000000,  0.0000738000000000 ]  - [   0.0003709900000000,  0.0003930200000000,  0.0001425200000000 ]  - [   0.0002643900000000,  0.0004119200000000,  0.0001014100000000 ]  - [   0.0002026300000000,  0.0000864400000000,  0.0002695900000000 ]  - [   0.0007995100000000, -0.0008592200000000, -0.0001790600000000 ]  - [   0.0003827500000000, -0.0005842100000000, -0.0001826400000000 ]  - [   0.0001815000000000, -0.0002890900000000, -0.0001245200000000 ]  - [   0.0004955800000000,  0.0000182900000000, -0.0001394100000000 ]  - [  -0.0003247300000000, -0.0005493000000000,  0.0001761500000000 ]  - [  -0.0914252500000000,  0.0569109700000000,  0.0730366700000000 ]  - [   0.0000214100000000, -0.0003581800000000,  0.0003699000000000 ]  - [   0.0000205700000000, -0.0002506800000000,  0.0003623300000000 ]  - [   0.0053624500000000, -0.0061059000000000, -0.0073151100000000 ]  - [  -0.0000776800000000, -0.0001668500000000, -0.0001203100000000 ]  - [  -0.0000755900000000, -0.0004872600000000, -0.0000872300000000 ]  - [  -0.0000665900000000,  0.0001392200000000, -0.0003126100000000 ]  - [  -0.0004872900000000,  0.0006997700000000, -0.0003993500000000 ]  - [  -0.0001585700000000,  0.0000224600000000,  0.0000847000000000 ]  - [  -0.0002690200000000,  0.0001797700000000, -0.0000683700000000 ]  - [  -0.0014829000000000, -0.0017556900000000, -0.0024435100000000 ]  - [   0.0000867800000000, -0.0000173800000000, -0.0001798500000000 ]  - [  -0.0002645100000000,  0.0004708200000000, -0.0000960200000000 ]  - [   0.0055355100000000, -0.0017889200000000, -0.0021653400000000 ]  - [   0.0000559900000000, -0.0001697900000000,  0.0000238400000000 ]  - [   0.0005867300000000,  0.0000260900000000,  0.0000232400000000 ]  - [   0.0007531300000000,  0.0000118000000000, -0.0001114900000000 ]  - [   0.0000153900000000, -0.0000203100000000, -0.0000291200000000 ]  - [   0.0001910800000000, -0.0004109200000000,  0.0005630300000000 ]  - [   0.0009053500000000,  0.0002588000000000,  0.0015440500000000 ]  - [   0.0000012600000000, -0.0000862700000000,  0.0002670000000000 ]  - [  -0.0001020900000000, -0.0003544400000000, -0.0006765500000000 ]  - [  -0.0001415600000000,  0.0005189900000000,  0.0007964600000000 ]  - [  -0.0000070300000000, -0.0002145400000000, -0.0003189300000000 ]  - [   0.0008254000000000,  0.0002548500000000,  0.0005921500000000 ]  - [  -0.0000837900000000, -0.0002270300000000,  0.0001722900000000 ]  - [  -0.0000838400000000, -0.0000652100000000,  0.0002292800000000 ]  - [   0.0003681100000000, -0.0002652200000000, -0.0000307900000000 ]  - [   0.0001766000000000, -0.0001718500000000, -0.0000456000000000 ]  - [   0.0001760900000000, -0.0001992000000000, -0.0000582800000000 ]  - [   0.0002118200000000,  0.0002415300000000, -0.0000428600000000 ]  - [   0.0003118300000000,  0.0003053000000000, -0.0000461700000000 ]  - [   0.0001629800000000,  0.0000672500000000,  0.0000941000000000 ]  - [  -0.0000275800000000,  0.0002396500000000, -0.0001962000000000 ]  - [   0.0003075700000000, -0.0003172200000000, -0.0006455600000000 ]  - [  -0.0001000800000000,  0.0000317200000000, -0.0001667700000000 ]  - [  -0.0004200100000000, -0.0000647900000000, -0.0002282200000000 ]  - [  -0.0005309300000000,  0.0002695200000000,  0.0001035800000000 ]  - [  -0.0000528300000000,  0.0003855800000000, -0.0000657500000000 ]  - [  -0.0002973500000000, -0.0004134600000000,  0.0000753000000000 ]  - [  -0.0002649600000000, -0.0001520400000000,  0.0002643000000000 ]  - [  -0.0000447800000000, -0.0001913200000000,  0.0000418300000000 ]  - [   0.0003360200000000, -0.0005434800000000,  0.0001981100000000 ]  - [   0.0008976900000000,  0.0005232000000000,  0.0013051500000000 ]  - [   0.0000517000000000, -0.0001620400000000,  0.0000591500000000 ]  - [   0.0861348800000000, -0.0543133500000000, -0.0693998100000000 ]  - [   0.0004131000000000,  0.0002620800000000, -0.0001605300000000 ]  - [   0.0000336100000000,  0.0005260700000000, -0.0001034300000000 ]  - [  -0.0009822500000000,  0.0002470300000000,  0.0002888500000000 ]  - [  -0.0008595400000000, -0.0005958800000000,  0.0010725700000000 ]  - [  -0.0003150500000000,  0.0001278400000000,  0.0000711000000000 ]  - [   0.0010204500000000, -0.0002922100000000, -0.0001313500000000 ]  - [   0.0036452100000000,  0.0044377900000000,  0.0053244600000000 ]  - [   0.0004195100000000,  0.0002842500000000, -0.0000781700000000 ]  - [  -0.0000458600000000, -0.0000495700000000,  0.0000497500000000 ]  - [  -0.0002608600000000, -0.0000500700000000,  0.0000705300000000 ]  - [   0.0002937900000000,  0.0000869700000000,  0.0000015400000000 ]  - [  -0.0003294600000000, -0.0003198700000000,  0.0000070200000000 ]  - [  -0.0030981500000000,  0.0003277900000000,  0.0003821200000000 ]  - [  -0.0004399700000000,  0.0001864000000000, -0.0000038700000000 ]  - [   0.0027528700000000,  0.0009947900000000,  0.0002144000000000 ]  - [  -0.0000176900000000,  0.0005203100000000, -0.0011827000000000 ]  - [   0.0000632500000000,  0.0003274700000000,  0.0000494100000000 ]  - [  -0.0006383400000000,  0.0005654500000000,  0.0005911300000000 ]  - [  -0.0015752500000000, -0.0013730800000000, -0.0002623600000000 ]  - [  -0.0000607200000000,  0.0002041100000000, -0.0000146600000000 ]  - [  -0.0004279000000000, -0.0000923700000000, -0.0011990300000000 ]  - [   0.0001085300000000,  0.0001105300000000, -0.0004111100000000 ]  - [  -0.0000823600000000,  0.0001907900000000, -0.0004592100000000 ]  - [   0.0000873200000000, -0.0006523400000000,  0.0000028000000000 ]  - [  -0.0001007300000000,  0.0002221100000000,  0.0003723800000000 ]  - [   0.0000603400000000,  0.0001403600000000,  0.0005752500000000 ]- atom:   25  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0075179100000000,  0.0109415700000000,  0.0185903400000000 ]  - [   0.0008375700000000, -0.0017542700000000,  0.0003054800000000 ]  - [   0.0002384800000000, -0.0003794400000000,  0.0001223400000000 ]  - [   0.0145271400000000, -0.0125650400000000, -0.0185530400000000 ]  - [   0.0004750800000000, -0.0000519000000000, -0.0003448300000000 ]  - [  -0.0001938100000000, -0.0003337900000000, -0.0001183900000000 ]  - [   0.0000421300000000,  0.0000279300000000,  0.0005851200000000 ]  - [  -0.0005536800000000,  0.0007002500000000,  0.0002732200000000 ]  - [  -0.0003875400000000,  0.0005717100000000,  0.0002502800000000 ]  - [   0.0006861100000000,  0.0004315500000000, -0.0006200800000000 ]  - [   0.0006565400000000,  0.0006327100000000, -0.0004434200000000 ]  - [   0.0004515700000000,  0.0005854800000000, -0.0002044700000000 ]  - [  -0.0007924400000000,  0.0006353800000000, -0.0002836300000000 ]  - [  -0.0004665000000000,  0.0005279700000000, -0.0002671700000000 ]  - [  -0.0004863800000000,  0.0005672800000000, -0.0002155700000000 ]  - [   0.0001233000000000,  0.0002595200000000,  0.0002745200000000 ]  - [   0.0003247200000000,  0.0005749800000000,  0.0002051600000000 ]  - [   0.0004278300000000,  0.0005536600000000,  0.0002450900000000 ]  - [   0.0004911500000000, -0.0010585700000000, -0.0006210700000000 ]  - [  -0.0001042100000000, -0.0001079900000000, -0.0001702300000000 ]  - [   0.0003119200000000, -0.0003825000000000, -0.0001648100000000 ]  - [  -0.0008812000000000, -0.0006845100000000,  0.0004735400000000 ]  - [  -0.0011845900000000, -0.0009805700000000,  0.0004827700000000 ]  - [  -0.0003700400000000, -0.0004169800000000,  0.0001713400000000 ]  - [   0.0929393000000000, -0.0562175300000000, -0.0717409200000000 ]  - [   0.0002943600000000,  0.0001064700000000, -0.0001945500000000 ]  - [   0.0002936600000000,  0.0000045200000000, -0.0001826600000000 ]  - [  -0.0057117100000000,  0.0057561000000000,  0.0070269800000000 ]  - [  -0.0002371300000000, -0.0000846100000000, -0.0000546000000000 ]  - [  -0.0002351700000000,  0.0002457300000000, -0.0000945200000000 ]  - [  -0.0002463300000000,  0.0001134900000000,  0.0004965500000000 ]  - [   0.0001775500000000, -0.0004568100000000,  0.0005866500000000 ]  - [  -0.0001553800000000,  0.0002302300000000,  0.0000932000000000 ]  - [   0.0005844000000000,  0.0000765100000000, -0.0001143400000000 ]  - [   0.0017961800000000,  0.0020121600000000,  0.0022726300000000 ]  - [   0.0002274800000000,  0.0002702000000000,  0.0000025900000000 ]  - [   0.0002796300000000, -0.0004730800000000,  0.0000972100000000 ]  - [  -0.0055461500000000,  0.0018340400000000,  0.0022208600000000 ]  - [  -0.0000516500000000,  0.0001706200000000, -0.0000239600000000 ]  - [  -0.0006067000000000, -0.0000232300000000, -0.0000209300000000 ]  - [  -0.0007718200000000, -0.0000144100000000,  0.0001106600000000 ]  - [  -0.0000196500000000,  0.0000210100000000,  0.0000292800000000 ]  - [  -0.0001920600000000,  0.0004103500000000, -0.0005624000000000 ]  - [  -0.0008952300000000, -0.0002573500000000, -0.0015222700000000 ]  - [  -0.0000015700000000,  0.0000885900000000, -0.0002685400000000 ]  - [   0.0001057200000000,  0.0003506600000000,  0.0006654000000000 ]  - [   0.0001448600000000, -0.0005242200000000, -0.0008030200000000 ]  - [   0.0000074300000000,  0.0002160900000000,  0.0003209100000000 ]  - [  -0.0011469100000000, -0.0005077600000000, -0.0004157900000000 ]  - [  -0.0002297700000000, -0.0000228400000000,  0.0000059300000000 ]  - [  -0.0002302400000000, -0.0001868000000000, -0.0000515000000000 ]  - [  -0.0000559000000000,  0.0000153700000000, -0.0001515800000000 ]  - [   0.0001364700000000, -0.0000783900000000, -0.0001333300000000 ]  - [   0.0001364500000000, -0.0000516900000000, -0.0001203100000000 ]  - [   0.0001003900000000,  0.0000083600000000,  0.0002221100000000 ]  - [   0.0000019600000000, -0.0000546800000000,  0.0002246500000000 ]  - [   0.0001530200000000,  0.0001883900000000,  0.0000792500000000 ]  - [  -0.0002862000000000,  0.0000101700000000,  0.0000187000000000 ]  - [  -0.0006231400000000,  0.0005730200000000,  0.0004740500000000 ]  - [  -0.0002159600000000,  0.0002238100000000, -0.0000061900000000 ]  - [   0.0004244700000000,  0.0006870900000000,  0.0002297100000000 ]  - [   0.0005280100000000,  0.0003456100000000, -0.0001004100000000 ]  - [   0.0000534100000000,  0.0002314000000000,  0.0000660400000000 ]  - [   0.0002968200000000, -0.0002015600000000, -0.0000772300000000 ]  - [   0.0002661400000000, -0.0004683900000000, -0.0002676200000000 ]  - [   0.0000452700000000, -0.0004289500000000, -0.0000421600000000 ]  - [  -0.0003356500000000, -0.0000730900000000, -0.0002003800000000 ]  - [  -0.0008991000000000, -0.0011428600000000, -0.0013115200000000 ]  - [  -0.0000524000000000, -0.0004587400000000, -0.0000592700000000 ]  - [  -0.0871394100000000,  0.0544001200000000,  0.0684478200000000 ]  - [  -0.0004114400000000,  0.0003575900000000,  0.0001601400000000 ]  - [  -0.0000346500000000,  0.0000872200000000,  0.0001041500000000 ]  - [   0.0003139800000000, -0.0002626700000000, -0.0003032000000000 ]  - [   0.0002023700000000,  0.0006184100000000, -0.0010884600000000 ]  - [  -0.0003554500000000, -0.0001290800000000, -0.0000718400000000 ]  - [  -0.0003581000000000,  0.0002830700000000,  0.0001362100000000 ]  - [  -0.0030866200000000, -0.0044895200000000, -0.0053877500000000 ]  - [   0.0002506300000000, -0.0002858700000000,  0.0000786700000000 ]  - [   0.0007310500000000,  0.0000489600000000, -0.0000501500000000 ]  - [   0.0009442900000000,  0.0000512900000000, -0.0000692700000000 ]  - [   0.0003790100000000, -0.0000888700000000, -0.0000011500000000 ]  - [  -0.0003539600000000,  0.0003227700000000, -0.0000082100000000 ]  - [   0.0024190800000000, -0.0003360600000000, -0.0003932500000000 ]  - [  -0.0002318500000000, -0.0001886600000000,  0.0000035700000000 ]  - [  -0.0027321100000000, -0.0008351600000000, -0.0004951200000000 ]  - [   0.0000057600000000, -0.0003821900000000,  0.0008965000000000 ]  - [  -0.0000656000000000, -0.0001923600000000, -0.0003490100000000 ]  - [   0.0006457100000000, -0.0004184200000000, -0.0002871400000000 ]  - [   0.0015614800000000,  0.0014933300000000,  0.0005560600000000 ]  - [   0.0000630600000000, -0.0000682200000000,  0.0003131200000000 ]  - [   0.0004279900000000, -0.0000410200000000,  0.0008863600000000 ]  - [  -0.0001067900000000, -0.0002510900000000,  0.0001177700000000 ]  - [   0.0000855000000000, -0.0003307300000000,  0.0001616800000000 ]  - [  -0.0000915200000000,  0.0005185400000000,  0.0002974200000000 ]  - [   0.0000991100000000, -0.0003619600000000, -0.0000771400000000 ]  - [  -0.0000639300000000, -0.0002767800000000, -0.0002736400000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0049193400000000,  0.0103550000000000,  0.0118958400000000 ]  - [   0.0017084500000000,  0.0002193300000000, -0.0003028200000000 ]  - [   0.0000989700000000, -0.0000664800000000,  0.0000271700000000 ]  - [  -0.0064054700000000,  0.0102681300000000,  0.0110244200000000 ]  - [  -0.0007895600000000,  0.0002201000000000, -0.0015060800000000 ]  - [  -0.0000695800000000, -0.0000622900000000, -0.0000678100000000 ]  - [   0.0001920300000000, -0.0002573800000000,  0.0007162400000000 ]  - [  -0.0007526500000000,  0.0008675100000000,  0.0003262400000000 ]  - [  -0.0005076100000000,  0.0007490600000000,  0.0001932200000000 ]  - [   0.0002287100000000, -0.0002971400000000, -0.0000013300000000 ]  - [   0.0007474200000000,  0.0008338700000000, -0.0003979000000000 ]  - [   0.0004658700000000,  0.0007608600000000, -0.0003093200000000 ]  - [  -0.0002859200000000,  0.0001524000000000,  0.0000071100000000 ]  - [  -0.0003901100000000,  0.0006034000000000, -0.0001979700000000 ]  - [  -0.0005600000000000,  0.0007119900000000, -0.0002893800000000 ]  - [   0.0000798700000000,  0.0001258500000000,  0.0002811500000000 ]  - [   0.0003370800000000,  0.0006396300000000,  0.0002406200000000 ]  - [   0.0005637200000000,  0.0007016400000000,  0.0002480100000000 ]  - [   0.0010826300000000, -0.0007670300000000, -0.0001875800000000 ]  - [   0.0000467300000000, -0.0003948800000000, -0.0003227100000000 ]  - [   0.0001837500000000, -0.0001796400000000, -0.0000952600000000 ]  - [  -0.0009878500000000, -0.0007937100000000,  0.0003243400000000 ]  - [  -0.0002571500000000, -0.0003925800000000, -0.0000294400000000 ]  - [  -0.0001984600000000, -0.0001867900000000,  0.0000784600000000 ]  - [   0.0552878600000000, -0.1466039600000000, -0.1130460900000000 ]  - [   0.0000285000000000,  0.0007251200000000,  0.0003491600000000 ]  - [  -0.0000731400000000,  0.0007192400000000,  0.0005572900000000 ]  - [   0.0057135700000000, -0.0182407800000000, -0.0119364500000000 ]  - [   0.0002123900000000,  0.0002359200000000, -0.0007876100000000 ]  - [  -0.0001145100000000,  0.0002421800000000, -0.0001704500000000 ]  - [  -0.0001429500000000,  0.0002903800000000,  0.0006942700000000 ]  - [   0.0004242800000000, -0.0008683200000000,  0.0010881100000000 ]  - [  -0.0002607300000000,  0.0004754800000000, -0.0000942200000000 ]  - [   0.0001076400000000, -0.0001917500000000, -0.0013410200000000 ]  - [   0.0020502600000000,  0.0027815500000000,  0.0031853600000000 ]  - [   0.0003014300000000,  0.0006125000000000,  0.0001791100000000 ]  - [   0.0019817100000000,  0.0002762900000000, -0.0002975100000000 ]  - [  -0.0109142800000000, -0.0010971500000000, -0.0007077400000000 ]  - [  -0.0003370900000000,  0.0003536100000000, -0.0000161900000000 ]  - [  -0.0007247700000000,  0.0002091300000000,  0.0001627800000000 ]  - [  -0.0012630900000000, -0.0002872600000000,  0.0000873100000000 ]  - [   0.0002283800000000,  0.0000986300000000,  0.0000206600000000 ]  - [  -0.0002050000000000,  0.0006147900000000, -0.0012214700000000 ]  - [   0.0004441800000000, -0.0007965300000000,  0.0007284100000000 ]  - [   0.0000435200000000,  0.0004075400000000, -0.0004460200000000 ]  - [  -0.0000060100000000,  0.0005875400000000,  0.0013661200000000 ]  - [   0.0002352600000000, -0.0007752900000000, -0.0006633500000000 ]  - [  -0.0000279000000000,  0.0003806800000000,  0.0004567400000000 ]  - [  -0.0005398700000000, -0.0012505700000000, -0.0009634100000000 ]  - [  -0.0002181900000000,  0.0001427400000000,  0.0001125900000000 ]  - [  -0.0000553700000000,  0.0001420200000000,  0.0002311700000000 ]  - [   0.0000159100000000, -0.0003793400000000,  0.0000085800000000 ]  - [   0.0000827100000000,  0.0000539500000000, -0.0002656100000000 ]  - [   0.0001098500000000,  0.0000545400000000, -0.0001461900000000 ]  - [   0.0000394300000000, -0.0000397000000000,  0.0003417000000000 ]  - [  -0.0000237600000000, -0.0001898800000000,  0.0004052300000000 ]  - [   0.0002185900000000,  0.0003552800000000, -0.0000322100000000 ]  - [  -0.0000425200000000, -0.0002426200000000, -0.0003770200000000 ]  - [  -0.0006051100000000,  0.0005680800000000,  0.0005473500000000 ]  - [  -0.0002545400000000,  0.0004373400000000,  0.0001066300000000 ]  - [   0.0001662900000000,  0.0010418100000000,  0.0003226500000000 ]  - [   0.0000787100000000,  0.0000631200000000,  0.0001888200000000 ]  - [  -0.0000083100000000, -0.0000761800000000, -0.0000236200000000 ]  - [   0.0000540900000000,  0.0001480500000000, -0.0001033400000000 ]  - [   0.0002156300000000, -0.0004513000000000, -0.0003696200000000 ]  - [   0.0000160000000000, -0.0006866100000000, -0.0000143200000000 ]  - [  -0.0001661500000000,  0.0002747700000000, -0.0001994500000000 ]  - [  -0.0010416200000000, -0.0012835500000000, -0.0017346700000000 ]  - [   0.0000053900000000, -0.0008227900000000,  0.0000163400000000 ]  - [  -0.0530720100000000,  0.1402390100000000,  0.1091616300000000 ]  - [  -0.0004086100000000, -0.0003016600000000,  0.0007882300000000 ]  - [   0.0000489700000000, -0.0003297600000000, -0.0001090500000000 ]  - [  -0.0000323600000000, -0.0006831700000000, -0.0003673400000000 ]  - [   0.0007766100000000,  0.0035081100000000, -0.0025236500000000 ]  - [  -0.0005814600000000, -0.0006572700000000,  0.0003657600000000 ]  - [  -0.0006841400000000, -0.0016450500000000,  0.0010818400000000 ]  - [   0.0068091300000000,  0.0009302700000000, -0.0057851500000000 ]  - [   0.0004796300000000, -0.0009441900000000, -0.0003064000000000 ]  - [   0.0008167700000000, -0.0000609100000000, -0.0001646700000000 ]  - [   0.0011334000000000,  0.0004268000000000, -0.0002177900000000 ]  - [   0.0002309200000000, -0.0003146600000000,  0.0001193100000000 ]  - [  -0.0014863600000000, -0.0000193900000000,  0.0002028900000000 ]  - [   0.0056704400000000,  0.0006909300000000,  0.0004232500000000 ]  - [  -0.0000756600000000, -0.0004956500000000, -0.0001112000000000 ]  - [  -0.0010027400000000, -0.0010046900000000, -0.0014863500000000 ]  - [   0.0003759800000000,  0.0008612900000000,  0.0009190400000000 ]  - [   0.0000060300000000, -0.0005882100000000, -0.0004521700000000 ]  - [   0.0014335500000000, -0.0009895700000000,  0.0007130800000000 ]  - [  -0.0008921700000000,  0.0007937600000000,  0.0001383200000000 ]  - [  -0.0000119300000000, -0.0005733400000000,  0.0004747600000000 ]  - [  -0.0001086600000000,  0.0008619900000000, -0.0007071700000000 ]  - [  -0.0002239900000000, -0.0005976400000000,  0.0001363800000000 ]  - [   0.0001444400000000, -0.0005943700000000,  0.0006085800000000 ]  - [  -0.0001163400000000,  0.0008513400000000,  0.0000972700000000 ]  - [   0.0002015700000000, -0.0005873500000000, -0.0002121700000000 ]  - [  -0.0000791800000000, -0.0005961300000000, -0.0006412600000000 ]- atom:   25  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0057784400000000, -0.0114240700000000, -0.0118133900000000 ]  - [  -0.0009874000000000, -0.0011829600000000,  0.0006446100000000 ]  - [   0.0005947500000000, -0.0008975900000000,  0.0003201400000000 ]  - [   0.0058222800000000, -0.0113369000000000, -0.0116625100000000 ]  - [   0.0000838000000000, -0.0011836400000000,  0.0011350200000000 ]  - [  -0.0006240900000000, -0.0009018300000000, -0.0002791300000000 ]  - [  -0.0008825300000000,  0.0012164900000000, -0.0003613600000000 ]  - [   0.0000493100000000,  0.0001067500000000,  0.0000254800000000 ]  - [  -0.0001906000000000,  0.0002226300000000,  0.0001584400000000 ]  - [   0.0004670700000000,  0.0012590800000000, -0.0003480300000000 ]  - [  -0.0000428200000000,  0.0001405400000000,  0.0000448900000000 ]  - [   0.0002340300000000,  0.0002105700000000, -0.0000389300000000 ]  - [  -0.0004101700000000,  0.0008128200000000, -0.0003540500000000 ]  - [  -0.0003056500000000,  0.0003654000000000, -0.0001505100000000 ]  - [  -0.0001355000000000,  0.0002563900000000, -0.0000576900000000 ]  - [   0.0006126000000000,  0.0008380700000000,  0.0000687000000000 ]  - [   0.0003575800000000,  0.0003291500000000,  0.0001079800000000 ]  - [   0.0001314900000000,  0.0002670000000000,  0.0001005900000000 ]  - [  -0.0003773900000000, -0.0002036500000000, -0.0001635300000000 ]  - [   0.0006483700000000, -0.0005744600000000, -0.0000285900000000 ]  - [   0.0005094500000000, -0.0007843200000000, -0.0002518000000000 ]  - [   0.0002816800000000, -0.0001772000000000,  0.0000247300000000 ]  - [  -0.0004404900000000, -0.0005767800000000,  0.0003771200000000 ]  - [  -0.0004949000000000, -0.0007771700000000,  0.0002682100000000 ]  - [  -0.0578831400000000,  0.1482582400000000,  0.1191710500000000 ]  - [   