# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/d42d339b-5a94-4132-96a8-b1b140e6b509/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 AgNO2 / Imm2 (44) / materials id 5770](https://mdr.nims.go.jp/datasets/5a0b2873-bd90-4cdb-bea0-f05cb4258a96)

## 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: "Imm2"  number: 44  Hall_symbol: "I 2 -2"primitive_matrix:- [ -0.500000000000000,  0.500000000000000,  0.500000000000000 ]- [  0.500000000000000, -0.500000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.500000000000000, -0.500000000000000 ]supercell_matrix:- [   3,   0,   0 ]- [   0,   2,   0 ]- [   0,   0,   3 ]primitive_cell:  lattice:  - [    -1.645939165000000,     3.208233940000000,     2.498463505000000 ] # a  - [     1.645939165000000,    -3.208233940000000,     2.498463505000000 ] # b  - [     1.645939165000000,     3.208233940000000,    -2.498463505000000 ] # c  points:  - symbol: N  # 1    coordinates: [  0.609544430000000,  0.609544430000000,  0.000000000000000 ]    mass: 14.006700  - symbol: O  # 2    coordinates: [  0.638497110000000,  0.473061730000000,  0.165435380000000 ]    mass: 15.999400  - symbol: O  # 3    coordinates: [  0.307626350000000,  0.473061730000000,  0.834564620000000 ]    mass: 15.999400  - symbol: Ag # 4    coordinates: [  0.044332140000000,  0.044332140000000,  0.000000000000000 ]    mass: 107.868200  reciprocal_lattice: # without 2pi  - [    -0.000000000000000,     0.155848984005200,     0.200122995192599 ] # a*  - [     0.303777934587273,     0.000000000000000,     0.200122995192599 ] # b*  - [     0.303777934587273,     0.155848984005200,     0.000000000000000 ] # c*unit_cell:  lattice:  - [     3.291878330000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     6.416467880000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,     4.996927010000000 ] # c  points:  - symbol: N  # 1    coordinates: [  0.500000000000000,  0.500000000000000,  0.109544430000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.609544430000000 ]    mass: 14.006700    reduced_to: 1  - symbol: O  # 3    coordinates: [  0.500000000000000,  0.665435380000000,  0.973061730000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 4    coordinates: [  0.500000000000000,  0.334564620000000,  0.973061730000000 ]    mass: 15.999400    reduced_to: 4  - symbol: O  # 5    coordinates: [  0.000000000000000,  0.165435380000000,  0.473061730000000 ]    mass: 15.999400    reduced_to: 3  - symbol: O  # 6    coordinates: [  0.000000000000000,  0.834564620000000,  0.473061730000000 ]    mass: 15.999400    reduced_to: 4  - symbol: Ag # 7    coordinates: [  0.500000000000000,  0.500000000000000,  0.544332140000000 ]    mass: 107.868200    reduced_to: 7  - symbol: Ag # 8    coordinates: [  0.000000000000000,  0.000000000000000,  0.044332140000000 ]    mass: 107.868200    reduced_to: 7supercell:  lattice:  - [     9.875634990000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    12.832935760000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    14.990781030000001 ] # c  points:  - symbol: N  # 1    coordinates: [  0.166666666666667,  0.250000000000000,  0.036514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 2    coordinates: [  0.500000000000000,  0.250000000000000,  0.036514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 3    coordinates: [  0.833333333333333,  0.250000000000000,  0.036514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 4    coordinates: [  0.166666666666667,  0.750000000000000,  0.036514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 5    coordinates: [  0.500000000000000,  0.750000000000000,  0.036514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 6    coordinates: [  0.833333333333333,  0.750000000000000,  0.036514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 7    coordinates: [  0.166666666666667,  0.250000000000000,  0.369848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 8    coordinates: [  0.500000000000000,  0.250000000000000,  0.369848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 9    coordinates: [  0.833333333333333,  0.250000000000000,  0.369848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 10    coordinates: [  0.166666666666667,  0.750000000000000,  0.369848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 11    coordinates: [  0.500000000000000,  0.750000000000000,  0.369848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 12    coordinates: [  0.833333333333333,  0.750000000000000,  0.369848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 13    coordinates: [  0.166666666666667,  0.250000000000000,  0.703181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 14    coordinates: [  0.500000000000000,  0.250000000000000,  0.703181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 15    coordinates: [  0.833333333333333,  0.250000000000000,  0.703181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 16    coordinates: [  0.166666666666667,  0.750000000000000,  0.703181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 17    coordinates: [  0.500000000000000,  0.750000000000000,  0.703181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 18    coordinates: [  0.833333333333333,  0.750000000000000,  0.703181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 19    coordinates: [  0.000000000000000,  0.000000000000000,  0.203181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 20    coordinates: [  0.333333333333333,  0.000000000000000,  0.203181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 21    coordinates: [  0.666666666666667,  0.000000000000000,  0.203181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 22    coordinates: [  0.000000000000000,  0.500000000000000,  0.203181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 23    coordinates: [  0.333333333333333,  0.500000000000000,  0.203181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 24    coordinates: [  0.666666666666667,  0.500000000000000,  0.203181476666667 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 25    coordinates: [  0.000000000000000,  0.000000000000000,  0.536514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 26    coordinates: [  0.333333333333333,  0.000000000000000,  0.536514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 27    coordinates: [  0.666666666666667,  0.000000000000000,  0.536514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 28    coordinates: [  0.000000000000000,  0.500000000000000,  0.536514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 29    coordinates: [  0.333333333333333,  0.500000000000000,  0.536514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 30    coordinates: [  0.666666666666667,  0.500000000000000,  0.536514810000000 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 31    coordinates: [  0.000000000000000,  0.000000000000000,  0.869848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 32    coordinates: [  0.333333333333333,  0.000000000000000,  0.869848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 33    coordinates: [  0.666666666666667,  0.000000000000000,  0.869848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 34    coordinates: [  0.000000000000000,  0.500000000000000,  0.869848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 35    coordinates: [  0.333333333333333,  0.500000000000000,  0.869848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: N  # 36    coordinates: [  0.666666666666667,  0.500000000000000,  0.869848143333333 ]    mass: 14.006700    reduced_to: 1  - symbol: O  # 37    coordinates: [  0.166666666666667,  0.332717690000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.500000000000000,  0.332717690000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 39    coordinates: [  0.833333333333333,  0.332717690000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 40    coordinates: [  0.166666666666667,  0.832717690000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 41    coordinates: [  0.500000000000000,  0.832717690000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 42    coordinates: [  0.833333333333333,  0.832717690000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 43    coordinates: [  0.166666666666667,  0.332717690000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 44    coordinates: [  0.500000000000000,  0.332717690000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 45    coordinates: [  0.833333333333333,  0.332717690000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 46    coordinates: [  0.166666666666667,  0.832717690000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 47    coordinates: [  0.500000000000000,  0.832717690000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 48    coordinates: [  0.833333333333333,  0.832717690000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 49    coordinates: [  0.166666666666667,  0.332717690000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 50    coordinates: [  0.500000000000000,  0.332717690000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 51    coordinates: [  0.833333333333333,  0.332717690000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 52    coordinates: [  0.166666666666667,  0.832717690000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 53    coordinates: [  0.500000000000000,  0.832717690000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 54    coordinates: [  0.833333333333333,  0.832717690000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 55    coordinates: [  0.166666666666667,  0.167282310000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 56    coordinates: [  0.500000000000000,  0.167282310000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 57    coordinates: [  0.833333333333333,  0.167282310000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 58    coordinates: [  0.166666666666667,  0.667282310000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 59    coordinates: [  0.500000000000000,  0.667282310000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 60    coordinates: [  0.833333333333333,  0.667282310000000,  0.324353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 61    coordinates: [  0.166666666666667,  0.167282310000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 62    coordinates: [  0.500000000000000,  0.167282310000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 63    coordinates: [  0.833333333333333,  0.167282310000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 64    coordinates: [  0.166666666666667,  0.667282310000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 65    coordinates: [  0.500000000000000,  0.667282310000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 66    coordinates: [  0.833333333333333,  0.667282310000000,  0.657687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 67    coordinates: [  0.166666666666667,  0.167282310000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 68    coordinates: [  0.500000000000000,  0.167282310000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 69    coordinates: [  0.833333333333333,  0.167282310000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 70    coordinates: [  0.166666666666667,  0.667282310000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 71    coordinates: [  0.500000000000000,  0.667282310000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 72    coordinates: [  0.833333333333333,  0.667282310000000,  0.991020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 73    coordinates: [  0.000000000000000,  0.082717690000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 74    coordinates: [  0.333333333333333,  0.082717690000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 75    coordinates: [  0.666666666666667,  0.082717690000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 76    coordinates: [  0.000000000000000,  0.582717690000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 77    coordinates: [  0.333333333333333,  0.582717690000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 78    coordinates: [  0.666666666666667,  0.582717690000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 79    coordinates: [  0.000000000000000,  0.082717690000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 80    coordinates: [  0.333333333333333,  0.082717690000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 81    coordinates: [  0.666666666666667,  0.082717690000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 82    coordinates: [  0.000000000000000,  0.582717690000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 83    coordinates: [  0.333333333333333,  0.582717690000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 84    coordinates: [  0.666666666666667,  0.582717690000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 85    coordinates: [  0.000000000000000,  0.082717690000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 86    coordinates: [  0.333333333333333,  0.082717690000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 87    coordinates: [  0.666666666666667,  0.082717690000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 88    coordinates: [  0.000000000000000,  0.582717690000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 89    coordinates: [  0.333333333333333,  0.582717690000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 90    coordinates: [  0.666666666666667,  0.582717690000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 91    coordinates: [  0.000000000000000,  0.417282310000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 92    coordinates: [  0.333333333333333,  0.417282310000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 93    coordinates: [  0.666666666666667,  0.417282310000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 94    coordinates: [  0.000000000000000,  0.917282310000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 95    coordinates: [  0.333333333333333,  0.917282310000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 96    coordinates: [  0.666666666666667,  0.917282310000000,  0.157687243333333 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 97    coordinates: [  0.000000000000000,  0.417282310000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 98    coordinates: [  0.333333333333333,  0.417282310000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 99    coordinates: [  0.666666666666667,  0.417282310000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 100    coordinates: [  0.000000000000000,  0.917282310000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 101    coordinates: [  0.333333333333333,  0.917282310000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 102    coordinates: [  0.666666666666667,  0.917282310000000,  0.491020576666667 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 103    coordinates: [  0.000000000000000,  0.417282310000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 104    coordinates: [  0.333333333333333,  0.417282310000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 105    coordinates: [  0.666666666666667,  0.417282310000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 106    coordinates: [  0.000000000000000,  0.917282310000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 107    coordinates: [  0.333333333333333,  0.917282310000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: O  # 108    coordinates: [  0.666666666666667,  0.917282310000000,  0.824353910000000 ]    mass: 15.999400    reduced_to: 55  - symbol: Ag # 109    coordinates: [  0.166666666666667,  0.250000000000000,  0.181444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 110    coordinates: [  0.500000000000000,  0.250000000000000,  0.181444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 111    coordinates: [  0.833333333333333,  0.250000000000000,  0.181444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 112    coordinates: [  0.166666666666667,  0.750000000000000,  0.181444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 113    coordinates: [  0.500000000000000,  0.750000000000000,  0.181444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 114    coordinates: [  0.833333333333333,  0.750000000000000,  0.181444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 