# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/11f7dc16-a58b-4e0f-b866-ac490eadb4d0/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 Er2SO2 / P-3m1 (164) / materials id 12671](https://mdr.nims.go.jp/datasets/3474425f-eaf7-4523-b5a2-04446d746a97)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  nac_unit_conversion_factor: 14.399652  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "P-3m1"  number: 164  Hall_symbol: "-P 3 2\""supercell_matrix:- [   3,   0,   0 ]- [   0,   3,   0 ]- [   0,   0,   2 ]primitive_cell:  lattice:  - [     3.716858840000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -1.858429420000000,     3.218894180000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     6.467888230000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.666666670000000,  0.333333330000000,  0.370399390000000 ]    mass: 15.999400  - symbol: O  # 2    coordinates: [  0.333333330000000,  0.666666670000000,  0.629600610000000 ]    mass: 15.999400  - symbol: S  # 3    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000  - symbol: Er # 4    coordinates: [  0.666666670000000,  0.333333330000000,  0.717431210000000 ]    mass: 167.259000  - symbol: Er # 5    coordinates: [  0.333333330000000,  0.666666670000000,  0.282568790000000 ]    mass: 167.259000  reciprocal_lattice: # without 2pi  - [     0.269044384801011,     0.155332847878833,     0.000000000000000 ] # a*  - [     0.000000000000000,     0.310665695757665,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.154609969195463 ] # c*unit_cell:  lattice:  - [     3.716858840000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -1.858429420000000,     3.218894180000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     6.467888230000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.666666670000000,  0.333333330000000,  0.370399390000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.333333330000000,  0.666666670000000,  0.629600610000000 ]    mass: 15.999400    reduced_to: 2  - symbol: S  # 3    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 3  - symbol: Er # 4    coordinates: [  0.666666670000000,  0.333333330000000,  0.717431210000000 ]    mass: 167.259000    reduced_to: 4  - symbol: Er # 5    coordinates: [  0.333333330000000,  0.666666670000000,  0.282568790000000 ]    mass: 167.259000    reduced_to: 5supercell:  lattice:  - [    11.150576520000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -5.575288260000000,     9.656682540000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    12.935776460000000 ] # c  points:  - symbol: O  # 1    coordinates: [  0.222222223333333,  0.111111110000000,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 2    coordinates: [  0.555555556666667,  0.111111110000000,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 3    coordinates: [  0.888888890000000,  0.111111110000000,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 4    coordinates: [  0.222222223333333,  0.444444443333333,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 5    coordinates: [  0.555555556666667,  0.444444443333333,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 6    coordinates: [  0.888888890000000,  0.444444443333333,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 7    coordinates: [  0.222222223333333,  0.777777776666667,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 8    coordinates: [  0.555555556666667,  0.777777776666667,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 9    coordinates: [  0.888888890000000,  0.777777776666667,  0.185199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 10    coordinates: [  0.222222223333333,  0.111111110000000,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 11    coordinates: [  0.555555556666667,  0.111111110000000,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 12    coordinates: [  0.888888890000000,  0.111111110000000,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 13    coordinates: [  0.222222223333333,  0.444444443333333,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 14    coordinates: [  0.555555556666667,  0.444444443333333,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 15    coordinates: [  0.888888890000000,  0.444444443333333,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 16    coordinates: [  0.222222223333333,  0.777777776666667,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 17    coordinates: [  0.555555556666667,  0.777777776666667,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 18    coordinates: [  0.888888890000000,  0.777777776666667,  0.685199695000000 ]    mass: 15.999400    reduced_to: 1  - symbol: O  # 19    coordinates: [  0.111111110000000,  0.222222223333333,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.444444443333333,  0.222222223333333,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 21    coordinates: [  0.777777776666667,  0.222222223333333,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 22    coordinates: [  0.111111110000000,  0.555555556666667,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 23    coordinates: [  0.444444443333333,  0.555555556666667,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 24    coordinates: [  0.777777776666667,  0.555555556666667,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 25    coordinates: [  0.111111110000000,  0.888888890000000,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 26    coordinates: [  0.444444443333333,  0.888888890000000,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 27    coordinates: [  0.777777776666667,  0.888888890000000,  0.314800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 28    coordinates: [  0.111111110000000,  0.222222223333333,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 29    coordinates: [  0.444444443333333,  0.222222223333333,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 30    coordinates: [  0.777777776666667,  0.222222223333333,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 31    coordinates: [  0.111111110000000,  0.555555556666667,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 32    coordinates: [  0.444444443333333,  0.555555556666667,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 33    coordinates: [  0.777777776666667,  0.555555556666667,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 34    coordinates: [  0.111111110000000,  0.888888890000000,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 35    coordinates: [  0.444444443333333,  0.888888890000000,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 36    coordinates: [  0.777777776666667,  0.888888890000000,  0.814800305000000 ]    mass: 15.999400    reduced_to: 19  - symbol: S  # 37    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 38    coordinates: [  0.333333333333333,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 39    coordinates: [  0.666666666666667,  0.000000000000000,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 40    coordinates: [  0.000000000000000,  0.333333333333333,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 41    coordinates: [  0.333333333333333,  0.333333333333333,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 42    coordinates: [  0.666666666666667,  0.333333333333333,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 43    coordinates: [  0.000000000000000,  0.666666666666667,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 44    coordinates: [  0.333333333333333,  0.666666666666667,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 45    coordinates: [  0.666666666666667,  0.666666666666667,  0.000000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 46    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 47    coordinates: [  0.333333333333333,  0.000000000000000,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 48    coordinates: [  0.666666666666667,  0.000000000000000,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 49    coordinates: [  0.000000000000000,  