0.0002844400000000, -0.0009653300000000, -0.0001692500000000 ]  - [   0.0003911700000000, -0.0009695700000000, -0.0003874700000000 ]  - [  -0.0061479100000000,  0.0181710800000000,  0.0120050600000000 ]  - [  -0.0005212600000000, -0.0004827300000000,  0.0006005400000000 ]  - [  -0.0001965700000000, -0.0004752000000000, -0.0000127100000000 ]  - [  -0.0001690800000000, -0.0000435200000000, -0.0005029100000000 ]  - [  -0.0007325700000000,  0.0011086000000000, -0.0008997600000000 ]  - [  -0.0000537000000000, -0.0002201600000000,  0.0002709900000000 ]  - [   0.0002111600000000,  0.0004456700000000,  0.0011707100000000 ]  - [  -0.0017170700000000, -0.0025021400000000, -0.0033328500000000 ]  - [   0.0000146500000000, -0.0003572300000000, -0.0003532900000000 ]  - [  -0.0019959400000000, -0.0002778500000000,  0.0002969900000000 ]  - [   0.0107652800000000,  0.0010779500000000,  0.0006714700000000 ]  - [   0.0003329500000000, -0.0003502400000000,  0.0000159600000000 ]  - [   0.0007009500000000, -0.0002063200000000, -0.0001594600000000 ]  - [   0.0012612800000000,  0.0002828600000000, -0.0000856000000000 ]  - [  -0.0002253800000000, -0.0000969800000000, -0.0000202900000000 ]  - [   0.0002077000000000, -0.0006047700000000,  0.0011986200000000 ]  - [  -0.0004462200000000,  0.0007850500000000, -0.0007304400000000 ]  - [  -0.0000426300000000, -0.0004035600000000,  0.0004418600000000 ]  - [   0.0000091900000000, -0.0005780700000000, -0.0013463600000000 ]  - [  -0.0002305800000000,  0.0007686600000000,  0.0006681900000000 ]  - [   0.0000275100000000, -0.0003764600000000, -0.0004512200000000 ]  - [   0.0002225100000000,  0.0009870400000000,  0.0011266800000000 ]  - [  -0.0000975700000000, -0.0003927300000000,  0.0000630200000000 ]  - [  -0.0002592900000000, -0.0003922200000000, -0.0000552800000000 ]  - [   0.0002970000000000,  0.0001244200000000, -0.0001837300000000 ]  - [   0.0002314900000000, -0.0003044500000000,  0.0000877400000000 ]  - [   0.0002029800000000, -0.0003022600000000, -0.0000329200000000 ]  - [   0.0002729500000000,  0.0002884200000000, -0.0001598500000000 ]  - [   0.0003364300000000,  0.0004379300000000, -0.0002247100000000 ]  - [   0.0000976900000000, -0.0000984100000000,  0.0002052800000000 ]  - [  -0.0002723100000000,  0.0004922500000000,  0.0001989800000000 ]  - [   0.0002851700000000, -0.0003112100000000, -0.0007170100000000 ]  - [  -0.0000625200000000, -0.0001800600000000, -0.0002781900000000 ]  - [  -0.0001642200000000, -0.0004139700000000, -0.0003174800000000 ]  - [  -0.0000772900000000,  0.0005559400000000, -0.0001863600000000 ]  - [   0.0000091600000000,  0.0006893400000000,  0.0000248100000000 ]  - [  -0.0000519700000000, -0.0007617800000000,  0.0001009800000000 ]  - [  -0.0002123400000000, -0.0001685500000000,  0.0003653500000000 ]  - [  -0.0000154900000000,  0.0000625000000000,  0.0000130900000000 ]  - [   0.0001623100000000, -0.0008859200000000,  0.0001899000000000 ]  - [   0.0010329500000000,  0.0006550500000000,  0.0017223100000000 ]  - [  -0.0000066900000000,  0.0001974700000000, -0.0000187100000000 ]  - [   0.0557287600000000, -0.1415623700000000, -0.1146266000000000 ]  - [   0.0004020900000000,  0.0009184300000000, -0.0007751700000000 ]  - [  -0.0000509000000000,  0.0009395900000000,  0.0001136400000000 ]  - [  -0.0006295100000000,  0.0006656300000000,  0.0003436500000000 ]  - [  -0.0014518100000000, -0.0035096100000000,  0.0025253600000000 ]  - [  -0.0000931800000000,  0.0006483000000000, -0.0003608700000000 ]  - [   0.0013625000000000,  0.0016610000000000, -0.0010855300000000 ]  - [  -0.0059845700000000, -0.0008863500000000,  0.0056304000000000 ]  - [   0.0001929400000000,  0.0009336200000000,  0.0003026200000000 ]  - [  -0.0001308900000000,  0.0000590500000000,  0.0001619700000000 ]  - [  -0.0004611700000000, -0.0004203000000000,  0.0002133600000000 ]  - [   0.0004356300000000,  0.0003114400000000, -0.0001194900000000 ]  - [   0.0008199400000000,  0.0000192900000000, -0.0002006800000000 ]  - [  -0.0062652500000000, -0.0006820700000000, -0.0004120700000000 ]  - [  -0.0005876500000000,  0.0004908700000000,  0.0001114800000000 ]  - [   0.0009699000000000,  0.0011247300000000,  0.0011807800000000 ]  - [  -0.0003791100000000, -0.0007014700000000, -0.0012120100000000 ]  - [  -0.0000058700000000,  0.0007173400000000,  0.0001494900000000 ]  - [  -0.0014111200000000,  0.0011085200000000, -0.0003876400000000 ]  - [   0.0008909400000000, -0.0006342100000000,  0.0001613600000000 ]  - [   0.0000118700000000,  0.0007043100000000, -0.0001735200000000 ]  - [   0.0001101600000000, -0.0009915800000000,  0.0004098500000000 ]  - [   0.0002220500000000,  0.0004541900000000, -0.0004271900000000 ]  - [  -0.0001436300000000,  0.0004468300000000, -0.0008939200000000 ]  - [   0.0001162100000000, -0.0009804100000000,  0.0001920500000000 ]  - [  -0.0001997600000000,  0.0004438200000000,  0.0005046200000000 ]  - [   0.0000768900000000,  0.0004502900000000,  0.0009239500000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0010496500000000, -0.0066949500000000, -0.0144733500000000 ]  - [   0.0003123500000000, -0.0009263000000000, -0.0006801200000000 ]  - [   0.0001117500000000, -0.0002256800000000,  0.0000336800000000 ]  - [  -0.0010471200000000,  0.0045420100000000,  0.0076218700000000 ]  - [  -0.0002419100000000, -0.0017490000000000, -0.0006768300000000 ]  - [  -0.0001043500000000, -0.0002424500000000, -0.0000662100000000 ]  - [  -0.0005138100000000,  0.0003069000000000,  0.0012659000000000 ]  - [  -0.0009039800000000,  0.0009297800000000,  0.0005005000000000 ]  - [  -0.0004922600000000,  0.0006019100000000,  0.0003327200000000 ]  - [   0.0010869000000000,  0.0000837400000000,  0.0006994800000000 ]  - [   0.0008486300000000,  0.0009196200000000, -0.0005124000000000 ]  - [   0.0005387500000000,  0.0005936400000000, -0.0002134000000000 ]  - [  -0.0001598900000000,  0.0001162500000000,  0.0000702900000000 ]  - [  -0.0004050700000000,  0.0006303400000000, -0.0002395600000000 ]  - [  -0.0005036200000000,  0.0006041500000000, -0.0002200800000000 ]  - [   0.0001985500000000,  0.0003345100000000,  0.0005087300000000 ]  - [   0.0003906100000000,  0.0006503700000000,  0.0003428700000000 ]  - [   0.0004847800000000,  0.0006107200000000,  0.0002878400000000 ]  - [   0.0011231000000000, -0.0006427300000000, -0.0003636300000000 ]  - [   0.0007925800000000, -0.0008472300000000, -0.0006992900000000 ]  - [   0.0002858200000000, -0.0003031100000000, -0.0001547200000000 ]  - [  -0.0010677400000000, -0.0007455000000000,  0.0002423000000000 ]  - [  -0.0004835600000000, -0.0004408600000000,  0.0000231500000000 ]  - [  -0.0002935100000000, -0.0002891700000000,  0.0001125000000000 ]  - [   0.0700272600000000, -0.1121254000000000, -0.1998995200000000 ]  - [   0.0004303500000000,  0.0003515000000000, -0.0004904400000000 ]  - [   0.0004393000000000,  0.0001379100000000, -0.0004888800000000 ]  - [  -0.0072047700000000,  0.0116980400000000,  0.0165124400000000 ]  - [  -0.0001527500000000, -0.0000447200000000,  0.0000729700000000 ]  - [  -0.0001892900000000,  0.0005753200000000,  0.0000712300000000 ]  - [   0.0002509700000000, -0.0004769200000000,  0.0011267300000000 ]  - [   0.0003413700000000, -0.0008775600000000,  0.0012967800000000 ]  - [  -0.0001524600000000,  0.0003108200000000,  0.0001405600000000 ]  - [   0.0001337700000000, -0.0011408000000000,  0.0000921300000000 ]  - [   0.0025339200000000,  0.0034083500000000,  0.0041298100000000 ]  - [   0.0002490100000000,  0.0003954200000000,  0.0000596900000000 ]  - [  -0.0001258900000000, -0.0002385300000000, -0.0002143800000000 ]  - [  -0.0136798700000000, -0.0007765700000000, -0.0012736300000000 ]  - [  -0.0002054500000000,  0.0003095400000000, -0.0000687900000000 ]  - [  -0.0007775700000000,  0.0001905600000000,  0.0002702600000000 ]  - [  -0.0012473500000000, -0.0001793700000000,  0.0001972300000000 ]  - [   0.0000291700000000,  0.0000641000000000,  0.0000630600000000 ]  - [   0.0002474200000000,  0.0006638600000000, -0.0020206500000000 ]  - [   0.0007096400000000,  0.0003985000000000, -0.0012847700000000 ]  - [   0.0000137700000000,  0.0003706100000000, -0.0006678500000000 ]  - [  -0.0000291700000000,  0.0007352200000000,  0.0018955600000000 ]  - [   0.0003412900000000,  0.0004330600000000,  0.0022643500000000 ]  - [   0.0000073900000000,  0.0002838200000000,  0.0006641700000000 ]  - [  -0.0006647800000000, -0.0011808900000000, -0.0014055200000000 ]  - [  -0.0002978900000000,  0.0000192500000000, -0.0000997400000000 ]  - [  -0.0002399600000000, -0.0001003100000000, -0.0000992000000000 ]  - [   0.0000947000000000, -0.0002237000000000,  0.0000243100000000 ]  - [   0.0001251300000000, -0.0000677100000000, -0.0001148200000000 ]  - [   0.0001131300000000,  0.0000518000000000, -0.0001142500000000 ]  - [   0.0000230700000000, -0.0001272700000000,  0.0004845400000000 ]  - [   0.0000200300000000, -0.0001918900000000,  0.0005474100000000 ]  - [   0.0001653200000000,  0.0002474600000000,  0.0000968400000000 ]  - [  -0.0002641100000000, -0.0001654100000000, -0.0001774400000000 ]  - [  -0.0007221200000000,  0.0007633600000000,  0.0007222600000000 ]  - [  -0.0002388400000000,  0.0003218500000000,  0.0000445600000000 ]  - [   0.0001712300000000,  0.0009141400000000,  0.0005605500000000 ]  - [  -0.0001092300000000,  0.0003613800000000,  0.0003475300000000 ]  - [   0.0000458600000000,  0.0001002400000000,  0.0000996200000000 ]  - [   0.0000176900000000,  0.0000865600000000, -0.0003272900000000 ]  - [   0.0002194800000000, -0.0005376700000000, -0.0005053900000000 ]  - [   0.0000294000000000, -0.0005250900000000, -0.0000831900000000 ]  - [  -0.0003755600000000,  0.0005764900000000, -0.0010102100000000 ]  - [  -0.0011819500000000, -0.0015625400000000, -0.0022095200000000 ]  - [  -0.0000567200000000, -0.0005689800000000, -0.0001279400000000 ]  - [  -0.0667823900000000,  0.1085573300000000,  0.1910456800000000 ]  - [  -0.0001811700000000,  0.0004138300000000,  0.0006559900000000 ]  - [  -0.0000931400000000, -0.0001051700000000,  0.0001664200000000 ]  - [  -0.0000565600000000, -0.0003537000000000, -0.0013991000000000 ]  - [   0.0006515600000000,  0.0012319400000000, -0.0023949400000000 ]  - [  -0.0003880500000000, -0.0002425700000000, -0.0001679700000000 ]  - [   0.0002272200000000,  0.0005869100000000,  0.0009860400000000 ]  - [   0.0084528100000000, -0.0060545400000000, -0.0017258800000000 ]  - [   0.0002709500000000, -0.0005570700000000,  0.0001969900000000 ]  - [   0.0008599000000000, -0.0000010000000000, -0.0002996300000000 ]  - [   0.0010815100000000,  0.0003106100000000, -0.0003822500000000 ]  - [   0.0003410200000000, -0.0001628400000000, -0.0000425900000000 ]  - [  -0.0001924700000000,  0.0002357400000000,  0.0002831100000000 ]  - [   0.0072142200000000,  0.0004918200000000,  0.0006911200000000 ]  - [  -0.0001122000000000, -0.0003391700000000,  0.0000546800000000 ]  - [  -0.0018314600000000, -0.0014568500000000, -0.0017945900000000 ]  - [  -0.0013491100000000,  0.0013137100000000, -0.0012370300000000 ]  - [  -0.0000915100000000, -0.0003278100000000, -0.0005321900000000 ]  - [   0.0025465800000000, -0.0016739000000000,  0.0027987600000000 ]  - [   0.0002511000000000,  0.0004200700000000,  0.0015465000000000 ]  - [   0.0000808700000000, -0.0003604500000000,  0.0006090500000000 ]  - [  -0.0008601800000000, -0.0000129300000000,  0.0000127300000000 ]  - [  -0.0002564200000000, -0.0006151600000000,  0.0003050700000000 ]  - [  -0.0000949700000000, -0.0005232100000000,  0.0010026700000000 ]  - [   0.0001828500000000, -0.0001858200000000, -0.0017280800000000 ]  - [   0.0002329300000000, -0.0005465600000000, -0.0004559300000000 ]  - [   0.0000255300000000, -0.0005180200000000, -0.0010380700000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0005005900000000,  0.0059981300000000,  0.0150344700000000 ]  - [   0.0003896200000000, -0.0000541000000000,  0.0010245200000000 ]  - [   0.0005801300000000, -0.0007375500000000,  0.0003121700000000 ]  - [   0.0004839500000000, -0.0055799500000000, -0.0080351700000000 ]  - [  -0.0004492100000000,  0.0007820300000000,  0.0003255100000000 ]  - [  -0.0005872700000000, -0.0007201600000000, -0.0002802000000000 ]  - [  -0.0001766600000000,  0.0006509100000000, -0.0009010300000000 ]  - [   0.0001974700000000,  0.0000482000000000, -0.0001465100000000 ]  - [  -0.0002064600000000,  0.0003702800000000,  0.0000178600000000 ]  - [  -0.0003798900000000,  0.0008742000000000, -0.0010347600000000 ]  - [  -0.0001404800000000,  0.0000584100000000,  0.0001569100000000 ]  - [   0.0001596000000000,  0.0003775200000000, -0.0001354500000000 ]  - [  -0.0005339900000000,  0.0008457900000000, -0.0004146200000000 ]  - [  -0.0002920400000000,  0.0003403200000000, -0.0001097900000000 ]  - [  -0.0001921400000000,  0.0003646800000000, -0.0001273600000000 ]  - [   0.0004908700000000,  0.0006269400000000, -0.0001576600000000 ]  - [   0.0003045300000000,  0.0003204500000000,  0.0000067500000000 ]  - [   0.0002120500000000,  0.0003591200000000,  0.0000609900000000 ]  - [  -0.0004128100000000, -0.0003323900000000,  0.0000131500000000 ]  - [  -0.0001003400000000, -0.0001195200000000,  0.0003488500000000 ]  - [   0.0004071400000000, -0.0006596600000000, -0.0001920800000000 ]  - [   0.0003607700000000, -0.0002259200000000,  0.0001069200000000 ]  - [  -0.0002190900000000, -0.0005310200000000,  0.0003251900000000 ]  - [  -0.0003995400000000, -0.0006741900000000,  0.0002337000000000 ]  - [  -0.0748567700000000,  0.1201763700000000,  0.2071047900000000 ]  - [  -0.0001142300000000, -0.0005942900000000,  0.0006625100000000 ]  - [  -0.0001254300000000, -0.0003791100000000,  0.0006648800000000 ]  - [   0.0071397700000000, -0.0122448500000000, -0.0170149300000000 ]  - [  -0.0001603100000000, -0.0002029900000000, -0.0002515000000000 ]  - [  -0.0001233200000000, -0.0008115600000000, -0.0002538300000000 ]  - [  -0.0005586100000000,  0.0007201100000000, -0.0009262400000000 ]  - [  -0.0006444800000000,  0.0011094500000000, -0.0010979500000000 ]  - [  -0.0001616200000000, -0.0000546700000000,  0.0000367700000000 ]  - [   0.0001799700000000,  0.0013709700000000, -0.0002744600000000 ]  - [  -0.0021821500000000, -0.0031108000000000, -0.0042421200000000 ]  - [   0.0000671800000000, -0.0001373700000000, -0.0002338000000000 ]  - [   0.0001373100000000,  0.0002387000000000,  0.0002088400000000 ]  - [   0.0134253800000000,  0.0007306500000000,  0.0012355500000000 ]  - [   0.0002029700000000, -0.0003031200000000,  0.0000677700000000 ]  - [   0.0007530700000000, -0.0001871800000000, -0.0002671800000000 ]  - [   0.0012331900000000,  0.0001735600000000, -0.0001918000000000 ]  - [  -0.0000292900000000, -0.0000623400000000, -0.0000621500000000 ]  - [  -0.0002491000000000, -0.0006541800000000,  0.0019977600000000 ]  - [  -0.0007075600000000, -0.0003984300000000,  0.0012583100000000 ]  - [  -0.0000133000000000, -0.0003646100000000,  0.0006584700000000 ]  - [   0.0000309200000000, -0.0007212700000000, -0.0018636100000000 ]  - [  -0.0003399800000000, -0.0004367600000000, -0.0022604400000000 ]  - [  -0.0000072700000000, -0.0002766000000000, -0.0006525200000000 ]  - [   0.0003430600000000,  0.0009094600000000,  0.0015601100000000 ]  - [  -0.0000177900000000, -0.0002673800000000,  0.0002749900000000 ]  - [  -0.0000730700000000, -0.0001483800000000,  0.0002761400000000 ]  - [   0.0002158600000000, -0.0000312200000000, -0.0001991900000000 ]  - [   0.0001880500000000, -0.0001815800000000, -0.0000641300000000 ]  - [   0.0002002900000000, -0.0002997600000000, -0.0000644900000000 ]  - [   0.0002884600000000,  0.0003744000000000, -0.0003002500000000 ]  - [   0.0002909000000000,  0.0004376900000000, -0.0003633500000000 ]  - [   0.0001505400000000,  0.0000097800000000,  0.0000768800000000 ]  - [  -0.0000494000000000,  0.0004104000000000, -0.0000040100000000 ]  - [   0.0003978400000000, -0.0005015600000000, -0.0008861000000000 ]  - [  -0.0000780800000000, -0.0000633200000000, -0.0002162000000000 ]  - [  -0.0001681700000000, -0.0002818500000000, -0.0005524100000000 ]  - [   0.0001143900000000,  0.0002563500000000, -0.0003453900000000 ]  - [  -0.0000457400000000,  0.0005119900000000, -0.0000989500000000 ]  - [  -0.0000158700000000, -0.0006960200000000,  0.0003240100000000 ]  - [  -0.0002139500000000, -0.0000848100000000,  0.0004976300000000 ]  - [  -0.0000293600000000, -0.0001001700000000,  0.0000819800000000 ]  - [   0.0003664400000000, -0.0011758500000000,  0.0009938800000000 ]  - [   0.0011634900000000,  0.0009286700000000,  0.0021778500000000 ]  - [   0.0000562100000000, -0.0000575800000000,  0.0001261000000000 ]  - [   0.0715485100000000, -0.1159098700000000, -0.1978335900000000 ]  - [   0.0001769200000000,  0.0002017200000000, -0.0006499300000000 ]  - [   0.0000928400000000,  0.0007133000000000, -0.0001631500000000 ]  - [  -0.0006042100000000,  0.0003363800000000,  0.0013745500000000 ]  - [  -0.0013153600000000, -0.0011854600000000,  0.0023594500000000 ]  - [  -0.0002831500000000,  0.0002349200000000,  0.0001681600000000 ]  - [   0.0004366800000000, -0.0005924300000000, -0.0009627400000000 ]  - [  -0.0075344100000000,  0.0058448800000000,  0.0016760200000000 ]  - [   0.0003984600000000,  0.0005433800000000, -0.0001967800000000 ]  - [  -0.0001730900000000,  0.0000000900000000,  0.0002954300000000 ]  - [  -0.0004009500000000, -0.0003028200000000,  0.0003749400000000 ]  - [   0.0003276500000000,  0.0001583400000000,  0.0000423400000000 ]  - [  -0.0004884100000000, -0.0002341700000000, -0.0002779800000000 ]  - [  -0.0077500200000000, -0.0004754900000000, -0.0006782200000000 ]  - [  -0.0005520100000000,  0.0003312400000000, -0.0000541800000000 ]  - [   0.0017896900000000,  0.0015699000000000,  0.0014736400000000 ]  - [   0.0013569400000000, -0.0011761700000000,  0.0009424200000000 ]  - [   0.0000900500000000,  0.0004546000000000,  0.0002263500000000 ]  - [  -0.0025350900000000,  0.0017998700000000, -0.0024931300000000 ]  - [  -0.0002399400000000, -0.0002645000000000, -0.0012347800000000 ]  - [  -0.0000793200000000,  0.0004905800000000, -0.0003053600000000 ]  - [   0.0008503300000000, -0.0001214100000000, -0.0003045100000000 ]  - [   0.0002534900000000,  0.0004679200000000, -0.0005920400000000 ]  - [   0.0000970300000000,  0.0003775300000000, -0.0012885000000000 ]  - [  -0.0001808300000000,  0.0000575100000000,  0.0020128000000000 ]  - [  -0.0002301600000000,  0.0003985600000000,  0.0007440300000000 ]  - [  -0.0000276900000000,  0.0003701100000000,  0.0013141800000000 ]- atom:   37  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0033451400000000, -0.0000965800000000, -0.0006799300000000 ]  - [   0.0007511200000000, -0.0004829800000000,  0.0003063900000000 ]  - [   0.0026103300000000, -0.0019012600000000,  0.0011467800000000 ]  - [  -0.0018908800000000, -0.0001389500000000, -0.0024097900000000 ]  - [  -0.0007360400000000, -0.0004832700000000, -0.0003371700000000 ]  - [  -0.0028823800000000, -0.0017399600000000, -0.0008121800000000 ]  - [  -0.0028823800000000,  0.0017399600000000,  0.0008121800000000 ]  - [  -0.0007360400000000,  0.0004832700000000,  0.0003371700000000 ]  - [  -0.0018908800000000,  0.0001389500000000,  0.0024097900000000 ]  - [   0.0026103300000000,  0.0019012600000000, -0.0011467800000000 ]  - [   0.0007511200000000,  0.0004829800000000, -0.0003063900000000 ]  - [   0.0033451400000000,  0.0000965800000000,  0.0006799300000000 ]  - [   0.0019116000000000, -0.0009319400000000,  0.0007944200000000 ]  - [   0.0000537000000000,  0.0004875100000000, -0.0000427200000000 ]  - [   0.0026456300000000,  0.0008769000000000, -0.0010320600000000 ]  - [  -0.0021827700000000, -0.0007690300000000, -0.0004624000000000 ]  - [  -0.0000390000000000,  0.0004868800000000,  0.0000116700000000 ]  - [  -0.0011907100000000,  0.0008316500000000, -0.0020599600000000 ]  - [  -0.0011907100000000, -0.0008316500000000,  0.0020599600000000 ]  - [  -0.0000390000000000, -0.0004868800000000, -0.0000116700000000 ]  - [  -0.0021827700000000,  0.0007690300000000,  0.0004624000000000 ]  - [   0.0026456300000000, -0.0008769000000000,  0.0010320600000000 ]  - [   0.0000537000000000, -0.0004875100000000,  0.0000427200000000 ]  - [   0.0019116000000000,  0.0009319400000000, -0.0007944200000000 ]  - [  -0.0001159700000000,  0.0018648800000000, -0.0000414500000000 ]  - [   0.0002101800000000, -0.0004589900000000, -0.0001139300000000 ]  - [   0.0057088400000000, -0.0109683800000000, -0.0134672600000000 ]  - [   0.0004398700000000,  0.0005878100000000, -0.0008549100000000 ]  - [  -0.0001391700000000, -0.0003513100000000, -0.0000604200000000 ]  - [   0.0006061100000000,  0.0011388200000000, -0.0013300200000000 ]  - [   0.0006061100000000, -0.0011388200000000,  0.0013300200000000 ]  - [  -0.0001391700000000,  0.0003513100000000,  0.0000604200000000 ]  - [   0.0004398700000000, -0.0005878100000000,  0.0008549100000000 ]  - [   0.0057088400000000,  0.0109683800000000,  0.0134672600000000 ]  - [   0.0002101800000000,  0.0004589900000000,  0.0001139300000000 ]  - [  -0.0001159700000000, -0.0018648800000000,  0.0000414500000000 ]  - [  -0.1102233400000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0037692600000000, -0.0000012800000000,  0.0000000100000000 ]  - [  -0.0037692600000000,  0.0000012800000000, -0.0000000100000000 ]  - [   0.0048698000000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0025012400000000, -0.0000001700000000,  0.0000000300000000 ]  - [   0.0025012400000000,  0.0000001700000000, -0.0000000300000000 ]  - [   0.0046719500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0003559700000000,  0.0000001100000000, -0.0000011900000000 ]  - [   0.0003559700000000, -0.0000001100000000,  0.0000011900000000 ]  - [  -0.0003055400000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0002028200000000, -0.0000001700000000,  0.0000001800000000 ]  - [  -0.0002028200000000,  0.0000001700000000, -0.0000001800000000 ]  - [  -0.0004285000000000, -0.0021139600000000,  0.0002205700000000 ]  - [  -0.0001029100000000,  0.0002099800000000,  0.0002933300000000 ]  - [   0.0053707000000000,  0.0107086100000000,  0.0136345100000000 ]  - [   0.0007529900000000, -0.0008366300000000,  0.0006745900000000 ]  - [   0.0001743200000000,  0.0001020100000000, -0.0001185200000000 ]  - [   0.0009186000000000, -0.0013847600000000,  0.0011498300000000 ]  - [   0.0009186000000000,  0.0013847600000000, -0.0011498300000000 ]  - [   0.0001743200000000, -0.0001020100000000,  0.0001185200000000 ]  - [   0.0007529900000000,  0.0008366300000000, -0.0006745900000000 ]  - [   0.0053707000000000, -0.0107086100000000, -0.0136345100000000 ]  - [  -0.0001029100000000, -0.0002099800000000, -0.0002933300000000 ]  - [  -0.0004285000000000,  0.0021139600000000, -0.0002205700000000 ]  - [  -0.0008761300000000,  0.0015532000000000, -0.0016397900000000 ]  - [  -0.0000411400000000,  0.0001103200000000, -0.0000820300000000 ]  - [  -0.0024054100000000, -0.0044726500000000, -0.0057231100000000 ]  - [  -0.0024054100000000,  0.0044726500000000,  0.0057231100000000 ]  - [  -0.0000411400000000, -0.0001103200000000,  0.0000820300000000 ]  - [  -0.0008761300000000, -0.0015532000000000,  0.0016397900000000 ]  - [  -0.0024080700000000, -0.0050820500000000, -0.0057136900000000 ]  - [  -0.0000412200000000, -0.0005087500000000, -0.0000816800000000 ]  - [  -0.0008767600000000,  0.0009342000000000, -0.0016411000000000 ]  - [  -0.0008767600000000, -0.0009342000000000,  0.0016411000000000 ]  - [  -0.0000412200000000,  0.0005087500000000,  0.0000816800000000 ]  - [  -0.0024080700000000,  0.0050820500000000,  0.0057136900000000 ]  - [  -0.0036481000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0020181200000000, -0.0008914300000000,  0.0003376700000000 ]  - [  -0.0020181200000000,  0.0008914300000000, -0.0003376700000000 ]  - [   0.0521036200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0024164000000000, -0.0014316300000000, -0.0002396800000000 ]  - [   0.0024164000000000,  0.0014316300000000,  0.0002396800000000 ]  - [  -0.0029779000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0013531100000000,  0.0008917200000000, -0.0003378600000000 ]  - [  -0.0013531100000000, -0.0008917200000000,  0.0003378600000000 ]  - [   0.0438494200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0017473100000000,  0.0014318900000000,  0.0002400100000000 ]  - [   0.0017473100000000, -0.0014318900000000, -0.0002400100000000 ]  - [   0.0030331700000000,  0.0000698900000000, -0.0001486000000000 ]  - [   0.0007210300000000,  0.0000698100000000, -0.0001497800000000 ]  - [   0.0025089700000000,  0.0000696400000000, -0.0001498800000000 ]  - [  -0.0058125600000000,  0.0000707700000000,  0.0001481900000000 ]  - [  -0.0007907300000000,  0.0000698700000000,  0.0001485800000000 ]  - [  -0.0026495100000000,  0.0000706000000000,  0.0001486400000000 ]  - [  -0.0026495100000000, -0.0000706000000000, -0.0001486400000000 ]  - [  -0.0007907300000000, -0.0000698700000000, -0.0001485800000000 ]  - [  -0.0058125600000000, -0.0000707700000000, -0.0001481900000000 ]  - [   0.0025089700000000, -0.0000696400000000,  0.0001498800000000 ]  - [   0.0007210300000000, -0.0000698100000000,  0.0001497800000000 ]  - [   0.0030331700000000, -0.0000698900000000,  0.0001486000000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0005047800000000, -0.0007515400000000,  0.0003718700000000 ]  - [   0.0002904200000000, -0.0003383900000000,  0.0001026800000000 ]  - [   0.0002853900000000, -0.0004636700000000,  0.0000537900000000 ]  - [  -0.0001490100000000, -0.0006543700000000, -0.0007277200000000 ]  - [  -0.0002147100000000, -0.0002915100000000, -0.0001596600000000 ]  - [  -0.0005962200000000, -0.0003010200000000,  0.0002086600000000 ]  - [  -0.0000965000000000,  0.0006658600000000,  0.0005607100000000 ]  - [  -0.0004829600000000,  0.0006783700000000,  0.0001903100000000 ]  - [  -0.0005506200000000,  0.0003225800000000, -0.0003767800000000 ]  - [   0.0004109800000000,  0.0005025700000000, -0.0002936000000000 ]  - [   0.0004086900000000,  0.0006319800000000, -0.0002466300000000 ]  - [   0.0001947500000000,  0.0002251000000000,  0.0000182600000000 ]  - [  -0.0004109800000000,  0.0005025700000000, -0.0002936000000000 ]  - [  -0.0004086900000000,  0.0006319800000000, -0.0002466300000000 ]  - [  -0.0001947500000000,  0.0002251000000000,  0.0000182600000000 ]  - [   0.0000965000000000,  0.0006658600000000,  0.0005607100000000 ]  - [   0.0004829600000000,  0.0006783700000000,  0.0001903100000000 ]  - [   0.0005506200000000,  0.0003225800000000, -0.0003767800000000 ]  - [   0.0001490100000000, -0.0006543700000000, -0.0007277200000000 ]  - [   0.0002147100000000, -0.0002915100000000, -0.0001596600000000 ]  - [   0.0005962200000000, -0.0003010200000000,  0.0002086600000000 ]  - [  -0.0005047800000000, -0.0007515400000000,  0.0003718700000000 ]  - [  -0.0002904200000000, -0.0003383900000000,  0.0001026800000000 ]  - [  -0.0002853900000000, -0.0004636700000000,  0.0000537900000000 ]  - [   0.0006321900000000,  0.0001523200000000, -0.0001525900000000 ]  - [  -0.0000123200000000,  0.0002257800000000,  0.0003936100000000 ]  - [  -0.0016503800000000, -0.0011920800000000, -0.0006632400000000 ]  - [  -0.0001818500000000,  0.0000831200000000, -0.0002781400000000 ]  - [  -0.0001358700000000, -0.0000267800000000, -0.0001527900000000 ]  - [  -0.0001703900000000, -0.0004077400000000,  0.0000876500000000 ]  - [  -0.0001444300000000, -0.0001618700000000,  0.0002647500000000 ]  - [  -0.0001767700000000,  0.0002215500000000,  0.0000273800000000 ]  - [  -0.0001332200000000,  0.0003338500000000, -0.0001012000000000 ]  - [   0.0019724700000000, -0.0009825700000000, -0.0008430200000000 ]  - [   0.0003276200000000,  0.0004771900000000,  0.0002179900000000 ]  - [  -0.0003109800000000,  0.0004034200000000, -0.0003229600000000 ]  - [   0.0000000000000000, -0.0513522500000000, -0.0048772200000000 ]  - [   0.0000000000000000,  0.0007714600000000, -0.0000155700000000 ]  - [   0.0000000000000000,  0.0007624800000000, -0.0000155600000000 ]  - [   0.0000000000000000, -0.0000705800000000, -0.0000079700000000 ]  - [   0.0000000000000000,  0.0000362800000000,  0.0000023700000000 ]  - [   0.0000000000000000,  0.0000371100000000,  0.0000025700000000 ]  - [   0.0000000000000000, -0.0000410400000000,  0.0001774800000000 ]  - [   0.0000000000000000,  0.0000910000000000, -0.0001086700000000 ]  - [   0.0000000000000000,  0.0000937400000000, -0.0001111900000000 ]  - [   0.0000000000000000, -0.0006486600000000, -0.0010240800000000 ]  - [   0.0000000000000000,  0.0001735400000000,  0.0002390300000000 ]  - [   0.0000000000000000,  0.0001755900000000,  0.0002407800000000 ]  - [  -0.0006321900000000,  0.0001523200000000, -0.0001525900000000 ]  - [   0.0000123200000000,  0.0002257800000000,  0.0003936100000000 ]  - [   0.0016503800000000, -0.0011920800000000, -0.0006632400000000 ]  - [   0.0001818500000000,  0.0000831200000000, -0.0002781400000000 ]  - [   0.0001358700000000, -0.0000267800000000, -0.0001527900000000 ]  - [   0.0001703900000000, -0.0004077400000000,  0.0000876500000000 ]  - [   0.0001444300000000, -0.0001618700000000,  0.0002647500000000 ]  - [   0.0001767700000000,  0.0002215500000000,  0.0000273800000000 ]  - [   0.0001332200000000,  0.0003338500000000, -0.0001012000000000 ]  - [  -0.0019724700000000, -0.0009825700000000, -0.0008430200000000 ]  - [  -0.0003276200000000,  0.0004771900000000,  0.0002179900000000 ]  - [   0.0003109800000000,  0.0004034200000000, -0.0003229600000000 ]  - [   0.0001150800000000,  0.0003578500000000,  0.0001473700000000 ]  - [  -0.0000282800000000,  0.0000189800000000, -0.0000743700000000 ]  - [  -0.0002373100000000,  0.0010995600000000,  0.0007615100000000 ]  - [   0.0002379600000000,  0.0005012600000000,  0.0007649800000000 ]  - [   0.0000298200000000, -0.0005995200000000, -0.0000766800000000 ]  - [  -0.0001134100000000, -0.0002649400000000,  0.0001463900000000 ]  - [  -0.0002379600000000,  0.0005012600000000,  0.0007649800000000 ]  - [  -0.0000298200000000, -0.0005995200000000, -0.0000766800000000 ]  - [   0.0001134100000000, -0.0002649400000000,  0.0001463900000000 ]  - [  -0.0001150800000000,  0.0003578500000000,  0.0001473700000000 ]  - [   0.0000282800000000,  0.0000189800000000, -0.0000743700000000 ]  - [   0.0002373100000000,  0.0010995600000000,  0.0007615100000000 ]  - [  -0.0003375100000000,  0.0003301500000000, -0.0001496600000000 ]  - [  -0.0003628300000000, -0.0001717800000000,  0.0001055000000000 ]  - [  -0.0003092800000000, -0.0001739300000000,  0.0001058500000000 ]  - [  -0.0001885100000000,  0.0258456000000000,  0.0025482700000000 ]  - [  -0.0000224300000000, -0.0008051000000000, -0.0000816800000000 ]  - [   0.0006888100000000, -0.0007981500000000, -0.0000822700000000 ]  - [   0.0003375100000000,  0.0003301500000000, -0.0001496600000000 ]  - [   0.0003628300000000, -0.0001717800000000,  0.0001055000000000 ]  - [   0.0003092800000000, -0.0001739300000000,  0.0001058500000000 ]  - [   0.0001885100000000,  0.0258456000000000,  0.0025482700000000 ]  - [   0.0000224300000000, -0.0008051000000000, -0.0000816800000000 ]  - [  -0.0006888100000000, -0.0007981500000000, -0.0000822700000000 ]  - [   0.0000000000000000,  0.0009526200000000,  0.0007340400000000 ]  - [   0.0000000000000000, -0.0002783900000000, -0.0002513600000000 ]  - [   0.0000000000000000, -0.0001249000000000, -0.0004215300000000 ]  - [   0.0000000000000000,  0.0003501500000000, -0.0000978800000000 ]  - [   0.0000000000000000, -0.0001443000000000,  0.0002514500000000 ]  - [   0.0000000000000000, -0.0000445800000000,  0.0002346600000000 ]  - [   0.0000000000000000, -0.0001779000000000, -0.0000649600000000 ]  - [   0.0000000000000000, -0.0002845400000000, -0.0000407900000000 ]  - [   0.0000000000000000,  0.0002056300000000, -0.0003878000000000 ]  - [   0.0000000000000000, -0.0002580400000000, -0.0001245600000000 ]  - [   0.0000000000000000, -0.0004170600000000,  0.0000422200000000 ]  - [   0.0000000000000000,  0.0008083300000000,  0.0010354800000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0002163700000000, -0.0002638700000000,  0.0000021900000000 ]  - [   0.0003480000000000, -0.0005110900000000,  0.0001700300000000 ]  - [   0.0002676000000000, -0.0003997200000000, -0.0000584300000000 ]  - [  -0.0010727100000000, -0.0009926700000000,  0.0002961200000000 ]  - [  -0.0003661800000000, -0.0005229400000000, -0.0001767700000000 ]  - [  -0.0005445800000000, -0.0001042900000000,  0.0001697500000000 ]  - [  -0.0001499900000000,  0.0008676300000000,  0.0005175300000000 ]  - [  -0.0003308200000000,  0.0004464400000000,  0.0001715300000000 ]  - [   0.0003920200000000, -0.0000380700000000,  0.0006422700000000 ]  - [   0.0004300600000000,  0.0005676300000000, -0.0004126000000000 ]  - [   0.0003501000000000,  0.0004590700000000, -0.0001796300000000 ]  - [   0.0004839400000000,  0.0007108900000000, -0.0003537900000000 ]  - [  -0.0004300600000000,  0.0005676300000000, -0.0004126000000000 ]  - [  -0.0003501000000000,  0.0004590700000000, -0.0001796300000000 ]  - [  -0.0004839400000000,  0.0007108900000000, -0.0003537900000000 ]  - [   0.0001499900000000,  0.0008676300000000,  0.0005175300000000 ]  - [   0.0003308200000000,  0.0004464400000000,  0.0001715300000000 ]  - [  -0.0003920200000000, -0.0000380700000000,  0.0006422700000000 ]  - [   0.0010727100000000, -0.0009926700000000,  0.0002961200000000 ]  - [   0.0003661800000000, -0.0005229400000000, -0.0001767700000000 ]  - [   0.0005445800000000, -0.0001042900000000,  0.0001697500000000 ]  - [  -0.0002163700000000, -0.0002638700000000,  0.0000021900000000 ]  - [  -0.0003480000000000, -0.0005110900000000,  0.0001700300000000 ]  - [  -0.0002676000000000, -0.0003997200000000, -0.0000584300000000 ]  - [   0.0000588200000000, -0.0004231400000000, -0.0001192600000000 ]  - [   0.0001801400000000, -0.0001407000000000,  0.0000221400000000 ]  - [  -0.0020267300000000, -0.0008194500000000, -0.0011464200000000 ]  - [  -0.0001349000000000, -0.0002864300000000,  0.0001785700000000 ]  - [  -0.0001859000000000, -0.0001459200000000, -0.0000263400000000 ]  - [  -0.0002657900000000, -0.0002121100000000,  0.0001049700000000 ]  - [  -0.0000439100000000,  0.0000398500000000,  0.0002835100000000 ]  - [  -0.0001271700000000,  0.0001042400000000,  0.0001524800000000 ]  - [  -0.0001794400000000, -0.0000351300000000,  0.0003580300000000 ]  - [   0.0023594100000000, -0.0005587200000000, -0.0013618000000000 ]  - [   0.0001320200000000,  0.0001078500000000, -0.0001593700000000 ]  - [   0.0002525600000000, -0.0001705000000000, -0.0003027100000000 ]  - [   0.0000000000000000, -0.0048774000000000, -0.0506691700000000 ]  - [   0.0000000000000000, -0.0000177600000000, -0.0001502900000000 ]  - [   0.0000000000000000, -0.0000134200000000, -0.0001503800000000 ]  - [   0.0000000000000000,  0.0000080100000000,  0.0000211500000000 ]  - [   0.0000000000000000, -0.0000025600000000,  0.0000299100000000 ]  - [   0.0000000000000000, -0.0000024400000000,  0.0000299600000000 ]  - [   0.0000000000000000,  0.0000362300000000, -0.0000959600000000 ]  - [   0.0000000000000000,  0.0000642800000000, -0.0002315900000000 ]  - [   0.0000000000000000,  0.0000656100000000, -0.0002314900000000 ]  - [   0.0000000000000000,  0.0021155700000000,  0.0041672200000000 ]  - [   0.0000000000000000,  0.0000813000000000,  0.0004243900000000 ]  - [   0.0000000000000000,  0.0000792700000000,  0.0004226200000000 ]  - [  -0.0000588200000000, -0.0004231400000000, -0.0001192600000000 ]  - [  -0.0001801400000000, -0.0001407000000000,  0.0000221400000000 ]  - [   0.0020267300000000, -0.0008194500000000, -0.0011464200000000 ]  - [   0.0001349000000000, -0.0002864300000000,  0.0001785700000000 ]  - [   0.0001859000000000, -0.0001459200000000, -0.0000263400000000 ]  - [   0.0002657900000000, -0.0002121100000000,  0.0001049700000000 ]  - [   0.0000439100000000,  0.0000398500000000,  0.0002835100000000 ]  - [   0.0001271700000000,  0.0001042400000000,  0.0001524800000000 ]  - [   0.0001794400000000, -0.0000351300000000,  0.0003580300000000 ]  - [  -0.0023594100000000, -0.0005587200000000, -0.0013618000000000 ]  - [  -0.0001320200000000,  0.0001078500000000, -0.0001593700000000 ]  - [  -0.0002525600000000, -0.0001705000000000, -0.0003027100000000 ]  - [  -0.0001562000000000,  0.0004239300000000, -0.0000261400000000 ]  - [  -0.0000066000000000,  0.0003497900000000,  0.0000078800000000 ]  - [  -0.0003510500000000,  0.0010362300000000,  0.0010143500000000 ]  - [   0.0003564700000000,  0.0004170800000000,  0.0010303000000000 ]  - [   0.0000068000000000, -0.0002683200000000,  0.0000092600000000 ]  - [   0.0001614000000000, -0.0001937000000000, -0.0000213800000000 ]  - [  -0.0003564700000000,  0.0004170800000000,  0.0010303000000000 ]  - [  -0.0000068000000000, -0.0002683200000000,  0.0000092600000000 ]  - [  -0.0001614000000000, -0.0001937000000000, -0.0000213800000000 ]  - [   0.0001562000000000,  0.0004239300000000, -0.0000261400000000 ]  - [   0.0000066000000000,  0.0003497900000000,  0.0000078800000000 ]  - [   0.0003510500000000,  0.0010362300000000,  0.0010143500000000 ]  - [  -0.0003384200000000,  0.0000511500000000, -0.0002665200000000 ]  - [  -0.0003133100000000,  0.0000913200000000, -0.0001676900000000 ]  - [  -0.0003579700000000,  0.0000917400000000, -0.0001679800000000 ]  - [  -0.0001810800000000,  0.0024744800000000,  0.0261746200000000 ]  - [   0.0003260000000000,  0.0000854000000000,  0.0002535900000000 ]  - [   0.0003475500000000,  0.0000810800000000,  0.0002539500000000 ]  - [   0.0003384200000000,  0.0000511500000000, -0.0002665200000000 ]  - [   0.0003133100000000,  0.0000913200000000, -0.0001676900000000 ]  - [   0.0003579700000000,  0.0000917400000000, -0.0001679800000000 ]  - [   0.0001810800000000,  0.0024744800000000,  0.0261746200000000 ]  - [  -0.0003260000000000,  0.0000854000000000,  0.0002535900000000 ]  - [  -0.0003475500000000,  0.0000810800000000,  0.0002539500000000 ]  - [   0.0000000000000000, -0.0005268800000000, -0.0037765000000000 ]  - [   0.0000000000000000,  0.0001219000000000, -0.0003938700000000 ]  - [   0.0000000000000000, -0.0001417700000000, -0.0005119000000000 ]  - [   0.0000000000000000, -0.0001262700000000,  0.0003909100000000 ]  - [   0.0000000000000000,  0.0000873300000000,  0.0002874300000000 ]  - [   0.0000000000000000, -0.0000923700000000,  0.0003545100000000 ]  - [   0.0000000000000000, -0.0002298200000000,  0.0000595300000000 ]  - [   0.0000000000000000, -0.0000508400000000, -0.0000055400000000 ]  - [   0.0000000000000000, -0.0002694400000000,  0.0001031600000000 ]  - [   0.0000000000000000, -0.0002816000000000, -0.0002136200000000 ]  - [   0.0000000000000000, -0.0000136000000000, -0.0000961800000000 ]  - [   0.0000000000000000, -0.0006514300000000, -0.0034968200000000 ]- atom:   43  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0019291800000000,  0.0004000600000000,  0.0011917000000000 ]  - [   0.0003161500000000, -0.0004801000000000,  0.0001665400000000 ]  - [   0.0000380000000000,  0.0001266300000000,  0.0003624900000000 ]  - [  -0.0002333400000000, -0.0006048200000000, -0.0000790100000000 ]  - [  -0.0003178900000000, -0.0004752600000000, -0.0001624100000000 ]  - [   0.0000945300000000, -0.0002300800000000, -0.0001508600000000 ]  - [   0.0000945300000000,  0.0002300800000000,  0.0001508600000000 ]  - [  -0.0003178900000000,  0.0004752600000000,  0.0001624100000000 ]  - [  -0.0002333400000000,  0.0006048200000000,  0.0000790100000000 ]  - [   0.0000380000000000, -0.0001266300000000, -0.0003624900000000 ]  - [   0.0003161500000000,  0.0004801000000000, -0.0001665400000000 ]  - [  -0.0019291800000000, -0.0004000600000000, -0.0011917000000000 ]  - [  -0.0006673700000000,  0.0010957100000000,  0.0000109800000000 ]  - [  -0.0003844000000000,  0.0004911600000000, -0.0001837700000000 ]  - [  -0.0026631200000000,  0.0013570400000000,  0.0008631600000000 ]  - [   0.0007935100000000,  0.0007389600000000,  0.0001969900000000 ]  - [   0.0003794700000000,  0.0004942600000000,  0.0001866100000000 ]  - [   0.0004623600000000,  0.0003614600000000,  0.0002718200000000 ]  - [   0.0004623600000000, -0.0003614600000000, -0.0002718200000000 ]  - [   0.0003794700000000, -0.0004942600000000, -0.0001866100000000 ]  - [   0.0007935100000000, -0.0007389600000000, -0.0001969900000000 ]  - [  -0.0026631200000000, -0.0013570400000000, -0.0008631600000000 ]  - [  -0.0003844000000000, -0.0004911600000000,  0.0001837700000000 ]  - [  -0.0006673700000000, -0.0010957100000000, -0.0000109800000000 ]  - [   0.0003482600000000, -0.0003302300000000,  0.0003375400000000 ]  - [   0.0001579100000000, -0.0000812700000000,  0.0001040000000000 ]  - [   0.0010554500000000,  0.0003131000000000,  0.0007897700000000 ]  - [  -0.0002576000000000, -0.0001187200000000, -0.0001196100000000 ]  - [  -0.0001631500000000, -0.0000965900000000, -0.0000831200000000 ]  - [  -0.0002962300000000, -0.0003547200000000,  0.0002480800000000 ]  - [  -0.0002962300000000,  0.0003547200000000, -0.0002480800000000 ]  - [  -0.0001631500000000,  0.0000965900000000,  0.0000831200000000 ]  - [  -0.0002576000000000,  0.0001187200000000,  0.0001196100000000 ]  - [   0.0010554500000000, -0.0003131000000000, -0.0007897700000000 ]  - [   0.0001579100000000,  0.0000812700000000, -0.0001040000000000 ]  - [   0.0003482600000000,  0.0003302300000000, -0.0003375400000000 ]  - [   0.0046716200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0003577600000000,  0.0000005600000000, -0.0000000600000000 ]  - [   0.0003577600000000, -0.0000005600000000,  0.0000000600000000 ]  - [  -0.0003078300000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0002035300000000, -0.0000007200000000,  0.0000002000000000 ]  - [  -0.0002035300000000,  0.0000007200000000, -0.0000002000000000 ]  - [  -0.0521617900000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0000961800000000, -0.0000024700000000,  0.0000005400000000 ]  - [  -0.0000961800000000,  0.0000024700000000, -0.0000005400000000 ]  - [   0.0000720000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0000039500000000,  