115    coordinates: [  0.166666666666667,  0.250000000000000,  0.514777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 116    coordinates: [  0.500000000000000,  0.250000000000000,  0.514777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 117    coordinates: [  0.833333333333333,  0.250000000000000,  0.514777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 118    coordinates: [  0.166666666666667,  0.750000000000000,  0.514777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 119    coordinates: [  0.500000000000000,  0.750000000000000,  0.514777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 120    coordinates: [  0.833333333333333,  0.750000000000000,  0.514777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 121    coordinates: [  0.166666666666667,  0.250000000000000,  0.848110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 122    coordinates: [  0.500000000000000,  0.250000000000000,  0.848110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 123    coordinates: [  0.833333333333333,  0.250000000000000,  0.848110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 124    coordinates: [  0.166666666666667,  0.750000000000000,  0.848110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 125    coordinates: [  0.500000000000000,  0.750000000000000,  0.848110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 126    coordinates: [  0.833333333333333,  0.750000000000000,  0.848110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 127    coordinates: [  0.000000000000000,  0.000000000000000,  0.014777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 128    coordinates: [  0.333333333333333,  0.000000000000000,  0.014777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 129    coordinates: [  0.666666666666667,  0.000000000000000,  0.014777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 130    coordinates: [  0.000000000000000,  0.500000000000000,  0.014777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 131    coordinates: [  0.333333333333333,  0.500000000000000,  0.014777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 132    coordinates: [  0.666666666666667,  0.500000000000000,  0.014777380000000 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 133    coordinates: [  0.000000000000000,  0.000000000000000,  0.348110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 134    coordinates: [  0.333333333333333,  0.000000000000000,  0.348110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 135    coordinates: [  0.666666666666667,  0.000000000000000,  0.348110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 136    coordinates: [  0.000000000000000,  0.500000000000000,  0.348110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 137    coordinates: [  0.333333333333333,  0.500000000000000,  0.348110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 138    coordinates: [  0.666666666666667,  0.500000000000000,  0.348110713333333 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 139    coordinates: [  0.000000000000000,  0.000000000000000,  0.681444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 140    coordinates: [  0.333333333333333,  0.000000000000000,  0.681444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 141    coordinates: [  0.666666666666667,  0.000000000000000,  0.681444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 142    coordinates: [  0.000000000000000,  0.500000000000000,  0.681444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 143    coordinates: [  0.333333333333333,  0.500000000000000,  0.681444046666667 ]    mass: 107.868200    reduced_to: 109  - symbol: Ag # 144    coordinates: [  0.666666666666667,  0.500000000000000,  0.681444046666667 ]    mass: 107.868200    reduced_to: 109born_effective_charge:- # 1 (N)  - [ -0.348314400000000,  0.000000000000000, -0.000000000000000 ]  - [ -0.000000000000000,  3.211721470000001, -0.000000000000000 ]  - [  0.000000000000000, -0.000000000000000,  0.709018620000000 ]- # 2 (O)  - [ -0.385145190000000, -0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000, -2.118870330000000,  1.397287000000000 ]  - [ -0.000000000000000, -0.038315810000000, -0.844759260000000 ]- # 3 (O)  - [ -0.385145190000000, -0.000000000000000, -0.000000000000000 ]  - [  0.000000000000000, -2.118870330000000, -1.397287000000000 ]  - [  0.000000000000000,  0.038315810000000, -0.844759260000000 ]- # 4 (Ag)  - [  1.118604780000000, -0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  1.026019190000000, -0.000000000000000 ]  - [ -0.000000000000000, -0.000000000000000,  0.980499900000000 ]dielectric_constant:  - [  3.339651100000000,  0.000000000000000,  0.000000000000000 ]  - [  0.000000000000000,  5.869631850000000,  0.000000000000000 ]  - [  0.000000000000000,  0.000000000000000,  4.773317020000000 ]displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0503912200000000,  0.0000000000000000, -0.0082904500000000 ]  - [   0.0020828900000000,  0.0000000000000000, -0.0049667000000000 ]  - [   0.0020683100000000,  0.0000000000000000, -0.0067507100000000 ]  - [  -0.0002377300000000,  0.0000000000000000, -0.0058487900000000 ]  - [   0.0001743000000000,  0.0000000000000000, -0.0058715300000000 ]  - [   0.0001762800000000,  0.0000000000000000, -0.0058110600000000 ]  - [   0.0008331900000000,  0.0000000000000000, -0.0058226400000000 ]  - [  -0.0001816500000000,  0.0000000000000000, -0.0057912400000000 ]  - [  -0.0001846200000000,  0.0000000000000000, -0.0058272500000000 ]  - [   0.0000435100000000,  0.0000000000000000, -0.0058104800000000 ]  - [  -0.0000132500000000,  0.0000000000000000, -0.0058067400000000 ]  - [  -0.0000129800000000,  0.0000000000000000, -0.0058134300000000 ]  - [   0.0008317900000000,  0.0000000000000000, -0.0058198800000000 ]  - [  -0.0001829200000000,  0.0000000000000000, -0.0060062400000000 ]  - [  -0.0001822000000000,  0.0000000000000000, -0.0056608200000000 ]  - [   0.0000423500000000,  0.0000000000000000, -0.0058380800000000 ]  - [  -0.0000129700000000,  0.0000000000000000, -0.0058029500000000 ]  - [  -0.0000121100000000,  0.0000000000000000, -0.0058723200000000 ]  - [   0.0004017500000000, -0.0019302100000000, -0.0045967400000000 ]  - [   0.0003535600000000,  0.0018606200000000, -0.0070328100000000 ]  - [   0.0000582000000000, -0.0000015400000000, -0.0058357400000000 ]  - [   0.0004017500000000,  0.0019302100000000, -0.0045967400000000 ]  - [   0.0003535600000000, -0.0018606200000000, -0.0070328100000000 ]  - [   0.0000582000000000,  0.0000015400000000, -0.0058357400000000 ]  - [   0.0000308600000000,  0.0000091200000000, -0.0058189700000000 ]  - [   0.0000317700000000, -0.0000055100000000, -0.0058505700000000 ]  - [  -0.0000234700000000, -0.0000016200000000, -0.0058359300000000 ]  - [   0.0000308600000000, -0.0000091200000000, -0.0058189700000000 ]  - [   0.0000317700000000,  0.0000055100000000, -0.0058505700000000 ]  - [  -0.0000234700000000,  0.0000016200000000, -0.0058359300000000 ]  - [   0.0003679700000000,  0.0015868100000000, -0.0067165700000000 ]  - [   0.0003864800000000, -0.0015803400000000, -0.0049090900000000 ]  - [   0.0000593600000000,  0.0000023700000000, -0.0058141500000000 ]  - [   0.0003679700000000, -0.0015868100000000, -0.0067165700000000 ]  - [   0.0003864800000000,  0.0015803400000000, -0.0049090900000000 ]  - [   0.0000593600000000, -0.0000023700000000, -0.0058141500000000 ]  - [  -0.0011631800000000, -0.0022370600000000,  0.0021583000000000 ]  - [   0.0002366300000000, -0.0022312100000000,  0.0022391400000000 ]  - [   0.0002542500000000, -0.0022960500000000,  0.0020464200000000 ]  - [  -0.0001593800000000, -0.0022591900000000,  0.0021379200000000 ]  - [   0.0000597800000000, -0.0022492400000000,  0.0021877500000000 ]  - [   0.0000737900000000, -0.0022780900000000,  0.0021014900000000 ]  - [  -0.0000673900000000, -0.0022495100000000,  0.0021139900000000 ]  - [   0.0000305000000000, -0.0022676600000000,  0.0021926300000000 ]  - [   0.0000433200000000, -0.0022435200000000,  0.0020244700000000 ]  - [  -0.0000366500000000, -0.0022503200000000,  0.0021133800000000 ]  - [   0.0000057700000000, -0.0022643300000000,  0.0021036900000000 ]  - [   0.0000182200000000, -0.0022468500000000,  0.0021154600000000 ]  - [   0.0252553900000000, -0.0030489800000000,  0.0033526700000000 ]  - [  -0.0002812000000000, -0.0019702500000000,  0.0015091200000000 ]  - [  -0.0002943800000000, -0.0025517400000000,  0.0027545200000000 ]  - [   0.0000116400000000, -0.0022494200000000,  0.0021362800000000 ]  - [   0.0000430400000000, -0.0021976800000000,  0.0020838800000000 ]  - [   0.0000439300000000, -0.0023047500000000,  0.0021702600000000 ]  - [  -0.0011631800000000,  0.0022370600000000,  0.0021583000000000 ]  - [   0.0002366300000000,  0.0022312100000000,  0.0022391400000000 ]  - [   0.0002542500000000,  0.0022960500000000,  0.0020464200000000 ]  - [  -0.0001593800000000,  0.0022591900000000,  0.0021379200000000 ]  - [   0.0000597800000000,  0.0022492400000000,  0.0021877500000000 ]  - [   0.0000737900000000,  0.0022780900000000,  0.0021014900000000 ]  - [  -0.0000673900000000,  0.0022495100000000,  0.0021139900000000 ]  - [   0.0000305000000000,  0.0022676600000000,  0.0021926300000000 ]  - [   0.0000433200000000,  0.0022435200000000,  0.0020244700000000 ]  - [  -0.0000366500000000,  0.0022503200000000,  0.0021133800000000 ]  - [   0.0000057700000000,  0.0022643300000000,  0.0021036900000000 ]  - [   0.0000182200000000,  0.0022468500000000,  0.0021154600000000 ]  - [   0.0252553900000000,  0.0030489800000000,  0.0033526700000000 ]  - [  -0.0002812000000000,  0.0019702500000000,  0.0015091200000000 ]  - [  -0.0002943800000000,  0.0025517400000000,  0.0027545200000000 ]  - [   0.0000116400000000,  0.0022494200000000,  0.0021362800000000 ]  - [   0.0000430400000000,  0.0021976800000000,  0.0020838800000000 ]  - [   0.0000439300000000,  0.0023047500000000,  0.0021702600000000 ]  - [   0.0012217400000000, -0.0000732100000000, -0.0007309800000000 ]  - [   0.0011763600000000, -0.0043551500000000,  0.0049265700000000 ]  - [   0.0001430700000000, -0.0022475300000000,  0.0021165100000000 ]  - [  -0.0002522800000000, -0.0037200600000000,  0.0025152600000000 ]  - [  -0.0002013400000000, -0.0008597400000000,  0.0017295200000000 ]  - [   0.0000352300000000, -0.0022495300000000,  0.0021166100000000 ]  - [  -0.0000294100000000, -0.0022490100000000,  0.0020852600000000 ]  - [  -0.0000299000000000, -0.0022578200000000,  0.0021562700000000 ]  - [   0.0000392300000000, -0.0022484400000000,  0.0021211500000000 ]  - [  -0.0000235600000000, -0.0022606800000000,  0.0021008000000000 ]  - [  -0.0000226800000000, -0.0022433000000000,  0.0021392100000000 ]  - [   0.0000299800000000, -0.0022500200000000,  0.0021224700000000 ]  - [  -0.0005767200000000, -0.0037052200000000,  0.0026397900000000 ]  - [  -0.0005807300000000, -0.0008175300000000,  0.0016515200000000 ]  - [  -0.0000844000000000, -0.0022593100000000,  0.0021424800000000 ]  - [  -0.0000939600000000, -0.0015149600000000,  0.0024563000000000 ]  - [  -0.0000855000000000, -0.0030066800000000,  0.0018158100000000 ]  - [   0.0000028500000000, -0.0022553100000000,  0.0021403800000000 ]  - [   0.0012217400000000,  0.0000732100000000, -0.0007309800000000 ]  - [   0.0011763600000000,  0.0043551500000000,  0.0049265700000000 ]  - [   0.0001430700000000,  0.0022475300000000,  0.0021165100000000 ]  - [  -0.0002522800000000,  0.0037200600000000,  0.0025152600000000 ]  - [  -0.0002013400000000,  0.0008597400000000,  0.0017295200000000 ]  - [   0.0000352300000000,  0.0022495300000000,  0.0021166100000000 ]  - [  -0.0000294100000000,  0.0022490100000000,  0.0020852600000000 ]  - [  -0.0000299000000000,  0.0022578200000000,  0.0021562700000000 ]  - [   0.0000392300000000,  0.0022484400000000,  0.0021211500000000 ]  - [  -0.0000235600000000,  0.0022606800000000,  0.0021008000000000 ]  - [  -0.0000226800000000,  0.0022433000000000,  0.0021392100000000 ]  - [   0.0000299800000000,  0.0022500200000000,  0.0021224700000000 ]  - [  -0.0005767200000000,  0.0037052200000000,  0.0026397900000000 ]  - [  -0.0005807300000000,  0.0008175300000000,  0.0016515200000000 ]  - [  -0.0000844000000000,  0.0022593100000000,  0.0021424800000000 ]  - [  -0.0000939600000000,  0.0015149600000000,  0.0024563000000000 ]  - [  -0.0000855000000000,  0.0030066800000000,  0.0018158100000000 ]  - [   0.0000028500000000,  0.0022553100000000,  0.0021403800000000 ]  - [   0.0033901500000000,  0.0000000000000000,  0.0015044900000000 ]  - [  -0.0005558100000000,  0.0000000000000000,  0.0016500100000000 ]  - [  -0.0005808500000000,  0.0000000000000000,  0.0016459100000000 ]  - [   0.0003533100000000,  0.0000000000000000,  0.0016117700000000 ]  - [  -0.0001690900000000,  0.0000000000000000,  0.0016558000000000 ]  - [  -0.0001814400000000,  0.0000000000000000,  0.0016400300000000 ]  - [   0.0000382600000000,  0.0000000000000000,  0.0015298100000000 ]  - [  -0.0000257100000000,  0.0000000000000000,  0.0014203600000000 ]  - [  -0.0000138200000000,  0.0000000000000000,  0.0016003900000000 ]  - [   0.0000262600000000,  0.0000000000000000,  0.0015299500000000 ]  - [  -0.0000162400000000,  0.0000000000000000,  0.0014672900000000 ]  - [  -0.0000080000000000,  0.0000000000000000,  0.0015529400000000 ]  - [  -0.0084362800000000,  0.0000000000000000,  0.0016435600000000 ]  - [   0.0004543900000000,  0.0000000000000000,  0.0015682800000000 ]  - [   0.0004189600000000,  0.0000000000000000,  0.0015878100000000 ]  - [   0.0000012000000000,  0.0000000000000000,  0.0015719600000000 ]  - [   0.0000080300000000,  0.0000000000000000,  0.0016430800000000 ]  - [  -0.0000302700000000,  0.0000000000000000,  0.0015038900000000 ]  - [  -0.0004645200000000,  0.0003978300000000,  0.0016639600000000 ]  - [  -0.0005107000000000, -0.0003293000000000,  0.0013246300000000 ]  - [  -0.0002133700000000,  0.0000016700000000,  0.0015238100000000 ]  - [  -0.0004645200000000, -0.0003978300000000,  0.0016639600000000 ]  - [  -0.0005107000000000,  0.0003293000000000,  0.0013246300000000 ]  - [  -0.0002133700000000, -0.0000016700000000,  0.0015238100000000 ]  - [   0.0000879900000000, -0.0000274000000000,  0.0017403000000000 ]  - [   0.0000535800000000,  0.0000244000000000,  0.0014134900000000 ]  - [  -0.0000973300000000, -0.0000011500000000,  0.0015730200000000 ]  - [   0.0000879900000000,  0.0000274000000000,  0.0017403000000000 ]  - [   0.0000535800000000, -0.0000244000000000,  0.0014134900000000 ]  - [  -0.0000973300000000,  0.0000011500000000,  0.0015730200000000 ]  - [  -0.0000151100000000, -0.0000147200000000,  0.0017059100000000 ]  - [  -0.0000206400000000,  0.0000147600000000,  0.0016009400000000 ]  - [   0.0000145600000000, -0.0000002900000000,  0.0016202000000000 ]  - [  -0.0000151100000000,  0.0000147200000000,  0.0017059100000000 ]  - [  -0.0000206400000000, -0.0000147600000000,  0.0016009400000000 ]  - [   0.0000145600000000,  0.0000002900000000,  0.0016202000000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000000000000000, -0.5387105599999999,  0.0096335200000000 ]  - [  -0.0000026500000000, -0.0090504000000000, -0.0058364900000000 ]  - [   0.0000026500000000, -0.0090504000000000, -0.0058364900000000 ]  - [   0.0000000000000000,  0.0044975700000000, -0.0058391500000000 ]  - [   0.0000004600000000,  0.0029019800000000, -0.0058339900000000 ]  - [  -0.0000004600000000,  0.0029019800000000, -0.0058339900000000 ]  - [   0.0000000000000000,  0.0008762200000000, -0.0058232300000000 ]  - [  -0.0000004400000000, -0.0007804300000000, -0.0058109800000000 ]  - [   0.0000004400000000, -0.0007804300000000, -0.0058109800000000 ]  - [   0.0000000000000000,  0.0013533500000000, -0.0058108500000000 ]  - [  -0.0000001600000000,  0.0008015200000000, -0.0058105300000000 ]  - [   0.0000001600000000,  0.0008015200000000, -0.0058105300000000 ]  - [   0.0000000000000000,  0.0008774500000000, -0.0058711100000000 ]  - [  -0.0000004500000000, -0.0007803100000000, -0.0058360100000000 ]  - [   0.0000004500000000, -0.0007803100000000, -0.0058360100000000 ]  - [   0.0000000000000000,  0.0013545600000000, -0.0058359000000000 ]  - [  -0.0000004900000000,  0.0008019700000000, -0.0058359700000000 ]  - [   0.0000004900000000,  0.0008019700000000, -0.0058359700000000 ]  - [   0.0015897200000000,  