0.333333333333333,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 50    coordinates: [  0.333333333333333,  0.333333333333333,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 51    coordinates: [  0.666666666666667,  0.333333333333333,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 52    coordinates: [  0.000000000000000,  0.666666666666667,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 53    coordinates: [  0.333333333333333,  0.666666666666667,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: S  # 54    coordinates: [  0.666666666666667,  0.666666666666667,  0.500000000000000 ]    mass: 32.065000    reduced_to: 37  - symbol: Er # 55    coordinates: [  0.222222223333333,  0.111111110000000,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 56    coordinates: [  0.555555556666667,  0.111111110000000,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 57    coordinates: [  0.888888890000000,  0.111111110000000,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 58    coordinates: [  0.222222223333333,  0.444444443333333,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 59    coordinates: [  0.555555556666667,  0.444444443333333,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 60    coordinates: [  0.888888890000000,  0.444444443333333,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 61    coordinates: [  0.222222223333333,  0.777777776666667,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 62    coordinates: [  0.555555556666667,  0.777777776666667,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 63    coordinates: [  0.888888890000000,  0.777777776666667,  0.358715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 64    coordinates: [  0.222222223333333,  0.111111110000000,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 65    coordinates: [  0.555555556666667,  0.111111110000000,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 66    coordinates: [  0.888888890000000,  0.111111110000000,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 67    coordinates: [  0.222222223333333,  0.444444443333333,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 68    coordinates: [  0.555555556666667,  0.444444443333333,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 69    coordinates: [  0.888888890000000,  0.444444443333333,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 70    coordinates: [  0.222222223333333,  0.777777776666667,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 71    coordinates: [  0.555555556666667,  0.777777776666667,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 72    coordinates: [  0.888888890000000,  0.777777776666667,  0.858715605000000 ]    mass: 167.259000    reduced_to: 55  - symbol: Er # 73    coordinates: [  0.111111110000000,  0.222222223333333,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 74    coordinates: [  0.444444443333333,  0.222222223333333,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 75    coordinates: [  0.777777776666667,  0.222222223333333,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 76    coordinates: [  0.111111110000000,  0.555555556666667,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 77    coordinates: [  0.444444443333333,  0.555555556666667,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 78    coordinates: [  0.777777776666667,  0.555555556666667,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 79    coordinates: [  0.111111110000000,  0.888888890000000,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 80    coordinates: [  0.444444443333333,  0.888888890000000,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 81    coordinates: [  0.777777776666667,  0.888888890000000,  0.141284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 82    coordinates: [  0.111111110000000,  0.222222223333333,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 83    coordinates: [  0.444444443333333,  0.222222223333333,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 84    coordinates: [  0.777777776666667,  0.222222223333333,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 85    coordinates: [  0.111111110000000,  0.555555556666667,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 86    coordinates: [  0.444444443333333,  0.555555556666667,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 87    coordinates: [  0.777777776666667,  0.555555556666667,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 88    coordinates: [  0.111111110000000,  0.888888890000000,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 89    coordinates: [  0.444444443333333,  0.888888890000000,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73  - symbol: Er # 90    coordinates: [  0.777777776666667,  0.888888890000000,  0.641284395000000 ]    mass: 167.259000    reduced_to: 73born_effective_charge:- # 1 (O)  - [ -2.628510610000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -2.628510610000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000, -2.719315460000000 ]- # 2 (O)  - [ -2.628510610000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -2.628510610000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000, -2.719315460000000 ]- # 3 (S)  - [ -2.168432760000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -2.168432760000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000, -2.232468210000000 ]- # 4 (Er)  - [  3.712726990000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  3.712726990000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  3.835549570000000 ]- # 5 (Er)  - [  3.712726990000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  3.712726990000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  3.835549570000000 ]dielectric_constant:  - [  5.294835740000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  5.294835740000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  5.157273820000000 ]displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.1148815000000000, -0.0014335600000000,  0.0004834000000000 ]  - [   0.0077379000000000, -0.0029701600000000,  0.0009600400000000 ]  - [   0.0076813300000000,  0.0029417300000000, -0.0011216400000000 ]  - [  -0.0012726200000000, -0.0081108200000000, -0.0012319000000000 ]  - [  -0.0012979000000000,  0.0081879400000000,  0.0010902800000000 ]  - [   0.0012943400000000,  0.0000064900000000, -0.0000843200000000 ]  - [  -0.0013101100000000, -0.0022303400000000, -0.0002076600000000 ]  - [   0.0012962500000000,  0.0000017300000000, -0.0000881600000000 ]  - [  -0.0012617300000000,  0.0022412000000000,  0.0000319200000000 ]  - [  -0.0004468100000000, -0.0000007200000000, -0.0000909300000000 ]  - [   0.0002498500000000,  0.0000192000000000, -0.0004451100000000 ]  - [   0.0002569900000000, -0.0000217000000000,  0.0002615800000000 ]  - [  -0.0001418700000000, -0.0002091700000000, -0.0000451600000000 ]  - [  -0.0001448100000000,  0.0002062200000000, -0.0001346000000000 ]  - [   0.0003320400000000,  0.0000011000000000, -0.0000927800000000 ]  - [  -0.0001436800000000, -0.0002466500000000, -0.0003994300000000 ]  - [   0.0003306600000000,  0.0000006700000000, -0.0000909600000000 ]  - [  -0.0001418500000000,  0.0002532300000000,  0.0002186100000000 ]  - [   0.0104077100000000, -0.0093223000000000, -0.0158854000000000 ]  - [   0.0104257400000000,  0.0094222900000000,  0.0162613600000000 ]  - [   0.0027933300000000,  0.0000038000000000,  0.0000969000000000 ]  - [   0.0012813300000000, -0.0008626400000000, -0.0001751800000000 ]  - [  -0.0028081800000000,  0.0000020600000000,  0.0000936000000000 ]  - [   0.0012877300000000,  0.0008792900000000,  0.0003615900000000 ]  - [  -0.0058154000000000,  0.0000768500000000,  0.0000391300000000 ]  - [   0.0002898600000000, -0.0018002200000000,  0.0007596400000000 ]  - [   0.0003000600000000,  0.0017835900000000, -0.0005753500000000 ]  - [  -0.0006691700000000, -0.0004684500000000,  0.0006486600000000 ]  - [  -0.0006756500000000,  0.0004693700000000, -0.0004807500000000 ]  - [   0.0020651900000000, -0.0000044900000000,  