0.0000003400000000,  0.0000007600000000 ]  - [  -0.0000039500000000, -0.0000003400000000, -0.0000007600000000 ]  - [   0.0000341500000000,  0.0000812500000000, -0.0001605300000000 ]  - [  -0.0001557800000000, -0.0001686800000000,  0.0000753700000000 ]  - [   0.0007452300000000, -0.0005773500000000, -0.0006275300000000 ]  - [   0.0000502300000000, -0.0001346000000000, -0.0000585100000000 ]  - [   0.0001490900000000, -0.0001525800000000, -0.0000969500000000 ]  - [   0.0000106200000000,  0.0001097400000000, -0.0004315200000000 ]  - [   0.0000106200000000, -0.0001097400000000,  0.0004315200000000 ]  - [   0.0001490900000000,  0.0001525800000000,  0.0000969500000000 ]  - [   0.0000502300000000,  0.0001346000000000,  0.0000585100000000 ]  - [   0.0007452300000000,  0.0005773500000000,  0.0006275300000000 ]  - [  -0.0001557800000000,  0.0001686800000000, -0.0000753700000000 ]  - [   0.0000341500000000, -0.0000812500000000,  0.0001605300000000 ]  - [   0.0016324800000000,  0.0012719100000000, -0.0000768400000000 ]  - [   0.0000071000000000,  0.0003312300000000,  0.0000077700000000 ]  - [  -0.0002883000000000,  0.0006186500000000,  0.0002585100000000 ]  - [  -0.0002883000000000, -0.0006186500000000, -0.0002585100000000 ]  - [   0.0000071000000000, -0.0003312300000000, -0.0000077700000000 ]  - [   0.0016324800000000, -0.0012719100000000,  0.0000768400000000 ]  - [  -0.0002911200000000, -0.0000008800000000,  0.0002541500000000 ]  - [   0.0000052000000000, -0.0002882800000000,  0.0000078700000000 ]  - [   0.0016144100000000,  0.0006536100000000, -0.0000818000000000 ]  - [   0.0016144100000000, -0.0006536100000000,  0.0000818000000000 ]  - [   0.0000052000000000,  0.0002882800000000, -0.0000078700000000 ]  - [  -0.0002911200000000,  0.0000008800000000, -0.0002541500000000 ]  - [   0.0000279900000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0002034800000000,  0.0000571200000000,  0.0000328600000000 ]  - [  -0.0002034800000000, -0.0000571200000000, -0.0000328600000000 ]  - [  -0.0034799000000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0001159700000000,  0.0000982700000000, -0.0000637600000000 ]  - [   0.0001159700000000, -0.0000982700000000,  0.0000637600000000 ]  - [   0.0007091400000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0004657400000000, -0.0000570900000000, -0.0000324200000000 ]  - [   0.0004657400000000,  0.0000570900000000,  0.0000324200000000 ]  - [  -0.0041659300000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0005528300000000, -0.0001002600000000,  0.0000635200000000 ]  - [  -0.0005528300000000,  0.0001002600000000, -0.0000635200000000 ]  - [  -0.0001699700000000,  0.0000681700000000, -0.0001470700000000 ]  - [  -0.0000200400000000,  0.0000679300000000, -0.0001491000000000 ]  - [  -0.0004174100000000,  0.0000693100000000, -0.0001480800000000 ]  - [   0.0271678500000000, -0.0001336800000000,  0.0006176600000000 ]  - [   0.0000752300000000,  0.0000705700000000,  0.0001466800000000 ]  - [   0.0005555100000000,  0.0000662400000000,  0.0001458000000000 ]  - [   0.0005555100000000, -0.0000662400000000, -0.0001458000000000 ]  - [   0.0000752300000000, -0.0000705700000000, -0.0001466800000000 ]  - [   0.0271678500000000,  0.0001336800000000, -0.0006176600000000 ]  - [  -0.0004174100000000, -0.0000693100000000,  0.0001480800000000 ]  - [  -0.0000200400000000, -0.0000679300000000,  0.0001491000000000 ]  - [  -0.0001699700000000, -0.0000681700000000,  0.0001470700000000 ]- atom:   43  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0045401900000000,  0.0031737900000000, -0.0025002400000000 ]  - [  -0.0000603500000000,  0.0001247100000000, -0.0000186200000000 ]  - [   0.0010618000000000, -0.0005431200000000,  0.0011974100000000 ]  - [  -0.0010477300000000, -0.0012975900000000, -0.0005150700000000 ]  - [  -0.0001813900000000, -0.0001502700000000, -0.0001075500000000 ]  - [  -0.0003376400000000, -0.0003382300000000, -0.0003748400000000 ]  - [  -0.0003583900000000,  0.0006318400000000, -0.0000262100000000 ]  - [  -0.0005166600000000,  0.0008205500000000,  0.0002415700000000 ]  - [   0.0003518400000000, -0.0003287900000000, -0.0001688400000000 ]  - [  -0.0003768300000000,  0.0004240500000000,  0.0008588300000000 ]  - [   0.0007548500000000,  0.0010939600000000, -0.0003657500000000 ]  - [   0.0052753100000000,  0.0041737000000000, -0.0028336200000000 ]  - [   0.0003768300000000,  0.0004240500000000,  0.0008588300000000 ]  - [  -0.0007548500000000,  0.0010939600000000, -0.0003657500000000 ]  - [  -0.0052753100000000,  0.0041737000000000, -0.0028336200000000 ]  - [   0.0003583900000000,  0.0006318400000000, -0.0000262100000000 ]  - [   0.0005166600000000,  0.0008205500000000,  0.0002415700000000 ]  - [  -0.0003518400000000, -0.0003287900000000, -0.0001688400000000 ]  - [   0.0010477300000000, -0.0012975900000000, -0.0005150700000000 ]  - [   0.0001813900000000, -0.0001502700000000, -0.0001075500000000 ]  - [   0.0003376400000000, -0.0003382300000000, -0.0003748400000000 ]  - [   0.0045401900000000,  0.0031737900000000, -0.0025002400000000 ]  - [   0.0000603500000000,  0.0001247100000000, -0.0000186200000000 ]  - [  -0.0010618000000000, -0.0005431200000000,  0.0011974100000000 ]  - [  -0.0002557100000000,  0.0004837600000000,  0.0007450000000000 ]  - [   0.0000686400000000,  0.0002801700000000,  0.0004568200000000 ]  - [   0.0004148500000000, -0.0009113700000000,  0.0004903900000000 ]  - [   0.0001959700000000,  0.0004555900000000, -0.0008156500000000 ]  - [   0.0000583500000000,  0.0002532800000000, -0.0003699000000000 ]  - [  -0.0006774800000000, -0.0008948800000000, -0.0005252500000000 ]  - [   0.0003655400000000, -0.0006483800000000, -0.0003452200000000 ]  - [  -0.0003718100000000,  0.0005028400000000, -0.0001894600000000 ]  - [  -0.0005093900000000,  0.0007113300000000, -0.0006417100000000 ]  - [  -0.0001008400000000, -0.0006695500000000,  0.0003070400000000 ]  - [   0.0002431700000000,  0.0005300900000000,  0.0002778000000000 ]  - [   0.0005660100000000,  0.0007370100000000,  0.0005737900000000 ]  - [   0.0000000000000000, -0.0000409800000000,  0.0000360500000000 ]  - [   0.0000000000000000,  0.0000917700000000,  0.0000649500000000 ]  - [   0.0000000000000000,  0.0000929600000000,  0.0000651900000000 ]  - [   0.0000000000000000, -0.0006485900000000, -0.0021152900000000 ]  - [   0.0000000000000000,  0.0001738800000000, -0.0000796600000000 ]  - [   0.0000000000000000,  0.0001752200000000, -0.0000809400000000 ]  - [   0.0000000000000000, -0.0569143900000000,  0.0201295200000000 ]  - [   0.0000000000000000,  0.0013979200000000, -0.0004749100000000 ]  - [   0.0000000000000000,  0.0013842400000000, -0.0004611100000000 ]  - [   0.0000000000000000, -0.0008661500000000, -0.0016912100000000 ]  - [   0.0000000000000000,  0.0001228300000000, -0.0002097700000000 ]  - [   0.0000000000000000,  0.0001239000000000, -0.0002103300000000 ]  - [   0.0002557100000000,  0.0004837600000000,  0.0007450000000000 ]  - [  -0.0000686400000000,  0.0002801700000000,  0.0004568200000000 ]  - [  -0.0004148500000000, -0.0009113700000000,  0.0004903900000000 ]  - [  -0.0001959700000000,  0.0004555900000000, -0.0008156500000000 ]  - [  -0.0000583500000000,  0.0002532800000000, -0.0003699000000000 ]  - [   0.0006774800000000, -0.0008948800000000, -0.0005252500000000 ]  - [  -0.0003655400000000, -0.0006483800000000, -0.0003452200000000 ]  - [   0.0003718100000000,  0.0005028400000000, -0.0001894600000000 ]  - [   0.0005093900000000,  0.0007113300000000, -0.0006417100000000 ]  - [   0.0001008400000000, -0.0006695500000000,  0.0003070400000000 ]  - [  -0.0002431700000000,  0.0005300900000000,  0.0002778000000000 ]  - [  -0.0005660100000000,  0.0007370100000000,  0.0005737900000000 ]  - [  -0.0018875600000000, -0.0011393100000000,  0.0009482600000000 ]  - [  -0.0000453800000000, -0.0003201700000000,  0.0000205500000000 ]  - [  -0.0000010900000000,  0.0007969300000000, -0.0000160600000000 ]  - [  -0.0000002900000000,  0.0001829900000000, -0.0000174800000000 ]  - [   0.0000438400000000, -0.0009392500000000,  0.0000191900000000 ]  - [   0.0019146900000000, -0.0017821200000000,  0.0009510500000000 ]  - [   0.0000002900000000,  0.0001829900000000, -0.0000174800000000 ]  - [  -0.0000438400000000, -0.0009392500000000,  0.0000191900000000 ]  - [  -0.0019146900000000, -0.0017821200000000,  0.0009510500000000 ]  - [   0.0018875600000000, -0.0011393100000000,  0.0009482600000000 ]  - [   0.0000453800000000, -0.0003201700000000,  0.0000205500000000 ]  - [   0.0000010900000000,  0.0007969300000000, -0.0000160600000000 ]  - [  -0.0003362000000000,  0.0009814200000000,  0.0019395700000000 ]  - [  -0.0003378300000000, -0.0006281200000000,  0.0005771900000000 ]  - [  -0.0003289800000000, -0.0006310500000000,  0.0005801300000000 ]  - [   0.0003335400000000,  0.0010156900000000, -0.0004132600000000 ]  - [   0.0005040800000000, -0.0006488900000000, -0.0005691300000000 ]  - [   0.0001640300000000, -0.0006513700000000, -0.0005715800000000 ]  - [   0.0003362000000000,  0.0009814200000000,  0.0019395700000000 ]  - [   0.0003378300000000, -0.0006281200000000,  0.0005771900000000 ]  - [   0.0003289800000000, -0.0006310500000000,  0.0005801300000000 ]  - [  -0.0003335400000000,  0.0010156900000000, -0.0004132600000000 ]  - [  -0.0005040800000000, -0.0006488900000000, -0.0005691300000000 ]  - [  -0.0001640300000000, -0.0006513700000000, -0.0005715800000000 ]  - [   0.0000000000000000,  0.0013253900000000,  0.0010967700000000 ]  - [   0.0000000000000000, -0.0004836500000000, -0.0000400800000000 ]  - [   0.0000000000000000,  0.0000024500000000, -0.0000021100000000 ]  - [   0.0000000000000000,  0.0248115000000000, -0.0074311900000000 ]  - [   0.0000000000000000, -0.0013666300000000,  0.0006336400000000 ]  - [   0.0000000000000000, -0.0012553000000000, -0.0007053300000000 ]  - [   0.0000000000000000, -0.0014124800000000, -0.0010112800000000 ]  - [   0.0000000000000000, -0.0014994000000000,  0.0003273000000000 ]  - [   0.0000000000000000,  0.0246554100000000, -0.0073877400000000 ]  - [   0.0000000000000000, -0.0001349600000000,  0.0002965300000000 ]  - [   0.0000000000000000, -0.0006242800000000,  0.0002585100000000 ]  - [   0.0000000000000000,  0.0011868900000000,  0.0013942200000000 ]- atom:   43  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0140450100000000, -0.0091694500000000,  0.0050616900000000 ]  - [   0.0007819600000000, -0.0011920000000000,  0.0003430300000000 ]  - [   0.0002716200000000,  0.0012147000000000, -0.0004553400000000 ]  - [   0.0008775100000000,  0.0011396300000000,  0.0006010800000000 ]  - [  -0.0005136300000000, -0.0009660500000000, -0.0002247500000000 ]  - [   0.0002803200000000,  0.0000173600000000,  0.0003636700000000 ]  - [  -0.0009866600000000,  0.0009940600000000,  0.0007182000000000 ]  - [  -0.0001894800000000,  0.0000082000000000,  0.0001275800000000 ]  - [  -0.0015814900000000,  0.0021153400000000,  0.0009538600000000 ]  - [   0.0004313800000000,  0.0021942000000000, -0.0008110300000000 ]  - [  -0.0000793300000000, -0.0002181500000000, -0.0000091100000000 ]  - [  -0.0133432800000000, -0.0081960000000000,  0.0047231500000000 ]  - [  -0.0004313800000000,  0.0021942000000000, -0.0008110300000000 ]  - [   0.0000793300000000, -0.0002181500000000, -0.0000091100000000 ]  - [   0.0133432800000000, -0.0081960000000000,  0.0047231500000000 ]  - [   0.0009866600000000,  0.0009940600000000,  0.0007182000000000 ]  - [   0.0001894800000000,  0.0000082000000000,  0.0001275800000000 ]  - [   0.0015814900000000,  0.0021153400000000,  0.0009538600000000 ]  - [  -0.0008775100000000,  0.0011396300000000,  0.0006010800000000 ]  - [   0.0005136300000000, -0.0009660500000000, -0.0002247500000000 ]  - [  -0.0002803200000000,  0.0000173600000000,  0.0003636700000000 ]  - [  -0.0140450100000000, -0.0091694500000000,  0.0050616900000000 ]  - [  -0.0007819600000000, -0.0011920000000000,  0.0003430300000000 ]  - [  -0.0002716200000000,  0.0012147000000000, -0.0004553400000000 ]  - [   0.0007191700000000, -0.0013349900000000, -0.0019189800000000 ]  - [   0.0004242000000000, -0.0005687300000000, -0.0005723800000000 ]  - [   0.0016871000000000,  0.0006102300000000, -0.0011748000000000 ]  - [  -0.0008268300000000, -0.0014819000000000,  0.0017903800000000 ]  - [  -0.0004762200000000, -0.0005786800000000,  0.0005681100000000 ]  - [   0.0006446100000000,  0.0005473700000000,  0.0021666100000000 ]  - [  -0.0009562600000000,  0.0007895900000000,  0.0023562100000000 ]  - [   0.0001645300000000, -0.0003329200000000,  0.0007515600000000 ]  - [   0.0005170800000000, -0.0012350600000000,  0.0019742400000000 ]  - [  -0.0013776300000000,  0.0008539500000000, -0.0013646400000000 ]  - [  -0.0001125300000000, -0.0003230900000000, -0.0007560800000000 ]  - [  -0.0004082200000000, -0.0010893800000000, -0.0021031000000000 ]  - [   0.0000000000000000,  0.0001791800000000, -0.0000957000000000 ]  - [   0.0000000000000000, -0.0001109100000000, -0.0002317200000000 ]  - [   0.0000000000000000, -0.0001106600000000, -0.0002314200000000 ]  - [   0.0000000000000000,  0.0010255500000000,  0.0041674100000000 ]  - [   0.0000000000000000, -0.0002408800000000,  0.0004242200000000 ]  - [   0.0000000000000000, -0.0002402900000000,  0.0004236900000000 ]  - [   0.0000000000000000,  0.0202271100000000, -0.0962771500000000 ]  - [   0.0000000000000000, -0.0004706800000000, -0.0024651400000000 ]  - [   0.0000000000000000, -0.0004675600000000, -0.0024642000000000 ]  - [   0.0000000000000000,  0.0016945600000000,  0.0041689000000000 ]  - [   0.0000000000000000,  0.0002087400000000,  0.0015286000000000 ]  - [   0.0000000000000000,  0.0002087800000000,  0.0015274200000000 ]  - [  -0.0007191700000000, -0.0013349900000000, -0.0019189800000000 ]  - [  -0.0004242000000000, -0.0005687300000000, -0.0005723800000000 ]  - [  -0.0016871000000000,  0.0006102300000000, -0.0011748000000000 ]  - [   0.0008268300000000, -0.0014819000000000,  0.0017903800000000 ]  - [   0.0004762200000000, -0.0005786800000000,  0.0005681100000000 ]  - [  -0.0006446100000000,  0.0005473700000000,  0.0021666100000000 ]  - [   0.0009562600000000,  0.0007895900000000,  0.0023562100000000 ]  - [  -0.0001645300000000, -0.0003329200000000,  0.0007515600000000 ]  - [  -0.0005170800000000, -0.0012350600000000,  0.0019742400000000 ]  - [   0.0013776300000000,  0.0008539500000000, -0.0013646400000000 ]  - [   0.0001125300000000, -0.0003230900000000, -0.0007560800000000 ]  - [   0.0004082200000000, -0.0010893800000000, -0.0021031000000000 ]  - [   0.0062010600000000,  0.0044096700000000, -0.0025280200000000 ]  - [   0.0000833200000000,  0.0010743600000000, -0.0000543600000000 ]  - [   0.0011671600000000, -0.0009600400000000, -0.0005294900000000 ]  - [  -0.0011713900000000, -0.0015803500000000, -0.0005305000000000 ]  - [  -0.0000834200000000,  0.0004574600000000, -0.0000544500000000 ]  - [  -0.0061928200000000,  0.0037827200000000, -0.0025301200000000 ]  - [   0.0011713900000000, -0.0015803500000000, -0.0005305000000000 ]  - [   0.0000834200000000,  0.0004574600000000, -0.0000544500000000 ]  - [   0.0061928200000000,  0.0037827200000000, -0.0025301200000000 ]  - [  -0.0062010600000000,  0.0044096700000000, -0.0025280200000000 ]  - [  -0.0000833200000000,  0.0010743600000000, -0.0000543600000000 ]  - [  -0.0011671600000000, -0.0009600400000000, -0.0005294900000000 ]  - [  -0.0003377900000000, -0.0008810300000000, -0.0047252800000000 ]  - [  -0.0002286700000000,  0.0010772700000000, -0.0015936300000000 ]  - [  -0.0004438400000000,  0.0010765900000000, -0.0015929200000000 ]  - [   0.0003357600000000, -0.0006376700000000,  0.0021087300000000 ]  - [   0.0001017500000000,  0.0010401600000000,  0.0014902700000000 ]  - [   0.0005708000000000,  0.0010391500000000,  0.0014893800000000 ]  - [   0.0003377900000000, -0.0008810300000000, -0.0047252800000000 ]  - [   0.0002286700000000,  0.0010772700000000, -0.0015936300000000 ]  - [   0.0004438400000000,  0.0010765900000000, -0.0015929200000000 ]  - [  -0.0003357600000000, -0.0006376700000000,  0.0021087300000000 ]  - [  -0.0001017500000000,  0.0010401600000000,  0.0014902700000000 ]  - [  -0.0005708000000000,  0.0010391500000000,  0.0014893800000000 ]  - [   0.0000000000000000, -0.0021680000000000, -0.0031642200000000 ]  - [   0.0000000000000000,  0.0007617900000000, -0.0010488000000000 ]  - [   0.0000000000000000, -0.0007290400000000, -0.0014130700000000 ]  - [   0.0000000000000000, -0.0016130600000000,  0.0399382000000000 ]  - [   0.0000000000000000,  0.0015940300000000,  0.0012645400000000 ]  - [   0.0000000000000000, -0.0007833900000000,  0.0023686100000000 ]  - [   0.0000000000000000, -0.0009206900000000,  0.0020764700000000 ]  - [   0.0000000000000000,  0.0014611400000000,  0.0009621300000000 ]  - [   0.0000000000000000, -0.0043565100000000,  0.0451567900000000 ]  - [   0.0000000000000000, -0.0008661800000000, -0.0011176300000000 ]  - [   0.0000000000000000,  0.0006269700000000, -0.0007491700000000 ]  - [   0.0000000000000000, -0.0023030300000000, -0.0028663100000000 ]- atom:   61  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0017005800000000,  0.0007701300000000, -0.0007046000000000 ]  - [  -0.0003583400000000, -0.0000062800000000, -0.0000983600000000 ]  - [   0.0001262500000000, -0.0006316700000000,  0.0000659200000000 ]  - [  -0.0023879700000000, -0.0017261900000000, -0.0010444200000000 ]  - [  -0.0010557400000000, -0.0009623200000000, -0.0004476800000000 ]  - [  -0.0005701700000000, -0.0003377300000000, -0.0002816400000000 ]  - [  -0.0007748800000000,  0.0006168100000000,  0.0003295000000000 ]  - [  -0.0004596500000000,  0.0004806700000000,  0.0002287200000000 ]  - [  -0.0009193500000000,  0.0008835500000000,  0.0004236000000000 ]  - [  -0.0000808900000000,  0.0003487000000000, -0.0000170400000000 ]  - [   0.0002367300000000,  0.0004882600000000, -0.0001204800000000 ]  - [  -0.0002258900000000,  0.0000830900000000,  0.0000772400000000 ]  - [   0.0001105200000000,  0.0003069900000000, -0.0000641500000000 ]  - [  -0.0002559500000000,  0.0004998300000000, -0.0000677300000000 ]  - [   0.0002767000000000,  0.0000724300000000,  0.0000068600000000 ]  - [   0.0007997400000000,  0.0006527000000000,  0.0002862000000000 ]  - [   0.0004415300000000,  0.0004695400000000,  0.0002821900000000 ]  - [   0.0009639700000000,  0.0008925400000000,  0.0003510700000000 ]  - [   0.1988321800000000, -0.1164938000000000, -0.0725395600000000 ]  - [   0.0009825800000000, -0.0012536900000000, -0.0003033200000000 ]  - [   0.0005218200000000, -0.0003976200000000, -0.0002771000000000 ]  - [   0.1911399200000000,  0.1072275900000000, -0.0673803000000000 ]  - [   0.0002854500000000,  0.0002793400000000,  0.0000454600000000 ]  - [  -0.0001639700000000, -0.0005666600000000,  0.0000662200000000 ]  - [  -0.0002662800000000,  0.0000380700000000,  0.0002570400000000 ]  - [   0.0001042800000000, -0.0001348900000000,  0.0001334600000000 ]  - [  -0.0003743700000000, -0.0000475200000000, -0.0000207800000000 ]  - [  -0.0005787000000000, -0.0002927200000000,  0.0000824200000000 ]  - [  -0.0002110200000000, -0.0001179200000000, -0.0000415800000000 ]  - [  -0.0006846800000000, -0.0002031700000000, -0.0002033000000000 ]  - [  -0.0004535400000000,  0.0001788100000000,  0.0000718100000000 ]  - [  -0.0004232600000000,  0.0003395200000000, -0.0001279000000000 ]  - [  -0.0002021100000000,  0.0001421000000000,  0.0000591000000000 ]  - [  -0.0001408300000000,  0.0000727200000000, -0.0001051900000000 ]  - [  -0.0001081300000000, -0.0000886100000000, -0.0003054500000000 ]  - [   0.0001116900000000,  0.0001105100000000, -0.0001178200000000 ]  - [  -0.0008942800000000,  0.0001150800000000, -0.0001591400000000 ]  - [  -0.0023811600000000, -0.0002447200000000, -0.0003619800000000 ]  - [  -0.0000417200000000, -0.0000281400000000, -0.0000068900000000 ]  - [  -0.0008602300000000, -0.0001134900000000, -0.0001586100000000 ]  - [  -0.0024332900000000,  0.0002304200000000, -0.0003453800000000 ]  - [  -0.0000412400000000,  0.0000299200000000, -0.0000063800000000 ]  - [   0.0016303400000000, -0.0019106300000000,  0.0062216100000000 ]  - [  -0.0002862600000000, -0.0000022700000000,  0.0011637100000000 ]  - [   0.0000058600000000, -0.0000438000000000,  0.0000815500000000 ]  - [   0.0016162600000000,  0.0018935200000000,  0.0061718300000000 ]  - [  -0.0002928300000000, -0.0000015800000000,  0.0011742100000000 ]  - [   0.0000057500000000,  0.0000452900000000,  0.0000855000000000 ]  - [   0.0861021600000000,  0.0544136200000000,  0.0698178500000000 ]  - [  -0.0001234600000000, -0.0001749400000000,  0.0001805800000000 ]  - [   0.0002545000000000,  0.0002882400000000,  0.0002663500000000 ]  - [   0.0871678100000000, -0.0543420300000000,  0.0684104900000000 ]  - [   0.0001913600000000, -0.0000748100000000,  0.0000053000000000 ]  - [   0.0005700200000000, -0.0005224700000000,  0.0000918500000000 ]  - [   0.0004925800000000,  0.0002904600000000, -0.0002760400000000 ]  - [   0.0010603700000000,  0.0011671800000000, -0.0010901400000000 ]  - [   0.0002098700000000,  0.0001227500000000,  0.0000304500000000 ]  - [   0.0001788100000000, -0.0000380000000000, -0.0004661500000000 ]  - [   0.0007357800000000, -0.0009069500000000, -0.0012547900000000 ]  - [  -0.0001060300000000,  0.0001346900000000, -0.0001434200000000 ]  - [  -0.5865360700000000,  0.0083749800000000,  0.0018767700000000 ]  - [  -0.0004102900000000,  0.0003105500000000, -0.0000076200000000 ]  - [  -0.0004105400000000,  0.0003018900000000, -0.0000341900000000 ]  - [  -0.0005358000000000, -0.0003066600000000,  0.0002250800000000 ]  - [  -0.0008597100000000, -0.0003139300000000,  0.0010628700000000 ]  - [  -0.0005529200000000, -0.0003109500000000, -0.0000823900000000 ]  - [   0.0005071200000000, -0.0003091000000000, -0.0000453800000000 ]  - [   0.0002647700000000, -0.0003097500000000,  0.0001452200000000 ]  - [   0.0004791300000000, -0.0003099700000000, -0.0001546800000000 ]  - [   0.0017324800000000,  0.0003066700000000,  0.0005399400000000 ]  - [   0.0006156700000000,  0.0003107100000000,  0.0002082000000000 ]  - [   0.0006156500000000,  0.0003097500000000,  0.0001730700000000 ]  - [   0.0005857900000000,  0.0000764900000000,  0.0001263600000000 ]  - [   0.0010589700000000, -0.0000814200000000,  0.0001028500000000 ]  - [  -0.0002366700000000, -0.0000239600000000,  0.0000035100000000 ]  - [   0.0012819500000000, -0.0000762500000000,  0.0001250800000000 ]  - [   0.0017052400000000,  0.0000848500000000,  0.0001059200000000 ]  - [   0.0004347500000000,  0.0000223500000000,  0.0000034600000000 ]  - [   0.0009077600000000,  0.0012510500000000,  0.0011955900000000 ]  - [   0.0003288300000000, -0.0061207700000000,  0.0074664300000000 ]  - [   0.0002618300000000, -0.0000422000000000,  0.0000046600000000 ]  - [   0.0002620000000000, -0.0012848900000000,  0.0012290500000000 ]  - [  -0.0004487200000000,  0.0060730600000000,  0.0073858500000000 ]  - [  -0.0004074800000000,  0.0000373600000000,  0.0000066100000000 ]  - [   0.0104178000000000, -0.0107622000000000, -0.0097225400000000 ]  - [   0.0018233200000000,  0.0022143600000000, -0.0011554000000000 ]  - [   0.0000043600000000, -0.0000096700000000, -0.0000893000000000 ]  - [   0.0104216900000000,  0.0108715700000000, -0.0094221300000000 ]  - [   0.0017919300000000, -0.0020432700000000, -0.0008464000000000 ]  - [   0.0000002600000000,  0.0001461600000000,  0.0002109200000000 ]  - [   0.0001087500000000,  0.0000674600000000, -0.0008818800000000 ]  - [  -0.0000043100000000, -0.0000480500000000, -0.0002590100000000 ]  - [  -0.0003075500000000,  0.0015643900000000, -0.0035940500000000 ]  - [   0.0001124000000000, -0.0002032500000000, -0.0005918700000000 ]  - [  -0.0000073000000000, -0.0000924300000000,  0.0000338900000000 ]  - [  -0.0003031200000000, -0.0016953700000000, -0.0032752500000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0007553800000000,  0.0009917500000000, -0.0005570000000000 ]  - [   0.0008213900000000, -0.0007954600000000,  0.0003845200000000 ]  - [   0.0005558000000000, -0.0009769300000000,  0.0002756100000000 ]  - [   0.0007553800000000,  0.0009917500000000,  0.0005570000000000 ]  - [  -0.0008213900000000, -0.0007954600000000, -0.0003845200000000 ]  - [  -0.0005558000000000, -0.0009769300000000, -0.0002756100000000 ]  - [  -0.0007311600000000,  0.0010443400000000,  0.0002772700000000 ]  - [  -0.0002680000000000,  0.0002147800000000,  0.0001081100000000 ]  - [   0.0000222900000000,  0.0001615200000000, -0.0000104800000000 ]  - [   0.0007311600000000,  0.0010443400000000, -0.0002772700000000 ]  - [   0.0002680000000000,  0.0002147800000000, -0.0001081100000000 ]  - [  -0.0000222900000000,  0.0001615200000000,  0.0000104800000000 ]  - [  -0.0006603500000000,  0.0012545500000000, -0.0002234000000000 ]  - [   0.0001450600000000, -0.0000240900000000,  0.0000829700000000 ]  - [  -0.0000268200000000,  0.0001296500000000, -0.0000145700000000 ]  - [   0.0006603500000000,  0.0012545500000000,  0.0002234000000000 ]  - [  -0.0001450600000000, -0.0000240900000000, -0.0000829700000000 ]  - [   0.0000268200000000,  0.0001296500000000,  0.0000145700000000 ]  - [  -0.1087224100000000,  0.1389031300000000,  0.0534278900000000 ]  - [   0.0001318000000000, -0.0010336300000000, -0.0000831300000000 ]  - [   0.0007686700000000, -0.0010614000000000, -0.0003783800000000 ]  - [   0.1087224100000000,  0.1389031300000000, -0.0534278900000000 ]  - [  -0.0001318000000000, -0.0010336300000000,  0.0000831300000000 ]  - [  -0.0007686700000000, -0.0010614000000000,  0.0003783800000000 ]  - [  -0.0002201000000000,  0.0006009200000000,  0.0006848400000000 ]  - [   0.0002356800000000, -0.0005113800000000, -0.0001199500000000 ]  - [   0.0001174900000000, -0.0003710500000000,  0.0001440300000000 ]  - [   0.0002201000000000,  0.0006009200000000, -0.0006848400000000 ]  - [  -0.0002356800000000, -0.0005113800000000,  0.0001199500000000 ]  - [  -0.0001174900000000, -0.0003710500000000, -0.0001440300000000 ]  - [  -0.0002630200000000,  0.0005817900000000, -0.0003034800000000 ]  - [   0.0000001200000000, -0.0000151500000000,  0.0003145400000000 ]  - [  -0.0000378500000000, -0.0002501100000000,  0.0003019700000000 ]  - [   0.0002630200000000,  0.0005817900000000,  0.0003034800000000 ]  - [  -0.0000001200000000, -0.0000151500000000, -0.0003145400000000 ]  - [   0.0000378500000000, -0.0002501100000000, -0.0003019700000000 ]  - [   0.0012344500000000,  0.0000489100000000,  0.0001141200000000 ]  - [  -0.0047553200000000,  0.0007949700000000,  0.0007214700000000 ]  - [  -0.0001987900000000, -0.0002909000000000,  0.0000404400000000 ]  - [  -0.0012344500000000,  0.0000489100000000, -0.0001141200000000 ]  - [   0.0047553200000000,  0.0007949700000000, -0.0007214700000000 ]  - [   0.0001987900000000, -0.0002909000000000, -0.0000404400000000 ]  - [   0.0009710100000000, -0.0014660400000000,  0.0041221400000000 ]  - [   0.0003122900000000,  0.0004885300000000, -0.0012780900000000 ]  - [   0.0000212800000000, -0.0006314100000000,  0.0007659300000000 ]  - [  -0.0009710100000000, -0.0014660400000000, -0.0041221400000000 ]  - [  -0.0003122900000000,  0.0004885300000000,  0.0012780900000000 ]  - [  -0.0000212800000000, -0.0006314100000000, -0.0007659300000000 ]  - [   0.0555686300000000,  0.1418688600000000,  0.1150489500000000 ]  - [  -0.0003776500000000, -0.0007615000000000, -0.0003230500000000 ]  - [  -0.0001089900000000, -0.0007334800000000,  0.0001955800000000 ]  - [  -0.0555686300000000,  0.1418688600000000, -0.1150489500000000 ]  - [   0.0003776500000000, -0.0007615000000000,  0.0003230500000000 ]  - [   0.0001089900000000, -0.0007334800000000, -0.0001955800000000 ]  - [   0.0003931800000000,  0.0007086600000000, -0.0007830800000000 ]  - [  -0.0006707700000000, -0.0008396200000000,  0.0013275700000000 ]  - [   0.0000094600000000, -0.0003830700000000,  0.0003428900000000 ]  - [  -0.0003931800000000,  0.0007086600000000,  0.0007830800000000 ]  - [   0.0006707700000000, -0.0008396200000000, -0.0013275700000000 ]  - [  -0.0000094600000000, -0.0003830700000000, -0.0003428900000000 ]  - [   0.0000000000000000, -0.5863709000000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0011605200000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0011503900000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0012783300000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0009254300000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0003566000000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0010662000000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0000097700000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0002207900000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0013909200000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0008673100000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0008655200000000,  0.0000000000000000 ]  - [   0.0003240600000000, -0.0002118200000000,  0.0003056000000000 ]  - [  -0.0030270100000000, -0.0005559900000000,  0.0003165300000000 ]  - [  -0.0004618200000000,  0.0006092400000000, -0.0001789200000000 ]  - [  -0.0003240600000000, -0.0002118200000000, -0.0003056000000000 ]  - [   0.0030270100000000, -0.0005559900000000, -0.0003165300000000 ]  - [   0.0004618200000000,  0.0006092400000000,  0.0001789200000000 ]  - [   0.0015950000000000,  0.0016178000000000,  0.0022394200000000 ]  - [  -0.0069994800000000,  0.0051449600000000, -0.0110342200000000 ]  - [   0.0002080000000000,  0.0009260200000000, -0.0002794600000000 ]  - [  -0.0015950000000000,  0.0016178000000000, -0.0022394200000000 ]  - [   0.0069994800000000,  0.0051449600000000,  0.0110342200000000 ]  - [  -0.0002080000000000,  0.0009260200000000,  0.0002794600000000 ]  - [  -0.0101820100000000,  0.0040921800000000,  0.0064654200000000 ]  - [   0.0017233700000000,  0.0012438600000000, -0.0011997700000000 ]  - [  -0.0000493400000000,  0.0010550000000000,  0.0003783700000000 ]  - [   0.0101820100000000,  0.0040921800000000, -0.0064654200000000 ]  - [  -0.0017233700000000,  0.0012438600000000,  0.0011997700000000 ]  - [   0.0000493400000000,  0.0010550000000000, -0.0003783700000000 ]  - [  -0.0002497600000000, -0.0010221100000000,  0.0004982900000000 ]  - [  -0.0002190600000000,  0.0007485300000000, -0.0006624300000000 ]  - [  -0.0001167700000000,  0.0009899800000000, -0.0023854900000000 ]  - [   0.0002497600000000, -0.0010221100000000, -0.0004982900000000 ]  - [   0.0002190600000000,  0.0007485300000000,  0.0006624300000000 ]  - [   0.0001167700000000,  0.0009899800000000,  0.0023854900000000 ]- atom:   61  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0014433300000000, -0.0019455400000000,  0.0008959100000000 ]  - [  -0.0001216300000000, -0.0001753900000000, -0.0000340000000000 ]  - [   0.0001406900000000,  0.0000065500000000,  0.0000724700000000 ]  - [  -0.0014433300000000, -0.0019455400000000, -0.0008959100000000 ]  - [   0.0001216300000000, -0.0001753900000000,  0.0000340000000000 ]  - [  -0.0001406900000000,  0.0000065500000000, -0.0000724700000000 ]  - [   0.0000360100000000, -0.0000781200000000,  0.0000701900000000 ]  - [  -0.0004286100000000,  0.0007536900000000,  0.0002415500000000 ]  - [  -0.0007162600000000,  0.0008055100000000,  0.0003574800000000 ]  - [  -0.0000360100000000, -0.0000781200000000, -0.0000701900000000 ]  - [   0.0004286100000000,  0.0007536900000000, -0.0002415500000000 ]  - [   0.0007162600000000,  0.0008055100000000, -0.0003574800000000 ]  - [  -0.0000317700000000, -0.0002929300000000, -0.0001284800000000 ]  - [  -0.0008436500000000,  0.0009933300000000, -0.0004335700000000 ]  - [  -0.0006614800000000,  0.0008349800000000, -0.0003301800000000 ]  - [   0.0000317700000000, -0.0002929300000000,  0.0001284800000000 ]  - [   0.0008436500000000,  0.0009933300000000,  0.0004335700000000 ]  - [   0.0006614800000000,  0.0008349800000000,  0.0003301800000000 ]  - [   0.1148708300000000, -0.1419561700000000, -0.0564612400000000 ]  - [   0.0005664200000000,  0.0000591100000000, -0.0002661900000000 ]  - [  -0.0000782000000000,  0.0000944500000000,  0.0000326500000000 ]  - [  -0.1148708300000000, -0.1419561700000000,  0.0564612400000000 ]  - [  -0.0005664200000000,  0.0000591100000000,  0.0002661900000000 ]  - [   0.0000782000000000,  0.0000944500000000, -0.0000326500000000 ]  - [   0.0005320900000000, -0.0008563200000000, -0.0005117800000000 ]  - [   0.0000801700000000,  0.0002575700000000,  0.0002940700000000 ]  - [   0.0001934300000000,  0.0001208100000000,  0.0000381100000000 ]  - [  -0.0005320900000000, -0.0008563200000000,  0.0005117800000000 ]  - [  -0.0000801700000000,  0.0002575700000000, -0.0002940700000000 ]  - [  -0.0001934300000000,  0.0001208100000000, -0.0000381100000000 ]  - [  -0.0000507200000000, -0.0003291800000000,  0.0004792600000000 ]  - [  -0.0003150400000000,  0.0002645200000000, -0.0001361600000000 ]  - [  -0.0002761400000000,  0.0005018500000000, -0.0001249700000000 ]  - [   0.0000507200000000, -0.0003291800000000, -0.0004792600000000 ]  - [   0.0003150400000000,  0.0002645200000000,  0.0001361600000000 ]  - [   0.0002761400000000,  0.0005018500000000,  0.0001249700000000 ]  - [  -0.0012530000000000, -0.0000448800000000, -0.0001162700000000 ]  - [   0.0048031500000000, -0.0008071600000000, -0.0007319600000000 ]  - [   0.0001997300000000,  0.0002918800000000, -0.0000408900000000 ]  - [   0.0012530000000000, -0.0000448800000000,  0.0001162700000000 ]  - [  -0.0048031500000000, -0.0008071600000000,  0.0007319600000000 ]  - [  -0.0001997300000000,  0.0002918800000000,  0.0000408900000000 ]  - [  -0.0009540500000000,  0.0014549400000000, -0.0040683900000000 ]  - [  -0.0003057800000000, -0.0004933700000000,  0.0012624400000000 ]  - [  -0.0000212100000000,  0.0006311900000000, -0.0007676600000000 ]  - [   0.0009540500000000,  0.0014549400000000,  0.0040683900000000 ]  - [   0.0003057800000000, -0.0004933700000000, -0.0012624400000000 ]  - [   0.0000212100000000,  0.0006311900000000,  0.0007676600000000 ]  - [  -0.0531948500000000, -0.1399300300000000, -0.1093385500000000 ]  - [   0.0000619900000000,  0.0005106200000000,  0.0004967500000000 ]  - [  -0.0002045500000000,  0.0004858700000000, -0.0000170600000000 ]  - [   0.0531948500000000, -0.1399300300000000,  0.1093385500000000 ]  - [  -0.0000619900000000,  0.0005106200000000, -0.0004967500000000 ]  - [   0.0002045500000000,  0.0004858700000000,  0.0000170600000000 ]  - [  -0.0000775400000000, -0.0004534300000000,  0.0009692500000000 ]  - [   0.0009947400000000,  0.0010975500000000, -0.0011634000000000 ]  - [   0.0003067600000000,  0.0006396100000000, -0.0001698700000000 ]  - [   0.0000775400000000, -0.0004534300000000, -0.0009692500000000 ]  - [  -0.0009947400000000,  0.0010975500000000,  0.0011634000000000 ]  - [  -0.0003067600000000,  0.0006396100000000,  0.0001698700000000 ]  - [   0.0000000000000000,  0.5868215900000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0005329800000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0005430000000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0006611500000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0015518400000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0009767500000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0004456400000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0006078400000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0008398600000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0020012000000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0002444100000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0002461300000000,  0.0000000000000000 ]  - [  -0.0010133200000000,  0.0002090900000000, -0.0003047200000000 ]  - [   0.0023761200000000,  0.0005599600000000, -0.0003205900000000 ]  - [  -0.0002111100000000, -0.0006092400000000,  0.0001785800000000 ]  - [   0.0010133200000000,  0.0002090900000000,  0.0003047200000000 ]  - [  -0.0023761200000000,  0.0005599600000000,  0.0003205900000000 ]  - [   0.0002111100000000, -0.0006092400000000, -0.0001785800000000 ]  - [  -0.0009468100000000, -0.0016646700000000, -0.0022773800000000 ]  - [   0.0076975700000000, -0.0052037200000000,  0.0110346300000000 ]  - [   0.0004610000000000, -0.0009281500000000,  0.0002770500000000 ]  - [   0.0009468100000000, -0.0016646700000000,  0.0022773800000000 ]  - [  -0.0076975700000000, -0.0052037200000000, -0.0110346300000000 ]  - [  -0.0004610000000000, -0.0009281500000000, -0.0002770500000000 ]  - [   0.0101641000000000, -0.0038871500000000, -0.0067226900000000 ]  - [  -0.0016943400000000, -0.0010708500000000,  0.0008909800000000 ]  - [   0.0000514100000000, -0.0009157700000000, -0.0006775200000000 ]  - [  -0.0101641000000000, -0.0038871500000000,  0.0067226900000000 ]  - [   0.0016943400000000, -0.0010708500000000, -0.0008909800000000 ]  - [  -0.0000514100000000, -0.0009157700000000,  0.0006775200000000 ]  - [   0.0002466300000000,  0.0008852200000000, -0.0007863500000000 ]  - [   0.0002219900000000, -0.0008875400000000,  0.0003699300000000 ]  - [   0.0001129500000000, -0.0011221000000000,  0.0020651100000000 ]  - [  -0.0002466300000000,  0.0008852200000000,  0.0007863500000000 ]  - [  -0.0002219900000000, -0.0008875400000000, -0.0003699300000000 ]  - [  -0.0001129500000000, -0.0011221000000000, -0.0020651100000000 ]- atom:   61  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0012040800000000, -0.0012466900000000,  0.0008759400000000 ]  - [   0.0005764700000000, -0.0007114800000000,  0.0004950300000000 ]  - [   0.0004378700000000, -0.0004078100000000,  0.0002497400000000 ]  - [   0.0005173900000000,  0.0002958400000000,  0.0005389700000000 ]  - [  -0.0001253200000000, -0.0002601800000000,  0.0001438200000000 ]  - [  -0.0002583500000000, -0.0005626500000000, -0.0000979800000000 ]  - [  -0.0002555400000000,  0.0004143800000000, -0.0001174500000000 ]  - [  -0.0003349300000000,  0.0004679600000000,  0.0001147100000000 ]  - [  -0.0001290800000000,  0.0002933700000000, -0.0000373800000000 ]  - [   0.0004390100000000,  0.0005527200000000, -0.0004646300000000 ]  - [   0.0003609400000000,  0.0004999600000000, -0.0002345000000000 ]  - [   0.0005631600000000,  0.0006724400000000, -0.0003833000000000 ]  - [  -0.0002814800000000,  0.0005024900000000, -0.0008865300000000 ]  - [  -0.0003932400000000,  0.0005098900000000, -0.0001647600000000 ]  - [  -0.0005148000000000,  0.0006721300000000, -0.0004774800000000 ]  - [   0.0004133400000000,  0.0004618900000000, -0.0005360500000000 ]  - [   0.0003043500000000,  0.0004584100000000,  0.0001856200000000 ]  - [   0.0001727500000000,  0.0002914200000000, -0.0001334600000000 ]  - [  -0.0689989100000000,  0.0543637800000000,  0.0866773200000000 ]  - [   0.0002332900000000, -0.0001197100000000,  0.0002597300000000 ]  - [   0.0002514900000000, -0.0005306100000000, -0.0001419100000000 ]  - [  -0.0709724500000000, -0.0556734600000000,  0.0862968400000000 ]  - [  -0.0004590300000000, -0.0008663900000000,  0.0006056000000000 ]  - [  -0.0004401200000000, -0.0004371400000000,  0.0002040700000000 ]  - [  -0.0000731800000000,  0.0001931700000000,  0.0006432700000000 ]  - [   0.0000919200000000, -0.0001513400000000,  0.0001864000000000 ]  - [   0.0002577300000000,  0.0000619300000000,  0.0004371300000000 ]  - [  -0.0003848000000000, -0.0004470300000000,  0.0004701700000000 ]  - [  -0.0002239800000000, -0.0001034400000000,  0.0000129900000000 ]  - [  -0.0000534300000000, -0.0003128800000000,  0.0002559100000000 ]  - [  -0.0002332000000000,  0.0002290500000000, -0.0002373600000000 ]  - [  -0.0004233200000000,  0.0004926800000000, -0.0004115900000000 ]  - [  -0.0001986600000000,  0.0001392000000000,  0.0000068700000000 ]  - [   0.0000805400000000,  0.0000245300000000, -0.0004130700000000 ]  - [  -0.0001086800000000, -0.0002423800000000, -0.0005906400000000 ]  - [   0.0001146800000000,  0.0001119100000000, -0.0001712100000000 ]  - [  -0.0016479800000000,  0.0001488800000000, -0.0000246300000000 ]  - [  -0.0056952700000000,  0.0007593600000000,  0.0010168800000000 ]  - [  -0.0000821600000000, -0.0000753100000000,  0.0000084900000000 ]  - [  -0.0016352800000000, -0.0001450800000000, -0.0000221800000000 ]  - [  -0.0057454600000000, -0.0007671300000000,  0.0010282400000000 ]  - [  -0.0000822900000000,  0.0000757600000000,  0.0000090300000000 ]  - [  -0.0000693900000000,  0.0009420900000000, -0.0025023300000000 ]  - [   0.0002594200000000, -0.0000143600000000, -0.0005448600000000 ]  - [   0.0000076300000000,  0.0000190400000000, -0.0000549000000000 ]  - [  -0.0000896000000000, -0.0009572100000000, -0.0025543200000000 ]  - [   0.0002546700000000,  0.0000191600000000, -0.0005149800000000 ]  - [   0.0000073200000000, -0.0000203000000000, -0.0000531400000000 ]  - [   0.0711806100000000,  0.1159833000000000,  0.1979934100000000 ]  - [  -0.0000550700000000, -0.0002383100000000,  0.0002497000000000 ]  - [   0.0000039500000000,  0.0006586600000000,  0.0007429300000000 ]  - [   0.0667771700000000, -0.1079033800000000,  0.1908775600000000 ]  - [   0.0002624300000000, -0.0000153000000000,  0.0000803400000000 ]  - [   0.0003169600000000, -0.0009051200000000,  0.0005641600000000 ]  - [   0.0003564100000000,  0.0003210800000000, -0.0009106300000000 ]  - [   0.0014700600000000,  0.0018589700000000, -0.0021102200000000 ]  - [   0.0002167000000000,  0.0001099300000000, -0.0000392700000000 ]  - [   0.0000421900000000, -0.0000682700000000, -0.0010931700000000 ]  - [   0.0011467300000000, -0.0015983600000000, -0.0022769100000000 ]  - [  -0.0000983800000000,  0.0001449700000000, -0.0002142100000000 ]  - [   0.0016630100000000, -0.0077216400000000, -0.5864804200000000 ]  - [  -0.0000339800000000,  0.0003160800000000, -0.0004352900000000 ]  - [  -0.0000080900000000,  0.0003073800000000, -0.0004357600000000 ]  - [  -0.0002251800000000, -0.0003084100000000,  0.0011167600000000 ]  - [  -0.0010627600000000, -0.0003133100000000,  0.0018572000000000 ]  - [   0.0000824700000000, -0.0003093400000000,  0.0003528500000000 ]  - [  -0.0000452000000000, -0.0003103600000000,  