0.0028566500000000, -0.0046207300000000 ]  - [  -0.0015897200000000,  0.0028566500000000, -0.0046207300000000 ]  - [   0.0000000000000000,  0.0000444300000000, -0.0059871000000000 ]  - [  -0.0015770000000000,  0.0028942100000000, -0.0070206300000000 ]  - [   0.0015770000000000,  0.0028942100000000, -0.0070206300000000 ]  - [   0.0000000000000000,  0.0000479900000000, -0.0056829500000000 ]  - [   0.0000064400000000,  0.0000021900000000, -0.0053574300000000 ]  - [  -0.0000064400000000,  0.0000021900000000, -0.0053574300000000 ]  - [   0.0000000000000000, -0.0000020400000000, -0.0056990700000000 ]  - [  -0.0000057500000000,  0.0000016100000000, -0.0063143100000000 ]  - [   0.0000057500000000,  0.0000016100000000, -0.0063143100000000 ]  - [   0.0000000000000000, -0.0000014100000000, -0.0059746600000000 ]  - [  -0.0019066800000000,  0.0028733100000000, -0.0054692700000000 ]  - [   0.0019066800000000,  0.0028733100000000, -0.0054692700000000 ]  - [   0.0000000000000000,  0.0000449400000000, -0.0056675100000000 ]  - [   0.0018878500000000,  0.0028759200000000, -0.0061543200000000 ]  - [  -0.0018878500000000,  0.0028759200000000, -0.0061543200000000 ]  - [   0.0000000000000000,  0.0000475700000000, -0.0059546000000000 ]  - [   0.0000000000000000, -0.0020506600000000,  0.0038061200000000 ]  - [  -0.0001117300000000, -0.0017594300000000,  0.0017500400000000 ]  - [   0.0001117300000000, -0.0017594300000000,  0.0017500400000000 ]  - [   0.0000000000000000, -0.0031242900000000,  0.0028625400000000 ]  - [   0.0001047000000000, -0.0027595000000000,  0.0025410300000000 ]  - [  -0.0001047000000000, -0.0027595000000000,  0.0025410300000000 ]  - [   0.0000000000000000, -0.0009283800000000,  0.0008221200000000 ]  - [  -0.0001272900000000, -0.0016710700000000,  0.0017898600000000 ]  - [   0.0001272900000000, -0.0016710700000000,  0.0017898600000000 ]  - [   0.0000000000000000, -0.0031926000000000,  0.0025733400000000 ]  - [   0.0001029100000000, -0.0027995800000000,  0.0024006900000000 ]  - [  -0.0001029100000000, -0.0027995800000000,  0.0024006900000000 ]  - [   0.0000000000000000,  0.2789212400000000, -0.1523935600000000 ]  - [  -0.0021448600000000,  0.0021365900000000, -0.0004542500000000 ]  - [   0.0021448600000000,  0.0021365900000000, -0.0004542500000000 ]  - [   0.0000000000000000, -0.0049612300000000,  0.0040316300000000 ]  - [   0.0006215400000000, -0.0042055800000000,  0.0033343900000000 ]  - [  -0.0006215400000000, -0.0042055800000000,  0.0033343900000000 ]  - [   0.0000000000000000,  0.0024091500000000,  0.0005209400000000 ]  - [   0.0001000700000000,  0.0027478900000000,  0.0025384700000000 ]  - [  -0.0001000700000000,  0.0027478900000000,  0.0025384700000000 ]  - [   0.0000000000000000,  0.0013709800000000,  0.0014190100000000 ]  - [  -0.0001167700000000,  0.0017469900000000,  0.0017476700000000 ]  - [   0.0001167700000000,  0.0017469900000000,  0.0017476700000000 ]  - [   0.0000000000000000,  0.0035504800000000,  0.0034090700000000 ]  - [   0.0001149100000000,  0.0028199100000000,  0.0024305000000000 ]  - [  -0.0001149100000000,  0.0028199100000000,  0.0024305000000000 ]  - [   0.0000000000000000,  0.0012885100000000,  0.0016541600000000 ]  - [  -0.0001151100000000,  0.0016917800000000,  0.0018184500000000 ]  - [   0.0001151100000000,  0.0016917800000000,  0.0018184500000000 ]  - [   0.0000000000000000,  0.2618809600000000,  0.1412060700000000 ]  - [   0.0021462600000000,  0.0066287400000000,  0.0047034300000000 ]  - [  -0.0021462600000000,  0.0066287400000000,  0.0047034300000000 ]  - [   0.0000000000000000, -0.0004788800000000,  0.0002175400000000 ]  - [  -0.0006234900000000,  0.0002755300000000,  0.0009085800000000 ]  - [   0.0006234900000000,  0.0002755300000000,  0.0009085800000000 ]  - [  -0.0015100400000000, -0.0032488700000000,  0.0038349300000000 ]  - [   0.0015100400000000, -0.0032488700000000,  0.0038349300000000 ]  - [   0.0000000000000000, -0.0023863900000000,  0.0022579700000000 ]  - [   0.0010877100000000, -0.0035442100000000,  0.0030332600000000 ]  - [  -0.0010877100000000, -0.0035442100000000,  0.0030332600000000 ]  - [   0.0000000000000000, -0.0021335500000000,  0.0019803300000000 ]  - [  -0.0000343000000000, -0.0022929000000000,  0.0019785100000000 ]  - [   0.0000343000000000, -0.0022929000000000,  0.0019785100000000 ]  - [   0.0000000000000000, -0.0022634800000000,  0.0020817800000000 ]  - [   0.0000310600000000, -0.0022086600000000,  0.0022561400000000 ]  - [  -0.0000310600000000, -0.0022086600000000,  0.0022561400000000 ]  - [   0.0000000000000000, -0.0022148700000000,  0.0021627300000000 ]  - [  -0.0010537600000000, -0.0049603000000000,  0.0014165000000000 ]  - [   0.0010537600000000, -0.0049603000000000,  0.0014165000000000 ]  - [   0.0000000000000000, -0.0024191200000000,  0.0020247300000000 ]  - [  -0.0007463300000000, -0.0038035400000000,  0.0041474600000000 ]  - [   0.0007463300000000, -0.0038035400000000,  0.0041474600000000 ]  - [   0.0000000000000000, -0.0020972100000000,  0.0022689800000000 ]  - [   0.0014986900000000,  0.0012001300000000,  0.0003572800000000 ]  - [  -0.0014986900000000,  0.0012001300000000,  0.0003572800000000 ]  - [   0.0000000000000000,  0.0020909500000000,  0.0019660600000000 ]  - [  -0.0011089700000000,  0.0009601600000000,  0.0011817600000000 ]  - [   0.0011089700000000,  0.0009601600000000,  0.0011817600000000 ]  - [   0.0000000000000000,  0.0023509400000000,  0.0022484900000000 ]  - [   0.0000320200000000,  0.0021946500000000,  0.0022661800000000 ]  - [  -0.0000320200000000,  0.0021946500000000,  0.0022661800000000 ]  - [   0.0000000000000000,  0.0022162400000000,  0.0021636300000000 ]  - [  -0.0000331500000000,  0.0022789200000000,  0.0019880500000000 ]  - [   0.0000331500000000,  0.0022789200000000,  0.0019880500000000 ]  - [   0.0000000000000000,  0.0022657300000000,  0.0020833100000000 ]  - [   0.0010563700000000, -0.0004583000000000,  0.0028635700000000 ]  - [  -0.0010563700000000, -0.0004583000000000,  0.0028635700000000 ]  - [   0.0000000000000000,  0.0020747000000000,  0.0022566000000000 ]  - [   0.0007368200000000,  0.0007034100000000,  0.0001336600000000 ]  - [  -0.0007368200000000,  0.0007034100000000,  0.0001336600000000 ]  - [   0.0000000000000000,  0.0024009600000000,  0.0020148900000000 ]  - [   0.0000000000000000, -0.0028526900000000,  0.0016114400000000 ]  - [   0.0000004100000000, -0.0008192700000000,  0.0016501300000000 ]  - [  -0.0000004100000000, -0.0008192700000000,  0.0016501300000000 ]  - [   0.0000000000000000,  0.0008821200000000,  0.0016170800000000 ]  - [   0.0000023300000000,  0.0005762300000000,  0.0016503800000000 ]  - [  -0.0000023300000000,  0.0005762300000000,  0.0016503800000000 ]  - [   0.0000000000000000, -0.0000545300000000,  0.0015253600000000 ]  - [  -0.0000057900000000, -0.0001140000000000,  0.0015084100000000 ]  - [   0.0000057900000000, -0.0001140000000000,  0.0015084100000000 ]  - [   0.0000000000000000,  0.0001461100000000,  0.0015274200000000 ]  - [  -0.0000055300000000,  0.0001172300000000,  0.0015087900000000 ]  - [   0.0000055300000000,  0.0001172300000000,  0.0015087900000000 ]  - [   0.0000000000000000, -0.0261665400000000,  0.0016089300000000 ]  - [   0.0000148400000000, -0.0013660300000000,  0.0015739100000000 ]  - [  -0.0000148400000000, -0.0013660300000000,  0.0015739100000000 ]  - [   0.0000000000000000,  0.0008735200000000,  0.0015722800000000 ]  - [   0.0000183600000000,  0.0005639000000000,  0.0015736900000000 ]  - [  -0.0000183600000000,  0.0005639000000000,  0.0015736900000000 ]  - [   0.0055783500000000,  0.0074430300000000,  0.0008486400000000 ]  - [  -0.0055783500000000,  0.0074430300000000,  0.0008486400000000 ]  - [   0.0000000000000000,  0.0000920400000000,  0.0013794200000000 ]  - [  -0.0055757800000000,  0.0075029500000000,  0.0021589200000000 ]  - [   0.0055757800000000,  0.0075029500000000,  0.0021589200000000 ]  - [   0.0000000000000000,  0.0000951800000000,  0.0016750900000000 ]  - [   0.0001521700000000, -0.0000671000000000,  0.0011689800000000 ]  - [  -0.0001521700000000, -0.0000671000000000,  0.0011689800000000 ]  - [   0.0000000000000000, -0.0000009300000000,  0.0014659500000000 ]  - [  -0.0001115000000000, -0.0000680800000000,  0.0019788100000000 ]  - [   0.0001115000000000, -0.0000680800000000,  0.0019788100000000 ]  - [   0.0000000000000000, -0.0000003800000000,  0.0016808200000000 ]  - [   0.0001469200000000,  0.0000715600000000,  0.0021572400000000 ]  - [  -0.0001469200000000,  0.0000715600000000,  0.0021572400000000 ]  - [   0.0000000000000000,  0.0000056400000000,  0.0016996000000000 ]  - [  -0.0001419600000000,  0.0000755600000000,  0.0011433900000000 ]  - [   0.0001419600000000,  0.0000755600000000,  0.0011433900000000 ]  - [   0.0000000000000000,  0.0000062900000000,  0.0015371900000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.5315920800000000 ]  - [  -0.0008899700000000,  0.0000000000000000, -0.0075558500000000 ]  - [   0.0008899700000000,  0.0000000000000000, -0.0075558500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0064123900000000 ]  - [   0.0000287500000000,  0.0000000000000000, -0.0059628900000000 ]  - [  -0.0000287500000000,  0.0000000000000000, -0.0059628900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041677600000000 ]  - [   0.0001742600000000,  0.0000000000000000, -0.0055654200000000 ]  - [  -0.0001742600000000,  0.0000000000000000, -0.0055654200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057356600000000 ]  - [  -0.0000352100000000,  0.0000000000000000, -0.0057303000000000 ]  - [   0.0000352100000000,  0.0000000000000000, -0.0057303000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042763300000000 ]  - [  -0.0000163800000000,  0.0000000000000000, -0.0055914000000000 ]  - [   0.0000163800000000,  0.0000000000000000, -0.0055914000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057611300000000 ]  - [  -0.0000038400000000,  0.0000000000000000, -0.0057565700000000 ]  - [   0.0000038400000000,  0.0000000000000000, -0.0057565700000000 ]  - [   0.0009083600000000, -0.0003529600000000, -0.0055514200000000 ]  - [  -0.0009083600000000, -0.0003529600000000, -0.0055514200000000 ]  - [   0.0000000000000000, -0.0001468700000000, -0.0058495100000000 ]  - [   0.0009083600000000,  0.0003529600000000, -0.0055514200000000 ]  - [  -0.0009083600000000,  0.0003529600000000, -0.0055514200000000 ]  - [   0.0000000000000000,  0.0001468700000000, -0.0058495100000000 ]  - [  -0.0000163700000000, -0.0004784800000000, -0.0057051800000000 ]  - [   0.0000163700000000, -0.0004784800000000, -0.0057051800000000 ]  - [   0.0000000000000000, -0.0001405500000000, -0.0056920500000000 ]  - [  -0.0000163700000000,  0.0004784800000000, -0.0057051800000000 ]  - [   0.0000163700000000,  0.0004784800000000, -0.0057051800000000 ]  - [   0.0000000000000000,  0.0001405500000000, -0.0056920500000000 ]  - [  -0.0012337400000000, -0.0011948500000000, -0.0055518700000000 ]  - [   0.0012337400000000, -0.0011948500000000, -0.0055518700000000 ]  - [   0.0000000000000000,  0.0001562000000000, -0.0058251900000000 ]  - [  -0.0012337400000000,  0.0011948500000000, -0.0055518700000000 ]  - [   0.0012337400000000,  0.0011948500000000, -0.0055518700000000 ]  - [   0.0000000000000000, -0.0001562000000000, -0.0058251900000000 ]  - [   0.0000000000000000, -0.0035270700000000, -0.0005171000000000 ]  - [  -0.0002319700000000, -0.0022180900000000,  0.0020598000000000 ]  - [   0.0002319700000000, -0.0022180900000000,  0.0020598000000000 ]  - [   0.0000000000000000, -0.0022736500000000,  0.0021937000000000 ]  - [  -0.0000246900000000, -0.0022780200000000,  0.0021588800000000 ]  - [   0.0000246900000000, -0.0022780200000000,  0.0021588800000000 ]  - [   0.0000000000000000, -0.0022510100000000,  0.0025453000000000 ]  - [  -0.0000336200000000, -0.0022455800000000,  0.0019444100000000 ]  - [   0.0000336200000000, -0.0022455800000000,  0.0019444100000000 ]  - [   0.0000000000000000, -0.0022846800000000,  0.0019569400000000 ]  - [  -0.0000196600000000, -0.0022721000000000,  0.0019997600000000 ]  - [   0.0000196600000000, -0.0022721000000000,  0.0019997600000000 ]  - [   0.0000000000000000, -0.1376078400000000,  0.2278431000000000 ]  - [   0.0004884000000000, -0.0027231900000000,  0.0027374200000000 ]  - [  -0.0004884000000000, -0.0027231900000000,  0.0027374200000000 ]  - [   0.0000000000000000, -0.0022227300000000,  0.0024772300000000 ]  - [  -0.0000068300000000, -0.0021034300000000,  0.0022201900000000 ]  - [   0.0000068300000000, -0.0021034300000000,  0.0022201900000000 ]  - [   0.0000000000000000,  0.0035270700000000, -0.0005171000000000 ]  - [  -0.0002319700000000,  0.0022180900000000,  0.0020598000000000 ]  - [   0.0002319700000000,  0.0022180900000000,  0.0020598000000000 ]  - [   0.0000000000000000,  0.0022736500000000,  0.0021937000000000 ]  - [  -0.0000246900000000,  0.0022780200000000,  0.0021588800000000 ]  - [   0.0000246900000000,  0.0022780200000000,  0.0021588800000000 ]  - [   0.0000000000000000,  0.0022510100000000,  0.0025453000000000 ]  - [  -0.0000336200000000,  0.0022455800000000,  0.0019444100000000 ]  - [   0.0000336200000000,  0.0022455800000000,  0.0019444100000000 ]  - [   0.0000000000000000,  0.0022846800000000,  0.0019569400000000 ]  - [  -0.0000196600000000,  0.0022721000000000,  0.0019997600000000 ]  - [   0.0000196600000000,  0.0022721000000000,  0.0019997600000000 ]  - [   0.0000000000000000,  0.1376078400000000,  0.2278431000000000 ]  - [   0.0004884000000000,  0.0027231900000000,  0.0027374200000000 ]  - [  -0.0004884000000000,  0.0027231900000000,  0.0027374200000000 ]  - [   0.0000000000000000,  0.0022227300000000,  0.0024772300000000 ]  - [  -0.0000068300000000,  0.0021034300000000,  0.0022201900000000 ]  - [   0.0000068300000000,  0.0021034300000000,  0.0022201900000000 ]  - [  -0.0015209200000000, -0.0035223600000000,  0.0033104200000000 ]  - [   0.0015209200000000, -0.0035223600000000,  0.0033104200000000 ]  - [   0.0000000000000000, -0.0021173800000000,  0.0022403300000000 ]  - [  -0.0008237900000000, -0.0026554200000000,  0.0024661500000000 ]  - [   0.0008237900000000, -0.0026554200000000,  0.0024661500000000 ]  - [   0.0000000000000000, -0.0023426000000000,  0.0023120500000000 ]  - [   0.0001821500000000, -0.0019953700000000,  0.0017451100000000 ]  - [  -0.0001821500000000, -0.0019953700000000,  0.0017451100000000 ]  - [   0.0000000000000000, -0.0021649800000000,  0.0019542500000000 ]  - [  -0.0000014700000000, -0.0025847100000000,  0.0022142800000000 ]  - [   0.0000014700000000, -0.0025847100000000,  0.0022142800000000 ]  - [   0.0000000000000000, -0.0023408900000000,  0.0020913300000000 ]  - [   0.0008657800000000, -0.0013549500000000,  0.0017025300000000 ]  - [  -0.0008657800000000, -0.0013549500000000,  0.0017025300000000 ]  - [   0.0000000000000000, -0.0023818900000000,  0.0020857000000000 ]  - [   0.0002756100000000, -0.0026601000000000,  0.0017666100000000 ]  - [  -0.0002756100000000, -0.0026601000000000,  0.0017666100000000 ]  - [   0.0000000000000000, -0.0021606800000000,  0.0019757000000000 ]  - [  -0.0015209200000000,  0.0035223600000000,  0.0033104200000000 ]  - [   0.0015209200000000,  0.0035223600000000,  0.0033104200000000 ]  - [   0.0000000000000000,  0.0021173800000000,  0.0022403300000000 ]  - [  -0.0008237900000000,  0.0026554200000000,  0.0024661500000000 ]  - [   0.0008237900000000,  0.0026554200000000,  0.0024661500000000 ]  - [   0.0000000000000000,  0.0023426000000000,  0.0023120500000000 ]  - [   0.0001821500000000,  0.0019953700000000,  0.0017451100000000 ]  - [  -0.0001821500000000,  0.0019953700000000,  0.0017451100000000 ]  - [   0.0000000000000000,  0.0021649800000000,  0.0019542500000000 ]  - [  -0.0000014700000000,  0.0025847100000000,  0.0022142800000000 ]  - [   0.0000014700000000,  0.0025847100000000,  0.0022142800000000 ]  - [   0.0000000000000000,  0.0023408900000000,  0.0020913300000000 ]  - [   0.0008657800000000,  0.0013549500000000,  0.0017025300000000 ]  - [  -0.0008657800000000,  0.0013549500000000,  0.0017025300000000 ]  - [   0.0000000000000000,  0.0023818900000000,  0.0020857000000000 ]  - [   0.0002756100000000,  0.0026601000000000,  0.0017666100000000 ]  - [  -0.0002756100000000,  0.0026601000000000,  0.0017666100000000 ]  - [   0.0000000000000000,  0.0021606800000000,  