0.0000813500000000 ]  - [   0.0002998000000000, -0.0010166700000000,  0.0003077700000000 ]  - [  -0.0003353600000000, -0.0000034000000000,  0.0000882900000000 ]  - [   0.0002906800000000,  0.0010267900000000, -0.0001384300000000 ]  - [  -0.0014846100000000, -0.0000009600000000,  0.0000861300000000 ]  - [   0.0011263100000000, -0.0008468900000000, -0.0008509300000000 ]  - [   0.0011298300000000,  0.0008437500000000,  0.0010198500000000 ]  - [   0.0023097100000000,  0.0035895600000000,  0.0078102300000000 ]  - [   0.0022901700000000, -0.0036149400000000, -0.0078420900000000 ]  - [   0.0013905900000000, -0.0000026700000000, -0.0000019900000000 ]  - [   0.0040462200000000, -0.0023206800000000,  0.0045275600000000 ]  - [  -0.0039395700000000, -0.0000211900000000,  0.0000271200000000 ]  - [   0.0040836200000000,  0.0023425900000000, -0.0045805500000000 ]  - [   0.0000257600000000,  0.0000188000000000,  0.0000165600000000 ]  - [   0.0000231200000000, -0.0007874200000000,  0.0000570900000000 ]  - [   0.0000249200000000,  0.0007912000000000, -0.0000592400000000 ]  - [  -0.0007295900000000,  0.0001836000000000, -0.0002737700000000 ]  - [  -0.0007563900000000, -0.0001769500000000,  0.0002558400000000 ]  - [   0.0008128500000000, -0.0000013800000000,  0.0000028500000000 ]  - [   0.0007263500000000, -0.0003697800000000, -0.0010262200000000 ]  - [  -0.0010553500000000, -0.0000140000000000, -0.0000061700000000 ]  - [   0.0007268000000000,  0.0003703400000000,  0.0010323600000000 ]  - [   0.0000851900000000,  0.0000045800000000, -0.0000043700000000 ]  - [  -0.0000504800000000, -0.0004950500000000, -0.0004037300000000 ]  - [  -0.0000474100000000,  0.0004998700000000,  0.0004039400000000 ]  - [   0.0189408900000000,  0.0000217900000000,  0.0003511300000000 ]  - [  -0.0047565400000000,  0.0021420500000000, -0.0030274300000000 ]  - [  -0.0047589700000000, -0.0021283400000000,  0.0036421000000000 ]  - [   0.0009838400000000,  0.0046314000000000,  0.0029992800000000 ]  - [   0.0009894900000000, -0.0046314300000000, -0.0023720700000000 ]  - [  -0.0016046700000000, -0.0000081700000000,  0.0003215200000000 ]  - [   0.0003018600000000,  0.0015798500000000, -0.0003191500000000 ]  - [  -0.0008079500000000, -0.0000024000000000,  0.0003255400000000 ]  - [   0.0002516100000000, -0.0016016600000000,  0.0009771600000000 ]  - [   0.0035928400000000, -0.0000038600000000,  0.0003243500000000 ]  - [  -0.0021656300000000, -0.0003330600000000,  0.0023241100000000 ]  - [  -0.0021728800000000,  0.0003381400000000, -0.0016522000000000 ]  - [   0.0010376200000000,  0.0009280300000000, -0.0001666900000000 ]  - [   0.0010627900000000, -0.0009191300000000,  0.0008191700000000 ]  - [  -0.0024545700000000, -0.0000074300000000,  0.0003291900000000 ]  - [   0.0005372900000000,  0.0024923800000000,  0.0018206900000000 ]  - [  -0.0008850400000000,  0.0000016000000000,  0.0003266100000000 ]  - [   0.0005243300000000, -0.0024957800000000, -0.0011674900000000 ]  - [   0.0291477400000000, -0.0082967900000000,  0.0038520000000000 ]  - [   0.0310386700000000,  0.0094849500000000, -0.0051989700000000 ]  - [  -0.0063110300000000, -0.0000055100000000, -0.0003252100000000 ]  - [  -0.0019503300000000,  0.0024899700000000, -0.0003947500000000 ]  - [   0.0039892000000000, -0.0000078800000000, -0.0003159200000000 ]  - [  -0.0019732100000000, -0.0025269900000000, -0.0002614800000000 ]  - [   0.0146948600000000,  0.0000013500000000, -0.0003533600000000 ]  - [  -0.0026607900000000,  0.0038598900000000,  0.0000118000000000 ]  - [  -0.0026513200000000, -0.0038174700000000, -0.0006602500000000 ]  - [   0.0004780400000000,  0.0000645600000000, -0.0003223800000000 ]  - [   0.0004676400000000, -0.0000568900000000, -0.0003246300000000 ]  - [  -0.0009896700000000,  0.0000108800000000, -0.0003287300000000 ]  - [  -0.0001456800000000,  0.0004855800000000,  0.0000966800000000 ]  - [   0.0002972600000000,  0.0000022800000000, -0.0003185000000000 ]  - [  -0.0001380900000000, -0.0004976200000000, -0.0007345100000000 ]  - [   0.0005826200000000,  0.0000025600000000, -0.0003199800000000 ]  - [  -0.0002471200000000,  0.0003091700000000,  0.0002281400000000 ]  - [  -0.0002572200000000, -0.0003206600000000, -0.0008726200000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.1118349400000000 ]  - [  -0.0010548200000000,  0.0007456900000000, -0.0032701100000000 ]  - [   0.0010548200000000,  0.0007456900000000, -0.0032701100000000 ]  - [  -0.0001183800000000, -0.0012863400000000, -0.0032701100000000 ]  - [   0.0001183800000000, -0.0012863400000000, -0.0032701100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015184900000000 ]  - [  -0.0011731900000000,  0.0005406600000000, -0.0032701100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015185900000000 ]  - [   0.0011731900000000,  0.0005406600000000, -0.0032701100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0024653400000000 ]  - [   0.0003544200000000,  0.0001506900000000,  0.0017820800000000 ]  - [  -0.0003544200000000,  0.0001506900000000,  0.0017820800000000 ]  - [  -0.0003077100000000,  0.0002315900000000,  0.0017820800000000 ]  - [   0.0003077100000000,  0.0002315900000000,  0.0017820800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014395000000000 ]  - [   0.0000467100000000, -0.0003822800000000,  0.0017820800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014433400000000 ]  - [  -0.0000467100000000, -0.0003822800000000,  0.0017820800000000 ]  - [  -0.0161469600000000,  0.0093224500000000,  0.0034470100000000 ]  - [   0.0161469600000000,  0.0093224500000000,  0.0034470100000000 ]  - [   0.0000000000000000,  0.0003096300000000, -0.0013280200000000 ]  - [  -0.0002681500000000, -0.0001548200000000, -0.0013280200000000 ]  - [   0.0000000000000000,  0.0007747300000000, -0.0017106200000000 ]  - [   0.0002681500000000, -0.0001548200000000, -0.0013280200000000 ]  - [   0.0000000000000000, -0.0186449100000000,  0.0034470100000000 ]  - [   0.0006709300000000, -0.0003873600000000, -0.0017106200000000 ]  - [  -0.0006709300000000, -0.0003873600000000, -0.0017106200000000 ]  - [   0.0005623900000000, -0.0003246900000000,  0.0021722500000000 ]  - [  -0.0005623900000000, -0.0003246900000000,  0.0021722500000000 ]  - [   0.0000000000000000, -0.0002600400000000,  0.0014340100000000 ]  - [   0.0002252100000000,  0.0001300200000000,  0.0014340100000000 ]  - [   0.0000000000000000, -0.0010800700000000,  0.0023699500000000 ]  - [  -0.0002252100000000,  0.0001300200000000,  0.0014340100000000 ]  - [   0.0000000000000000,  0.0006493900000000,  0.0021722500000000 ]  - [  -0.0009353700000000,  0.0005400400000000,  0.0023699500000000 ]  - [   0.0009353700000000,  0.0005400400000000,  0.0023699500000000 ]  - [   0.0052386400000000,  0.0030245300000000,  0.0060329000000000 ]  - [  -0.0052386400000000,  0.0030245300000000,  0.0060329000000000 ]  - [   0.0000000000000000, -0.0000176900000000, -0.0002434800000000 ]  - [   0.0007608900000000, -0.0004393000000000,  0.0004029100000000 ]  - [   0.0000000000000000, -0.0060490600000000,  0.0060329000000000 ]  - [  -0.0007608900000000, -0.0004393000000000,  0.0004029100000000 ]  - [   0.0000000000000000,  0.0008786000000000,  0.0004029100000000 ]  - [   0.0000153200000000,  0.0000088400000000, -0.0002434800000000 ]  - [  -0.0000153200000000,  0.0000088400000000, -0.0002434800000000 ]  - [  -0.0030207400000000, -0.0017440300000000,  0.0031069400000000 ]  - [   0.0030207400000000, -0.0017440300000000,  0.0031069400000000 ]  - [   0.0000000000000000, -0.0001804900000000,  0.0006179100000000 ]  - [  -0.0005080700000000,  0.0002933300000000,  0.0008693400000000 ]  - [   0.0000000000000000,  0.0034880500000000,  0.0031069400000000 ]  - [   0.0005080700000000,  0.0002933300000000,  0.0008693400000000 ]  - [   0.0000000000000000, -0.0005866700000000,  0.0008693400000000 ]  - [   0.0001563100000000,  0.0000902500000000,  0.0006179100000000 ]  - [  -0.0001563100000000,  0.0000902500000000,  0.0006179100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0326022200000000 ]  - [  -0.0038352400000000,  0.0015704500000000,  0.0016365000000000 ]  - [   0.0038352400000000,  0.0015704500000000,  0.0016365000000000 ]  - [   0.0005575700000000, -0.0041066400000000,  0.0016365000000000 ]  - [  -0.0005575700000000, -0.0041066400000000,  0.0016365000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014827100000000 ]  - [  -0.0032776700000000,  0.0025361900000000,  0.0016365000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014965500000000 ]  - [   0.0032776700000000,  0.0025361900000000,  0.0016365000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043030000000000 ]  - [   0.0015663300000000,  0.0010055700000000, -0.0023258200000000 ]  - [  -0.0015663300000000,  0.0010055700000000, -0.0023258200000000 ]  - [  -0.0016540100000000,  0.0008537000000000, -0.0023258200000000 ]  - [   0.0016540100000000,  0.0008537000000000, -0.0023258200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012770300000000 ]  - [  -0.0000876800000000, -0.0018592700000000, -0.0023258200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0008467000000000 ]  - [   0.0000876800000000, -0.0018592700000000, -0.0023258200000000 ]  - [   0.0067864500000000, -0.0039181600000000,  0.0184022000000000 ]  - [  -0.0067864500000000, -0.0039181600000000,  0.0184022000000000 ]  - [   0.0000000000000000,  0.0002206000000000,  0.0016679100000000 ]  - [  -0.0001910500000000, -0.0001103000000000,  0.0016679100000000 ]  - [   0.0000000000000000,  0.0010786200000000,  0.0028929200000000 ]  - [   0.0001910500000000, -0.0001103000000000,  0.0016679100000000 ]  - [   0.0000000000000000,  0.0078363100000000,  0.0184022000000000 ]  - [   0.0009341200000000, -0.0005393100000000,  0.0028929200000000 ]  - [  -0.0009341200000000, -0.0005393100000000,  0.0028929200000000 ]  - [   0.0006254000000000, -0.0003610800000000, -0.0035930300000000 ]  - [  -0.0006254000000000, -0.0003610800000000, -0.0035930300000000 ]  - [   0.0000000000000000,  0.0000641500000000, -0.0022437500000000 ]  - [  -0.0000555500000000, -0.0000320700000000, -0.0022437500000000 ]  - [   0.0000000000000000, -0.0009518100000000, -0.0031529700000000 ]  - [   0.0000555500000000, -0.0000320700000000, -0.0022437500000000 ]  - [   0.0000000000000000,  0.0007221500000000, -0.0035930300000000 ]  - [  -0.0008243000000000,  0.0004759100000000, -0.0031529700000000 ]  - [   0.0008243000000000,  0.0004759100000000, -0.0031529700000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.1086570100000000 ]  - [   0.0010273800000000, -0.0007347500000000,  0.0031312000000000 ]  - [  -0.0010273800000000, -0.0007347500000000,  0.0031312000000000 ]  - [   0.0001226200000000,  0.0012571100000000,  0.0031312000000000 ]  - [  -0.0001226200000000,  0.0012571100000000,  0.0031312000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0013916500000000 ]  - [   0.0011500000000000, -0.0005223600000000,  0.0031312000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0013979900000000 ]  - [  -0.0011500000000000, -0.0005223600000000,  0.0031312000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025919000000000 ]  - [  -0.0003522800000000, -0.0001584500000000, -0.0018983500000000 ]  - [   0.0003522800000000, -0.0001584500000000, -0.0018983500000000 ]  - [   0.0003133600000000, -0.0002258600000000, -0.0018983500000000 ]  - [  -0.0003133600000000, -0.0002258600000000, -0.0018983500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015633700000000 ]  - [  -0.0000389200000000,  0.0003843100000000, -0.0018983500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015595600000000 ]  - [   0.0000389200000000,  0.0003843100000000, -0.0018983500000000 ]  - [   0.0160021600000000, -0.0092388500000000, -0.0033557500000000 ]  - [  -0.0160021600000000, -0.0092388500000000, -0.0033557500000000 ]  - [   0.0000000000000000, -0.0003081100000000,  0.0014473700000000 ]  - [   0.0002668300000000,  0.0001540600000000,  0.0014473700000000 ]  - [   0.0000000000000000, -0.0007683500000000,  0.0018295300000000 ]  - [  -0.0002668300000000,  0.0001540600000000,  0.0014473700000000 ]  - [   0.0000000000000000,  0.0184777100000000, -0.0033557500000000 ]  - [  -0.0006654100000000,  0.0003841800000000,  0.0018295300000000 ]  - [   0.0006654100000000,  0.0003841800000000,  0.0018295300000000 ]  - [  -0.0005733100000000,  0.0003310000000000, -0.0020344100000000 ]  - [   0.0005733100000000,  0.0003310000000000, -0.0020344100000000 ]  - [   0.0000000000000000,  0.0002510500000000, -0.0012913500000000 ]  - [  -0.0002174200000000, -0.0001255300000000, -0.0012913500000000 ]  - [   0.0000000000000000,  0.0010876100000000, -0.0022418900000000 ]  - [   0.0002174200000000, -0.0001255300000000, -0.0012913500000000 ]  - [   0.0000000000000000, -0.0006620000000000, -0.0020344100000000 ]  - [   0.0009419000000000, -0.0005438000000000, -0.0022418900000000 ]  - [  -0.0009419000000000, -0.0005438000000000, -0.0022418900000000 ]  - [  -0.0052954300000000, -0.0030573200000000, -0.0060610100000000 ]  - [   0.0052954300000000, -0.0030573200000000, -0.0060610100000000 ]  - [   0.0000000000000000,  0.0000165200000000,  0.0002393800000000 ]  - [  -0.0007369000000000,  0.0004254500000000, -0.0003742200000000 ]  - [   0.0000000000000000,  0.0061146300000000, -0.0060610100000000 ]  - [   0.0007369000000000,  0.0004254500000000, -0.0003742200000000 ]  - [   0.0000000000000000, -0.0008509000000000, -0.0003742200000000 ]  - [  -0.0000143100000000, -0.0000082600000000,  0.0002393800000000 ]  - [   0.0000143100000000, -0.0000082600000000,  0.0002393800000000 ]  - [   0.0029811600000000,  0.0017211700000000, -0.0030849700000000 ]  - [  -0.0029811600000000,  0.0017211700000000, -0.0030849700000000 ]  - [   0.0000000000000000,  0.0001810500000000, -0.0006234600000000 ]  - [   0.0005095000000000, -0.0002941600000000, -0.0008840000000000 ]  - [   0.0000000000000000, -0.0034423500000000, -0.0030849700000000 ]  - [  -0.0005095000000000, -0.0002941600000000, -0.0008840000000000 ]  - [   0.0000000000000000,  0.0005883200000000, -0.0008840000000000 ]  - [  -0.0001567900000000, -0.0000905200000000, -0.0006234600000000 ]  - [   0.0001567900000000, -0.0000905200000000, -0.0006234600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0289503100000000 ]  - [   0.0038215000000000, -0.0015682000000000, -0.0009599400000000 ]  - [  -0.0038215000000000, -0.0015682000000000, -0.0009599400000000 ]  - [  -0.0005526500000000,  0.0040936200000000, -0.0009599400000000 ]  - [   0.0005526500000000,  0.0040936200000000, -0.0009599400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0008234900000000 ]  - [   0.0032688500000000, -0.0025254200000000, -0.0009599400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0008266400000000 ]  - [  -0.0032688500000000, -0.0025254200000000, -0.0009599400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049335700000000 ]  - [  -0.0015672000000000, -0.0010161700000000,  0.0029567200000000 ]  - [   0.0015672000000000, -0.0010161700000000,  0.0029567200000000 ]  - [   0.0016636300000000, -0.0008491500000000,  0.0029567200000000 ]  - [  -0.0016636300000000, -0.0008491500000000,  0.0029567200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018942800000000 ]  - [   0.0000964300000000,  0.0018653200000000,  0.0029567200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014803500000000 ]  - [  -0.0000964300000000,  0.0018653200000000,  0.0029567200000000 ]  - [  -0.0069782000000000,  0.0040288600000000, -0.0189678200000000 ]  - [   0.0069782000000000,  0.0040288600000000, -0.0189678200000000 ]  - [   0.0000000000000000, -0.0002180600000000, -0.0023072200000000 ]  - [   0.0001888400000000,  0.0001090300000000, -0.0023072200000000 ]  - [   0.0000000000000000, -0.0010681800000000, -0.0035479300000000 ]  - [  -0.0001888400000000,  0.0001090300000000, -0.0023072200000000 ]  - [   0.0000000000000000, -0.0080577300000000, -0.0189678200000000 ]  - [  -0.0009250700000000,  0.0005340900000000, -0.0035479300000000 ]  - [   0.0009250700000000,  0.0005340900000000, -0.0035479300000000 ]  - [  -0.0006134500000000,  0.0003541700000000,  0.0029171500000000 ]  - [   0.0006134500000000,  0.0003541700000000,  0.0029171500000000 ]  - [   0.0000000000000000, -0.0000705700000000,  0.0015857200000000 ]  - [   0.0000611200000000,  0.0000352900000000,  0.0015857200000000 ]  - [   0.0000000000000000,  0.0009399600000000,  0.0024823900000000 ]  - [  -0.0000611200000000,  0.0000352900000000,  0.0015857200000000 ]  - [   0.0000000000000000, -0.0007083500000000,  0.0029171500000000 ]  - [   0.0008140300000000, -0.0004699800000000,  0.0024823900000000 ]  - [  -0.0008140300000000, -0.0004699800000000,  0.0024823900000000 ]- atom:   37  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0022930100000000,  0.0036150200000000,  0.0052256700000000 ]  - [   0.0013911900000000,  0.0000020700000000, -0.0000474000000000 ]  - [   0.0023054700000000, -0.0035911900000000, -0.0053063800000000 ]  - [   0.0000229300000000, -0.0000100800000000, -0.0000515900000000 ]  - [   0.0000216600000000,  0.0007891000000000, -0.0000654100000000 ]  - [   0.0000296700000000, -0.0007870700000000, -0.0000363700000000 ]  - [   0.0040704400000000, -0.0023418100000000,  0.0007045100000000 ]  - [   0.0040595900000000,  0.0023264800000000, -0.0007926700000000 ]  - [  -0.0039410000000000,  0.0000214500000000, -0.0000830000000000 ]  - [  -0.0007415900000000,  0.0001765100000000, -0.0030678500000000 ]  - [   0.0008099400000000, -0.0000010000000000, -0.0000586600000000 ]  - [  -0.0007409800000000, -0.0001832500000000,  0.0029344100000000 ]  - [   0.0000841700000000,  0.0000020500000000, -0.0000534800000000 ]  - [  -0.0000485200000000,  0.0004967600000000, -0.0002005400000000 ]  - [  -0.0000491200000000, -0.0004949400000000,  0.0001012900000000 ]  - [   0.0007268100000000, -0.0003709600000000, -0.0005600800000000 ]  - [   0.0007251100000000,  0.0003692100000000,  0.0004548900000000 ]  - [  -0.0010527400000000, -0.0000020600000000, -0.0000441500000000 ]  - [  -0.0010527400000000,  0.0000020600000000,  0.0000441500000000 ]  - [   0.0007268100000000,  0.0003709600000000,  0.0005600800000000 ]  - [   0.0007251100000000, -0.0003692100000000, -0.0004548900000000 ]  - [  -0.0000485200000000, -0.0004967600000000,  0.0002005400000000 ]  - [  -0.0000491200000000,  0.0004949400000000, -0.0001012900000000 ]  - [   0.0000841700000000, -0.0000020500000000,  0.0000534800000000 ]  - [  -0.0007415900000000, -0.0001765100000000,  0.0030678500000000 ]  - [   0.0008099400000000,  0.0000010000000000,  0.0000586600000000 ]  - [  -0.0007409800000000,  0.0001832500000000, -0.0029344100000000 ]  - [  -0.0039410000000000, -0.0000214500000000,  0.0000830000000000 ]  - [   0.0040704400000000,  0.0023418100000000, -0.0007045100000000 ]  - [   0.0040595900000000, -0.0023264800000000,  0.0007926700000000 ]  - [   0.0000216600000000, -0.0007891000000000,  0.0000654100000000 ]  - [   0.0000296700000000,  0.0007870700000000,  0.0000363700000000 ]  - [   0.0000229300000000,  0.0000100800000000,  0.0000515900000000 ]  - [   0.0022930100000000, -0.0036150200000000, -0.0052256700000000 ]  - [   0.0013911900000000, -0.0000020700000000,  0.0000474000000000 ]  - [   0.0023054700000000,  0.0035911900000000,  0.0053063800000000 ]  - [  -0.0676479300000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0067316300000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0066504000000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0009458400000000, -0.0033132900000000, -0.0004297300000000 ]  - [   0.0009454400000000,  0.0033213100000000,  0.0004368000000000 ]  - [   0.0006555900000000,  0.0000009500000000, -0.0000024200000000 ]  - [   0.0009454400000000, -0.0033213100000000, -0.0004368000000000 ]  - [   0.0006555900000000, -0.0000009500000000,  0.0000024200000000 ]  - [   0.0009458400000000,  0.0033132900000000,  0.0004297300000000 ]  - [  -0.0008226500000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0003307700000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0003296700000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0000980800000000, -0.0002450400000000, -0.0000063400000000 ]  - [  -0.0000960700000000,  0.0002484300000000,  0.0000045200000000 ]  - [   0.0002440700000000,  0.0000005200000000, -0.0000005900000000 ]  - [  -0.0000960700000000, -0.0002484300000000, -0.0000045200000000 ]  - [   0.0002440700000000, -0.0000005200000000,  0.0000005900000000 ]  - [  -0.0000980800000000,  0.0002450400000000,  0.0000063400000000 ]  - [   0.0004940600000000, -0.0006338000000000, -0.0012160100000000 ]  - [  -0.0008245400000000, -0.0000013700000000,  0.0003056200000000 ]  - [   0.0004834800000000,  0.0006250300000000,  0.0018378900000000 ]  - [  -0.0000275200000000,  0.0000056700000000,  0.0003143800000000 ]  - [   0.0000022200000000, -0.0004793800000000,  0.0001838200000000 ]  - [   0.0000029000000000,  0.0004772900000000,  0.0004386400000000 ]  - [  -0.0007842600000000,  0.0004374100000000, -0.0006103800000000 ]  - [  -0.0007818500000000, -0.0004331200000000,  0.0012269200000000 ]  - [   0.0015795400000000,  0.0000036200000000,  0.0003171200000000 ]  - [   0.0086320700000000,  0.0020305300000000, -0.0038215100000000 ]  - [  -0.0037929800000000, -0.0000048400000000,  0.0003188700000000 ]  - [   0.0083267700000000, -0.0018183900000000,  0.0040995900000000 ]  - [   0.0008383800000000,  0.0000118600000000,  0.0003092200000000 ]  - [  -0.0004313400000000, -0.0019439600000000, -0.0000560400000000 ]  - [  -0.0004304300000000,  0.0019389400000000,  0.0006753000000000 ]  - [  -0.0018879700000000,  0.0015796900000000,  0.0009909400000000 ]  - [  -0.0018953100000000, -0.0015724100000000, -0.0003726500000000 ]  - [   0.0051480200000000,  0.0000109500000000,  0.0003200600000000 ]  - [   0.0051480200000000, -0.0000109500000000, -0.0003200600000000 ]  - [  -0.0018879700000000, -0.0015796900000000, -0.0009909400000000 ]  - [  -0.0018953100000000,  0.0015724100000000,  0.0003726500000000 ]  - [  -0.0004313400000000,  0.0019439600000000,  0.0000560400000000 ]  - [  -0.0004304300000000, -0.0019389400000000, -0.0006753000000000 ]  - [   0.0008383800000000, -0.0000118600000000, -0.0003092200000000 ]  - [   0.0086320700000000, -0.0020305300000000,  0.0038215100000000 ]  - [  -0.0037929800000000,  0.0000048400000000, -0.0003188700000000 ]  - [   0.0083267700000000,  0.0018183900000000, -0.0040995900000000 ]  - [   0.0015795400000000, -0.0000036200000000, -0.0003171200000000 ]  - [  -0.0007842600000000, -0.0004374100000000,  0.0006103800000000 ]  - [  -0.0007818500000000,  0.0004331200000000, -0.0012269200000000 ]  - [   0.0000022200000000,  0.0004793800000000, -0.0001838200000000 ]  - [   0.0000029000000000, -0.0004772900000000, -0.0004386400000000 ]  - [  -0.0000275200000000, -0.0000056700000000, -0.0003143800000000 ]  - [   0.0004940600000000,  0.0006338000000000,  0.0012160100000000 ]  - [  -0.0008245400000000,  0.0000013700000000, -0.0003056200000000 ]  - [   0.0004834800000000, -0.0006250300000000, -0.0018378900000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0078570300000000,  0.0045362600000000,  0.0060023400000000 ]  - [   0.0000000000000000, -0.0000652900000000, -0.0003155600000000 ]  - [  -0.0078570300000000,  0.0045362600000000,  0.0060023400000000 ]  - [   0.0000000000000000,  0.0052659400000000,  0.0003184900000000 ]  - [  -0.0000565400000000,  0.0000326400000000, -0.0003155600000000 ]  - [   0.0000565400000000,  0.0000326400000000, -0.0003155600000000 ]  - [   0.0045604400000000, -0.0026329700000000,  0.0003184900000000 ]  - [  -0.0045604400000000, -0.0026329700000000,  0.0003184900000000 ]  - [   0.0000000000000000, -0.0090725200000000,  0.0060023400000000 ]  - [  -0.0002591400000000, -0.0001496100000000,  0.0030136400000000 ]  - [   0.0000000000000000,  0.0004668900000000,  0.0005455600000000 ]  - [   0.0002591400000000, -0.0001496100000000,  0.0030136400000000 ]  - [   0.0000000000000000, -0.0011826800000000,  0.0007972100000000 ]  - [   0.0004043400000000, -0.0002334500000000,  0.0005455600000000 ]  - [  -0.0004043400000000, -0.0002334500000000,  