0.0004258900000000 ]  - [   0.0001447700000000, -0.0003091000000000,  0.0004063900000000 ]  - [  -0.0001550600000000, -0.0003089600000000,  0.0002199900000000 ]  - [  -0.0005397200000000,  0.0003038600000000, -0.0009873700000000 ]  - [  -0.0001725500000000,  0.0003125400000000, -0.0003294800000000 ]  - [  -0.0002081500000000,  0.0003103000000000, -0.0003291100000000 ]  - [   0.0005186900000000,  0.0000995700000000, -0.0000157700000000 ]  - [   0.0028704700000000,  0.0001311600000000, -0.0002169800000000 ]  - [  -0.0002376500000000, -0.0000500700000000, -0.0000075800000000 ]  - [   0.0012024000000000, -0.0001010300000000, -0.0000159300000000 ]  - [   0.0035221600000000, -0.0001287800000000, -0.0002123100000000 ]  - [   0.0004326000000000,  0.0000513000000000, -0.0000062400000000 ]  - [   0.0019172700000000,  0.0025429900000000,  0.0023840800000000 ]  - [   0.0092483200000000, -0.0116501700000000,  0.0105955700000000 ]  - [   0.0002861100000000, -0.0000925600000000, -0.0000087900000000 ]  - [   0.0012656600000000, -0.0025904500000000,  0.0024252200000000 ]  - [   0.0085762000000000,  0.0116784600000000,  0.0105814000000000 ]  - [  -0.0003818600000000,  0.0000938100000000, -0.0000033600000000 ]  - [  -0.0073329300000000,  0.0051852100000000,  0.0004740000000000 ]  - [  -0.0009197300000000, -0.0009195700000000,  0.0000844200000000 ]  - [  -0.0000078700000000,  0.0001228200000000, -0.0002126200000000 ]  - [  -0.0072609500000000, -0.0050050600000000,  0.0006715700000000 ]  - [  -0.0009496200000000,  0.0010840500000000,  0.0004021500000000 ]  - [  -0.0000092800000000,  0.0000192300000000,  0.0000857300000000 ]  - [  -0.0002008600000000, -0.0000358100000000,  0.0007155300000000 ]  - [  -0.0000071500000000, -0.0000740000000000, -0.0000333100000000 ]  - [  -0.0000106100000000, -0.0007055600000000,  0.0012676200000000 ]  - [  -0.0002004900000000, -0.0001071300000000,  0.0009961000000000 ]  - [  -0.0000107400000000, -0.0000636100000000,  0.0002606400000000 ]  - [  -0.0000075600000000,  0.0005771400000000,  0.0015914000000000 ]- atom:   73  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0021511400000000, -0.0008064400000000,  0.0009369700000000 ]  - [   0.0006368300000000, -0.0005129700000000,  0.0002623200000000 ]  - [   0.0032579400000000, -0.0009207400000000, -0.0002262000000000 ]  - [  -0.0021047500000000,  0.0002825800000000,  0.0009037200000000 ]  - [  -0.0005423700000000, -0.0004715600000000, -0.0002565800000000 ]  - [  -0.0021044700000000, -0.0017546900000000, -0.0006589300000000 ]  - [  -0.0021044700000000,  0.0017546900000000,  0.0006589300000000 ]  - [  -0.0005423700000000,  0.0004715600000000,  0.0002565800000000 ]  - [  -0.0021047500000000, -0.0002825800000000, -0.0009037200000000 ]  - [   0.0032579400000000,  0.0009207400000000,  0.0002262000000000 ]  - [   0.0006368300000000,  0.0005129700000000, -0.0002623200000000 ]  - [   0.0021511400000000,  0.0008064400000000, -0.0009369700000000 ]  - [   0.0010839600000000, -0.0003561900000000,  0.0002530500000000 ]  - [  -0.0001453900000000,  0.0005093300000000, -0.0000672400000000 ]  - [   0.0000447300000000,  0.0009273800000000,  0.0010449700000000 ]  - [  -0.0011833500000000, -0.0003960600000000, -0.0004517500000000 ]  - [   0.0000382700000000,  0.0004695600000000,  0.0000815300000000 ]  - [  -0.0019031900000000,  0.0003606400000000,  0.0004676400000000 ]  - [  -0.0019031900000000, -0.0003606400000000, -0.0004676400000000 ]  - [   0.0000382700000000, -0.0004695600000000, -0.0000815300000000 ]  - [  -0.0011833500000000,  0.0003960600000000,  0.0004517500000000 ]  - [   0.0000447300000000, -0.0009273800000000, -0.0010449700000000 ]  - [  -0.0001453900000000, -0.0005093300000000,  0.0000672400000000 ]  - [   0.0010839600000000,  0.0003561900000000, -0.0002530500000000 ]  - [  -0.0004882100000000,  0.0001727700000000,  0.0003635500000000 ]  - [   0.0001766400000000, -0.0003698200000000,  0.0000371400000000 ]  - [  -0.0003752100000000,  0.0009962300000000,  0.0010722500000000 ]  - [   0.0005283300000000,  0.0009007000000000, -0.0001913300000000 ]  - [  -0.0000741100000000, -0.0002700500000000, -0.0001515900000000 ]  - [   0.0031454800000000, -0.0065436900000000,  0.0079310500000000 ]  - [   0.0031454800000000,  0.0065436900000000, -0.0079310500000000 ]  - [  -0.0000741100000000,  0.0002700500000000,  0.0001515900000000 ]  - [   0.0005283300000000, -0.0009007000000000,  0.0001913300000000 ]  - [  -0.0003752100000000, -0.0009962300000000, -0.0010722500000000 ]  - [   0.0001766400000000,  0.0003698200000000, -0.0000371400000000 ]  - [  -0.0004882100000000, -0.0001727700000000, -0.0003635500000000 ]  - [  -0.0033249000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0016898900000000,  0.0000257300000000, -0.0000226800000000 ]  - [  -0.0016898900000000, -0.0000257300000000,  0.0000226800000000 ]  - [   0.0517150500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0020885400000000, -0.0003547300000000,  0.0000119100000000 ]  - [   0.0020885400000000,  0.0003547300000000, -0.0000119100000000 ]  - [   0.0003682500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0001306700000000,  0.0000043700000000, -0.0001063700000000 ]  - [   0.0001306700000000, -0.0000043700000000,  0.0001063700000000 ]  - [  -0.0038185000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0002191100000000,  0.0001676200000000,  0.0002315000000000 ]  - [  -0.0002191100000000, -0.0001676200000000, -0.0002315000000000 ]  - [  -0.0005478700000000, -0.0006010200000000, -0.0004296400000000 ]  - [  -0.0002001700000000, -0.0000222700000000,  0.0000822800000000 ]  - [  -0.0007600400000000, -0.0009230400000000, -0.0006539800000000 ]  - [   0.0001719200000000, -0.0012840600000000, -0.0002346000000000 ]  - [   0.0000530900000000,  0.0001314500000000, -0.0003084600000000 ]  - [  -0.0026023800000000,  0.0058696800000000, -0.0076050700000000 ]  - [  -0.0026023800000000, -0.0058696800000000,  0.0076050700000000 ]  - [   0.0000530900000000, -0.0001314500000000,  0.0003084600000000 ]  - [   0.0001719200000000,  0.0012840600000000,  0.0002346000000000 ]  - [  -0.0007600400000000,  0.0009230400000000,  0.0006539800000000 ]  - [  -0.0002001700000000,  0.0000222700000000, -0.0000822800000000 ]  - [  -0.0005478700000000,  0.0006010200000000,  0.0004296400000000 ]  - [   0.0009308500000000,  0.0009827200000000,  0.0008651500000000 ]  - [   0.0000985400000000,  0.0001827500000000,  0.0000977800000000 ]  - [   0.0013823500000000, -0.0024080700000000,  0.0032134600000000 ]  - [   0.0013823500000000,  0.0024080700000000, -0.0032134600000000 ]  - [   0.0000985400000000, -0.0001827500000000, -0.0000977800000000 ]  - [   0.0009308500000000, -0.0009827200000000, -0.0008651500000000 ]  - [  -0.0000165700000000, -0.0076494900000000,  0.0089059300000000 ]  - [  -0.0000724800000000, -0.0004364800000000, -0.0000471000000000 ]  - [   0.0005888400000000,  0.0009589800000000,  0.0015914100000000 ]  - [   0.0005888400000000, -0.0009589800000000, -0.0015914100000000 ]  - [  -0.0000724800000000,  0.0004364800000000,  0.0000471000000000 ]  - [  -0.0000165700000000,  0.0076494900000000, -0.0089059300000000 ]  - [  -0.1723257700000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0018118600000000, -0.0004448400000000,  0.0000675200000000 ]  - [  -0.0018118600000000,  0.0004448400000000, -0.0000675200000000 ]  - [   0.0025241000000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0014622400000000, -0.0006874800000000, -0.0000917700000000 ]  - [   0.0014622400000000,  0.0006874800000000,  0.0000917700000000 ]  - [   0.1136684300000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0006951300000000,  0.0010061800000000, -0.0001616400000000 ]  - [  -0.0006951300000000, -0.0010061800000000,  0.0001616400000000 ]  - [   0.0020135700000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0008232600000000,  0.0005237800000000,  0.0002229700000000 ]  - [   0.0008232600000000, -0.0005237800000000, -0.0002229700000000 ]  - [   0.0049090700000000, -0.0004151900000000, -0.0007759600000000 ]  - [   0.0004859600000000, -0.0000363300000000, -0.0002889200000000 ]  - [   0.0018464000000000,  0.0003283300000000, -0.0000210200000000 ]  - [  -0.0015840800000000,  0.0004227600000000,  0.0009523200000000 ]  - [  -0.0004508000000000,  0.0001269000000000,  0.0002269600000000 ]  - [  -0.0018737600000000,  0.0001934900000000,  0.0000435100000000 ]  - [  -0.0018737600000000, -0.0001934900000000, -0.0000435100000000 ]  - [  -0.0004508000000000, -0.0001269000000000, -0.0002269600000000 ]  - [  -0.0015840800000000, -0.0004227600000000, -0.0009523200000000 ]  - [   0.0018464000000000, -0.0003283300000000,  0.0000210200000000 ]  - [   0.0004859600000000,  0.0000363300000000,  0.0002889200000000 ]  - [   0.0049090700000000,  0.0004151900000000,  0.0007759600000000 ]- atom:   73  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0014558500000000, -0.0001568000000000, -0.0005742900000000 ]  - [   0.0000642100000000, -0.0004590400000000,  0.0000885700000000 ]  - [  -0.0025548100000000, -0.0000624800000000,  0.0005896700000000 ]  - [   0.0013891300000000, -0.0012704000000000, -0.0012708000000000 ]  - [  -0.0001602500000000, -0.0005007500000000, -0.0000942200000000 ]  - [   0.0013944000000000,  0.0007871500000000,  0.0002858000000000 ]  - [   0.0013944000000000, -0.0007871500000000, -0.0002858000000000 ]  - [  -0.0001602500000000,  0.0005007500000000,  0.0000942200000000 ]  - [   0.0013891300000000,  0.0012704000000000,  0.0012708000000000 ]  - [  -0.0025548100000000,  0.0000624800000000, -0.0005896700000000 ]  - [   0.0000642100000000,  0.0004590400000000, -0.0000885700000000 ]  - [  -0.0014558500000000,  0.0001568000000000,  0.0005742900000000 ]  - [  -0.0017685400000000,  0.0013227200000000, -0.0006016800000000 ]  - [  -0.0005522400000000,  0.0004618700000000, -0.0002819900000000 ]  - [  -0.0007281900000000,  0.0000388300000000, -0.0013860500000000 ]  - [   0.0018743000000000,  0.0013583000000000,  0.0008009300000000 ]  - [   0.0006601100000000,  0.0005019700000000,  0.0002677800000000 ]  - [   0.0026029500000000,  0.0006248700000000, -0.0001048300000000 ]  - [   0.0026029500000000, -0.0006248700000000,  0.0001048300000000 ]  - [   0.0006601100000000, -0.0005019700000000, -0.0002677800000000 ]  - [   0.0018743000000000, -0.0013583000000000, -0.0008009300000000 ]  - [  -0.0007281900000000, -0.0000388300000000,  0.0013860500000000 ]  - [  -0.0005522400000000, -0.0004618700000000,  0.0002819900000000 ]  - [  -0.0017685400000000, -0.0013227200000000,  0.0006016800000000 ]  - [   0.0008042900000000, -0.0004172800000000, -0.0001782500000000 ]  - [   0.0001341100000000,  0.0001219000000000,  0.0001454800000000 ]  - [   0.0006837200000000, -0.0012273500000000, -0.0008895100000000 ]  - [  -0.0008472500000000, -0.0011423000000000,  0.0000144500000000 ]  - [  -0.0002393300000000,  0.0000198600000000, -0.0000278300000000 ]  - [  -0.0035849100000000,  0.0062479000000000, -0.0080544500000000 ]  - [  -0.0035849100000000, -0.0062479000000000,  0.0080544500000000 ]  - [  -0.0002393300000000, -0.0000198600000000,  0.0000278300000000 ]  - [  -0.0008472500000000,  0.0011423000000000, -0.0000144500000000 ]  - [   0.0006837200000000,  0.0012273500000000,  0.0008895100000000 ]  - [   0.0001341100000000, -0.0001219000000000, -0.0001454800000000 ]  - [   0.0008042900000000,  0.0004172800000000,  0.0001782500000000 ]  - [   0.0033022800000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0016835400000000, -0.0000263200000000,  0.0000225000000000 ]  - [   0.0016835400000000,  0.0000263200000000, -0.0000225000000000 ]  - [  -0.0442081800000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0020742400000000,  0.0003583400000000, -0.0000117700000000 ]  - [  -0.0020742400000000, -0.0003583400000000,  0.0000117700000000 ]  - [  -0.0003673500000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0001302500000000, -0.0000027500000000,  0.0001024100000000 ]  - [  -0.0001302500000000,  0.0000027500000000, -0.0001024100000000 ]  - [   0.0038271200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0002180700000000, -0.0001707600000000, -0.0002313600000000 ]  - [   0.0002180700000000,  0.0001707600000000,  0.0002313600000000 ]  - [   0.0002305200000000,  0.0003472600000000,  0.0006050000000000 ]  - [  -0.0001125600000000, -0.0002259300000000,  0.0000975400000000 ]  - [   0.0004470800000000,  0.0006725000000000,  0.0008293800000000 ]  - [   0.0001459200000000,  0.0010253400000000,  0.0000579700000000 ]  - [   0.0002600900000000, -0.0003796900000000,  0.0001286900000000 ]  - [   0.0029136200000000, -0.0060624500000000,  0.0073548900000000 ]  - [   0.0029136200000000,  0.0060624500000000, -0.0073548900000000 ]  - [   0.0002600900000000,  0.0003796900000000, -0.0001286900000000 ]  - [   0.0001459200000000, -0.0010253400000000, -0.0000579700000000 ]  - [   0.0004470800000000, -0.0006725000000000, -0.0008293800000000 ]  - [  -0.0001125600000000,  0.0002259300000000, -0.0000975400000000 ]  - [   0.0002305200000000, -0.0003472600000000, -0.0006050000000000 ]  - [  -0.0009370700000000, -0.0003530900000000, -0.0008553400000000 ]  - [  -0.0000988900000000,  0.0004369300000000, -0.0000972200000000 ]  - [  -0.0013787900000000,  0.0029928600000000, -0.0031758500000000 ]  - [  -0.0013787900000000, -0.0029928600000000,  0.0031758500000000 ]  - [  -0.0000988900000000, -0.0004369300000000,  0.0000972200000000 ]  - [  -0.0009370700000000,  0.0003530900000000,  0.0008553400000000 ]  - [   0.0001048300000000,  0.0070390000000000, -0.0089133800000000 ]  - [   0.0000736200000000, -0.0001837800000000,  0.0000489400000000 ]  - [  -0.0005802700000000, -0.0015796800000000, -0.0015912500000000 ]  - [  -0.0005802700000000,  0.0015796800000000,  0.0015912500000000 ]  - [   0.0000736200000000,  0.0001837800000000, -0.0000489400000000 ]  - [   0.0001048300000000, -0.0070390000000000,  0.0089133800000000 ]  - [   0.1615670400000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0011410200000000,  0.0004357000000000, -0.0000682300000000 ]  - [   0.0011410200000000, -0.0004357000000000,  0.0000682300000000 ]  - [  -0.0018373100000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0007884500000000,  0.0006846800000000,  0.0000925100000000 ]  - [  -0.0007884500000000, -0.0006846800000000, -0.0000925100000000 ]  - [  -0.1102705100000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0013495700000000, -0.0010031200000000,  0.0001602700000000 ]  - [   0.0013495700000000,  0.0010031200000000, -0.0001602700000000 ]  - [  -0.0026725700000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0014842500000000, -0.0005191800000000, -0.0002214800000000 ]  - [  -0.0014842500000000,  0.0005191800000000,  0.0002214800000000 ]  - [  -0.0049341600000000,  0.0005703000000000,  0.0005043900000000 ]  - [  -0.0004841200000000,  0.0001773700000000, -0.0000103700000000 ]  - [  -0.0018350200000000, -0.0001921800000000, -0.0002760200000000 ]  - [   0.0015713800000000, -0.0002888300000000, -0.0006573200000000 ]  - [   0.0004487100000000,  0.0000114300000000,  0.0000713200000000 ]  - [   0.0018639900000000, -0.0000520600000000,  0.0002529900000000 ]  - [   0.0018639900000000,  0.0000520600000000, -0.0002529900000000 ]  - [   0.0004487100000000, -0.0000114300000000, -0.0000713200000000 ]  - [   0.0015713800000000,  0.0002888300000000,  0.0006573200000000 ]  - [  -0.0018350200000000,  0.0001921800000000,  0.0002760200000000 ]  - [  -0.0004841200000000, -0.0001773700000000,  0.0000103700000000 ]  - [  -0.0049341600000000, -0.0005703000000000, -0.0005043900000000 ]- atom:   73  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0003640400000000,  0.0004554400000000, -0.0012184700000000 ]  - [   0.0006853400000000, -0.0010399100000000,  0.0002874100000000 ]  - [   0.0022800400000000, -0.0016145900000000,  0.0007485500000000 ]  - [   0.0011807300000000,  0.0004736400000000, -0.0004361700000000 ]  - [  -0.0006277700000000, -0.0010231000000000, -0.0003662100000000 ]  - [  -0.0019711700000000, -0.0015268200000000, -0.0015022600000000 ]  - [   0.0012860400000000, -0.0005672900000000, -0.0011571500000000 ]  - [  -0.0000659800000000, -0.0000546800000000, -0.0000182000000000 ]  - [  -0.0018686200000000,  0.0014344200000000, -0.0000916900000000 ]  - [  -0.0015932900000000, -0.0006551500000000,  0.0004081800000000 ]  - [   0.0000099100000000, -0.0000711200000000, -0.0000600600000000 ]  - [   0.0010495700000000,  0.0014108400000000, -0.0015643800000000 ]  - [  -0.0008537100000000,  0.0005501800000000, -0.0000740400000000 ]  - [  -0.0000419600000000,  0.0000662100000000, -0.0000612000000000 ]  - [  -0.0002726600000000,  0.0007984900000000, -0.0004328500000000 ]  - [   0.0006977800000000,  0.0006173800000000,  0.0002414700000000 ]  - [   0.0000830100000000,  0.0000853500000000,  0.0000124800000000 ]  - [   0.0004274300000000,  0.0007696800000000,  0.0002596400000000 ]  - [   0.0002773800000000, -0.0001930700000000, -0.0000820900000000 ]  - [   0.0006145500000000, -0.0008825400000000, -0.0003361900000000 ]  - [   0.0000078400000000, -0.0003573000000000, -0.0001104400000000 ]  - [  -0.0004235500000000, -0.0001632000000000, -0.0000788400000000 ]  - [  -0.0006556700000000, -0.0009020200000000,  0.0002875500000000 ]  - [   0.0001465000000000, -0.0004239000000000,  0.0002751900000000 ]  - [   0.0004121100000000, -0.0008034000000000, -0.0002556000000000 ]  - [   0.0002860000000000, -0.0007777300000000, -0.0001503400000000 ]  - [  -0.0004529300000000,  0.0033714000000000,  0.0013016500000000 ]  - [   0.0001317000000000, -0.0017841300000000, -0.0006792900000000 ]  - [  -0.0004414200000000, -0.0010629100000000,  0.0004601500000000 ]  - [  -0.0046192300000000,  0.0007493700000000,  0.0058763400000000 ]  - [   0.0043064300000000,  0.0010685000000000,  0.0060197100000000 ]  - [   0.0001292700000000, -0.0008153500000000,  0.0006413500000000 ]  - [  -0.0004428200000000, -0.0015233800000000, -0.0004986100000000 ]  - [   0.0007622500000000,  0.0036479800000000,  0.0011170200000000 ]  - [   0.0000282200000000, -0.0005286000000000, -0.0003285500000000 ]  - [  -0.0000980500000000, -0.0005464600000000, -0.0004353000000000 ]  - [   0.0000114800000000,  0.0003304100000000,  0.0000511500000000 ]  - [   0.0008992400000000, -0.0001731200000000,  0.0000915600000000 ]  - [  -0.0008843900000000, -0.0001728400000000,  0.0000912900000000 ]  - [  -0.0000892100000000,  0.0258442600000000, -0.0024743000000000 ]  - [  -0.0014425600000000, -0.0008040800000000, -0.0000832800000000 ]  - [   0.0014205100000000, -0.0007994000000000, -0.0000829900000000 ]  - [  -0.0000016500000000,  0.0009812600000000, -0.0008790000000000 ]  - [  -0.0000574200000000, -0.0006292700000000,  0.0010762200000000 ]  - [   0.0000566600000000, -0.0006298200000000,  0.0010766300000000 ]  - [   0.0000084600000000,  0.0010154900000000,  0.0006354000000000 ]  - [   0.0001002900000000, -0.0006497800000000, -0.0010390700000000 ]  - [  -0.0000983500000000, -0.0006503400000000, -0.0010390400000000 ]  - [  -0.0001063500000000, -0.0001846600000000,  0.0000894200000000 ]  - [  -0.0002450500000000, -0.0004393100000000, -0.0000722700000000 ]  - [  -0.0001039900000000,  0.0003006900000000,  0.0003982900000000 ]  - [  -0.0001657900000000, -0.0001409700000000, -0.0003241300000000 ]  - [   0.0003445400000000, -0.0006190200000000,  0.0002464800000000 ]  - [   0.0004976600000000,  0.0005366400000000, -0.0005440900000000 ]  - [  -0.0001657500000000,  0.0008375100000000, -0.0004239800000000 ]  - [  -0.0000304300000000, -0.0003667400000000,  0.0004235000000000 ]  - [   0.0004775800000000,  0.0001028800000000, -0.0001469800000000 ]  - [  -0.0002057700000000,  0.0005477200000000,  0.0002159300000000 ]  - [  -0.0000693100000000, -0.0001860900000000, -0.0002482700000000 ]  - [  -0.0002054800000000,  0.0000651000000000, -0.0000895400000000 ]  - [   0.0000747000000000,  0.0000958900000000,  0.0000972100000000 ]  - [  -0.0000227700000000,  0.0009180700000000, -0.0000503700000000 ]  - [  -0.0000873700000000, -0.0002369100000000,  0.0001179200000000 ]  - [   0.0000787700000000, -0.0008773700000000,  0.0001421300000000 ]  - [   0.0000238600000000,  0.0002977700000000, -0.0000511500000000 ]  - [  -0.0000783000000000, -0.0005157800000000,  0.0001034000000000 ]  - [  -0.0061484000000000,  0.0048906900000000, -0.0117669300000000 ]  - [  -0.0000402400000000,  0.0006168000000000, -0.0000936900000000 ]  - [   0.0012596900000000,  0.0013203600000000,  0.0025498100000000 ]  - [  -0.0012765200000000,  0.0019634200000000,  0.0025831400000000 ]  - [   0.0000395500000000,  0.0012343500000000, -0.0000924300000000 ]  - [   0.0060463200000000,  0.0054600500000000, -0.0115623500000000 ]  - [   0.0002463900000000, -0.0310496900000000,  0.0134773100000000 ]  - [   0.0001106200000000,  0.0020850800000000, -0.0000723600000000 ]  - [  -0.0007718600000000,  0.0020676900000000, -0.0000726500000000 ]  - [   0.0003282000000000, -0.0028784600000000, -0.0022769000000000 ]  - [  -0.0003544200000000,  0.0011750300000000,  0.0001361600000000 ]  - [   