0.0019757000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0458273100000000 ]  - [   0.0011428500000000,  0.0000000000000000,  0.0014420200000000 ]  - [  -0.0011428500000000,  0.0000000000000000,  0.0014420200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014347600000000 ]  - [   0.0000131500000000,  0.0000000000000000,  0.0014797800000000 ]  - [  -0.0000131500000000,  0.0000000000000000,  0.0014797800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0019796300000000 ]  - [   0.0001441200000000,  0.0000000000000000,  0.0016685400000000 ]  - [  -0.0001441200000000,  0.0000000000000000,  0.0016685400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015842100000000 ]  - [   0.0000331300000000,  0.0000000000000000,  0.0015648300000000 ]  - [  -0.0000331300000000,  0.0000000000000000,  0.0015648300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0310825100000000 ]  - [   0.0000525600000000,  0.0000000000000000,  0.0020703500000000 ]  - [  -0.0000525600000000,  0.0000000000000000,  0.0020703500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017016900000000 ]  - [   0.0000192100000000,  0.0000000000000000,  0.0016886600000000 ]  - [  -0.0000192100000000,  0.0000000000000000,  0.0016886600000000 ]  - [   0.0036602400000000,  0.0046869700000000,  0.0005308200000000 ]  - [  -0.0036602400000000,  0.0046869700000000,  0.0005308200000000 ]  - [   0.0000000000000000,  0.0001303700000000,  0.0013926400000000 ]  - [   0.0036602400000000, -0.0046869700000000,  0.0005308200000000 ]  - [  -0.0036602400000000, -0.0046869700000000,  0.0005308200000000 ]  - [   0.0000000000000000, -0.0001303700000000,  0.0013926400000000 ]  - [  -0.0002531100000000, -0.0004448800000000,  0.0015727100000000 ]  - [   0.0002531100000000, -0.0004448800000000,  0.0015727100000000 ]  - [   0.0000000000000000, -0.0000913400000000,  0.0015305400000000 ]  - [  -0.0002531100000000,  0.0004448800000000,  0.0015727100000000 ]  - [   0.0002531100000000,  0.0004448800000000,  0.0015727100000000 ]  - [   0.0000000000000000,  0.0000913400000000,  0.0015305400000000 ]  - [   0.0000102800000000, -0.0000177600000000,  0.0018469600000000 ]  - [  -0.0000102800000000, -0.0000177600000000,  0.0018469600000000 ]  - [   0.0000000000000000, -0.0000072100000000,  0.0017657600000000 ]  - [   0.0000102800000000,  0.0000177600000000,  0.0018469600000000 ]  - [  -0.0000102800000000,  0.0000177600000000,  0.0018469600000000 ]  - [   0.0000000000000000,  0.0000072100000000,  0.0017657600000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.5283156500000000 ]  - [   0.0008930500000000,  0.0000000000000000, -0.0041369900000000 ]  - [  -0.0008930500000000,  0.0000000000000000, -0.0041369900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0052658900000000 ]  - [  -0.0000328900000000,  0.0000000000000000, -0.0057061900000000 ]  - [   0.0000328900000000,  0.0000000000000000, -0.0057061900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0074030700000000 ]  - [  -0.0001716900000000,  0.0000000000000000, -0.0060468100000000 ]  - [   0.0001716900000000,  0.0000000000000000, -0.0060468100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0058916700000000 ]  - [   0.0000343600000000,  0.0000000000000000, -0.0058924700000000 ]  - [  -0.0000343600000000,  0.0000000000000000, -0.0058924700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0075093200000000 ]  - [   0.0000179400000000,  0.0000000000000000, -0.0060807100000000 ]  - [  -0.0000179400000000,  0.0000000000000000, -0.0060807100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059183000000000 ]  - [   0.0000026100000000,  0.0000000000000000, -0.0059176300000000 ]  - [  -0.0000026100000000,  0.0000000000000000, -0.0059176300000000 ]  - [  -0.0009007000000000,  0.0003359300000000, -0.0060925100000000 ]  - [   0.0009007000000000,  0.0003359300000000, -0.0060925100000000 ]  - [   0.0000000000000000,  0.0001596400000000, -0.0058226900000000 ]  - [  -0.0009007000000000, -0.0003359300000000, -0.0060925100000000 ]  - [   0.0009007000000000, -0.0003359300000000, -0.0060925100000000 ]  - [   0.0000000000000000, -0.0001596400000000, -0.0058226900000000 ]  - [   0.0000142600000000,  0.0004717900000000, -0.0059675700000000 ]  - [  -0.0000142600000000,  0.0004717900000000, -0.0059675700000000 ]  - [   0.0000000000000000,  0.0001385000000000, -0.0059798400000000 ]  - [   0.0000142600000000, -0.0004717900000000, -0.0059675700000000 ]  - [  -0.0000142600000000, -0.0004717900000000, -0.0059675700000000 ]  - [   0.0000000000000000, -0.0001385000000000, -0.0059798400000000 ]  - [   0.0012032800000000,  0.0012013500000000, -0.0060908100000000 ]  - [  -0.0012032800000000,  0.0012013500000000, -0.0060908100000000 ]  - [   0.0000000000000000, -0.0001450000000000, -0.0058001500000000 ]  - [   0.0012032800000000, -0.0012013500000000, -0.0060908100000000 ]  - [  -0.0012032800000000, -0.0012013500000000, -0.0060908100000000 ]  - [   0.0000000000000000,  0.0001450000000000, -0.0058001500000000 ]  - [   0.0000000000000000, -0.0010263100000000,  0.0047667700000000 ]  - [   0.0002159800000000, -0.0023322500000000,  0.0022304500000000 ]  - [  -0.0002159800000000, -0.0023322500000000,  0.0022304500000000 ]  - [   0.0000000000000000, -0.0022696000000000,  0.0020936600000000 ]  - [   0.0000126500000000, -0.0022751400000000,  0.0021342600000000 ]  - [  -0.0000126500000000, -0.0022751400000000,  0.0021342600000000 ]  - [   0.0000000000000000, -0.0022807900000000,  0.0016709500000000 ]  - [   0.0000199900000000, -0.0022935100000000,  0.0022752700000000 ]  - [  -0.0000199900000000, -0.0022935100000000,  0.0022752700000000 ]  - [   0.0000000000000000, -0.0022439400000000,  0.0022723600000000 ]  - [   0.0000076200000000, -0.0022642100000000,  0.0022217300000000 ]  - [  -0.0000076200000000, -0.0022642100000000,  0.0022217300000000 ]  - [   0.0000000000000000,  0.1429686700000000, -0.2283661800000000 ]  - [  -0.0004813400000000, -0.0018157300000000,  0.0015198000000000 ]  - [   0.0004813400000000, -0.0018157300000000,  0.0015198000000000 ]  - [   0.0000000000000000, -0.0023044500000000,  0.0017740500000000 ]  - [   0.0000031000000000, -0.0024292000000000,  0.0020277100000000 ]  - [  -0.0000031000000000, -0.0024292000000000,  0.0020277100000000 ]  - [   0.0000000000000000,  0.0010263100000000,  0.0047667700000000 ]  - [   0.0002159800000000,  0.0023322500000000,  0.0022304500000000 ]  - [  -0.0002159800000000,  0.0023322500000000,  0.0022304500000000 ]  - [   0.0000000000000000,  0.0022696000000000,  0.0020936600000000 ]  - [   0.0000126500000000,  0.0022751400000000,  0.0021342600000000 ]  - [  -0.0000126500000000,  0.0022751400000000,  0.0021342600000000 ]  - [   0.0000000000000000,  0.0022807900000000,  0.0016709500000000 ]  - [   0.0000199900000000,  0.0022935100000000,  0.0022752700000000 ]  - [  -0.0000199900000000,  0.0022935100000000,  0.0022752700000000 ]  - [   0.0000000000000000,  0.0022439400000000,  0.0022723600000000 ]  - [   0.0000076200000000,  0.0022642100000000,  0.0022217300000000 ]  - [  -0.0000076200000000,  0.0022642100000000,  0.0022217300000000 ]  - [   0.0000000000000000, -0.1429686700000000, -0.2283661800000000 ]  - [  -0.0004813400000000,  0.0018157300000000,  0.0015198000000000 ]  - [   0.0004813400000000,  0.0018157300000000,  0.0015198000000000 ]  - [   0.0000000000000000,  0.0023044500000000,  0.0017740500000000 ]  - [   0.0000031000000000,  0.0024292000000000,  0.0020277100000000 ]  - [  -0.0000031000000000,  0.0024292000000000,  0.0020277100000000 ]  - [   0.0014825400000000, -0.0010361800000000,  0.0009158400000000 ]  - [  -0.0014825400000000, -0.0010361800000000,  0.0009158400000000 ]  - [   0.0000000000000000, -0.0024357400000000,  0.0020074700000000 ]  - [   0.0008115000000000, -0.0018498800000000,  0.0017412900000000 ]  - [  -0.0008115000000000, -0.0018498800000000,  0.0017412900000000 ]  - [   0.0000000000000000, -0.0021537100000000,  0.0019071300000000 ]  - [  -0.0001803000000000, -0.0025269500000000,  0.0024924800000000 ]  - [   0.0001803000000000, -0.0025269500000000,  0.0024924800000000 ]  - [   0.0000000000000000, -0.0023625700000000,  0.0022942900000000 ]  - [   0.0000010900000000, -0.0019611700000000,  0.0020380100000000 ]  - [  -0.0000010900000000, -0.0019611700000000,  0.0020380100000000 ]  - [   0.0000000000000000, -0.0021798200000000,  0.0021549500000000 ]  - [  -0.0008841800000000, -0.0032119200000000,  0.0025977400000000 ]  - [   0.0008841800000000, -0.0032119200000000,  0.0025977400000000 ]  - [   0.0000000000000000, -0.0021744000000000,  0.0022085000000000 ]  - [  -0.0002774200000000, -0.0018816800000000,  0.0025295300000000 ]  - [   0.0002774200000000, -0.0018816800000000,  0.0025295300000000 ]  - [   0.0000000000000000, -0.0023641900000000,  0.0023018800000000 ]  - [   0.0014825400000000,  0.0010361800000000,  0.0009158400000000 ]  - [  -0.0014825400000000,  0.0010361800000000,  0.0009158400000000 ]  - [   0.0000000000000000,  0.0024357400000000,  0.0020074700000000 ]  - [   0.0008115000000000,  0.0018498800000000,  0.0017412900000000 ]  - [  -0.0008115000000000,  0.0018498800000000,  0.0017412900000000 ]  - [   0.0000000000000000,  0.0021537100000000,  0.0019071300000000 ]  - [  -0.0001803000000000,  0.0025269500000000,  0.0024924800000000 ]  - [   0.0001803000000000,  0.0025269500000000,  0.0024924800000000 ]  - [   0.0000000000000000,  0.0023625700000000,  0.0022942900000000 ]  - [   0.0000010900000000,  0.0019611700000000,  0.0020380100000000 ]  - [  -0.0000010900000000,  0.0019611700000000,  0.0020380100000000 ]  - [   0.0000000000000000,  0.0021798200000000,  0.0021549500000000 ]  - [  -0.0008841800000000,  0.0032119200000000,  0.0025977400000000 ]  - [   0.0008841800000000,  0.0032119200000000,  0.0025977400000000 ]  - [   0.0000000000000000,  0.0021744000000000,  0.0022085000000000 ]  - [  -0.0002774200000000,  0.0018816800000000,  0.0025295300000000 ]  - [   0.0002774200000000,  0.0018816800000000,  0.0025295300000000 ]  - [   0.0000000000000000,  0.0023641900000000,  0.0023018800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0406946900000000 ]  - [  -0.0011374200000000,  0.0000000000000000,  0.0018361700000000 ]  - [   0.0011374200000000,  0.0000000000000000,  0.0018361700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017935400000000 ]  - [  -0.0000070300000000,  0.0000000000000000,  0.0018147300000000 ]  - [   0.0000070300000000,  0.0000000000000000,  0.0018147300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010812000000000 ]  - [  -0.0001539100000000,  0.0000000000000000,  0.0013460100000000 ]  - [   0.0001539100000000,  0.0000000000000000,  0.0013460100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014665500000000 ]  - [  -0.0000425600000000,  0.0000000000000000,  0.0014485200000000 ]  - [   0.0000425600000000,  0.0000000000000000,  0.0014485200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0284566500000000 ]  - [  -0.0000325600000000,  0.0000000000000000,  0.0010788500000000 ]  - [   0.0000325600000000,  0.0000000000000000,  0.0010788500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014412500000000 ]  - [   0.0000181800000000,  0.0000000000000000,  0.0014525200000000 ]  - [  -0.0000181800000000,  0.0000000000000000,  0.0014525200000000 ]  - [  -0.0036325500000000, -0.0046193500000000,  0.0024596300000000 ]  - [   0.0036325500000000, -0.0046193500000000,  0.0024596300000000 ]  - [   0.0000000000000000, -0.0001251900000000,  0.0016542800000000 ]  - [  -0.0036325500000000,  0.0046193500000000,  0.0024596300000000 ]  - [   0.0036325500000000,  0.0046193500000000,  0.0024596300000000 ]  - [   0.0000000000000000,  0.0001251900000000,  0.0016542800000000 ]  - [   0.0002842900000000,  0.0004359100000000,  0.0015688900000000 ]  - [  -0.0002842900000000,  0.0004359100000000,  0.0015688900000000 ]  - [   0.0000000000000000,  0.0000893900000000,  0.0016066300000000 ]  - [   0.0002842900000000, -0.0004359100000000,  0.0015688900000000 ]  - [  -0.0002842900000000, -0.0004359100000000,  0.0015688900000000 ]  - [   0.0000000000000000, -0.0000893900000000,  0.0016066300000000 ]  - [  -0.0000040600000000,  0.0000196000000000,  0.0014548000000000 ]  - [   0.0000040600000000,  0.0000196000000000,  0.0014548000000000 ]  - [   0.0000000000000000,  0.0000073600000000,  0.0014676600000000 ]  - [  -0.0000040600000000, -0.0000196000000000,  0.0014548000000000 ]  - [   0.0000040600000000, -0.0000196000000000,  0.0014548000000000 ]  - [   0.0000000000000000, -0.0000073600000000,  0.0014676600000000 ]- atom:   37  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0011519800000000, -0.0000019000000000, -0.0058382800000000 ]  - [   0.0002391000000000,  0.0001109100000000, -0.0056070700000000 ]  - [   0.0002399800000000, -0.0001054100000000, -0.0060578500000000 ]  - [  -0.0001481400000000, -0.0000079400000000, -0.0058321800000000 ]  - [   0.0000606200000000, -0.0001224800000000, -0.0058194100000000 ]  - [   0.0000611300000000,  0.0001022000000000, -0.0058524300000000 ]  - [   0.0252527700000000,  0.0011441700000000, -0.0067949300000000 ]  - [  -0.0002875400000000,  0.0021689100000000, -0.0063009700000000 ]  - [  -0.0002894600000000, -0.0021154800000000, -0.0053310400000000 ]  - [   0.0000122300000000, -0.0000186500000000, -0.0058095200000000 ]  - [   0.0000427500000000, -0.0006417300000000, -0.0058011200000000 ]  - [   0.0000429100000000,  0.0006134600000000, -0.0058145800000000 ]  - [  -0.0000567900000000,  0.0000050500000000, -0.0058373000000000 ]  - [   0.0000307600000000,  0.0001218900000000, -0.0058086100000000 ]  - [   0.0000318200000000, -0.0001210100000000, -0.0058571500000000 ]  - [  -0.0000262200000000, -0.0000075000000000, -0.0058329000000000 ]  - [   0.0000055900000000, -0.0001085200000000, -0.0058151700000000 ]  - [   0.0000073900000000,  0.0001019100000000, -0.0058442000000000 ]  - [  -0.0002263000000000, -0.0010937200000000, -0.0050237700000000 ]  - [  -0.0002388000000000,  0.0011082500000000, -0.0066543100000000 ]  - [   0.0000458900000000,  0.0000110400000000, -0.0058360200000000 ]  - [   0.0011866000000000,  0.0014964400000000, -0.0043411800000000 ]  - [   0.0012009800000000, -0.0015027300000000, -0.0073403200000000 ]  - [   0.0001536800000000, -0.0000090000000000, -0.0058320700000000 ]  - [  -0.0000952000000000,  0.0007256700000000, -0.0061062500000000 ]  - [  -0.0000964300000000, -0.0007528900000000, -0.0055597500000000 ]  - [   0.0000143200000000,  0.0000016700000000, -0.0058332500000000 ]  - [  -0.0005776400000000,  0.0010498200000000, -0.0067034700000000 ]  - [  -0.0005918400000000, -0.0010535300000000, -0.0049500400000000 ]  - [  -0.0000732700000000, -0.0000013600000000, -0.0058375800000000 ]  - [  -0.0000242000000000, -0.0000316000000000, -0.0058050100000000 ]  - [  -0.0000232800000000,  0.0000255900000000, -0.0058083800000000 ]  - [   0.0000306400000000,  0.0000027800000000, -0.0058061400000000 ]  - [  -0.0000304100000000,  0.0000352000000000, -0.0059856000000000 ]  - [  -0.0000304100000000, -0.0000354400000000, -0.0056232800000000 ]  - [   0.0000401500000000, -0.0000021600000000, -0.0058082900000000 ]  - [  -0.0244275800000000, -0.0038354600000000,  0.0029699900000000 ]  - [   0.0019777100000000, -0.0035372600000000,  0.0029867900000000 ]  - [   0.0019389600000000, -0.0010720800000000,  0.0013293900000000 ]  - [   0.0000333900000000, -0.0022612300000000,  0.0021339200000000 ]  - [  -0.0001786300000000, -0.0017573500000000,  0.0018885100000000 ]  - [  -0.0001611700000000, -0.0027946200000000,  0.0023970100000000 ]  - [  -0.0001796800000000, -0.0022788300000000,  0.0021231500000000 ]  - [   0.0000118600000000, -0.0023623000000000,  0.0021664600000000 ]  - [   0.0000246400000000, -0.0021914100000000,  0.0020573900000000 ]  - [   0.0000400300000000, -0.0022656700000000,  0.0021112100000000 ]  - [  -0.0000227500000000, -0.0022290500000000,  0.0020587500000000 ]  - [  -0.0000092900000000, -0.0023321700000000,  0.0021674500000000 ]  - [  -0.0001687400000000, -0.0022561400000000,  0.0021164400000000 ]  - [   0.0000122700000000, -0.0023770600000000,  0.0020377000000000 ]  - [   0.0000132500000000, -0.0022026200000000,  0.0022245300000000 ]  - [   0.0000509700000000, -0.0022662600000000,  0.0021230800000000 ]  - [  -0.0000224200000000, -0.0021833800000000,  0.0020466900000000 ]  - [  -0.0000204600000000, -0.0023395600000000,  0.0021898700000000 ]  - [  -0.0146400700000000,  