0.0005455600000000 ]  - [  -0.0010242300000000,  0.0005913400000000,  0.0007972100000000 ]  - [   0.0010242300000000,  0.0005913400000000,  0.0007972100000000 ]  - [   0.0000000000000000,  0.0002992300000000,  0.0030136400000000 ]  - [   0.0000000000000000,  0.0003045600000000,  0.0031719200000000 ]  - [   0.0010222200000000,  0.0005901800000000,  0.0009606000000000 ]  - [  -0.0010222200000000,  0.0005901800000000,  0.0009606000000000 ]  - [  -0.0003968400000000, -0.0002291100000000,  0.0007016900000000 ]  - [   0.0003968400000000, -0.0002291100000000,  0.0007016900000000 ]  - [   0.0000000000000000, -0.0011803600000000,  0.0009606000000000 ]  - [   0.0002637600000000, -0.0001522800000000,  0.0031719200000000 ]  - [   0.0000000000000000,  0.0004582300000000,  0.0007016900000000 ]  - [  -0.0002637600000000, -0.0001522800000000,  0.0031719200000000 ]  - [   0.0000000000000000, -0.0089909000000000,  0.0060987200000000 ]  - [  -0.0045322000000000, -0.0026166700000000,  0.0004539700000000 ]  - [   0.0045322000000000, -0.0026166700000000,  0.0004539700000000 ]  - [   0.0000530700000000,  0.0000306400000000, -0.0001668000000000 ]  - [  -0.0000530700000000,  0.0000306400000000, -0.0001668000000000 ]  - [   0.0000000000000000,  0.0052333300000000,  0.0004539700000000 ]  - [  -0.0077863500000000,  0.0044954500000000,  0.0060987200000000 ]  - [   0.0000000000000000, -0.0000612800000000, -0.0001668000000000 ]  - [   0.0077863500000000,  0.0044954500000000,  0.0060987200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0908182800000000 ]  - [  -0.0000129900000000,  0.0004978200000000, -0.0025066000000000 ]  - [   0.0000129900000000,  0.0004978200000000, -0.0025066000000000 ]  - [  -0.0004246300000000, -0.0002601600000000, -0.0025066000000000 ]  - [   0.0004246300000000, -0.0002601600000000, -0.0025066000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015366100000000 ]  - [  -0.0004376200000000, -0.0002376600000000, -0.0025066000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015289400000000 ]  - [   0.0004376200000000, -0.0002376600000000, -0.0025066000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0021327700000000 ]  - [  -0.0000041100000000,  0.0000081600000000,  0.0012081000000000 ]  - [   0.0000041100000000,  0.0000081600000000,  0.0012081000000000 ]  - [  -0.0000050100000000, -0.0000076300000000,  0.0012081000000000 ]  - [   0.0000050100000000, -0.0000076300000000,  0.0012081000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010098000000000 ]  - [  -0.0000091200000000, -0.0000005200000000,  0.0012081000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010063300000000 ]  - [   0.0000091200000000, -0.0000005200000000,  0.0012081000000000 ]  - [  -0.0005621700000000, -0.0003245700000000, -0.0033762100000000 ]  - [   0.0000000000000000,  0.0000530600000000, -0.0006971400000000 ]  - [   0.0005621700000000, -0.0003245700000000, -0.0033762100000000 ]  - [   0.0000000000000000, -0.0007198700000000, -0.0016594400000000 ]  - [   0.0000459500000000, -0.0000265300000000, -0.0006971400000000 ]  - [  -0.0000459500000000, -0.0000265300000000, -0.0006971400000000 ]  - [  -0.0006234300000000,  0.0003599400000000, -0.0016594400000000 ]  - [   0.0006234300000000,  0.0003599400000000, -0.0016594400000000 ]  - [   0.0000000000000000,  0.0006491400000000, -0.0033762100000000 ]  - [   0.0002821300000000,  0.0001628900000000,  0.0090492900000000 ]  - [   0.0000000000000000, -0.0011839400000000,  0.0017531000000000 ]  - [  -0.0002821300000000,  0.0001628900000000,  0.0090492900000000 ]  - [   0.0000000000000000,  0.0024634900000000,  0.0021193600000000 ]  - [  -0.0010253200000000,  0.0005919700000000,  0.0017531000000000 ]  - [   0.0010253200000000,  0.0005919700000000,  0.0017531000000000 ]  - [   0.0021334400000000, -0.0012317400000000,  0.0021193600000000 ]  - [  -0.0021334400000000, -0.0012317400000000,  0.0021193600000000 ]  - [   0.0000000000000000, -0.0003257700000000,  0.0090492900000000 ]  - [   0.0000000000000000,  0.0000229400000000,  0.0087131400000000 ]  - [  -0.0021332800000000, -0.0012316500000000,  0.0015070800000000 ]  - [   0.0021332800000000, -0.0012316500000000,  0.0015070800000000 ]  - [   0.0010362300000000,  0.0005982700000000,  0.0011415300000000 ]  - [  -0.0010362300000000,  0.0005982700000000,  0.0011415300000000 ]  - [   0.0000000000000000,  0.0024633000000000,  0.0015070800000000 ]  - [   0.0000198700000000, -0.0000114700000000,  0.0087131400000000 ]  - [   0.0000000000000000, -0.0011965400000000,  0.0011415300000000 ]  - [  -0.0000198700000000, -0.0000114700000000,  0.0087131400000000 ]  - [   0.0000000000000000,  0.0006464900000000, -0.0040100500000000 ]  - [   0.0006211700000000,  0.0003586400000000, -0.0022864400000000 ]  - [  -0.0006211700000000,  0.0003586400000000, -0.0022864400000000 ]  - [  -0.0000437100000000, -0.0000252400000000, -0.0013273600000000 ]  - [   0.0000437100000000, -0.0000252400000000, -0.0013273600000000 ]  - [   0.0000000000000000, -0.0007172700000000, -0.0022864400000000 ]  - [   0.0005598800000000, -0.0003232400000000, -0.0040100500000000 ]  - [   0.0000000000000000,  0.0000504700000000, -0.0013273600000000 ]  - [  -0.0005598800000000, -0.0003232400000000, -0.0040100500000000 ]- atom:   55  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0189441900000000,  0.0000175400000000, -0.0000886900000000 ]  - [  -0.0047699800000000,  0.0013155800000000,  0.0037603600000000 ]  - [  -0.0047507000000000, -0.0013145200000000, -0.0038963500000000 ]  - [   0.0002830100000000,  0.0050375900000000, -0.0033456000000000 ]  - [   0.0002700400000000, -0.0050517200000000,  0.0031994600000000 ]  - [  -0.0008085200000000, -0.0000045400000000, -0.0000820200000000 ]  - [   0.0010154000000000,  0.0011736300000000,  0.0004630600000000 ]  - [  -0.0016101600000000,  0.0000006900000000, -0.0000779400000000 ]  - [   0.0009618800000000, -0.0011918200000000, -0.0006497100000000 ]  - [   0.0036048500000000, -0.0000032800000000, -0.0000890600000000 ]  - [  -0.0021741300000000, -0.0009272300000000, -0.0016517600000000 ]  - [  -0.0021736600000000,  0.0009351500000000,  0.0014808400000000 ]  - [   0.0005322800000000,  0.0012243900000000, -0.0001860900000000 ]  - [   0.0005291400000000, -0.0012355600000000,  0.0000058600000000 ]  - [  -0.0008849600000000, -0.0000026500000000, -0.0000890400000000 ]  - [   0.0010450900000000,  0.0021961000000000, -0.0017513500000000 ]  - [  -0.0024523300000000, -0.0000036500000000, -0.0000870600000000 ]  - [   0.0010538500000000, -0.0021899600000000,  0.0015750700000000 ]  - [   0.0291466400000000, -0.0083173400000000,  0.0066590800000000 ]  - [   0.0310376800000000,  0.0094582000000000, -0.0071088600000000 ]  - [  -0.0063063200000000, -0.0000080600000000,  0.0000894500000000 ]  - [  -0.0019529700000000,  0.0024993300000000, -0.0001022800000000 ]  - [   0.0039798300000000,  0.0000015500000000,  0.0000875400000000 ]  - [  -0.0019601400000000, -0.0025234200000000,  0.0002758800000000 ]  - [   0.0147036300000000, -0.0000666600000000,  0.0000657000000000 ]  - [  -0.0026603200000000,  0.0038524200000000,  0.0010114900000000 ]  - [  -0.0026604600000000, -0.0038135800000000, -0.0008394800000000 ]  - [   0.0004704900000000,  0.0000658200000000,  0.0007029500000000 ]  - [   0.0004733800000000, -0.0000604400000000, -0.0005449400000000 ]  - [  -0.0009878000000000, -0.0000019400000000,  0.0000819900000000 ]  - [  -0.0001370400000000,  0.0004891400000000,  0.0000165300000000 ]  - [   0.0002928200000000,  0.0000001800000000,  0.0000807000000000 ]  - [  -0.0001424400000000, -0.0004901700000000,  0.0001468200000000 ]  - [   0.0005808700000000, -0.0000019100000000,  0.0000791000000000 ]  - [  -0.0002495400000000,  0.0003148000000000, -0.0007348600000000 ]  - [  -0.0002527600000000, -0.0003128800000000,  0.0009026000000000 ]  - [   0.0004815800000000, -0.0006273100000000, -0.0005676300000000 ]  - [   0.0004950300000000,  0.0006330700000000,  0.0005563300000000 ]  - [  -0.0008251000000000,  0.0000026500000000,  0.0000016700000000 ]  - [  -0.0007841100000000,  0.0004353600000000, -0.0006209200000000 ]  - [   0.0015809500000000,  0.0000018300000000, -0.0000040600000000 ]  - [  -0.0007809500000000, -0.0004362700000000,  0.0006219200000000 ]  - [  -0.0000279100000000, -0.0000077400000000, -0.0000058500000000 ]  - [   0.0000020300000000,  0.0004779100000000, -0.0000424900000000 ]  - [   0.0000023500000000, -0.0004781900000000,  0.0000438500000000 ]  - [   0.0083077200000000,  0.0018347500000000,  0.0002708600000000 ]  - [   0.0086535300000000, -0.0020132500000000,  0.0000069100000000 ]  - [  -0.0037923500000000,  0.0000072400000000, -0.0000087900000000 ]  - [  -0.0018873300000000,  0.0015738600000000,  0.0021283500000000 ]  - [   0.0051483200000000, -0.0000814700000000, -0.0000830200000000 ]  - [  -0.0018980600000000, -0.0015831000000000, -0.0021400000000000 ]  - [   0.0008384600000000, -0.0000063200000000,  0.0000108800000000 ]  - [  -0.0004269900000000,  0.0019353600000000,  0.0010308100000000 ]  - [  -0.0004349700000000, -0.0019460000000000, -0.0010286700000000 ]  - [  -0.1472094600000000, -0.0009328700000000,  0.0008228700000000 ]  - [   0.0247929400000000, -0.0032544300000000,  0.0017640100000000 ]  - [   0.0244847200000000,  0.0032328500000000, -0.0011689900000000 ]  - [   0.0000957900000000, -0.0173561900000000, -0.0037874000000000 ]  - [   0.0001077400000000,  0.0174695000000000,  0.0043831300000000 ]  - [   0.0030442000000000,  0.0000178800000000,  0.0002905400000000 ]  - [   0.0000371200000000, -0.0109260400000000, -0.0023471400000000 ]  - [   0.0030487500000000, -0.0000054000000000,  0.0002923200000000 ]  - [   0.0001604800000000,  0.0109151100000000,  0.0028928600000000 ]  - [  -0.0010398300000000, -0.0000050700000000,  0.0003140400000000 ]  - [   0.0004891300000000,  0.0000152500000000,  0.0008747100000000 ]  - [   0.0004938000000000, -0.0000198800000000, -0.0002747200000000 ]  - [  -0.0002488700000000, -0.0004138500000000,  0.0001362000000000 ]  - [  -0.0002381900000000,  0.0004015600000000,  0.0004681600000000 ]  - [   0.0004856300000000,  0.0000004200000000,  0.0003082500000000 ]  - [  -0.0002499700000000, -0.0004349500000000,  0.0007151500000000 ]  - [   0.0004898100000000,  0.0000094500000000,  0.0002990400000000 ]  - [  -0.0002394400000000,  0.0004465500000000, -0.0001093600000000 ]  - [   0.0001725500000000, -0.0021013600000000,  0.0184146000000000 ]  - [   0.0000989200000000,  0.0020861400000000, -0.0191451400000000 ]  - [   0.0043014800000000,  0.0000033600000000, -0.0003026100000000 ]  - [   0.0014475700000000, -0.0016285800000000,  0.0002762100000000 ]  - [  -0.0029036600000000,  0.0000045800000000, -0.0002991300000000 ]  - [   0.0014639700000000,  0.0016532000000000, -0.0008654000000000 ]  - [  -0.0034878600000000,  0.0000402700000000, -0.0002169900000000 ]  - [   0.0011396500000000, -0.0023483700000000, -0.0024918600000000 ]  - [   0.0011530800000000,  0.0023315400000000,  0.0018885900000000 ]  - [  -0.0013366100000000, -0.0050767700000000, -0.0049851400000000 ]  - [  -0.0013113200000000,  0.0050923100000000,  0.0044097000000000 ]  - [   0.0034413000000000, -0.0000086000000000, -0.0002907300000000 ]  - [   0.0000823300000000, -0.0019369300000000, -0.0013870900000000 ]  - [   0.0001805900000000,  0.0000098900000000, -0.0003020500000000 ]  - [   0.0000768200000000,  0.0019481400000000,  0.0007871600000000 ]  - [  -0.0101322900000000, -0.0000128500000000, -0.0002958800000000 ]  - [   0.0052355100000000, -0.0029144800000000,  0.0026413800000000 ]  - [   0.0052305700000000,  0.0029154500000000, -0.0032388700000000 ]- atom:   55  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0292470900000000 ]  - [   0.0033261000000000, -0.0011721500000000,  0.0012267400000000 ]  - [  -0.0033261000000000, -0.0011721500000000,  0.0012267400000000 ]  - [  -0.0006479400000000,  0.0034665600000000,  0.0012267400000000 ]  - [   0.0006479400000000,  0.0034665600000000,  0.0012267400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011008000000000 ]  - [   0.0026781600000000, -0.0022944100000000,  0.0012267400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010921800000000 ]  - [  -0.0026781600000000, -0.0022944100000000,  0.0012267400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0046921000000000 ]  - [  -0.0019912000000000, -0.0005803300000000, -0.0027021000000000 ]  - [   0.0019912000000000, -0.0005803300000000, -0.0027021000000000 ]  - [   0.0014981800000000, -0.0014342600000000, -0.0027021000000000 ]  - [  -0.0014981800000000, -0.0014342600000000, -0.0027021000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012273000000000 ]  - [  -0.0004930200000000,  0.0020145900000000, -0.0027021000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0016519400000000 ]  - [   0.0004930200000000,  0.0020145900000000, -0.0027021000000000 ]  - [   0.0044558100000000, -0.0025725600000000,  0.0187146600000000 ]  - [  -0.0044558100000000, -0.0025725600000000,  0.0187146600000000 ]  - [   0.0000000000000000,  0.0000763400000000,  0.0020463100000000 ]  - [  -0.0000661100000000, -0.0000381700000000,  0.0020463100000000 ]  - [   0.0000000000000000,  0.0003926100000000,  0.0032848500000000 ]  - [   0.0000661100000000, -0.0000381700000000,  0.0020463100000000 ]  - [   0.0000000000000000,  0.0051451200000000,  0.0187146600000000 ]  - [   0.0003400100000000, -0.0001963100000000,  0.0032848500000000 ]  - [  -0.0003400100000000, -0.0001963100000000,  0.0032848500000000 ]  - [  -0.0000026700000000,  0.0000015400000000, -0.0031874300000000 ]  - [   0.0000026700000000,  0.0000015400000000, -0.0031874300000000 ]  - [   0.0000000000000000, -0.0004897900000000, -0.0018403700000000 ]  - [   0.0004241700000000,  0.0002449000000000, -0.0018403700000000 ]  - [   0.0000000000000000,  0.0006351700000000, -0.0027534700000000 ]  - [  -0.0004241700000000,  0.0002449000000000, -0.0018403700000000 ]  - [   0.0000000000000000, -0.0000030900000000, -0.0031874300000000 ]  - [   0.0005500800000000, -0.0003175900000000, -0.0027534700000000 ]  - [  -0.0005500800000000, -0.0003175900000000, -0.0027534700000000 ]  - [  -0.0015203100000000, -0.0008777500000000, -0.0036885000000000 ]  - [   0.0015203100000000, -0.0008777500000000, -0.0036885000000000 ]  - [   0.0000000000000000, -0.0001490500000000, -0.0010187800000000 ]  - [  -0.0009155600000000,  0.0005286000000000, -0.0019752900000000 ]  - [   0.0000000000000000,  0.0017555000000000, -0.0036885000000000 ]  - [   0.0009155600000000,  0.0005286000000000, -0.0019752900000000 ]  - [   0.0000000000000000, -0.0010572000000000, -0.0019752900000000 ]  - [   0.0001290800000000,  0.0000745300000000, -0.0010187800000000 ]  - [  -0.0001290800000000,  0.0000745300000000, -0.0010187800000000 ]  - [  -0.0041153100000000, -0.0023759800000000,  0.0090357000000000 ]  - [   0.0041153100000000, -0.0023759800000000,  0.0090357000000000 ]  - [   0.0000000000000000, -0.0004226000000000,  0.0014542200000000 ]  - [   0.0006865000000000, -0.0003963500000000,  0.0018142800000000 ]  - [   0.0000000000000000,  0.0047519500000000,  0.0090357000000000 ]  - [  -0.0006865000000000, -0.0003963500000000,  0.0018142800000000 ]  - [   0.0000000000000000,  0.0007927100000000,  0.0018142800000000 ]  - [   0.0003659800000000,  0.0002113000000000,  0.0014542200000000 ]  - [  -0.0003659800000000,  0.0002113000000000,  0.0014542200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1297944700000000 ]  - [  -0.0015004900000000,  0.0038880200000000, -0.0084636800000000 ]  - [   0.0015004900000000,  0.0038880200000000, -0.0084636800000000 ]  - [  -0.0026168800000000, -0.0032434700000000, -0.0084636800000000 ]  - [   0.0026168800000000, -0.0032434700000000, -0.0084636800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0028556300000000 ]  - [  -0.0041173700000000, -0.0006445500000000, -0.0084636800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0028501200000000 ]  - [   0.0041173700000000, -0.0006445500000000, -0.0084636800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0060305100000000 ]  - [  -0.0005688000000000, -0.0001471100000000,  0.0039529600000000 ]  - [   0.0005688000000000, -0.0001471100000000,  0.0039529600000000 ]  - [   0.0004118100000000, -0.0004190400000000,  0.0039529600000000 ]  - [  -0.0004118100000000, -0.0004190400000000,  0.0039529600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029291000000000 ]  - [  -0.0001570000000000,  0.0005661600000000,  0.0039529600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029245700000000 ]  - [   0.0001570000000000,  0.0005661600000000,  0.0039529600000000 ]  - [   0.0186589600000000, -0.0107727600000000,  0.0120435600000000 ]  - [  -0.0186589600000000, -0.0107727600000000,  0.0120435600000000 ]  - [   0.0000000000000000, -0.0006569200000000, -0.0006145400000000 ]  - [   0.0005689100000000,  0.0003284600000000, -0.0006145400000000 ]  - [   0.0000000000000000, -0.0025173600000000, -0.0007458600000000 ]  - [  -0.0005689100000000,  0.0003284600000000, -0.0006145400000000 ]  - [   0.0000000000000000,  0.0215455200000000,  0.0120435600000000 ]  - [  -0.0021801000000000,  0.0012586800000000, -0.0007458600000000 ]  - [   0.0021801000000000,  0.0012586800000000, -0.0007458600000000 ]  - [  -0.0047177600000000,  0.0027238000000000,  0.0072585500000000 ]  - [   0.0047177600000000,  0.0027238000000000,  0.0072585500000000 ]  - [   0.0000000000000000,  0.0012444300000000,  0.0008516000000000 ]  - [  -0.0010777100000000, -0.0006222100000000,  0.0008516000000000 ]  - [   0.0000000000000000,  0.0033954800000000,  0.0045417700000000 ]  - [   0.0010777100000000, -0.0006222100000000,  0.0008516000000000 ]  - [   0.0000000000000000, -0.0054476000000000,  0.0072585500000000 ]  - [   0.0029405700000000, -0.0016977400000000,  0.0045417700000000 ]  - [  -0.0029405700000000, -0.0016977400000000,  0.0045417700000000 ]- atom:   55  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0323146800000000 ]  - [  -0.0033380800000000,  0.0011710200000000, -0.0013585300000000 ]  - [   0.0033380800000000,  0.0011710200000000, -0.0013585300000000 ]  - [   0.0006549100000000, -0.0034763700000000, -0.0013585300000000 ]  - [  -0.0006549100000000, -0.0034763700000000, -0.0013585300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012136800000000 ]  - [  -0.0026831700000000,  0.0023053500000000, -0.0013585300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012072800000000 ]  - [   0.0026831700000000,  0.0023053500000000, -0.0013585300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045442000000000 ]  - [   0.0019810800000000,  0.0005709900000000,  0.0025867600000000 ]  - [  -0.0019810800000000,  0.0005709900000000,  0.0025867600000000 ]  - [  -0.0014850300000000,  0.0014301700000000,  0.0025867600000000 ]  - [   0.0014850300000000,  0.0014301700000000,  0.0025867600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010997500000000 ]  - [   0.0004960400000000, -0.0020011600000000,  0.0025867600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015500100000000 ]  - [  -0.0004960400000000, -0.0020011600000000,  0.0025867600000000 ]  - [  -0.0045840500000000,  0.0026466000000000, -0.0186440800000000 ]  - [   0.0045840500000000,  0.0026466000000000, -0.0186440800000000 ]  - [   0.0000000000000000, -0.0000692800000000, -0.0019279000000000 ]  - [   0.0000600000000000,  0.0000346400000000, -0.0019279000000000 ]  - [   0.0000000000000000, -0.0003804200000000, -0.0031625300000000 ]  - [  -0.0000600000000000,  0.0000346400000000, -0.0019279000000000 ]  - [   0.0000000000000000, -0.0052932100000000, -0.0186440800000000 ]  - [  -0.0003294600000000,  0.0001902100000000, -0.0031625300000000 ]  - [   0.0003294600000000,  0.0001902100000000, -0.0031625300000000 ]  - [  -0.0000042300000000,  0.0000024400000000,  0.0033069800000000 ]  - [   0.0000042300000000,  0.0000024400000000,  0.0033069800000000 ]  - [   0.0000000000000000,  0.0004703300000000,  0.0019685000000000 ]  - [  -0.0004073200000000, -0.0002351700000000,  0.0019685000000000 ]  - [   0.0000000000000000, -0.0006315400000000,  0.0028780200000000 ]  - [   0.0004073200000000, -0.0002351700000000,  0.0019685000000000 ]  - [   0.0000000000000000, -0.0000048900000000,  0.0033069800000000 ]  - [  -0.0005469300000000,  0.0003157700000000,  0.0028780200000000 ]  - [   0.0005469300000000,  0.0003157700000000,  0.0028780200000000 ]  - [   0.0015278600000000,  0.0008821100000000,  0.0037006200000000 ]  - [  -0.0015278600000000,  0.0008821100000000,  0.0037006200000000 ]  - [   0.0000000000000000,  0.0001395000000000,  0.0010035700000000 ]  - [   0.0009218800000000, -0.0005322500000000,  0.0019745700000000 ]  - [   0.0000000000000000, -0.0017642200000000,  0.0037006200000000 ]  - [  -0.0009218800000000, -0.0005322500000000,  0.0019745700000000 ]  - [   0.0000000000000000,  0.0010644900000000,  0.0019745700000000 ]  - [  -0.0001208100000000, -0.0000697500000000,  0.0010035700000000 ]  - [   0.0001208100000000, -0.0000697500000000,  0.0010035700000000 ]  - [   0.0038033900000000,  0.0021958900000000, -0.0087262300000000 ]  - [  -0.0038033900000000,  0.0021958900000000, -0.0087262300000000 ]  - [   0.0000000000000000,  0.0004231000000000, -0.0014479600000000 ]  - [  -0.0006805700000000,  0.0003929300000000, -0.0018149500000000 ]  - [   0.0000000000000000, -0.0043917700000000, -0.0087262300000000 ]  - [   0.0006805700000000,  0.0003929300000000, -0.0018149500000000 ]  - [   0.0000000000000000, -0.0007858500000000, -0.0018149500000000 ]  - [  -0.0003664100000000, -0.0002115500000000, -0.0014479600000000 ]  - [   0.0003664100000000, -0.0002115500000000, -0.0014479600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1330106300000000 ]  - [   0.0014269800000000, -0.0038518300000000,  0.0090589800000000 ]  - [  -0.0014269800000000, -0.0038518300000000,  0.0090589800000000 ]  - [   0.0026222900000000,  0.0031617200000000,  0.0090589800000000 ]  - [  -0.0026222900000000,  0.0031617200000000,  0.0090589800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034622200000000 ]  - [   0.0040492700000000,  0.0006901100000000,  0.0090589800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034703200000000 ]  - [  -0.0040492700000000,  0.0006901100000000,  0.0090589800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054197600000000 ]  - [   0.0005795200000000,  0.0001436300000000, -0.0033472200000000 ]  - [  -0.0005795200000000,  0.0001436300000000, -0.0033472200000000 ]  - [  -0.0004141500000000,  0.0004300700000000, -0.0033472200000000 ]  - [   0.0004141500000000,  0.0004300700000000, -0.0033472200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023221200000000 ]  - [   0.0001653700000000, -0.0005737000000000, -0.0033472200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023155200000000 ]  - [  -0.0001653700000000, -0.0005737000000000, -0.0033472200000000 ]  - [  -0.0189034800000000,  0.0109139300000000, -0.0127694300000000 ]  - [   0.0189034800000000,  0.0109139300000000, -0.0127694300000000 ]  - [   0.0000000000000000,  0.0006616900000000,  0.0000133800000000 ]  - [  -0.0005730400000000, -0.0003308500000000,  0.0000133800000000 ]  - [   0.0000000000000000,  0.0025266600000000,  0.0001402300000000 ]  - [   0.0005730400000000, -0.0003308500000000,  0.0000133800000000 ]  - [   0.0000000000000000, -0.0218278600000000, -0.0127694300000000 ]  - [   0.0021881500000000, -0.0012633300000000,  0.0001402300000000 ]  - [  -0.0021881500000000, -0.0012633300000000,  0.0001402300000000 ]  - [   0.0046799200000000, -0.0027019500000000, -0.0078469200000000 ]  - [  -0.0046799200000000, -0.0027019500000000, -0.0078469200000000 ]  - [   0.0000000000000000, -0.0012539300000000, -0.0014741300000000 ]  - [   0.0010859300000000,  0.0006269600000000, -0.0014741300000000 ]  - [   0.0000000000000000, -0.0033939100000000, -0.0051663900000000 ]  - [  -0.0010859300000000,  0.0006269600000000, -0.0014741300000000 ]  - [   0.0000000000000000,  0.0054039000000000, -0.0078469200000000 ]  - [  -0.0029392100000000,  0.0016969500000000, -0.0051663900000000 ]  - [   0.0029392100000000,  0.0016969500000000, -0.0051663900000000 ]