0.0010171200000000,  0.0011698700000000,  0.0001358700000000 ]  - [  -0.0000489100000000, -0.0128980500000000,  0.0010245800000000 ]  - [   0.0013453900000000,  0.0006245300000000, -0.0000240400000000 ]  - [  -0.0006628500000000,  0.0006292700000000, -0.0000259100000000 ]  - [  -0.0003446000000000, -0.0006236200000000, -0.0002972600000000 ]  - [  -0.0008597300000000,  0.0002852800000000,  0.0000232400000000 ]  - [   0.0001822200000000,  0.0002899000000000,  0.0000256600000000 ]  - [  -0.0004631400000000, -0.0012959100000000, -0.0004503500000000 ]  - [  -0.0001168400000000,  0.0009310300000000,  0.0005468000000000 ]  - [   0.0011710000000000,  0.0010767700000000,  0.0007000100000000 ]  - [   0.0002557300000000, -0.0015293300000000,  0.0010246000000000 ]  - [   0.0000948600000000,  0.0009785400000000, -0.0004799000000000 ]  - [  -0.0011361800000000,  0.0010798400000000, -0.0008370800000000 ]  - [   0.0011493900000000,  0.0009396500000000, -0.0011355700000000 ]  - [  -0.0000904100000000,  0.0008406800000000, -0.0007744800000000 ]  - [  -0.0002473400000000, -0.0016632300000000,  0.0007369400000000 ]  - [  -0.0011837800000000,  0.0009378600000000,  0.0009989500000000 ]  - [   0.0001126600000000,  0.0007936600000000,  0.0008434200000000 ]  - [   0.0004430900000000, -0.0014324700000000, -0.0001514000000000 ]- atom:   73  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000954300000000, -0.0014665900000000, -0.0016328800000000 ]  - [   0.0001564600000000, -0.0003616500000000,  0.0000584300000000 ]  - [  -0.0023002000000000,  0.0007850200000000, -0.0003570400000000 ]  - [   0.0010185200000000, -0.0008333800000000,  0.0000361500000000 ]  - [  -0.0001390700000000, -0.0003530500000000, -0.0000632100000000 ]  - [   0.0014861300000000,  0.0003339600000000,  0.0026211100000000 ]  - [  -0.0021671200000000,  0.0013029900000000,  0.0029297900000000 ]  - [  -0.0005544000000000,  0.0006137800000000,  0.0002831500000000 ]  - [  -0.0017043600000000,  0.0001279200000000,  0.0003743000000000 ]  - [   0.0029695200000000,  0.0017427500000000, -0.0007024300000000 ]  - [   0.0005359400000000,  0.0006056300000000, -0.0002893900000000 ]  - [   0.0005916300000000, -0.0004947200000000, -0.0019769700000000 ]  - [   0.0000638900000000,  0.0005849600000000, -0.0002831000000000 ]  - [  -0.0004211200000000,  0.0006046800000000, -0.0002265200000000 ]  - [   0.0003246500000000,  0.0000585900000000, -0.0001871500000000 ]  - [   0.0000560400000000,  0.0004758900000000,  0.0002257100000000 ]  - [   0.0004347900000000,  0.0006136400000000,  0.0002271500000000 ]  - [   0.0001512200000000,  0.0003545100000000,  0.0001511300000000 ]  - [   0.0005520500000000, -0.0006066500000000, -0.0001890800000000 ]  - [   0.0002604700000000, -0.0003525500000000, -0.0001202900000000 ]  - [   0.0006488500000000, -0.0004973900000000, -0.0001249400000000 ]  - [  -0.0010290500000000, -0.0009096800000000,  0.0001727900000000 ]  - [  -0.0002754200000000, -0.0003619600000000,  0.0001221600000000 ]  - [  -0.0007714100000000, -0.0003865200000000,  0.0000681600000000 ]  - [   0.0004520700000000, -0.0004792700000000, -0.0012995200000000 ]  - [   0.0002285500000000,  0.0002388000000000, -0.0000800200000000 ]  - [   0.0012405900000000, -0.0026543500000000, -0.0022939600000000 ]  - [  -0.0002937300000000, -0.0012091200000000,  0.0008898500000000 ]  - [  -0.0002373700000000,  0.0001780900000000,  0.0001110600000000 ]  - [   0.0052027700000000,  0.0055538700000000, -0.0017350000000000 ]  - [  -0.0055087400000000,  0.0058600800000000, -0.0016684900000000 ]  - [  -0.0000797200000000,  0.0004293500000000,  0.0002841200000000 ]  - [  -0.0000264800000000, -0.0009577500000000,  0.0010581500000000 ]  - [  -0.0009199200000000, -0.0023934200000000, -0.0024590100000000 ]  - [   0.0000847000000000,  0.0004860300000000, -0.0002582300000000 ]  - [  -0.0001395200000000, -0.0002308900000000, -0.0014735400000000 ]  - [   0.0000145500000000, -0.0001495000000000, -0.0002665600000000 ]  - [  -0.0003297500000000,  0.0001052500000000, -0.0001675200000000 ]  - [   0.0003459600000000,  0.0001062100000000, -0.0001683500000000 ]  - [  -0.0000469400000000, -0.0025480700000000,  0.0261724100000000 ]  - [   0.0002340500000000,  0.0000842700000000,  0.0002532100000000 ]  - [  -0.0002460400000000,  0.0000798200000000,  0.0002536800000000 ]  - [  -0.0000003200000000,  0.0019403900000000, -0.0047268700000000 ]  - [  -0.0000335800000000,  0.0005770500000000, -0.0015907000000000 ]  - [   0.0000317800000000,  0.0005798700000000, -0.0015951400000000 ]  - [   0.0000079400000000,  0.0004137600000000,  0.0021093600000000 ]  - [   0.0000636700000000,  0.0005695100000000,  0.0014859200000000 ]  - [  -0.0000637300000000,  0.0005711000000000,  0.0014914700000000 ]  - [  -0.0002059100000000, -0.0002875700000000, -0.0002072600000000 ]  - [  -0.0001588200000000, -0.0000072400000000,  0.0000453800000000 ]  - [  -0.0002258300000000, -0.0003386500000000, -0.0002873100000000 ]  - [   0.0001497900000000, -0.0003233900000000,  0.0001934000000000 ]  - [   0.0001615200000000, -0.0000163900000000, -0.0000319500000000 ]  - [  -0.0002203000000000, -0.0005691800000000,  0.0006301700000000 ]  - [   0.0005547500000000, -0.0002667000000000,  0.0007396200000000 ]  - [   0.0001542000000000,  0.0002388500000000,  0.0001406700000000 ]  - [   0.0001660900000000, -0.0000781700000000,  0.0003651200000000 ]  - [  -0.0000858300000000, -0.0000930100000000, -0.0004708800000000 ]  - [  -0.0001563900000000,  0.0002461000000000, -0.0001304400000000 ]  - [  -0.0001070100000000, -0.0000372400000000, -0.0003859900000000 ]  - [   0.0001245000000000,  0.0006116400000000, -0.0000219700000000 ]  - [   0.0000028400000000,  0.0001311200000000, -0.0000081200000000 ]  - [   0.0000995600000000,  0.0006373700000000, -0.0002294100000000 ]  - [  -0.0001091400000000, -0.0000014900000000, -0.0002008400000000 ]  - [  -0.0000039500000000, -0.0004875800000000, -0.0000065800000000 ]  - [  -0.0001270700000000, -0.0000015400000000, -0.0000108900000000 ]  - [   0.0073411100000000, -0.0112125700000000,  0.0104971600000000 ]  - [   0.0000058500000000, -0.0005855600000000, -0.0000053400000000 ]  - [   0.0012038600000000,  0.0019339600000000,  0.0023904300000000 ]  - [  -0.0012208500000000,  0.0025821800000000,  0.0024178800000000 ]  - [  -0.0000053000000000,  0.0000312400000000, -0.0000077300000000 ]  - [  -0.0075129500000000, -0.0108601000000000,  0.0106798400000000 ]  - [   0.0003111500000000,  0.0134787300000000, -0.0398304200000000 ]  - [  -0.0004016100000000, -0.0000742300000000, -0.0009699000000000 ]  - [  -0.0002658800000000, -0.0000706000000000, -0.0009714400000000 ]  - [   0.0003263800000000,  0.0022768300000000,  0.0032166800000000 ]  - [   0.0004293200000000, -0.0001320400000000,  0.0012505900000000 ]  - [   0.0002413000000000, -0.0001400600000000,  0.0012531400000000 ]  - [  -0.0000742300000000,  0.0010241100000000, -0.0125685600000000 ]  - [   0.0001783700000000, -0.0000285200000000, -0.0003080800000000 ]  - [   0.0004983800000000, -0.0000203100000000, -0.0003096400000000 ]  - [  -0.0003500500000000,  0.0002968400000000,  0.0005211800000000 ]  - [  -0.0001192400000000, -0.0000255200000000,  0.0002563700000000 ]  - [  -0.0005633200000000, -0.0000222700000000,  0.0002584800000000 ]  - [  -0.0009993100000000,  0.0001502600000000, -0.0013323600000000 ]  - [  -0.0001153900000000, -0.0003077300000000, -0.0010444400000000 ]  - [  -0.0012867400000000, -0.0011167900000000, -0.0015266500000000 ]  - [   0.0012081300000000, -0.0001725000000000,  0.0046444400000000 ]  - [   0.0001067700000000, -0.0002755400000000,  0.0010991500000000 ]  - [   0.0012964400000000, -0.0011312400000000,  0.0014967400000000 ]  - [  -0.0012786700000000, -0.0012642400000000,  0.0011956300000000 ]  - [  -0.0001039200000000, -0.0004165400000000,  0.0008101200000000 ]  - [  -0.0011829500000000, -0.0003214500000000,  0.0043241700000000 ]  - [   0.0012668800000000, -0.0012494200000000, -0.0012207300000000 ]  - [   0.0001115000000000, -0.0004472900000000, -0.0007515600000000 ]  - [   0.0009777600000000,  0.0000121700000000, -0.0010312700000000 ]- atom:   85  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0019337400000000,  0.0018668800000000, -0.0007632000000000 ]  - [   0.0000084500000000, -0.0006745600000000,  0.0000286100000000 ]  - [  -0.0007477900000000, -0.0001289200000000, -0.0001841800000000 ]  - [  -0.0015425000000000, -0.0062640300000000, -0.0058072800000000 ]  - [  -0.0000082500000000, -0.0006452300000000, -0.0000364200000000 ]  - [   0.0004341300000000,  0.0005732200000000,  0.0000089500000000 ]  - [   0.0001546600000000,  0.0000383000000000,  0.0003996100000000 ]  - [  -0.0001849600000000,  0.0004226200000000,  0.0001188600000000 ]  - [   0.0003592600000000,  0.0002743800000000,  0.0003159600000000 ]  - [  -0.0001800600000000,  0.0002185400000000, -0.0001693700000000 ]  - [   0.0001881500000000,  0.0004228100000000, -0.0001184500000000 ]  - [   0.0001244700000000,  0.0005135300000000, -0.0000924200000000 ]  - [  -0.0008783800000000,  0.0007507600000000, -0.0001820800000000 ]  - [  -0.0005073600000000,  0.0005412400000000, -0.0002294200000000 ]  - [  -0.0005782500000000,  0.0004629100000000, -0.0002581000000000 ]  - [   0.0008432900000000,  0.0009333400000000, -0.0000531100000000 ]  - [   0.0005062100000000,  0.0005391500000000,  0.0002275100000000 ]  - [   0.0009797500000000,  0.0006481300000000,  0.0000102100000000 ]  - [  -0.0009986000000000,  0.0053648400000000,  0.0054671300000000 ]  - [   0.0006854500000000, -0.0003277800000000, -0.0003099500000000 ]  - [   0.0011189300000000, -0.0015423600000000, -0.0003509000000000 ]  - [  -0.0026183500000000, -0.0028212400000000,  0.0011040600000000 ]  - [  -0.0006902100000000, -0.0003019400000000,  0.0003210000000000 ]  - [  -0.0014395500000000, -0.0008433800000000,  0.0005328200000000 ]  - [   0.0029173200000000, -0.0011120800000000, -0.0017277400000000 ]  - [   0.0002230100000000, -0.0001227400000000, -0.0000044800000000 ]  - [   0.0001493800000000,  0.0002519400000000, -0.0012673700000000 ]  - [  -0.0007994000000000, -0.0015536000000000,  0.0024635000000000 ]  - [  -0.0002195300000000, -0.0001167300000000, -0.0000058800000000 ]  - [  -0.0017262600000000,  0.0007723600000000,  0.0001570000000000 ]  - [  -0.0005810300000000,  0.0000167300000000,  0.0009494300000000 ]  - [  -0.0000467700000000, -0.0001012200000000,  0.0003479300000000 ]  - [  -0.0002388300000000,  0.0002658900000000,  0.0001906400000000 ]  - [   0.0002506700000000,  0.0002466900000000, -0.0002732900000000 ]  - [   0.0000551100000000, -0.0000792100000000, -0.0003249000000000 ]  - [   0.0002176200000000,  0.0001991000000000, -0.0001201500000000 ]  - [   0.0030334700000000,  0.0000031500000000, -0.0000060600000000 ]  - [   0.0025098300000000, -0.0000009400000000, -0.0000007000000000 ]  - [   0.0007220400000000, -0.0000019800000000, -0.0000005100000000 ]  - [  -0.0058150400000000, -0.0000002100000000, -0.0000008300000000 ]  - [  -0.0026499100000000, -0.0000017900000000,  0.0000014000000000 ]  - [  -0.0007915400000000, -0.0000008200000000,  0.0000007300000000 ]  - [  -0.0001694500000000,  0.0000068300000000, -0.0000159500000000 ]  - [  -0.0004169300000000, -0.0000006700000000, -0.0000068700000000 ]  - [  -0.0000195400000000, -0.0000007600000000, -0.0000024600000000 ]  - [   0.0271651300000000,  0.0000122000000000, -0.0000017200000000 ]  - [   0.0005551700000000,  0.0000038400000000,  0.0000070300000000 ]  - [   0.0000748500000000, -0.0000048700000000,  0.0000006100000000 ]  - [   0.0025675300000000,  0.0008598600000000,  0.0018926800000000 ]  - [  -0.0000941600000000, -0.0001347300000000,  0.0001772000000000 ]  - [  -0.0001732000000000, -0.0005040000000000,  0.0014373900000000 ]  - [  -0.0004843900000000,  0.0012910400000000, -0.0026179700000000 ]  - [   0.0000958800000000, -0.0001401900000000, -0.0001664000000000 ]  - [  -0.0014093200000000, -0.0010123200000000, -0.0003319400000000 ]  - [  -0.0002748000000000,  0.0002354900000000, -0.0007608900000000 ]  - [   0.0002631100000000,  0.0003460600000000, -0.0001633800000000 ]  - [   0.0000724000000000, -0.0000201500000000, -0.0000037100000000 ]  - [  -0.0000711600000000,  0.0000134100000000,  0.0000893800000000 ]  - [  -0.0002561400000000,  0.0003239900000000,  0.0001402100000000 ]  - [  -0.0000944500000000,  0.0000450500000000, -0.0000645400000000 ]  - [   0.0103274800000000, -0.0097454700000000, -0.0072144100000000 ]  - [   0.0000038500000000,  0.0002621800000000, -0.0000086900000000 ]  - [   0.0017983100000000,  0.0020054500000000, -0.0009291100000000 ]  - [   0.0001150900000000, -0.0005613600000000,  0.0002014100000000 ]  - [  -0.0000042600000000, -0.0005273100000000,  0.0000092200000000 ]  - [  -0.0002885800000000, -0.0004157700000000,  0.0000143600000000 ]  - [   0.0001059200000000, -0.0000647500000000, -0.0002006600000000 ]  - [  -0.0000066200000000, -0.0000854500000000, -0.0000081500000000 ]  - [  -0.0003217300000000, -0.0001853800000000, -0.0000036000000000 ]  - [   0.0105138800000000,  0.0106029600000000,  0.0073811100000000 ]  - [   0.0000013100000000,  0.0003627300000000,  0.0000081800000000 ]  - [   0.0018169500000000, -0.0014122300000000,  0.0009410100000000 ]  - [   0.0045943600000000, -0.0004596500000000, -0.0009977200000000 ]  - [   0.0015049500000000,  0.0011827400000000, -0.0012844600000000 ]  - [   0.0001489300000000, -0.0001126000000000, -0.0001173500000000 ]  - [  -0.0012438500000000, -0.0002570800000000,  0.0012048500000000 ]  - [  -0.0015322500000000,  0.0011481300000000,  0.0012960500000000 ]  - [  -0.0001139100000000, -0.0000897600000000,  0.0001094900000000 ]  - [   0.0052495700000000,  0.0004470700000000,  0.0009803000000000 ]  - [   0.0021764800000000, -0.0011717100000000,  0.0012692200000000 ]  - [   0.0008217000000000,  0.0001182100000000,  0.0001094500000000 ]  - [  -0.0019114800000000,  0.0002464700000000, -0.0011870600000000 ]  - [  -0.0022032200000000, -0.0011370300000000, -0.0012793500000000 ]  - [  -0.0007842500000000,  0.0000967400000000, -0.0001010400000000 ]  - [  -0.0395498600000000, -0.0003484300000000, -0.0007207900000000 ]  - [  -0.0009902300000000,  0.0000682600000000, -0.0001526700000000 ]  - [  -0.0009906000000000,  0.0000720000000000, -0.0001523700000000 ]  - [   0.0031240300000000,  0.0000566500000000,  0.0001607700000000 ]  - [   0.0011784400000000,  0.0000750100000000,  0.0001514100000000 ]  - [   0.0011786600000000,  0.0000679600000000,  0.0001502000000000 ]  - [   0.0007433400000000, -0.0000721500000000, -0.0001430500000000 ]  - [   0.0002044900000000, -0.0000666500000000, -0.0001447900000000 ]  - [   0.0004179400000000, -0.0000787400000000, -0.0001378800000000 ]  - [  -0.0009946300000000, -0.0000761900000000,  0.0001475600000000 ]  - [  -0.0002250200000000, -0.0000629800000000,  0.0001494600000000 ]  - [  -0.0125006200000000,  0.0001123200000000,  0.0005318800000000 ]- atom:   85  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0002204300000000,  0.0025493300000000, -0.0001727900000000 ]  - [   0.0006445600000000, -0.0011121600000000,  0.0003057500000000 ]  - [   0.0009089400000000, -0.0010391900000000,  0.0004378000000000 ]  - [  -0.0064268300000000,  0.0009518000000000, -0.0032453400000000 ]  - [  -0.0009627000000000, -0.0014132500000000, -0.0004649000000000 ]  - [   0.0002931200000000, -0.0019497900000000,  0.0001920800000000 ]  - [  -0.0009790600000000,  0.0011021200000000,  0.0009738500000000 ]  - [   0.0000863100000000, -0.0001741500000000, -0.0000109700000000 ]  - [   0.0032209500000000, -0.0017731200000000, -0.0012123800000000 ]  - [   0.0005776300000000,  0.0006565900000000, -0.0004618500000000 ]  - [   0.0000781600000000,  0.0000249600000000, -0.0000572300000000 ]  - [   0.0009179500000000,  0.0011611500000000, -0.0004331000000000 ]  - [  -0.0005776300000000,  0.0006565900000000, -0.0004618500000000 ]  - [  -0.0000781600000000,  0.0000249600000000, -0.0000572300000000 ]  - [  -0.0009179500000000,  0.0011611500000000, -0.0004331000000000 ]  - [   0.0009790600000000,  0.0011021200000000,  0.0009738500000000 ]  - [  -0.0000863100000000, -0.0001741500000000, -0.0000109700000000 ]  - [  -0.0032209500000000, -0.0017731200000000, -0.0012123800000000 ]  - [   0.0064268300000000,  0.0009518000000000, -0.0032453400000000 ]  - [   0.0009627000000000, -0.0014132500000000, -0.0004649000000000 ]  - [  -0.0002931200000000, -0.0019497900000000,  0.0001920800000000 ]  - [   0.0002204300000000,  0.0025493300000000, -0.0001727900000000 ]  - [  -0.0006445600000000, -0.0011121600000000,  0.0003057500000000 ]  - [  -0.0009089400000000, -0.0010391900000000,  0.0004378000000000 ]  - [   0.0010681600000000, -0.0011962800000000, -0.0014276300000000 ]  - [   0.0004170700000000, -0.0007809600000000, -0.0003031800000000 ]  - [   0.0006095200000000,  0.0006523000000000,  0.0013342900000000 ]  - [  -0.0006498400000000, -0.0011785800000000,  0.0016501300000000 ]  - [  -0.0002937500000000, -0.0007670700000000,  0.0003378400000000 ]  - [   0.0012764700000000,  0.0005856800000000, -0.0004301500000000 ]  - [  -0.0001800100000000,  0.0010531300000000,  0.0000339600000000 ]  - [   0.0000251700000000, -0.0004051400000000,  0.0006336000000000 ]  - [   0.0001056000000000, -0.0004016400000000,  0.0005449600000000 ]  - [   0.0007441500000000,  0.0010420200000000, -0.0002121800000000 ]  - [  -0.0001367500000000, -0.0003947100000000, -0.0005639000000000 ]  - [  -0.0000538400000000, -0.0004044900000000, -0.0005377500000000 ]  - [   0.0000000000000000,  0.0008813400000000, -0.0005889300000000 ]  - [   0.0000000000000000, -0.0001939500000000, -0.0002125000000000 ]  - [   0.0000000000000000, -0.0003511200000000,  0.0000534300000000 ]  - [   0.0000000000000000,  0.0002779800000000,  0.0001989200000000 ]  - [   0.0000000000000000, -0.0001134100000000,  0.0001620100000000 ]  - [   0.0000000000000000, -0.0002177900000000, -0.0000172800000000 ]  - [   0.0000000000000000,  0.0012581600000000, -0.0022431600000000 ]  - [   0.0000000000000000, -0.0000676300000000, -0.0008025100000000 ]  - [   0.0000000000000000, -0.0005567700000000,  0.0006931400000000 ]  - [   0.0000000000000000,  0.0246964200000000,  0.0024338000000000 ]  - [   0.0000000000000000, -0.0013400500000000,  0.0008605000000000 ]  - [   0.0000000000000000, -0.0014358800000000, -0.0015204900000000 ]  - [  -0.0010681600000000, -0.0011962800000000, -0.0014276300000000 ]  - [  -0.0004170700000000, -0.0007809600000000, -0.0003031800000000 ]  - [  -0.0006095200000000,  0.0006523000000000,  0.0013342900000000 ]  - [   0.0006498400000000, -0.0011785800000000,  0.0016501300000000 ]  - [   0.0002937500000000, -0.0007670700000000,  0.0003378400000000 ]  - [  -0.0012764700000000,  0.0005856800000000, -0.0004301500000000 ]  - [   0.0001800100000000,  0.0010531300000000,  0.0000339600000000 ]  - [  -0.0000251700000000, -0.0004051400000000,  0.0006336000000000 ]  - [  -0.0001056000000000, -0.0004016400000000,  0.0005449600000000 ]  - [  -0.0007441500000000,  0.0010420200000000, -0.0002121800000000 ]  - [   0.0001367500000000, -0.0003947100000000, -0.0005639000000000 ]  - [   0.0000538400000000, -0.0004044900000000, -0.0005377500000000 ]  - [  -0.0109118300000000,  0.0043089200000000,  0.0051316500000000 ]  - [  -0.0000780100000000,  0.0012946100000000,  0.0000531200000000 ]  - [   0.0021170400000000,  0.0014554800000000, -0.0009965500000000 ]  - [   0.0001369900000000, -0.0012681900000000, -0.0000352300000000 ]  - [   0.0000223900000000,  0.0005074900000000,  0.0000056800000000 ]  - [   0.0016389200000000,  0.0007504900000000,  0.0006451000000000 ]  - [  -0.0001369900000000, -0.0012681900000000, -0.0000352300000000 ]  - [  -0.0000223900000000,  0.0005074900000000,  0.0000056800000000 ]  - [  -0.0016389200000000,  0.0007504900000000,  0.0006451000000000 ]  - [   0.0109118300000000,  0.0043089200000000,  0.0051316500000000 ]  - [   0.0000780100000000,  0.0012946100000000,  0.0000531200000000 ]  - [  -0.0021170400000000,  0.0014554800000000, -0.0009965500000000 ]  - [  -0.0008313000000000, -0.0013677100000000,  0.0000796500000000 ]  - [  -0.0000708400000000,  0.0010072900000000, -0.0011863100000000 ]  - [  -0.0004406300000000,  0.0008640800000000, -0.0003813300000000 ]  - [  -0.0000230300000000, -0.0016011500000000,  0.0002471200000000 ]  - [   0.0002092300000000,  0.0010095800000000,  0.0012013500000000 ]  - [   0.0002760700000000,  0.0009113800000000,  0.0003505400000000 ]  - [   0.0008313000000000, -0.0013677100000000,  0.0000796500000000 ]  - [   0.0000708400000000,  0.0010072900000000, -0.0011863100000000 ]  - [   0.0004406300000000,  0.0008640800000000, -0.0003813300000000 ]  - [   0.0000230300000000, -0.0016011500000000,  0.0002471200000000 ]  - [  -0.0002092300000000,  0.0010095800000000,  0.0012013500000000 ]  - [  -0.0002760700000000,  0.0009113800000000,  0.0003505400000000 ]  - [   0.0000000000000000, -0.0487333600000000, -0.0542953400000000 ]  - [   0.0000000000000000,  0.0022529700000000, -0.0002272100000000 ]  - [   0.0000000000000000,  0.0022372000000000,  