0.0026071600000000,  0.0023119100000000 ]  - [   0.0000841300000000,  0.0013915800000000,  0.0018217900000000 ]  - [   0.0001036800000000,  0.0031767000000000,  0.0024746700000000 ]  - [  -0.0001971100000000,  0.0023025400000000,  0.0021593900000000 ]  - [   0.0002991100000000,  0.0027110900000000,  0.0024390200000000 ]  - [   0.0003062200000000,  0.0018799400000000,  0.0018721600000000 ]  - [   0.0002052900000000,  0.0022691900000000,  0.0021158300000000 ]  - [  -0.0000465700000000,  0.0022247100000000,  0.0020411200000000 ]  - [  -0.0000319500000000,  0.0023393300000000,  0.0021892700000000 ]  - [  -0.0000972500000000,  0.0022822400000000,  0.0021236900000000 ]  - [   0.0000409500000000,  0.0023298600000000,  0.0021577200000000 ]  - [   0.0000526400000000,  0.0022169300000000,  0.0020675700000000 ]  - [   0.0002160800000000,  0.0022910100000000,  0.0021365300000000 ]  - [  -0.0000455000000000,  0.0021883700000000,  0.0019504400000000 ]  - [  -0.0000437600000000,  0.0023483200000000,  0.0022945000000000 ]  - [  -0.0000865400000000,  0.0022828400000000,  0.0021329000000000 ]  - [   0.0000410400000000,  0.0023799200000000,  0.0021377500000000 ]  - [   0.0000417800000000,  0.0022183300000000,  0.0021391500000000 ]  - [   0.0004511500000000, -0.0011171900000000,  0.0016364400000000 ]  - [   0.0004576700000000, -0.0034679300000000,  0.0026147500000000 ]  - [   0.0000918800000000, -0.0022999300000000,  0.0021302000000000 ]  - [  -0.0003333300000000, -0.0036930800000000,  0.0032100100000000 ]  - [  -0.0003211600000000, -0.0008505900000000,  0.0009932500000000 ]  - [  -0.0000000200000000, -0.0022574100000000,  0.0021080900000000 ]  - [  -0.0003224500000000, -0.0026629500000000,  0.0031546000000000 ]  - [  -0.0003426800000000, -0.0018814900000000,  0.0010754900000000 ]  - [   0.0000106500000000, -0.0022771700000000,  0.0021283700000000 ]  - [   0.0004430500000000, -0.0027965800000000,  0.0026268200000000 ]  - [   0.0004548800000000, -0.0017934900000000,  0.0016383400000000 ]  - [   0.0001031200000000, -0.0022716700000000,  0.0021258700000000 ]  - [   0.0000017700000000, -0.0022718100000000,  0.0021477800000000 ]  - [   0.0000128300000000, -0.0022794200000000,  0.0021377400000000 ]  - [  -0.0000042900000000, -0.0022920200000000,  0.0021495900000000 ]  - [   0.0000014000000000, -0.0023051700000000,  0.0022092800000000 ]  - [   0.0000132700000000, -0.0022657800000000,  0.0020842500000000 ]  - [  -0.0000042500000000, -0.0022842000000000,  0.0021448800000000 ]  - [   0.0007968000000000,  0.0002004600000000,  0.0025309300000000 ]  - [   0.0007979800000000,  0.0043887200000000,  0.0016887700000000 ]  - [   0.0001131600000000,  0.0022915200000000,  0.0021269600000000 ]  - [   0.0000231900000000,  0.0028193800000000,  0.0018020000000000 ]  - [   0.0000408000000000,  0.0017197300000000,  0.0024265300000000 ]  - [  -0.0000117700000000,  0.0022513700000000,  0.0021085500000000 ]  - [   0.0007857400000000,  0.0018522900000000,  0.0006670500000000 ]  - [   0.0007982700000000,  0.0026731300000000,  0.0036038900000000 ]  - [   0.0001241100000000,  0.0022803600000000,  0.0021329200000000 ]  - [   0.0000252900000000,  0.0018371000000000,  0.0019305000000000 ]  - [   0.0000278400000000,  0.0027350000000000,  0.0023321400000000 ]  - [  -0.0000009100000000,  0.0022697300000000,  0.0021260900000000 ]  - [   0.0000007200000000,  0.0022662500000000,  0.0022132100000000 ]  - [   0.0000120900000000,  0.0023078800000000,  0.0020848000000000 ]  - [   0.0000034400000000,  0.0022816600000000,  0.0021456200000000 ]  - [   0.0000016500000000,  0.0023029900000000,  0.0021653600000000 ]  - [   0.0000133500000000,  0.0022858000000000,  0.0021425200000000 ]  - [  -0.0000112400000000,  0.0022695500000000,  0.0021408100000000 ]  - [   0.0064087400000000,  0.0000269400000000,  0.0016103600000000 ]  - [  -0.0004545500000000,  0.0002461900000000,  0.0017677400000000 ]  - [  -0.0004591100000000, -0.0002397700000000,  0.0015169800000000 ]  - [   0.0002641100000000, -0.0000039100000000,  0.0016064500000000 ]  - [  -0.0001175600000000, -0.0001047800000000,  0.0016893100000000 ]  - [  -0.0001216300000000,  0.0000973800000000,  0.0015896400000000 ]  - [  -0.0006333300000000,  0.0000186400000000,  0.0014961400000000 ]  - [   0.0000405100000000,  0.0001396600000000,  0.0014159900000000 ]  - [   0.0000449300000000, -0.0001371200000000,  0.0015752000000000 ]  - [   0.0000604600000000, -0.0000056500000000,  0.0015153200000000 ]  - [  -0.0000319000000000, -0.0001081900000000,  0.0014468800000000 ]  - [  -0.0000210900000000,  0.0001004100000000,  0.0015462800000000 ]  - [   0.0000877400000000, -0.0000004200000000,  0.0015616700000000 ]  - [  -0.0000282600000000,  0.0000103100000000,  0.0015973300000000 ]  - [  -0.0000671000000000, -0.0000118400000000,  0.0015256700000000 ]  - [   0.0000737200000000, -0.0000012200000000,  0.0015607200000000 ]  - [  -0.0000188400000000, -0.0000119300000000,  0.0015770700000000 ]  - [  -0.0000560500000000,  0.0000090400000000,  0.0015455700000000 ]  - [   0.0000403900000000,  0.0000075800000000,  0.0014586800000000 ]  - [   0.0000503300000000, -0.0000067700000000,  0.0015291800000000 ]  - [  -0.0000689600000000,  0.0000006100000000,  0.0015155500000000 ]  - [   0.0000542100000000, -0.0000438200000000,  0.0012712700000000 ]  - [   0.0000666300000000,  0.0000438200000000,  0.0017222700000000 ]  - [  -0.0001517400000000, -0.0000009700000000,  0.0015156500000000 ]  - [   0.0001975700000000, -0.0001219700000000,  0.0017715000000000 ]  - [   0.0001754000000000,  0.0001179400000000,  0.0013500500000000 ]  - [   0.0000406100000000,  0.0000013600000000,  0.0015618000000000 ]  - [   0.0005029600000000, -0.0003182700000000,  0.0004102900000000 ]  - [   0.0004646500000000,  0.0003479100000000,  0.0027440600000000 ]  - [  -0.0004286100000000, -0.0000020000000000,  0.0015621200000000 ]  - [  -0.0000026600000000,  0.0000065300000000,  0.0016013600000000 ]  - [  -0.0000043600000000, -0.0000090200000000,  0.0016817200000000 ]  - [   0.0000091300000000, -0.0000007900000000,  0.0016073400000000 ]  - [   0.0000210400000000, -0.0000194200000000,  0.0017733700000000 ]  - [   0.0000163100000000,  0.0000202200000000,  0.0015040200000000 ]  - [  -0.0000535900000000, -0.0000012000000000,  0.0016067200000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000000000000000,  0.0001853300000000, -0.0071292800000000 ]  - [  -0.0000391100000000,  0.0004915700000000, -0.0057954900000000 ]  - [   0.0000391100000000,  0.0004915700000000, -0.0057954900000000 ]  - [   0.0000000000000000, -0.0008745600000000, -0.0058546500000000 ]  - [  -0.0000199900000000, -0.0005053400000000, -0.0058533200000000 ]  - [   0.0000199900000000, -0.0005053400000000, -0.0058533200000000 ]  - [   0.0000000000000000,  0.2595950500000000, -0.1385854400000000 ]  - [  -0.0002941000000000,  0.0043599900000000, -0.0062824600000000 ]  - [   0.0002941000000000,  0.0043599900000000, -0.0062824600000000 ]  - [   0.0000000000000000, -0.0027084500000000, -0.0057921500000000 ]  - [  -0.0000582300000000, -0.0019529500000000, -0.0056600300000000 ]  - [   0.0000582300000000, -0.0019529500000000, -0.0056600300000000 ]  - [   0.0000000000000000,  0.0013036000000000, -0.0058415500000000 ]  - [   0.0000059400000000,  0.0005710000000000, -0.0058296100000000 ]  - [  -0.0000059400000000,  0.0005710000000000, -0.0058296100000000 ]  - [   0.0000000000000000, -0.0009483100000000, -0.0058738300000000 ]  - [   0.0000026700000000, -0.0005517400000000, -0.0058562100000000 ]  - [  -0.0000026700000000, -0.0005517400000000, -0.0058562100000000 ]  - [   0.0014117900000000, -0.0012921200000000, -0.0062451900000000 ]  - [  -0.0014117900000000, -0.0012921200000000, -0.0062451900000000 ]  - [   0.0000000000000000,  0.0001069400000000, -0.0059295900000000 ]  - [  -0.0021730200000000, -0.0010112900000000, -0.0071234600000000 ]  - [   0.0021730200000000, -0.0010112900000000, -0.0071234600000000 ]  - [   0.0000000000000000, -0.0001460300000000, -0.0057074500000000 ]  - [  -0.0007373600000000, -0.0015411100000000, -0.0062355700000000 ]  - [   0.0007373600000000, -0.0015411100000000, -0.0062355700000000 ]  - [   0.0000000000000000,  0.0001498500000000, -0.0057474900000000 ]  - [   0.0014508800000000, -0.0027044900000000, -0.0049146800000000 ]  - [  -0.0014508800000000, -0.0027044900000000, -0.0049146800000000 ]  - [   0.0000000000000000, -0.0001703800000000, -0.0059614600000000 ]  - [   0.0000060500000000,  0.0000326600000000, -0.0061434600000000 ]  - [  -0.0000060500000000,  0.0000326600000000, -0.0061434600000000 ]  - [   0.0000000000000000,  0.0000244900000000, -0.0059045800000000 ]  - [  -0.0000086000000000, -0.0000473400000000, -0.0055575700000000 ]  - [   0.0000086000000000, -0.0000473400000000, -0.0055575700000000 ]  - [   0.0000000000000000, -0.0000228800000000, -0.0057314400000000 ]  - [   0.0000000000000000, -0.4152234100000000,  0.1445276000000000 ]  - [   0.0012250000000000, -0.0049639300000000,  0.0036066300000000 ]  - [  -0.0012250000000000, -0.0049639300000000,  0.0036066300000000 ]  - [   0.0000000000000000, -0.0006648800000000,  0.0009385500000000 ]  - [  -0.0005098600000000, -0.0008180100000000,  0.0012540800000000 ]  - [   0.0005098600000000, -0.0008180100000000,  0.0012540800000000 ]  - [   0.0000000000000000, -0.0029494900000000,  0.0029816000000000 ]  - [   0.0000720100000000, -0.0026152200000000,  0.0024103400000000 ]  - [  -0.0000720100000000, -0.0026152200000000,  0.0024103400000000 ]  - [   0.0000000000000000, -0.0016180000000000,  0.0016122000000000 ]  - [  -0.0000870400000000, -0.0018958700000000,  0.0018463200000000 ]  - [   0.0000870400000000, -0.0018958700000000,  0.0018463200000000 ]  - [   0.0000000000000000, -0.0029521400000000,  0.0023487700000000 ]  - [   0.0000769700000000, -0.0026127800000000,  0.0023267200000000 ]  - [  -0.0000769700000000, -0.0026127800000000,  0.0023267200000000 ]  - [   0.0000000000000000, -0.0016172200000000,  0.0018853800000000 ]  - [  -0.0000720700000000, -0.0018932400000000,  0.0019591900000000 ]  - [   0.0000720700000000, -0.0018932400000000,  0.0019591900000000 ]  - [   0.0000000000000000,  0.1462161900000000, -0.0035774900000000 ]  - [  -0.0009072800000000,  0.0002967600000000,  0.0009497700000000 ]  - [   0.0009072800000000,  0.0002967600000000,  0.0009497700000000 ]  - [   0.0000000000000000,  0.0039236000000000,  0.0033441400000000 ]  - [   0.0003839400000000,  0.0035752000000000,  0.0028961000000000 ]  - [  -0.0003839400000000,  0.0035752000000000,  0.0028961000000000 ]  - [   0.0000000000000000,  0.0015395200000000,  0.0012732800000000 ]  - [  -0.0000832000000000,  0.0019025600000000,  0.0018472600000000 ]  - [   0.0000832000000000,  0.0019025600000000,  0.0018472600000000 ]  - [   0.0000000000000000,  0.0028468400000000,  0.0026462600000000 ]  - [   0.0000686800000000,  0.0025920600000000,  0.0023915600000000 ]  - [  -0.0000686800000000,  0.0025920600000000,  0.0023915600000000 ]  - [   0.0000000000000000,  0.0015443600000000,  0.0012517400000000 ]  - [  -0.0000657600000000,  0.0018995300000000,  0.0019336000000000 ]  - [   0.0000657600000000,  0.0018995300000000,  0.0019336000000000 ]  - [   0.0000000000000000,  0.0028470300000000,  0.0024428500000000 ]  - [   0.0000663400000000,  0.0025902200000000,  0.0023268500000000 ]  - [  -0.0000663400000000,  0.0025902200000000,  0.0023268500000000 ]  - [   0.0005000700000000, -0.0009015700000000,  0.0027648300000000 ]  - [  -0.0005000700000000, -0.0009015700000000,  0.0027648300000000 ]  - [   0.0000000000000000, -0.0022212800000000,  0.0022230100000000 ]  - [   0.0003970700000000, -0.0016845700000000,  0.0007446500000000 ]  - [  -0.0003970700000000, -0.0016845700000000,  0.0007446500000000 ]  - [   0.0000000000000000, -0.0022587300000000,  0.0019556000000000 ]  - [   0.0014111100000000, -0.0016751500000000,  0.0003953900000000 ]  - [  -0.0014111100000000, -0.0016751500000000,  0.0003953900000000 ]  - [   0.0000000000000000, -0.0022561600000000,  0.0021153200000000 ]  - [  -0.0011829800000000, -0.0008995300000000,  0.0012403100000000 ]  - [   0.0011829800000000, -0.0008995300000000,  0.0012403100000000 ]  - [   0.0000000000000000, -0.0022229100000000,  0.0021637000000000 ]  - [   0.0000004000000000, -0.0022531000000000,  0.0022603700000000 ]  - [  -0.0000004000000000, -0.0022531000000000,  0.0022603700000000 ]  - [   0.0000000000000000, -0.0022484400000000,  0.0021847200000000 ]  - [  -0.0000269100000000, -0.0022551800000000,  0.0020652200000000 ]  - [   0.0000269100000000, -0.0022551800000000,  0.0020652200000000 ]  - [   0.0000000000000000, -0.0022493500000000,  0.0021169000000000 ]  - [  -0.0004214100000000,  0.0040482900000000,  0.0011343200000000 ]  - [   0.0004214100000000,  0.0040482900000000,  0.0011343200000000 ]  - [   0.0000000000000000,  0.0024286500000000,  0.0020440400000000 ]  - [  -0.0004634100000000,  0.0031439900000000,  0.0036949100000000 ]  - [   0.0004634100000000,  0.0031439900000000,  0.0036949100000000 ]  - [   0.0000000000000000,  0.0020593600000000,  0.0021432700000000 ]  - [  -0.0021248600000000,  0.0040438900000000,  0.0046915500000000 ]  - [   0.0021248600000000,  0.0040438900000000,  0.0046915500000000 ]  - [   0.0000000000000000,  0.0024283500000000,  0.0023041000000000 ]  - [   0.0005223500000000,  0.0031345600000000,  0.0026350700000000 ]  - [  -0.0005223500000000,  0.0031345600000000,  0.0026350700000000 ]  - [   0.0000000000000000,  0.0020585400000000,  0.0019640300000000 ]  - [  -0.0000249600000000,  0.0023248700000000,  0.0020920000000000 ]  - [   0.0000249600000000,  0.0023248700000000,  0.0020920000000000 ]  - [   0.0000000000000000,  0.0022784500000000,  0.0021385500000000 ]  - [   0.0000082900000000,  0.0021972100000000,  0.0022205200000000 ]  - [  -0.0000082900000000,  0.0021972100000000,  0.0022205200000000 ]  - [   0.0000000000000000,  0.0022162200000000,  0.0021655500000000 ]  - [   0.0000000000000000,  0.0124743600000000,  0.0071268800000000 ]  - [  -0.0000116300000000,  0.0007177000000000,  0.0018893300000000 ]  - [   0.0000116300000000,  0.0007177000000000,  0.0018893300000000 ]  - [   0.0000000000000000, -0.0005236100000000,  0.0015452500000000 ]  - [   0.0000450500000000, -0.0003440300000000,  0.0016367200000000 ]  - [  -0.0000450500000000, -0.0003440300000000,  0.0016367200000000 ]  - [   0.0000000000000000,  0.0028988000000000, -0.0043013400000000 ]  - [  -0.0000528600000000,  0.0005526200000000,  0.0013203000000000 ]  - [   0.0000528600000000,  0.0005526200000000,  0.0013203000000000 ]  - [   0.0000000000000000, -0.0006004800000000,  0.0015762800000000 ]  - [   0.0000074500000000, -0.0004083800000000,  0.0015360300000000 ]  - [  -0.0000074500000000, -0.0004083800000000,  0.0015360300000000 ]  - [   0.0000000000000000,  0.0000256400000000,  0.0015681500000000 ]  - [   0.0000103900000000,  0.0000754100000000,  0.0015572500000000 ]  - [  -0.0000103900000000,  0.0000754100000000,  0.0015572500000000 ]  - [   0.0000000000000000, -0.0000988900000000,  0.0015555200000000 ]  - [   0.0000206800000000, -0.0000783200000000,  0.0015596000000000 ]  - [  -0.0000206800000000, -0.0000783200000000,  0.0015596000000000 ]  - [  -0.0001075600000000,  0.0000197800000000,  0.0011798200000000 ]  - [   0.0001075600000000,  0.0000197800000000,  0.0011798200000000 ]  - [   0.0000000000000000,  0.0000069400000000,  0.0014729300000000 ]  - [   0.0001214700000000, -0.0000617000000000,  0.0017765000000000 ]  - [  -0.0001214700000000, -0.0000617000000000,  0.0017765000000000 ]  - [   0.0000000000000000, -0.0000122400000000,  0.0015753600000000 ]  - [  -0.0028844000000000, -0.0022272000000000,  0.0015634500000000 ]  - [   0.0028844000000000, -0.0022272000000000,  0.0015634500000000 ]  - [   0.0000000000000000,  0.0000986800000000,  0.0016904900000000 ]  - [   0.0017691200000000, -0.0036839400000000,  0.0016678800000000 ]  - [  -0.0017691200000000, -0.0036839400000000,  0.0016678800000000 ]  - [   0.0000000000000000, -0.0001333000000000,  0.0015009300000000 ]  - [  -0.0000807600000000,  0.0000012600000000,  0.0019357600000000 ]  - [   0.0000807600000000,  0.0000012600000000,  0.0019357600000000 ]  - [   0.0000000000000000,  0.0000091100000000,  0.0016825200000000 ]  - [   0.0000898900000000,  0.0000393500000000,  0.0013562900000000 ]  - [  -0.0000898900000000,  0.0000393500000000,  0.0013562900000000 ]  - [   0.0000000000000000, -0.0000095300000000,  0.0015334100000000 ]- atom:   37  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000000000000000, -0.0001709200000000, -0.0045965600000000 ]  - [   0.0000364300000000, -0.0004951700000000, -0.0058810300000000 ]  - [  -0.0000364300000000, -0.0004951700000000, -0.0058810300000000 ]  - [   0.0000000000000000,  0.0008799700000000, -0.0058194400000000 ]  - [   0.0000197300000000,  0.0005080400000000, -0.0058192600000000 ]  - [  -0.0000197300000000,  0.0005080400000000, -0.0058192600000000 ]  - [   0.0000000000000000, -0.2812509500000000,  0.1423602400000000 ]  - [   0.0002948300000000, -0.0044026900000000, -0.0053434200000000 ]  - [  -0.0002948300000000, -0.0044026900000000, -0.0053434200000000 ]  - [   0.0000000000000000,  0.0027318800000000, -0.0058413800000000 ]  - [   0.0000568300000000,  0.0019779500000000, -0.0059526700000000 ]  - [  -0.0000568300000000,  0.0019779500000000, -0.0059526700000000 ]  - [   0.0000000000000000, -0.0013168600000000, -0.0058406900000000 ]  - [  -0.0000077900000000, -0.0005765700000000, -0.0058461300000000 ]  - [   0.0000077900000000, -0.0005765700000000, -0.0058461300000000 ]  - [   0.0000000000000000,  0.0009560600000000, -0.0058019000000000 ]  - [  -0.0000043900000000,  0.0005563700000000, -0.0058189200000000 ]  - [   0.0000043900000000,  0.0005563700000000, -0.0058189200000000 ]  - [  -0.0014406800000000,  0.0012910900000000, -0.0054235700000000 ]  - [   0.0014406800000000,  0.0012910900000000, -0.0054235700000000 ]  - [   0.0000000000000000, -0.0001104700000000, -0.0057406900000000 ]  - [   0.0021222100000000,  0.0010366200000000, -0.0045956000000000 ]  - [  -0.0021222100000000,  0.0010366200000000, -0.0045956000000000 ]  - [   0.0000000000000000,  0.0001490300000000, -0.0059665800000000 ]  - [   0.0007648700000000,  0.0015595400000000, -0.0054196800000000 ]  - [  -0.0007648700000000,  0.0015595400000000, -0.0054196800000000 ]  - [   0.0000000000000000, -0.0001535000000000, -0.0059296400000000 ]  - [  -0.0014263700000000,  0.0027125900000000, -0.0067516800000000 ]  - [   0.0014263700000000,  0.0027125900000000, -0.0067516800000000 ]  - [   0.0000000000000000,  0.0001737500000000, -0.0057134800000000 ]  - [  -0.0000057500000000, -0.0000369500000000, -0.0054778700000000 ]  - [   0.0000057500000000, -0.0000369500000000, -0.0054778700000000 ]  - [   0.0000000000000000, -0.0000262300000000, -0.0057192100000000 ]  - [   0.0000086300000000,  0.0000505000000000, -0.0060681500000000 ]  - [  -0.0000086300000000,  0.0000505000000000, -0.0060681500000000 ]  - [   0.0000000000000000,  0.0000243200000000, -0.0058938100000000 ]  - [   0.0000000000000000,  0.4375745400000000, -0.1560861300000000 ]  - [  -0.0012458800000000,  0.0004725700000000,  0.0006701600000000 ]  - [   0.0012458800000000,  0.0004725700000000,  0.0006701600000000 ]  - [   0.0000000000000000, -0.0038493500000000,  0.0033564400000000 ]  - [   0.0005020600000000, -0.0037037600000000,  0.0030395300000000 ]  - [  -0.0005020600000000, -0.0037037600000000,  0.0030395300000000 ]  - [   0.0000000000000000, -0.0015228700000000,  0.0012450800000000 ]  - [  -0.0000844400000000, -0.0018768700000000,  0.0018071800000000 ]  - [   0.0000844400000000, -0.0018768700000000,  0.0018071800000000 ]  - [   0.0000000000000000, -0.0028715800000000,  0.0026220400000000 ]  - [   0.0000758400000000, -0.0026023300000000,  0.0023756900000000 ]  - [  -0.0000758400000000, -0.0026023300000000,  0.0023756900000000 ]  - [   0.0000000000000000, -0.0015262400000000,  0.0019042500000000 ]  - [  -0.0000788400000000, -0.0018744500000000,  0.0019175500000000 ]  - [   0.0000788400000000, -0.0018744500000000,  0.0019175500000000 ]  - [   0.0000000000000000, -0.0028704400000000,  0.0023612900000000 ]  - [   0.0000709900000000, -0.0025998700000000,  0.0022859600000000 ]  - [  -0.0000709900000000, -0.0025998700000000,  0.0022859600000000 ]  - [   0.0000000000000000, -0.1467036700000000,  0.0084821200000000 ]  - [   0.0009045200000000,  0.0042331800000000,  0.0033537600000000 ]  - [  -0.0009045200000000,  0.0042331800000000,  0.0033537600000000 ]  - [   0.0000000000000000,  0.0005667500000000,  0.0009344700000000 ]  - [  -0.0004061600000000,  0.0009067900000000,  0.0013813000000000 ]  - [   0.0004061600000000,  0.0009067900000000,  0.0013813000000000 ]  - [   0.0000000000000000,  0.0029419100000000,  0.0029786900000000 ]  - [   0.0000720200000000,  0.0025953000000000,  0.0023773800000000 ]  - [  -0.0000720200000000,  0.0025953000000000,  0.0023773800000000 ]  - [   0.0000000000000000,  0.0016317300000000,  0.0015804300000000 ]  - [  -0.0000810700000000,  0.0018989900000000,  0.0018277900000000 ]  - [   0.0000810700000000,  0.0018989900000000,  0.0018277900000000 ]  - [   0.0000000000000000,  0.0029464500000000,  0.0030230200000000 ]  - [   0.0000650500000000,  0.0025922000000000,  0.0023153000000000 ]  - [  -0.0000650500000000,  0.0025922000000000,  0.0023153000000000 ]  - [   0.0000000000000000,  0.0016313700000000,  0.0018013000000000 ]  - [  -0.0000685000000000,  0.0018968500000000,  0.0019170200000000 ]  - [   0.0000685000000000,  0.0018968500000000,  0.0019170200000000 ]  - [  -0.0005044100000000, -0.0035963000000000,  0.0014406200000000 ]  - [   0.0005044100000000, -0.0035963000000000,  0.0014406200000000 ]  - [   0.0000000000000000, -0.0022611600000000,  0.0019999100000000 ]  - [  -0.0004007300000000, -0.0028276400000000,  0.0034839200000000 ]  - [   0.0004007300000000, -0.0028276400000000,  0.0034839200000000 ]  - [   0.0000000000000000, -0.0022283600000000,  0.0022733700000000 ]  - [  -0.0014425500000000, -0.0028186400000000,  0.0038688400000000 ]  - [   0.0014425500000000, -0.0028186400000000,  0.0038688400000000 ]  - [   0.0000000000000000, -0.0022255700000000,  0.0021290700000000 ]  - [   0.0011607400000000, -0.0035932700000000,  0.0030072400000000 ]  - [  -0.0011607400000000, -0.0035932700000000,  0.0030072400000000 ]  - [   0.0000000000000000, -0.0022625800000000,  0.0020826900000000 ]  - [  -0.0000119100000000, -0.0022550400000000,  0.0020275700000000 ]  - [   0.0000119100000000, -0.0022550400000000,  0.0020275700000000 ]  - [   0.0000000000000000, -0.0022502000000000,  0.0020967900000000 ]  - [   0.0000144700000000, -0.0022569500000000,  0.0022265900000000 ]  - [  -0.0000144700000000, -0.0022569500000000,  0.0022265900000000 ]  - [   0.0000000000000000, -0.0022512200000000,  0.0021662500000000 ]  - [   0.0004260800000000,  0.0004335600000000,  0.0030880500000000 ]  - [  -0.0004260800000000,  0.0004335600000000,  0.0030880500000000 ]  - [   0.0000000000000000,  0.0020520400000000,  0.0021831100000000 ]  - [   0.0004562400000000,  0.0013539000000000,  0.0005079300000000 ]  - [  -0.0004562400000000,  0.0013539000000000,  0.0005079300000000 ]  - [   0.0000000000000000,  0.0024285100000000,  0.0020851900000000 ]  - [   0.0021022400000000,  0.0004302000000000, -0.0004317500000000 ]  - [  -0.0021022400000000,  0.0004302000000000, -0.0004317500000000 ]  - [   0.0000000000000000,  0.0020514700000000,  0.0019398200000000 ]  - [  -0.0005421000000000,  0.0013431000000000,  0.0016001800000000 ]  - [   0.0005421000000000,  0.0013431000000000,  0.0016001800000000 ]  - [   0.0000000000000000,  0.0024272200000000,  0.0022858100000000 ]  - [   0.0000134300000000,  0.0021820200000000,  0.0021988600000000 ]  - [  -0.0000134300000000,  0.0021820200000000,  0.0021988600000000 ]  - [   0.0000000000000000,  0.0022191800000000,  0.0021451800000000 ]  - [  -0.0000209100000000,  0.0023156900000000,  0.0020723200000000 ]  - [   0.0000209100000000,  0.0023156900000000,  0.0020723200000000 ]  - [   0.0000000000000000,  0.0022843400000000,  0.0021191400000000 ]  - [   0.0000000000000000, -0.0126163800000000, -0.0040155100000000 ]  - [   0.0000221900000000, -0.0007225900000000,  0.0014174400000000 ]  - [  -0.0000221900000000, -0.0007225900000000,  0.0014174400000000 ]  - [   0.0000000000000000,  0.0005294800000000,  0.0016947600000000 ]  - [  -0.0000409600000000,  0.0003476600000000,  0.0016681800000000 ]  - [   0.0000409600000000,  0.0003476600000000,  0.0016681800000000 ]  - [   0.0000000000000000, -0.0029286200000000,  0.0073894000000000 ]  - [   0.0000396000000000, -0.0005573400000000,  0.0016975400000000 ]  - [  -0.0000396000000000, -0.0005573400000000,  0.0016975400000000 ]  - [   0.0000000000000000,  0.0006059700000000,  0.0014784500000000 ]  - [  -0.0000197700000000,  0.0004121600000000,  0.0014819000000000 ]  - [   0.0000197700000000,  0.0004121600000000,  0.0014819000000000 ]  - [   0.0000000000000000, -0.0000259300000000,  0.0015759600000000 ]  - [   0.0000280100000000, -0.0000763400000000,  0.0015910100000000 ]  - [  -0.0000280100000000, -0.0000763400000000,  0.0015910100000000 ]  - [   0.0000000000000000,  0.0000994900000000,  0.0015913500000000 ]  - [   0.0000171100000000,  0.0000788600000000,  0.0015888300000000 ]  - [  -0.0000171100000000,  0.0000788600000000,  0.0015888300000000 ]  - [   0.0000971600000000, -0.0000233200000000,  0.0018399200000000 ]  - [  -0.0000971600000000, -0.0000233200000000,  0.0018399200000000 ]  - [   0.0000000000000000, -0.0000080800000000,  0.0015835500000000 ]  - [  -0.0001313300000000,  0.0000639500000000,  0.0012387700000000 ]  - [   0.0001313300000000,  0.0000639500000000,  0.0012387700000000 ]  - [   0.0000000000000000,  0.0000130000000000,  0.0014804200000000 ]  - [   0.0030084600000000,  0.0023041500000000,  0.0015787300000000 ]  - [  -0.0030084600000000,  0.0023041500000000,  0.0015787300000000 ]  - [   0.0000000000000000, -0.0001002800000000,  0.0014567900000000 ]  - [  -0.0016769200000000,  0.0036227100000000,  0.0014507600000000 ]  - [   0.0016769200000000,  0.0036227100000000,  0.0014507600000000 ]  - [   0.0000000000000000,  0.0001338100000000,  0.0016483100000000 ]  - [   0.0000874200000000, -0.0000027800000000,  0.0013630000000000 ]  - [  -0.0000874200000000, -0.0000027800000000,  0.0013630000000000 ]  - [   0.0000000000000000, -0.0000101000000000,  0.0015544600000000 ]  - [  -0.0000843000000000, -0.0000381300000000,  0.0019479400000000 ]  - [   0.0000843000000000, -0.0000381300000000,  0.0019479400000000 ]  - [   0.0000000000000000,  0.0000102400000000,  0.0017057300000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0016272500000000, -0.0084802400000000 ]  - [  -0.0000913200000000, -0.0003917400000000, -0.0059210400000000 ]  - [   0.0000913200000000, -0.0003917400000000, -0.0059210400000000 ]  - [   0.0000000000000000,  0.0007172300000000, -0.0057890400000000 ]  - [  -0.0000392900000000,  0.0003968700000000, -0.0058255200000000 ]  - [   0.0000392900000000,  0.0003968700000000, -0.0058255200000000 ]  - [   0.0000000000000000, -0.1515052100000000,  0.2243539600000000 ]  - [   0.0006193000000000, -0.0025720000000000, -0.0052022300000000 ]  - [  -0.0006193000000000, -0.0025720000000000, -0.0052022300000000 ]  - [   0.0000000000000000,  0.0018981100000000, -0.0054586400000000 ]  - [   0.0000413100000000,  0.0012083400000000, -0.0057138800000000 ]  - [  -0.0000413100000000,  0.0012083400000000, -0.0057138800000000 ]  - [   0.0000000000000000, -0.0013045300000000, -0.0054008500000000 ]  - [  -0.0000891600000000, -0.0003196800000000, -0.0060015000000000 ]  - [   0.0000891600000000, -0.0003196800000000, -0.0060015000000000 ]  - [   0.0000000000000000,  0.0004621400000000, -0.0059944300000000 ]  - [   0.0000011400000000,  0.0002917800000000, -0.0059478100000000 ]  - [  -0.0000011400000000,  0.0002917800000000, -0.0059478100000000 ]  - [  -0.0003900400000000,  0.0009214300000000, -0.0054862400000000 ]  - [   0.0003900400000000,  0.0009214300000000, -0.0054862400000000 ]  - [   0.0000000000000000, -0.0001334600000000, -0.0056428200000000 ]  - [   0.0027989000000000,  0.0017252800000000, -0.0046435900000000 ]  - [  -0.0027989000000000,  0.0017252800000000, -0.0046435900000000 ]  - [   0.0000000000000000,  0.0001460800000000, -0.0057151100000000 ]  - [  -0.0003188900000000,  0.0020036700000000, -0.0062113300000000 ]  - [   0.0003188900000000,  0.0020036700000000, -0.0062113300000000 ]  - [   0.0000000000000000,  0.0001275100000000, -0.0060017500000000 ]  - [  -0.0004901700000000, -0.0007096200000000, -0.0062804300000000 ]  - [   0.0004901700000000, -0.0007096200000000, -0.0062804300000000 ]  - [   0.0000000000000000, -0.0001151900000000, -0.0058958500000000 ]  - [   0.0000176800000000,  0.0001358300000000, -0.0057219400000000 ]  - [  -0.0000176800000000,  0.0001358300000000, -0.0057219400000000 ]  - [   0.0000000000000000,  0.0000394500000000, -0.0058448800000000 ]  - [   0.0000347100000000, -0.0001440600000000, -0.0061853100000000 ]  - [  -0.0000347100000000, -0.0001440600000000, -0.0061853100000000 ]  - [   0.0000000000000000, -0.0000410600000000, -0.0059798600000000 ]  - [   0.0000000000000000,  0.1524809100000000, -0.1772972700000000 ]  - [  -0.0008321000000000, -0.0007976300000000,  0.0008277900000000 ]  - [   0.0008321000000000, -0.0007976300000000,  0.0008277900000000 ]  - [   0.0000000000000000, -0.0034606900000000,  0.0026307300000000 ]  - [   0.0002418300000000, -0.0031522400000000,  0.0024972600000000 ]  - [  -0.0002418300000000, -0.0031522400000000,  0.0024972600000000 ]  - [   0.0000000000000000, -0.0020216600000000,  0.0013388600000000 ]  - [   0.0000892900000000, -0.0020503100000000,  0.0020932800000000 ]  - [  -0.0000892900000000, -0.0020503100000000,  0.0020932800000000 ]  - [   0.0000000000000000, -0.0024893600000000,  0.0025135600000000 ]  - [   0.0000650100000000, -0.0024181000000000,  0.0023272200000000 ]  - [  -0.0000650100000000, -0.0024181000000000,  0.0023272200000000 ]  - [   0.0000000000000000, -0.0013914800000000,  0.0013589100000000 ]  - [  -0.0000577800000000, -0.0019520800000000,  0.0021058600000000 ]  - [   0.0000577800000000, -0.0019520800000000,  0.0021058600000000 ]  - [   0.0000000000000000, -0.0027500500000000,  0.0025196000000000 ]  - [   0.0000562100000000, -0.0025179700000000,  0.0023411700000000 ]  - [  -0.0000562100000000, -0.0025179700000000,  0.0023411700000000 ]  - [   0.0000000000000000,  0.0086985300000000, -0.0676802900000000 ]  - [   0.0003293700000000,  0.0034593300000000,  0.0025594600000000 ]  - [  -0.0003293700000000,  0.0034593300000000,  0.0025594600000000 ]  - [   0.0000000000000000,  0.0010588500000000,  0.0007987500000000 ]  - [  -0.0002772500000000,  0.0015096500000000,  0.0014848100000000 ]  - [   0.0002772500000000,  0.0015096500000000,  0.0014848100000000 ]  - [   0.0000000000000000,  0.0031340200000000,  0.0035980000000000 ]  - [   0.0001624500000000,  0.0024458300000000,  0.0024012600000000 ]  - [  -0.0001624500000000,  0.0024458300000000,  0.0024012600000000 ]  - [   0.0000000000000000,  0.0019281100000000,  0.0020269000000000 ]  - [  -0.0000052400000000,  0.0020504000000000,  0.0020419500000000 ]  - [   0.0000052400000000,  0.0020504000000000,  0.0020419500000000 ]  - [   0.0000000000000000,  0.0030915800000000,  0.0035686100000000 ]  - [   0.0000703100000000,  0.0025167700000000,  0.0024127200000000 ]  - [  -0.0000703100000000,  0.0025167700000000,  0.0024127200000000 ]  - [   0.0000000000000000,  0.0017203000000000,  0.0020385200000000 ]  - [  -0.0000568100000000,  0.0019716400000000,  0.0020549900000000 ]  - [   0.0000568100000000,  0.0019716400000000,  0.0020549900000000 ]  - [  -0.0005037700000000, -0.0031407800000000,  0.0019557700000000 ]  - [   0.0005037700000000, -0.0031407800000000,  0.0019557700000000 ]  - [   0.0000000000000000, -0.0022086600000000,  0.0019760200000000 ]  - [  -0.0010416900000000, -0.0039753500000000,  0.0035641600000000 ]  - [   0.0010416900000000, -0.0039753500000000,  0.0035641600000000 ]  - [   0.0000000000000000, -0.0022577200000000,  0.0021753200000000 ]  - [  -0.0011176100000000, -0.0036199600000000,  0.0035805400000000 ]  - [   0.0011176100000000, -0.0036199600000000,  0.0035805400000000 ]  - [   0.0000000000000000, -0.0024076900000000,  0.0021822800000000 ]  - [   0.0004803300000000, -0.0015975300000000,  0.0019638400000000 ]  - [  -0.0004803300000000, -0.0015975300000000,  0.0019638400000000 ]  - [   0.0000000000000000, -0.0021378900000000,  0.0019840800000000 ]  - [  -0.0000610900000000, -0.0023440200000000,  0.0023039400000000 ]  - [   0.0000610900000000, -0.0023440200000000,  0.0023039400000000 ]  - [   0.0000000000000000, -0.0022802400000000,  