0.0003358400000000 ]  - [   0.0000000000000000, -0.0026742500000000,  0.0020526400000000 ]  - [   0.0000000000000000,  0.0011051600000000,  0.0005855400000000 ]  - [   0.0000000000000000,  0.0011020000000000, -0.0005676500000000 ]  - [   0.0000000000000000, -0.0002874500000000,  0.0004441500000000 ]  - [   0.0000000000000000,  0.0008206500000000, -0.0005761400000000 ]  - [   0.0000000000000000, -0.0014179700000000,  0.0013458100000000 ]  - [   0.0000000000000000,  0.0007057600000000, -0.0015675900000000 ]  - [   0.0000000000000000,  0.0014782700000000,  0.0011334100000000 ]  - [   0.0000000000000000,  0.0112520300000000,  0.0482682700000000 ]- atom:   85  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0009286600000000, -0.0034998300000000,  0.0005259600000000 ]  - [   0.0000556500000000,  0.0001355600000000,  0.0000442400000000 ]  - [  -0.0002081800000000,  0.0000682900000000, -0.0000872300000000 ]  - [   0.0057104600000000, -0.0018642400000000,  0.0029327100000000 ]  - [   0.0002588800000000,  0.0004345200000000,  0.0001132200000000 ]  - [  -0.0009975100000000,  0.0009843900000000, -0.0005429600000000 ]  - [   0.0002757900000000, -0.0001266200000000, -0.0006207400000000 ]  - [  -0.0007856700000000,  0.0011403400000000,  0.0003610700000000 ]  - [  -0.0038797100000000,  0.0027159900000000,  0.0015482500000000 ]  - [   0.0001245300000000,  0.0003134500000000,  0.0001101800000000 ]  - [   0.0006215300000000,  0.0009419500000000, -0.0002928700000000 ]  - [  -0.0002158000000000, -0.0001890900000000,  0.0000812400000000 ]  - [  -0.0001245300000000,  0.0003134500000000,  0.0001101800000000 ]  - [  -0.0006215300000000,  0.0009419500000000, -0.0002928700000000 ]  - [   0.0002158000000000, -0.0001890900000000,  0.0000812400000000 ]  - [  -0.0002757900000000, -0.0001266200000000, -0.0006207400000000 ]  - [   0.0007856700000000,  0.0011403400000000,  0.0003610700000000 ]  - [   0.0038797100000000,  0.0027159900000000,  0.0015482500000000 ]  - [  -0.0057104600000000, -0.0018642400000000,  0.0029327100000000 ]  - [  -0.0002588800000000,  0.0004345200000000,  0.0001132200000000 ]  - [   0.0009975100000000,  0.0009843900000000, -0.0005429600000000 ]  - [  -0.0009286600000000, -0.0034998300000000,  0.0005259600000000 ]  - [  -0.0000556500000000,  0.0001355600000000,  0.0000442400000000 ]  - [   0.0002081800000000,  0.0000682900000000, -0.0000872300000000 ]  - [  -0.0007617900000000,  0.0009347500000000,  0.0015995300000000 ]  - [  -0.0001031200000000,  0.0005266200000000,  0.0004795400000000 ]  - [  -0.0002914600000000, -0.0009132700000000, -0.0011588100000000 ]  - [   0.0003339200000000,  0.0009206100000000, -0.0018243000000000 ]  - [  -0.0000205900000000,  0.0005128600000000, -0.0005145700000000 ]  - [  -0.0015913300000000, -0.0008452900000000,  0.0002569500000000 ]  - [  -0.0001279100000000, -0.0008018200000000,  0.0001435500000000 ]  - [  -0.0003368600000000,  0.0006483300000000, -0.0004500700000000 ]  - [  -0.0004173700000000,  0.0006438100000000, -0.0003590900000000 ]  - [  -0.0004277800000000, -0.0007910400000000,  0.0000293700000000 ]  - [   0.0004474900000000,  0.0006377800000000,  0.0003806300000000 ]  - [   0.0003645500000000,  0.0006462900000000,  0.0003528800000000 ]  - [   0.0000000000000000, -0.0008802900000000,  0.0005884800000000 ]  - [   0.0000000000000000,  0.0001897900000000,  0.0002102600000000 ]  - [   0.0000000000000000,  0.0003467600000000, -0.0000550700000000 ]  - [   0.0000000000000000, -0.0002787700000000, -0.0001965700000000 ]  - [   0.0000000000000000,  0.0001099900000000, -0.0001606500000000 ]  - [   0.0000000000000000,  0.0002138100000000,  0.0000180900000000 ]  - [   0.0000000000000000, -0.0012543800000000,  0.0022257400000000 ]  - [   0.0000000000000000,  0.0000652000000000,  0.0007942200000000 ]  - [   0.0000000000000000,  0.0005545200000000, -0.0006976100000000 ]  - [   0.0000000000000000, -0.0247725700000000, -0.0034459000000000 ]  - [   0.0000000000000000,  0.0013285000000000, -0.0008464800000000 ]  - [   0.0000000000000000,  0.0014335300000000,  0.0015332100000000 ]  - [   0.0007617900000000,  0.0009347500000000,  0.0015995300000000 ]  - [   0.0001031200000000,  0.0005266200000000,  0.0004795400000000 ]  - [   0.0002914600000000, -0.0009132700000000, -0.0011588100000000 ]  - [  -0.0003339200000000,  0.0009206100000000, -0.0018243000000000 ]  - [   0.0000205900000000,  0.0005128600000000, -0.0005145700000000 ]  - [   0.0015913300000000, -0.0008452900000000,  0.0002569500000000 ]  - [   0.0001279100000000, -0.0008018200000000,  0.0001435500000000 ]  - [   0.0003368600000000,  0.0006483300000000, -0.0004500700000000 ]  - [   0.0004173700000000,  0.0006438100000000, -0.0003590900000000 ]  - [   0.0004277800000000, -0.0007910400000000,  0.0000293700000000 ]  - [  -0.0004474900000000,  0.0006377800000000,  0.0003806300000000 ]  - [  -0.0003645500000000,  0.0006462900000000,  0.0003528800000000 ]  - [   0.0107238900000000, -0.0036697000000000, -0.0050606300000000 ]  - [   0.0000765900000000, -0.0006746500000000, -0.0000521900000000 ]  - [  -0.0021402100000000, -0.0008590500000000,  0.0010066500000000 ]  - [  -0.0001344700000000,  0.0006401500000000,  0.0000360200000000 ]  - [  -0.0000220100000000, -0.0011254100000000, -0.0000056800000000 ]  - [  -0.0016224900000000, -0.0013606400000000, -0.0006386600000000 ]  - [   0.0001344700000000,  0.0006401500000000,  0.0000360200000000 ]  - [   0.0000220100000000, -0.0011254100000000, -0.0000056800000000 ]  - [   0.0016224900000000, -0.0013606400000000, -0.0006386600000000 ]  - [  -0.0107238900000000, -0.0036697000000000, -0.0050606300000000 ]  - [  -0.0000765900000000, -0.0006746500000000, -0.0000521900000000 ]  - [   0.0021402100000000, -0.0008590500000000,  0.0010066500000000 ]  - [   0.0001542900000000,  0.0013642300000000, -0.0000847200000000 ]  - [  -0.0005958200000000, -0.0010069800000000,  0.0011801600000000 ]  - [  -0.0002257700000000, -0.0008620000000000,  0.0003753700000000 ]  - [   0.0006884200000000,  0.0015948000000000, -0.0002458700000000 ]  - [   0.0004595500000000, -0.0010090900000000, -0.0011952300000000 ]  - [   0.0003899000000000, -0.0009091500000000, -0.0003440700000000 ]  - [  -0.0001542900000000,  0.0013642300000000, -0.0000847200000000 ]  - [   0.0005958200000000, -0.0010069800000000,  0.0011801600000000 ]  - [   0.0002257700000000, -0.0008620000000000,  0.0003753700000000 ]  - [  -0.0006884200000000,  0.0015948000000000, -0.0002458700000000 ]  - [  -0.0004595500000000, -0.0010090900000000, -0.0011952300000000 ]  - [  -0.0003899000000000, -0.0009091500000000, -0.0003440700000000 ]  - [   0.0000000000000000,  0.0488216900000000,  0.0547586300000000 ]  - [   0.0000000000000000, -0.0021034400000000, -0.0000721600000000 ]  - [   0.0000000000000000, -0.0021197700000000, -0.0006435300000000 ]  - [   0.0000000000000000,  0.0027958200000000, -0.0017427300000000 ]  - [   0.0000000000000000, -0.0009633800000000, -0.0002864800000000 ]  - [   0.0000000000000000, -0.0009682300000000,  0.0008702200000000 ]  - [   0.0000000000000000,  0.0001397800000000, -0.0007367500000000 ]  - [   0.0000000000000000, -0.0009600300000000,  0.0002887800000000 ]  - [   0.0000000000000000,  0.0012661500000000, -0.0016321100000000 ]  - [   0.0000000000000000, -0.0008437700000000,  0.0018448800000000 ]  - [   0.0000000000000000, -0.0016153400000000, -0.0008421000000000 ]  - [   0.0000000000000000, -0.0110991900000000, -0.0479339700000000 ]- atom:   85  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0005822600000000,  0.0010826800000000, -0.0004112300000000 ]  - [   0.0005367500000000, -0.0009496500000000,  0.0002586900000000 ]  - [   0.0000874300000000, -0.0003016500000000, -0.0003435500000000 ]  - [  -0.0097813800000000, -0.0060836800000000,  0.0024184500000000 ]  - [  -0.0004254600000000, -0.0008785800000000, -0.0001570200000000 ]  - [  -0.0000752500000000,  0.0002823800000000,  0.0006001800000000 ]  - [  -0.0000070200000000,  0.0014487000000000, -0.0000734300000000 ]  - [  -0.0000189800000000,  0.0000631000000000,  0.0000271400000000 ]  - [   0.0073210700000000, -0.0042986600000000, -0.0023881600000000 ]  - [   0.0008572300000000,  0.0009415500000000, -0.0005484600000000 ]  - [   0.0002649100000000,  0.0001917800000000, -0.0001641500000000 ]  - [   0.0010764600000000,  0.0015171200000000, -0.0007648600000000 ]  - [  -0.0008572300000000,  0.0009415500000000, -0.0005484600000000 ]  - [  -0.0002649100000000,  0.0001917800000000, -0.0001641500000000 ]  - [  -0.0010764600000000,  0.0015171200000000, -0.0007648600000000 ]  - [   0.0000070200000000,  0.0014487000000000, -0.0000734300000000 ]  - [   0.0000189800000000,  0.0000631000000000,  0.0000271400000000 ]  - [  -0.0073210700000000, -0.0042986600000000, -0.0023881600000000 ]  - [   0.0097813800000000, -0.0060836800000000,  0.0024184500000000 ]  - [   0.0004254600000000, -0.0008785800000000, -0.0001570200000000 ]  - [   0.0000752500000000,  0.0002823800000000,  0.0006001800000000 ]  - [   0.0005822600000000,  0.0010826800000000, -0.0004112300000000 ]  - [  -0.0005367500000000, -0.0009496500000000,  0.0002586900000000 ]  - [  -0.0000874300000000, -0.0003016500000000, -0.0003435500000000 ]  - [   0.0004999900000000, -0.0014609200000000, -0.0015410300000000 ]  - [   0.0003550600000000, -0.0004254700000000, -0.0002884500000000 ]  - [  -0.0008897200000000,  0.0009464800000000, -0.0009923400000000 ]  - [   0.0002910800000000, -0.0006686400000000,  0.0025551100000000 ]  - [  -0.0003202500000000, -0.0004495500000000,  0.0003669100000000 ]  - [  -0.0005605200000000, -0.0001173100000000,  0.0013015600000000 ]  - [   0.0008848100000000,  0.0006845800000000,  0.0002425700000000 ]  - [   0.0001077800000000, -0.0001564100000000,  0.0005367200000000 ]  - [   0.0001532300000000, -0.0006249600000000,  0.0012300800000000 ]  - [   0.0002993800000000,  0.0000711300000000, -0.0019628900000000 ]  - [  -0.0000682400000000, -0.0002334100000000, -0.0006890900000000 ]  - [  -0.0002679100000000, -0.0006545000000000, -0.0012623900000000 ]  - [   0.0000000000000000,  0.0008861400000000, -0.0036433700000000 ]  - [   0.0000000000000000, -0.0002744000000000, -0.0003627300000000 ]  - [   0.0000000000000000, -0.0001040800000000, -0.0002444500000000 ]  - [   0.0000000000000000,  0.0002417100000000,  0.0002471400000000 ]  - [   0.0000000000000000, -0.0000845200000000,  0.0002065000000000 ]  - [   0.0000000000000000, -0.0001055700000000,  0.0001397800000000 ]  - [   0.0000000000000000,  0.0012418300000000, -0.0030043300000000 ]  - [   0.0000000000000000,  0.0001476700000000, -0.0012658900000000 ]  - [   0.0000000000000000,  0.0001072000000000, -0.0008932500000000 ]  - [   0.0000000000000000,  0.0059973000000000,  0.0398291600000000 ]  - [   0.0000000000000000,  0.0008621500000000,  0.0022208400000000 ]  - [   0.0000000000000000, -0.0004814600000000,  0.0011055900000000 ]  - [  -0.0004999900000000, -0.0014609200000000, -0.0015410300000000 ]  - [  -0.0003550600000000, -0.0004254700000000, -0.0002884500000000 ]  - [   0.0008897200000000,  0.0009464800000000, -0.0009923400000000 ]  - [  -0.0002910800000000, -0.0006686400000000,  0.0025551100000000 ]  - [   0.0003202500000000, -0.0004495500000000,  0.0003669100000000 ]  - [   0.0005605200000000, -0.0001173100000000,  0.0013015600000000 ]  - [  -0.0008848100000000,  0.0006845800000000,  0.0002425700000000 ]  - [  -0.0001077800000000, -0.0001564100000000,  0.0005367200000000 ]  - [  -0.0001532300000000, -0.0006249600000000,  0.0012300800000000 ]  - [  -0.0002993800000000,  0.0000711300000000, -0.0019628900000000 ]  - [   0.0000682400000000, -0.0002334100000000, -0.0006890900000000 ]  - [   0.0002679100000000, -0.0006545000000000, -0.0012623900000000 ]  - [  -0.0095829100000000,  0.0069122400000000,  0.0005283000000000 ]  - [   0.0000617700000000,  0.0008341900000000, -0.0000636600000000 ]  - [  -0.0010003500000000, -0.0007342600000000,  0.0002391200000000 ]  - [   0.0007347600000000, -0.0009483500000000,  0.0008587000000000 ]  - [   0.0001131800000000,  0.0002032700000000,  0.0001129600000000 ]  - [   0.0034143900000000,  0.0019019200000000,  0.0014253900000000 ]  - [  -0.0007347600000000, -0.0009483500000000,  0.0008587000000000 ]  - [  -0.0001131800000000,  0.0002032700000000,  0.0001129600000000 ]  - [  -0.0034143900000000,  0.0019019200000000,  0.0014253900000000 ]  - [   0.0095829100000000,  0.0069122400000000,  0.0005283000000000 ]  - [  -0.0000617700000000,  0.0008341900000000, -0.0000636600000000 ]  - [   0.0010003500000000, -0.0007342600000000,  0.0002391200000000 ]  - [  -0.0009791600000000, -0.0002994800000000, -0.0011781300000000 ]  - [  -0.0002077300000000,  0.0008463000000000, -0.0013712600000000 ]  - [  -0.0004734500000000,  0.0006936200000000, -0.0008960600000000 ]  - [   0.0011565700000000, -0.0008835200000000,  0.0045019800000000 ]  - [   0.0002316600000000,  0.0009834400000000,  0.0013425700000000 ]  - [   0.0004130600000000,  0.0006255600000000,  0.0009518000000000 ]  - [   0.0009791600000000, -0.0002994800000000, -0.0011781300000000 ]  - [   0.0002077300000000,  0.0008463000000000, -0.0013712600000000 ]  - [   0.0004734500000000,  0.0006936200000000, -0.0008960600000000 ]  - [  -0.0011565700000000, -0.0008835200000000,  0.0045019800000000 ]  - [  -0.0002316600000000,  0.0009834400000000,  0.0013425700000000 ]  - [  -0.0004130600000000,  0.0006255600000000,  0.0009518000000000 ]  - [   0.0000000000000000, -0.0524894700000000, -0.1365277000000000 ]  - [   0.0000000000000000,  0.0005518200000000, -0.0014986100000000 ]  - [   0.0000000000000000, -0.0000036800000000, -0.0014964300000000 ]  - [   0.0000000000000000, -0.0018222300000000,  0.0022871800000000 ]  - [   0.0000000000000000,  0.0007849100000000,  0.0008682600000000 ]  - [   0.0000000000000000, -0.0003637900000000,  0.0008668200000000 ]  - [   0.0000000000000000, -0.0006613500000000,  0.0008967400000000 ]  - [   0.0000000000000000,  0.0003621200000000,  0.0004089000000000 ]  - [   0.0000000000000000, -0.0015544700000000,  0.0020708900000000 ]  - [   0.0000000000000000, -0.0017768900000000, -0.0005134700000000 ]  - [   0.0000000000000000,  0.0009156600000000, -0.0002831300000000 ]  - [   0.0000000000000000,  0.0475013900000000,  0.0897814100000000 ]- atom:   85  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0012816600000000, -0.0020703200000000,  0.0007614300000000 ]  - [   0.0001592100000000, -0.0000189800000000,  0.0000891500000000 ]  - [   0.0006132800000000, -0.0006715800000000,  0.0006901500000000 ]  - [   0.0091119800000000,  0.0051340100000000, -0.0026246000000000 ]  - [  -0.0002680500000000, -0.0000881600000000, -0.0001900400000000 ]  - [  -0.0006200700000000, -0.0012593900000000, -0.0009460600000000 ]  - [  -0.0006856700000000, -0.0004855200000000,  0.0004156400000000 ]  - [  -0.0006800400000000,  0.0009087800000000,  0.0003214700000000 ]  - [  -0.0080852400000000,  0.0053013100000000,  0.0027406200000000 ]  - [  -0.0001625500000000,  0.0000247600000000,  0.0002022300000000 ]  - [   0.0004342800000000,  0.0007800000000000, -0.0001860400000000 ]  - [  -0.0003853000000000, -0.0005544300000000,  0.0004168500000000 ]  - [   0.0001625500000000,  0.0000247600000000,  0.0002022300000000 ]  - [  -0.0004342800000000,  0.0007800000000000, -0.0001860400000000 ]  - [   0.0003853000000000, -0.0005544300000000,  0.0004168500000000 ]  - [   0.0006856700000000, -0.0004855200000000,  0.0004156400000000 ]  - [   0.0006800400000000,  0.0009087800000000,  0.0003214700000000 ]  - [   0.0080852400000000,  0.0053013100000000,  0.0027406200000000 ]  - [  -0.0091119800000000,  0.0051340100000000, -0.0026246000000000 ]  - [   0.0002680500000000, -0.0000881600000000, -0.0001900400000000 ]  - [   0.0006200700000000, -0.0012593900000000, -0.0009460600000000 ]  - [  -0.0012816600000000, -0.0020703200000000,  0.0007614300000000 ]  - [  -0.0001592100000000, -0.0000189800000000,  0.0000891500000000 ]  - [  -0.0006132800000000, -0.0006715800000000,  0.0006901500000000 ]  - [  -0.0002088100000000,  0.0012044900000000,  0.0017259200000000 ]  - [  -0.0000436000000000,  0.0001770100000000,  0.0004704600000000 ]  - [   0.0011895900000000, -0.0011849000000000,  0.0011861700000000 ]  - [  -0.0005889400000000,  0.0004287800000000, -0.0027350300000000 ]  - [   0.0000082600000000,  0.0002002500000000, -0.0005483400000000 ]  - [   0.0002570800000000, -0.0001411900000000, -0.0014792900000000 ]  - [  -0.0012002200000000, -0.0004343100000000, -0.0000740200000000 ]  - [  -0.0004213700000000,  0.0004068200000000, -0.0003604700000000 ]  - [  -0.0004682000000000,  0.0008792200000000, -0.0010620600000000 ]  - [   0.0000041600000000,  0.0001641800000000,  0.0017769200000000 ]  - [   0.0003816900000000,  0.0004829000000000,  0.0005101100000000 ]  - [   0.0005812000000000,  0.0009123200000000,  0.0010902000000000 ]  - [   0.0000000000000000, -0.0008845800000000,  0.0036282900000000 ]  - [   0.0000000000000000,  0.0002703600000000,  0.0003621900000000 ]  - [   0.0000000000000000,  0.0001062900000000,  0.0002456900000000 ]  - [   0.0000000000000000, -0.0002436800000000, -0.0002475900000000 ]  - [   0.0000000000000000,  0.0000836800000000, -0.0002076100000000 ]  - [   0.0000000000000000,  0.0001051700000000, -0.0001410600000000 ]  - [   0.0000000000000000, -0.0012501200000000,  0.0030203000000000 ]  - [   0.0000000000000000, -0.0001498100000000,  0.0012711100000000 ]  - [   0.0000000000000000, -0.0001079300000000,  0.0008982900000000 ]  - [   0.0000000000000000, -0.0089060100000000, -0.0452560000000000 ]  - [   0.0000000000000000, -0.0008560900000000, -0.0022307900000000 ]  - [   0.0000000000000000,  0.0004804300000000, -0.0011172100000000 ]  - [   0.0002088100000000,  0.0012044900000000,  0.0017259200000000 ]  - [   0.0000436000000000,  0.0001770100000000,  0.0004704600000000 ]  - [  -0.0011895900000000, -0.0011849000000000,  0.0011861700000000 ]  - [   0.0005889400000000,  0.0004287800000000, -0.0027350300000000 ]  - [  -0.0000082600000000,  0.0002002500000000, -0.0005483400000000 ]  - [  -0.0002570800000000, -0.0001411900000000, -0.0014792900000000 ]  - [   0.0012002200000000, -0.0004343100000000, -0.0000740200000000 ]  - [   0.0004213700000000,  0.0004068200000000, -0.0003604700000000 ]  - [   0.0004682000000000,  0.0008792200000000, -0.0010620600000000 ]  - [  -0.0000041600000000,  0.0001641800000000,  0.0017769200000000 ]  - [  -0.0003816900000000,  0.0004829000000000,  0.0005101100000000 ]  - [  -0.0005812000000000,  0.0009123200000000,  0.0010902000000000 ]  - [   0.0095590400000000, -0.0062707200000000, -0.0006148500000000 ]  - [  -0.0000608700000000, -0.0002202800000000,  0.0000621300000000 ]  - [   0.0010012500000000,  0.0013519800000000, -0.0002466800000000 ]  - [  -0.0007383300000000,  0.0003361600000000, -0.0008530500000000 ]  - [  -0.0001127200000000, -0.0008260900000000, -0.0001127000000000 ]  - [  -0.0034537200000000, -0.0025477900000000, -0.0014338200000000 ]  - [   0.0007383300000000,  0.0003361600000000, -0.0008530500000000 ]  - [   0.0001127200000000, -0.0008260900000000, -0.0001127000000000 ]  - [   0.0034537200000000, -0.0025477900000000, -0.0014338200000000 ]  - [  -0.0095590400000000, -0.0062707200000000, -0.0006148500000000 ]  - [   0.0000608700000000, -0.0002202800000000,  0.0000621300000000 ]  - [  -0.0010012500000000,  0.0013519800000000, -0.0002466800000000 ]  - [   0.0003025400000000,  0.0003022100000000,  0.0011852200000000 ]  - [  -0.0004627800000000, -0.0008510300000000,  0.0013751800000000 ]  - [  -0.0001939400000000, -0.0006993100000000,  0.0009015900000000 ]  - [  -0.0004554300000000,  0.0008790000000000, -0.0044679200000000 ]  - [   0.0004410900000000, -0.0009866500000000, -0.0013495300000000 ]  - [   0.0002562600000000, -0.0006334800000000, -0.0009583300000000 ]  - [  -0.0003025400000000,  0.0003022100000000,  0.0011852200000000 ]  - [   0.0004627800000000, -0.0008510300000000,  0.0013751800000000 ]  - [   0.0001939400000000, -0.0006993100000000,  0.0009015900000000 ]  - [   0.0004554300000000,  0.0008790000000000, -0.0044679200000000 ]  - [  -0.0004410900000000, -0.0009866500000000, -0.0013495300000000 ]  - [  -0.0002562600000000, -0.0006334800000000, -0.0009583300000000 ]  - [   0.0000000000000000,  0.0566485600000000,  0.1433961000000000 ]  - [   0.0000000000000000, -0.0004261500000000,  0.0012021900000000 ]  - [   0.0000000000000000,  0.0001460200000000,  0.0012013500000000 ]  - [   0.0000000000000000,  0.0019723600000000, -0.0020052300000000 ]  - [   0.0000000000000000, -0.0006501100000000, -0.0005758100000000 ]  - [   0.0000000000000000,  0.0005034200000000, -0.0005754000000000 ]  - [   0.0000000000000000,  0.0005238000000000, -0.0011997600000000 ]  - [   0.0000000000000000, -0.0005049400000000, -0.0007057800000000 ]  - [   0.0000000000000000,  0.0014224600000000, -0.0023790400000000 ]  - [   0.0000000000000000,  0.0016406600000000,  0.0008206000000000 ]  - [   0.0000000000000000, -0.0010599300000000,  0.0005870500000000 ]  - [   0.0000000000000000, -0.0487239200000000, -0.0913490800000000 ]