0.0022490100000000 ]  - [  -0.0000020600000000, -0.0021450700000000,  0.0023012900000000 ]  - [   0.0000020600000000, -0.0021450700000000,  0.0023012900000000 ]  - [   0.0000000000000000, -0.0022123300000000,  0.0022488400000000 ]  - [   0.0014555000000000, -0.0002850000000000,  0.0023716000000000 ]  - [  -0.0014555000000000, -0.0002850000000000,  0.0023716000000000 ]  - [   0.0000000000000000,  0.0020679600000000,  0.0020550900000000 ]  - [   0.0001935400000000,  0.0017419000000000,  0.0013368200000000 ]  - [  -0.0001935400000000,  0.0017419000000000,  0.0013368200000000 ]  - [   0.0000000000000000,  0.0024112400000000,  0.0020847300000000 ]  - [  -0.0004165200000000,  0.0032224700000000,  0.0023764500000000 ]  - [   0.0004165200000000,  0.0032224700000000,  0.0023764500000000 ]  - [   0.0000000000000000,  0.0023184400000000,  0.0020634700000000 ]  - [   0.0003170700000000,  0.0006563100000000,  0.0013368200000000 ]  - [  -0.0003170700000000,  0.0006563100000000,  0.0013368200000000 ]  - [   0.0000000000000000,  0.0022199400000000,  0.0020912300000000 ]  - [  -0.0000699300000000,  0.0023160000000000,  0.0024411000000000 ]  - [   0.0000699300000000,  0.0023160000000000,  0.0024411000000000 ]  - [   0.0000000000000000,  0.0022609100000000,  0.0022938600000000 ]  - [  -0.0000193700000000,  0.0021871300000000,  0.0021656600000000 ]  - [   0.0000193700000000,  0.0021871300000000,  0.0021656600000000 ]  - [   0.0000000000000000,  0.0022345300000000,  0.0022072200000000 ]  - [   0.0000000000000000, -0.0073738900000000,  0.0129380200000000 ]  - [   0.0000887500000000, -0.0005492700000000,  0.0016722800000000 ]  - [  -0.0000887500000000, -0.0005492700000000,  0.0016722800000000 ]  - [   0.0000000000000000,  0.0004358600000000,  0.0016068600000000 ]  - [   0.0000782200000000,  0.0002845800000000,  0.0016628000000000 ]  - [  -0.0000782200000000,  0.0002845800000000,  0.0016628000000000 ]  - [   0.0000000000000000, -0.0059869600000000,  0.0047248200000000 ]  - [  -0.0005967200000000, -0.0003011900000000,  0.0015785100000000 ]  - [   0.0005967200000000, -0.0003011900000000,  0.0015785100000000 ]  - [   0.0000000000000000,  0.0003254500000000,  0.0016859100000000 ]  - [  -0.0001003100000000,  0.0002142600000000,  0.0016015500000000 ]  - [   0.0001003100000000,  0.0002142600000000,  0.0016015500000000 ]  - [   0.0000000000000000,  0.0000434600000000,  0.0011895100000000 ]  - [  -0.0000221400000000, -0.0000491700000000,  0.0014088300000000 ]  - [   0.0000221400000000, -0.0000491700000000,  0.0014088300000000 ]  - [   0.0000000000000000,  0.0000592400000000,  0.0014238900000000 ]  - [   0.0000081600000000,  0.0000512700000000,  0.0014660000000000 ]  - [  -0.0000081600000000,  0.0000512700000000,  0.0014660000000000 ]  - [   0.0000050300000000, -0.0000475200000000,  0.0015369100000000 ]  - [  -0.0000050300000000, -0.0000475200000000,  0.0015369100000000 ]  - [   0.0000000000000000, -0.0000118100000000,  0.0014637200000000 ]  - [  -0.0001718300000000,  0.0001206700000000,  0.0009746500000000 ]  - [   0.0001718300000000,  0.0001206700000000,  0.0009746500000000 ]  - [   0.0000000000000000,  0.0000169400000000,  0.0013845300000000 ]  - [   0.0003699500000000,  0.0000410100000000,  0.0020286600000000 ]  - [  -0.0003699500000000,  0.0000410100000000,  0.0020286600000000 ]  - [   0.0000000000000000, -0.0000382800000000,  0.0016682200000000 ]  - [  -0.0040055700000000,  0.0038493400000000,  0.0022587700000000 ]  - [   0.0040055700000000,  0.0038493400000000,  0.0022587700000000 ]  - [   0.0000000000000000,  0.0000682500000000,  0.0018035400000000 ]  - [   0.0001315200000000,  0.0001515700000000,  0.0013650300000000 ]  - [  -0.0001315200000000,  0.0001515700000000,  0.0013650300000000 ]  - [   0.0000000000000000,  0.0000435300000000,  0.0015259100000000 ]  - [   0.0000700400000000, -0.0001256200000000,  0.0016424100000000 ]  - [  -0.0000700400000000, -0.0001256200000000,  0.0016424100000000 ]  - [   0.0000000000000000, -0.0000424800000000,  0.0016059000000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000, -0.0016589000000000, -0.0032013000000000 ]  - [   0.0000943500000000,  0.0003953300000000, -0.0057511000000000 ]  - [  -0.0000943500000000,  0.0003953300000000, -0.0057511000000000 ]  - [   0.0000000000000000, -0.0007295700000000, -0.0058894100000000 ]  - [   0.0000394700000000, -0.0003998300000000, -0.0058512800000000 ]  - [  -0.0000394700000000, -0.0003998300000000, -0.0058512800000000 ]  - [   0.0000000000000000,  0.1418048300000000, -0.2318785300000000 ]  - [  -0.0006247700000000,  0.0025830700000000, -0.0064207600000000 ]  - [   0.0006247700000000,  0.0025830700000000, -0.0064207600000000 ]  - [   0.0000000000000000, -0.0019174400000000, -0.0061644800000000 ]  - [  -0.0000440200000000, -0.0012203900000000, -0.0059091300000000 ]  - [   0.0000440200000000, -0.0012203900000000, -0.0059091300000000 ]  - [   0.0000000000000000,  0.0012798800000000, -0.0062757800000000 ]  - [   0.0000870800000000,  0.0003196000000000, -0.0056723600000000 ]  - [  -0.0000870800000000,  0.0003196000000000, -0.0056723600000000 ]  - [   0.0000000000000000, -0.0004598800000000, -0.0056799800000000 ]  - [  -0.0000024800000000, -0.0002932100000000, -0.0057262900000000 ]  - [   0.0000024800000000, -0.0002932100000000, -0.0057262900000000 ]  - [   0.0004050700000000, -0.0009293700000000, -0.0062066500000000 ]  - [  -0.0004050700000000, -0.0009293700000000, -0.0062066500000000 ]  - [   0.0000000000000000,  0.0001343800000000, -0.0060354100000000 ]  - [  -0.0028520300000000, -0.0017505800000000, -0.0070437700000000 ]  - [   0.0028520300000000, -0.0017505800000000, -0.0070437700000000 ]  - [   0.0000000000000000, -0.0001467400000000, -0.0059633300000000 ]  - [   0.0003146700000000, -0.0020080300000000, -0.0054531000000000 ]  - [  -0.0003146700000000, -0.0020080300000000, -0.0054531000000000 ]  - [   0.0000000000000000, -0.0001267400000000, -0.0056726900000000 ]  - [   0.0004903400000000,  0.0007350800000000, -0.0053811100000000 ]  - [  -0.0004903400000000,  0.0007350800000000, -0.0053811100000000 ]  - [   0.0000000000000000,  0.0001165700000000, -0.0057784300000000 ]  - [  -0.0000182600000000, -0.0001324400000000, -0.0059045200000000 ]  - [   0.0000182600000000, -0.0001324400000000, -0.0059045200000000 ]  - [   0.0000000000000000, -0.0000393700000000, -0.0057803300000000 ]  - [  -0.0000356400000000,  0.0001434400000000, -0.0054345400000000 ]  - [   0.0000356400000000,  0.0001434400000000, -0.0054345400000000 ]  - [   0.0000000000000000,  0.0000404400000000, -0.0056438200000000 ]  - [   0.0000000000000000, -0.1477731900000000,  0.1782320800000000 ]  - [   0.0008256100000000, -0.0037334800000000,  0.0034739100000000 ]  - [  -0.0008256100000000, -0.0037334800000000,  0.0034739100000000 ]  - [   0.0000000000000000, -0.0010430300000000,  0.0016457500000000 ]  - [  -0.0002571800000000, -0.0013664900000000,  0.0017910000000000 ]  - [   0.0002571800000000, -0.0013664900000000,  0.0017910000000000 ]  - [   0.0000000000000000, -0.0024662700000000,  0.0028835600000000 ]  - [  -0.0001016600000000, -0.0024607000000000,  0.0021274700000000 ]  - [   0.0001016600000000, -0.0024607000000000,  0.0021274700000000 ]  - [   0.0000000000000000, -0.0020126400000000,  0.0017176400000000 ]  - [  -0.0000774200000000, -0.0020914800000000,  0.0018928200000000 ]  - [   0.0000774200000000, -0.0020914800000000,  0.0018928200000000 ]  - [   0.0000000000000000, -0.0031281200000000,  0.0029052700000000 ]  - [   0.0000568200000000, -0.0025555100000000,  0.0021396300000000 ]  - [  -0.0000568200000000, -0.0025555100000000,  0.0021396300000000 ]  - [   0.0000000000000000, -0.0017398600000000,  0.0017238100000000 ]  - [  -0.0000584100000000, -0.0019873800000000,  0.0019061400000000 ]  - [   0.0000584100000000, -0.0019873800000000,  0.0019061400000000 ]  - [   0.0000000000000000, -0.0033566300000000,  0.0717953800000000 ]  - [  -0.0003388900000000,  0.0010564900000000,  0.0017337100000000 ]  - [   0.0003388900000000,  0.0010564900000000,  0.0017337100000000 ]  - [   0.0000000000000000,  0.0034679700000000,  0.0034985300000000 ]  - [   0.0002674900000000,  0.0030252600000000,  0.0028150000000000 ]  - [  -0.0002674900000000,  0.0030252600000000,  0.0028150000000000 ]  - [   0.0000000000000000,  0.0013639300000000,  0.0006788400000000 ]  - [  -0.0001743800000000,  0.0020648000000000,  0.0018213900000000 ]  - [   0.0001743800000000,  0.0020648000000000,  0.0018213900000000 ]  - [   0.0000000000000000,  0.0025702400000000,  0.0022029200000000 ]  - [  -0.0000072800000000,  0.0024608700000000,  0.0021814500000000 ]  - [   0.0000072800000000,  0.0024608700000000,  0.0021814500000000 ]  - [   0.0000000000000000,  0.0013864500000000,  0.0006495100000000 ]  - [  -0.0000730300000000,  0.0019864800000000,  0.0018324200000000 ]  - [   0.0000730300000000,  0.0019864800000000,  0.0018324200000000 ]  - [   0.0000000000000000,  0.0027868100000000,  0.0022146200000000 ]  - [   0.0000563500000000,  0.0025361700000000,  0.0021945200000000 ]  - [  -0.0000563500000000,  0.0025361700000000,  0.0021945200000000 ]  - [   0.0004911100000000, -0.0013742800000000,  0.0022705800000000 ]  - [  -0.0004911100000000, -0.0013742800000000,  0.0022705800000000 ]  - [   0.0000000000000000, -0.0022906000000000,  0.0022564700000000 ]  - [   0.0010506900000000, -0.0005034000000000,  0.0006360900000000 ]  - [  -0.0010506900000000, -0.0005034000000000,  0.0006360900000000 ]  - [   0.0000000000000000, -0.0022439700000000,  0.0020574100000000 ]  - [   0.0011171300000000, -0.0008819100000000,  0.0006524300000000 ]  - [  -0.0011171300000000, -0.0008819100000000,  0.0006524300000000 ]  - [   0.0000000000000000, -0.0020914900000000,  0.0020650900000000 ]  - [  -0.0004809600000000, -0.0029225600000000,  0.0022786300000000 ]  - [   0.0004809600000000, -0.0029225600000000,  0.0022786300000000 ]  - [   0.0000000000000000, -0.0023621800000000,  0.0022646100000000 ]  - [   0.0000489400000000, -0.0021835500000000,  0.0019900300000000 ]  - [  -0.0000489400000000, -0.0021835500000000,  0.0019900300000000 ]  - [   0.0000000000000000, -0.0022331400000000,  0.0020348800000000 ]  - [  -0.0000093800000000, -0.0023789600000000,  0.0019876500000000 ]  - [   0.0000093800000000, -0.0023789600000000,  0.0019876500000000 ]  - [   0.0000000000000000, -0.0023017800000000,  0.0020340500000000 ]  - [  -0.0014889000000000,  0.0048363500000000,  0.0018481200000000 ]  - [   0.0014889000000000,  0.0048363500000000,  0.0018481200000000 ]  - [   0.0000000000000000,  0.0024324600000000,  0.0021781700000000 ]  - [  -0.0002132100000000,  0.0027753400000000,  0.0029063700000000 ]  - [   0.0002132100000000,  0.0027753400000000,  0.0029063700000000 ]  - [   0.0000000000000000,  0.0020885200000000,  0.0021502800000000 ]  - [   0.0004200300000000,  0.0012687000000000,  0.0018552300000000 ]  - [  -0.0004200300000000,  0.0012687000000000,  0.0018552300000000 ]  - [   0.0000000000000000,  0.0021796800000000,  0.0021867200000000 ]  - [  -0.0003104400000000,  0.0038420500000000,  0.0029061400000000 ]  - [   0.0003104400000000,  0.0038420500000000,  0.0029061400000000 ]  - [   0.0000000000000000,  0.0022780400000000,  0.0021571400000000 ]  - [   0.0000578600000000,  0.0022089000000000,  0.0018503600000000 ]  - [  -0.0000578600000000,  0.0022089000000000,  0.0018503600000000 ]  - [   0.0000000000000000,  0.0022542600000000,  0.0019915700000000 ]  - [   0.0000077200000000,  0.0023346400000000,  0.0021266200000000 ]  - [  -0.0000077200000000,  0.0023346400000000,  0.0021266200000000 ]  - [   0.0000000000000000,  0.0022803200000000,  0.0020792200000000 ]  - [   0.0000000000000000,  0.0072140500000000, -0.0103369900000000 ]  - [  -0.0000961700000000,  0.0005581100000000,  0.0016248900000000 ]  - [   0.0000961700000000,  0.0005581100000000,  0.0016248900000000 ]  - [   0.0000000000000000, -0.0004426100000000,  0.0016248300000000 ]  - [  -0.0000740200000000, -0.0002884300000000,  0.0016345700000000 ]  - [   0.0000740200000000, -0.0002884300000000,  0.0016345700000000 ]  - [   0.0000000000000000,  0.0058126400000000, -0.0015011000000000 ]  - [   0.0005813800000000,  0.0003000800000000,  0.0014327200000000 ]  - [  -0.0005813800000000,  0.0003000800000000,  0.0014327200000000 ]  - [   0.0000000000000000, -0.0003221700000000,  0.0013652700000000 ]  - [   0.0000910400000000, -0.0002137300000000,  0.0014130000000000 ]  - [  -0.0000910400000000, -0.0002137300000000,  0.0014130000000000 ]  - [   0.0000000000000000, -0.0000436400000000,  0.0019542800000000 ]  - [   0.0000590800000000,  0.0000486300000000,  0.0017368500000000 ]  - [  -0.0000590800000000,  0.0000486300000000,  0.0017368500000000 ]  - [   0.0000000000000000, -0.0000607200000000,  0.0017205800000000 ]  - [   0.0000299000000000, -0.0000511400000000,  0.0016790300000000 ]  - [  -0.0000299000000000, -0.0000511400000000,  0.0016790300000000 ]  - [  -0.0000185100000000,  0.0000470700000000,  0.0014744400000000 ]  - [   0.0000185100000000,  0.0000470700000000,  0.0014744400000000 ]  - [   0.0000000000000000,  0.0000108600000000,  0.0015875000000000 ]  - [   0.0001659300000000, -0.0001218100000000,  0.0020471900000000 ]  - [  -0.0001659300000000, -0.0001218100000000,  0.0020471900000000 ]  - [   0.0000000000000000, -0.0000154200000000,  0.0016674000000000 ]  - [  -0.0003547900000000, -0.0000521000000000,  0.0011154700000000 ]  - [   0.0003547900000000, -0.0000521000000000,  0.0011154700000000 ]  - [   0.0000000000000000,  0.0000385200000000,  0.0014751900000000 ]  - [   0.0040493600000000, -0.0038341900000000,  0.0008481100000000 ]  - [  -0.0040493600000000, -0.0038341900000000,  0.0008481100000000 ]  - [   0.0000000000000000, -0.0000690600000000,  0.0013371900000000 ]  - [  -0.0001265500000000, -0.0001501400000000,  0.0019352800000000 ]  - [   0.0001265500000000, -0.0001501400000000,  0.0019352800000000 ]  - [   0.0000000000000000, -0.0000432700000000,  0.0017090900000000 ]  - [  -0.0000665300000000,  0.0001257300000000,  0.0016591600000000 ]  - [   0.0000665300000000,  0.0001257300000000,  0.0016591600000000 ]  - [   0.0000000000000000,  0.0000433900000000,  0.0016291400000000 ]- atom:  109  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0033865200000000,  0.0000000000000000, -0.0057087600000000 ]  - [  -0.0005697100000000,  0.0000000000000000, -0.0069921800000000 ]  - [  -0.0005631000000000,  0.0000000000000000, -0.0047115800000000 ]  - [   0.0003479000000000,  0.0000000000000000, -0.0058390400000000 ]  - [  -0.0001729400000000,  0.0000000000000000, -0.0058465100000000 ]  - [  -0.0001726500000000,  0.0000000000000000, -0.0058294800000000 ]  - [  -0.0084758900000000,  0.0000000000000000, -0.0058510500000000 ]  - [   0.0004583200000000,  0.0000000000000000, -0.0058573900000000 ]  - [   0.0004529600000000,  0.0000000000000000, -0.0057731300000000 ]  - [  -0.0000376900000000,  0.0000000000000000, -0.0058123000000000 ]  - [   0.0000085400000000,  0.0000000000000000, -0.0058121000000000 ]  - [   0.0000075900000000,  0.0000000000000000, -0.0058116800000000 ]  - [   0.0000482300000000,  0.0000000000000000, -0.0058319100000000 ]  - [  -0.0000251000000000,  0.0000000000000000, -0.0059877700000000 ]  - [  -0.0000243300000000,  0.0000000000000000, -0.0056893500000000 ]  - [   0.0000350200000000,  0.0000000000000000, -0.0058383500000000 ]  - [  -0.0000171900000000,  0.0000000000000000, -0.0058757700000000 ]  - [  -0.0000162300000000,  0.0000000000000000, -0.0058008100000000 ]  - [  -0.0004878100000000,  0.0055575300000000, -0.0094637700000000 ]  - [  -0.0004968800000000, -0.0055954700000000, -0.0021721000000000 ]  - [  -0.0002040200000000, -0.0000094500000000, -0.0058334000000000 ]  - [  -0.0004878100000000, -0.0055575300000000, -0.0094637700000000 ]  - [  -0.0004968800000000,  0.0055954700000000, -0.0021721000000000 ]  - [  -0.0002040200000000,  0.0000094500000000, -0.0058334000000000 ]  - [  -0.0000158400000000,  0.0001529700000000, -0.0058436900000000 ]  - [  -0.0000155400000000, -0.0001386300000000, -0.0058308200000000 ]  - [   0.0000097000000000, -0.0000013300000000, -0.0058382100000000 ]  - [  -0.0000158400000000, -0.0001529700000000, -0.0058436900000000 ]  - [  -0.0000155400000000,  0.0001386300000000, -0.0058308200000000 ]  - [   0.0000097000000000,  0.0000013300000000, -0.0058382100000000 ]  - [   0.0000876700000000,  0.0001376300000000, -0.0055447100000000 ]  - [   0.0000919100000000, -0.0001258900000000, -0.0060837800000000 ]  - [  -0.0001357500000000, -0.0000002500000000, -0.0058139400000000 ]  - [   0.0000876700000000, -0.0001376300000000, -0.0055447100000000 ]  - [   0.0000919100000000,  0.0001258900000000, -0.0060837800000000 ]  - [  -0.0001357500000000,  0.0000002500000000, -0.0058139400000000 ]  - [   0.0063927700000000, -0.0022426700000000,  0.0021455900000000 ]  - [  -0.0004553900000000, -0.0022527900000000,  0.0020562000000000 ]  - [  -0.0004417500000000, -0.0022754400000000,  0.0022344300000000 ]  - [   0.0002476800000000, -0.0022577400000000,  0.0021403200000000 ]  - [  -0.0001172300000000, -0.0023113400000000,  0.0020724500000000 ]  - [  -0.0001054800000000, -0.0022148500000000,  0.0022171300000000 ]  - [   0.0000381700000000, -0.0022501700000000,  0.0021138000000000 ]  - [  -0.0000283300000000, -0.0022514000000000,  0.0021478700000000 ]  - [  -0.0000169900000000, -0.0022588200000000,  0.0020749400000000 ]  - [   0.0000232500000000, -0.0022495200000000,  0.0021153700000000 ]  - [  -0.0000179100000000, -0.0022617100000000,  0.0021179800000000 ]  - [  -0.0000063300000000, -0.0022481900000000,  0.0021045600000000 ]  - [  -0.0006241100000000, -0.0022310400000000,  0.0020795600000000 ]  - [   0.0000384600000000, -0.0022103100000000,  0.0027194500000000 ]  - [   0.0000373700000000, -0.0022953100000000,  0.0015417800000000 ]  - [   0.0000698100000000, -0.0022484000000000,  0.0021266400000000 ]  - [  -0.0000313600000000, -0.0022703800000000,  0.0022197900000000 ]  - [  -0.0000307100000000, -0.0022353200000000,  0.0020301600000000 ]  - [   0.0063927700000000,  0.0022426700000000,  0.0021455900000000 ]  - [  -0.0004553900000000,  0.0022527900000000,  0.0020562000000000 ]  - [  -0.0004417500000000,  0.0022754400000000,  0.0022344300000000 ]  - [   0.0002476800000000,  0.0022577400000000,  0.0021403200000000 ]  - [  -0.0001172300000000,  0.0023113400000000,  0.0020724500000000 ]  - [  -0.0001054800000000,  0.0022148500000000,  0.0022171300000000 ]  - [   0.0000381700000000,  0.0022501700000000,  0.0021138000000000 ]  - [  -0.0000283300000000,  0.0022514000000000,  0.0021478700000000 ]  - [  -0.0000169900000000,  0.0022588200000000,  0.0020749400000000 ]  - [   0.0000232500000000,  0.0022495200000000,  0.0021153700000000 ]  - [  -0.0000179100000000,  0.0022617100000000,  0.0021179800000000 ]  - [  -0.0000063300000000,  0.0022481900000000,  0.0021045600000000 ]  - [  -0.0006241100000000,  0.0022310400000000,  0.0020795600000000 ]  - [   0.0000384600000000,  0.0022103100000000,  0.0027194500000000 ]  - [   0.0000373700000000,  0.0022953100000000,  0.0015417800000000 ]  - [   0.0000698100000000,  0.0022484000000000,  0.0021266400000000 ]  - [  -0.0000313600000000,  0.0022703800000000,  0.0022197900000000 ]  - [  -0.0000307100000000,  0.0022353200000000,  0.0020301600000000 ]  - [   0.0004982700000000, -0.0039899400000000,  0.0061087400000000 ]  - [   0.0005191700000000, -0.0005342800000000, -0.0019390500000000 ]  - [  -0.0004781600000000, -0.0022416200000000,  0.0021082800000000 ]  - [   0.0002035600000000,  0.0006649400000000,  0.0017459200000000 ]  - [   0.0002206200000000, -0.0052152200000000,  0.0024789200000000 ]  - [  -0.0000094100000000, -0.0022572800000000,  0.0021178000000000 ]  - [   0.0000518500000000, -0.0023879600000000,  0.0022962500000000 ]  - [   0.0000592500000000, -0.0021254700000000,  0.0019584700000000 ]  - [  -0.0001416300000000, -0.0022481700000000,  0.0021227700000000 ]  - [   0.0000401900000000, -0.0021473900000000,  0.0021069600000000 ]  - [   0.0000414700000000, -0.0023473600000000,  0.0021329500000000 ]  - [  -0.0000593300000000, -0.0022497700000000,  0.0021240900000000 ]  - [   0.0000195000000000, -0.0023586100000000,  0.0020837000000000 ]  - [   0.0000350800000000, -0.0021736400000000,  0.0022126400000000 ]  - [  -0.0000707100000000, -0.0022566200000000,  0.0021433300000000 ]  - [  -0.0000007800000000, -0.0021795000000000,  0.0020186900000000 ]  - [   0.0000093300000000, -0.0023370500000000,  0.0022695500000000 ]  - [  -0.0000062800000000, -0.0022572300000000,  0.0021434200000000 ]  - [   0.0004982700000000,  0.0039899400000000,  0.0061087400000000 ]  - [   0.0005191700000000,  0.0005342800000000, -0.0019390500000000 ]  - [  -0.0004781600000000,  0.0022416200000000,  0.0021082800000000 ]  - [   0.0002035600000000, -0.0006649400000000,  0.0017459200000000 ]  - [   0.0002206200000000,  0.0052152200000000,  0.0024789200000000 ]  - [  -0.0000094100000000,  0.0022572800000000,  0.0021178000000000 ]  - [   0.0000518500000000,  0.0023879600000000,  0.0022962500000000 ]  - [   0.0000592500000000,  0.0021254700000000,  0.0019584700000000 ]  - [  -0.0001416300000000,  0.0022481700000000,  0.0021227700000000 ]  - [   0.0000401900000000,  0.0021473900000000,  0.0021069600000000 ]  - [   0.0000414700000000,  0.0023473600000000,  0.0021329500000000 ]  - [  -0.0000593300000000,  0.0022497700000000,  0.0021240900000000 ]  - [   0.0000195000000000,  0.0023586100000000,  0.0020837000000000 ]  - [   0.0000350800000000,  0.0021736400000000,  0.0022126400000000 ]  - [  -0.0000707100000000,  0.0022566200000000,  0.0021433300000000 ]  - [  -0.0000007800000000,  0.0021795000000000,  0.0020186900000000 ]  - [   0.0000093300000000,  0.0023370500000000,  0.0022695500000000 ]  - [  -0.0000062800000000,  0.0022572300000000,  0.0021434200000000 ]  - [  -0.0064424200000000,  0.0000000000000000,  0.0016281500000000 ]  - [   0.0014426200000000,  0.0000000000000000,  0.0022154200000000 ]  - [   0.0013711300000000,  0.0000000000000000,  0.0011038000000000 ]  - [  -0.0006288700000000,  0.0000000000000000,  0.0016170400000000 ]  - [   0.0003152700000000,  0.0000000000000000,  0.0016674800000000 ]  - [   0.0003088000000000,  0.0000000000000000,  0.0016334400000000 ]  - [  -0.0003206100000000,  0.0000000000000000,  0.0015191100000000 ]  - [   0.0001226600000000,  0.0000000000000000,  0.0016442900000000 ]  - [   0.0001397700000000,  0.0000000000000000,  0.0013725600000000 ]  - [  -0.0001189100000000,  0.0000000000000000,  0.0015277600000000 ]  - [   0.0000528300000000,  0.0000000000000000,  0.0015235000000000 ]  - [   0.0000638300000000,  0.0000000000000000,  0.0014940400000000 ]  - [  -0.0002710300000000,  0.0000000000000000,  0.0015768200000000 ]  - [   0.0001227000000000,  0.0000000000000000,  0.0014203900000000 ]  - [   0.0000899300000000,  0.0000000000000000,  0.0017224500000000 ]  - [  -0.0000707500000000,  0.0000000000000000,  0.0015714800000000 ]  - [   0.0000528800000000,  0.0000000000000000,  0.0015208200000000 ]  - [   0.0000157100000000,  0.0000000000000000,  0.0016226500000000 ]  - [  -0.0002159300000000,  0.0001371800000000,  0.0020063500000000 ]  - [  -0.0002111000000000, -0.0001356800000000,  0.0010006800000000 ]  - [   0.0003329800000000, -0.0000015000000000,  0.0015246300000000 ]  - [  -0.0002159300000000, -0.0001371800000000,  0.0020063500000000 ]  - [  -0.0002111000000000,  0.0001356800000000,  0.0010006800000000 ]  - [   0.0003329800000000,  0.0000015000000000,  0.0015246300000000 ]  - [  -0.0002140000000000,  0.0001396100000000,  0.0012780600000000 ]  - [  -0.0002617400000000, -0.0001304000000000,  0.0018748500000000 ]  - [   0.0003816500000000, -0.0000016000000000,  0.0015738400000000 ]  - [  -0.0002140000000000, -0.0001396100000000,  0.0012780600000000 ]  - [  -0.0002617400000000,  0.0001304000000000,  0.0018748500000000 ]  - [   0.0003816500000000,  0.0000016000000000,  0.0015738400000000 ]  - [  -0.0000400300000000,  0.0000072700000000,  0.0016808900000000 ]  - [  -0.0000462300000000, -0.0000055200000000,  0.0016200300000000 ]  - [   0.0000791700000000, -0.0000002000000000,  0.0016176200000000 ]  - [  -0.0000400300000000, -0.0000072700000000,  0.0016808900000000 ]  - [  -0.0000462300000000,  0.0000055200000000,  0.0016200300000000 ]  - [   0.0000791700000000,  0.0000002000000000,  0.0016176200000000 ]- atom:  109  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000000000000000, -0.0028592800000000, -0.0057490900000000 ]  - [   0.0000007200000000, -0.0008179100000000, -0.0058296700000000 ]  - [  -0.0000007200000000, -0.0008179100000000, -0.0058296700000000 ]  - [   0.0000000000000000,  0.0008814100000000, -0.0058318300000000 ]  - [  -0.0000005200000000,  0.0005721100000000, -0.0058350200000000 ]  - [   0.0000005200000000,  0.0005721100000000, -0.0058350200000000 ]  - [   0.0000000000000000, -0.0261985200000000, -0.0058834700000000 ]  - [  -0.0000011400000000, -0.0013744100000000, -0.0058092800000000 ]  - [   0.0000011400000000, -0.0013744100000000, -0.0058092800000000 ]  - [   0.0000000000000000,  0.0008707100000000, -0.0058102200000000 ]  - [   0.0000000600000000,  0.0005637600000000, -0.0058094500000000 ]  - [  -0.0000000600000000,  0.0005637600000000, -0.0058094500000000 ]  - [   0.0000000000000000, -0.0000539300000000, -0.0058378500000000 ]  - [  -0.0000009000000000, -0.0001156600000000, -0.0058357700000000 ]  - [   0.0000009000000000, -0.0001156600000000, -0.0058357700000000 ]  - [   0.0000000000000000,  0.0001467300000000, -0.0058327300000000 ]  - [  -0.0000008500000000,  0.0001192400000000, -0.0058314400000000 ]  - [   0.0000008500000000,  0.0001192400000000, -0.0058314400000000 ]  - [   0.0003532700000000,  0.0074528600000000, -0.0104534200000000 ]  - [  -0.0003532700000000,  0.0074528600000000, -0.0104534200000000 ]  - [   0.0000000000000000,  0.0001061500000000, -0.0059641900000000 ]  - [  -0.0003736800000000,  0.0075174600000000, -0.0011526000000000 ]  - [   0.0003736800000000,  0.0075174600000000, -0.0011526000000000 ]  - [   0.0000000000000000,  0.0000903600000000, -0.0057044600000000 ]  - [  -0.0000145600000000,  0.0000777200000000, -0.0058194900000000 ]  - [   0.0000145600000000,  0.0000777200000000, -0.0058194900000000 ]  - [   0.0000000000000000,  0.0000081100000000, -0.0058284500000000 ]  - [   0.0000152000000000,  0.0000797800000000, -0.0058515100000000 ]  - [  -0.0000152000000000,  0.0000797800000000, -0.0058515100000000 ]  - [   0.0000000000000000,  0.0000056400000000, -0.0058439000000000 ]  - [  -0.0000263100000000, -0.0000701800000000, -0.0053672200000000 ]  - [   0.0000263100000000, -0.0000701800000000, -0.0053672200000000 ]  - [   0.0000000000000000,  0.0000028200000000, -0.0057182600000000 ]  - [   0.0000267800000000, -0.0000699400000000, -0.0062481400000000 ]  - [  -0.0000267800000000, -0.0000699400000000, -0.0062481400000000 ]  - [   0.0000000000000000, -0.0000027400000000, -0.0058991500000000 ]  - [   0.0000000000000000,  0.0103656300000000, -0.0050902500000000 ]  - [  -0.0002477900000000, -0.0015564700000000,  0.0015903600000000 ]  - [   0.0002477900000000, -0.0015564700000000,  0.0015903600000000 ]  - [   0.0000000000000000, -0.0028001100000000,  0.0025827800000000 ]  - [   0.0000942900000000, -0.0026336300000000,  0.0024367800000000 ]  - [  -0.0000942900000000, -0.0026336300000000,  0.0024367800000000 ]  - [   0.0000000000000000, -0.0022541900000000,  0.0021668800000000 ]  - [  -0.0000164800000000, -0.0021974200000000,  0.0020636100000000 ]  - [   0.0000164800000000, -0.0021974200000000,  0.0020636100000000 ]  - [   0.0000000000000000, -0.0023648400000000,  0.0021747500000000 ]  - [   0.0000051200000000, -0.0023581200000000,  0.0021662500000000 ]  - [  -0.0000051200000000, -0.0023581200000000,  0.0021662500000000 ]  - [   0.0000000000000000,  0.0006464000000000, -0.0037716900000000 ]  - [  -0.0001403700000000, -0.0017314100000000,  0.0018299300000000 ]  - [   0.0001403700000000, -0.0017314100000000,  0.0018299300000000 ]  - [   0.0000000000000000, -0.0028768500000000,  0.0024511100000000 ]  - [   0.0001026700000000, -0.0026768500000000,  0.0023358500000000 ]  - [  -0.0001026700000000, -0.0026768500000000,  0.0023358500000000 ]  - [   0.0000000000000000,  0.0148025400000000,  0.0095402700000000 ]  - [   0.0002369100000000,  0.0030161400000000,  0.0027104700000000 ]  - [  -0.0002369100000000,  0.0030161400000000,  0.0027104700000000 ]  - [   0.0000000000000000,  0.0017568600000000,  0.0017112400000000 ]  - [  -0.0001065000000000,  0.0019349300000000,  0.0018621700000000 ]  - [   0.0001065000000000,  0.0019349300000000,  0.0018621700000000 ]  - [   0.0000000000000000,  0.0022923600000000,  0.0020749200000000 ]  - [   0.0000044500000000,  0.0023587400000000,  0.0021678400000000 ]  - [  -0.0000044500000000,  0.0023587400000000,  0.0021678400000000 ]  - [   0.0000000000000000,  0.0021751700000000,  0.0020617900000000 ]  - [  -0.0000171900000000,  0.0021909100000000,  0.0020608900000000 ]  - [   0.0000171900000000,  0.0021909100000000,  0.0020608900000000 ]  - [   0.0000000000000000,  0.0052051800000000,  0.0080404300000000 ]  - [   0.0001376100000000,  0.0028195700000000,  0.0024218600000000 ]  - [  -0.0001376100000000,  0.0028195700000000,  0.0024218600000000 ]  - [   0.0000000000000000,  0.0016641700000000,  0.0018013000000000 ]  - [  -0.0001042100000000,  0.0018760200000000,  0.0019196400000000 ]  - [   0.0001042100000000,  0.0018760200000000,  0.0019196400000000 ]  - [   0.0003013300000000, -0.0059563100000000,  0.0059492300000000 ]  - [  -0.0003013300000000, -0.0059563100000000,  0.0059492300000000 ]  - [   0.0000000000000000, -0.0024275000000000,  0.0021988500000000 ]  - [   0.0001165600000000, -0.0045580200000000,  0.0021620700000000 ]  - [  -0.0001165600000000, -0.0045580200000000,  0.0021620700000000 ]  - [   0.0000000000000000, -0.0021593600000000,  0.0020739800000000 ]  - [   0.0000425900000000, -0.0023432200000000,  0.0022522800000000 ]  - [  -0.0000425900000000, -0.0023432200000000,  0.0022522800000000 ]  - [   0.0000000000000000, -0.0022840600000000,  0.0021450900000000 ]  - [  -0.0000075500000000, -0.0022666900000000,  0.0020869300000000 ]  - [   0.0000075500000000, -0.0022666900000000,  0.0020869300000000 ]  - [   0.0000000000000000, -0.0022551400000000,  0.0021129300000000 ]  - [   0.0000143200000000, -0.0022336300000000,  0.0020185900000000 ]  - [  -0.0000143200000000, -0.0022336300000000,  0.0020185900000000 ]  - [   0.0000000000000000, -0.0022999600000000,  0.0021091100000000 ]  - [  -0.0000137200000000, -0.0022729900000000,  0.0022973000000000 ]  - [   0.0000137200000000, -0.0022729900000000,  0.0022973000000000 ]  - [   0.0000000000000000, -0.0022686700000000,  0.0021895300000000 ]  - [  -0.0003672500000000, -0.0013860700000000, -0.0017549500000000 ]  - [   0.0003672500000000, -0.0013860700000000, -0.0017549500000000 ]  - [   0.0000000000000000,  0.0021494800000000,  0.0020557500000000 ]  - [  -0.0001210500000000, -0.0000172500000000,  0.0020456200000000 ]  - [   0.0001210500000000, -0.0000172500000000,  0.0020456200000000 ]  - [   0.0000000000000000,  0.0023521400000000,  0.0021476800000000 ]  - [  -0.0000456200000000,  0.0021945000000000,  0.0019983600000000 ]  - [   0.0000456200000000,  0.0021945000000000,  0.0019983600000000 ]  - [   0.0000000000000000,  0.0022670500000000,  0.0021156600000000 ]  - [   0.0000057400000000,  0.0022954600000000,  0.0021738600000000 ]  - [  -0.0000057400000000,  0.0022954600000000,  0.0021738600000000 ]  - [   0.0000000000000000,  0.0022804400000000,  0.0021397400000000 ]  - [  -0.0000259500000000,  0.0023308000000000,  0.0022797900000000 ]  - [   0.0000259500000000,  0.0023308000000000,  0.0022797900000000 ]  - [   0.0000000000000000,  0.0022702800000000,  0.0021894100000000 ]  - [   0.0000016000000000,  0.0022984900000000,  0.0020053900000000 ]  - [  -0.0000016000000000,  0.0022984900000000,  0.0020053900000000 ]  - [   0.0000000000000000,  0.0022775200000000,  0.0020973900000000 ]  - [   0.0000000000000000, -0.0103647800000000,  0.0014292300000000 ]  - [   0.0000077000000000, -0.0014224600000000,  0.0016373400000000 ]  - [  -0.0000077000000000, -0.0014224600000000,  0.0016373400000000 ]  - [   0.0000000000000000,  0.0006088300000000,  0.0016051900000000 ]  - [   0.0000017500000000,  0.0003360400000000,  0.0016399300000000 ]  - [  -0.0000017500000000,  0.0003360400000000,  0.0016399300000000 ]  - [   0.0000000000000000,  0.0001853800000000,  0.0015154200000000 ]  - [  -0.0000051300000000, -0.0000619700000000,  0.0014966600000000 ]  - [   0.0000051300000000, -0.0000619700000000,  0.0014966600000000 ]  - [   0.0000000000000000,  0.0000691900000000,  0.0015142000000000 ]  - [  -0.0000067000000000,  0.0000576000000000,  0.0014942500000000 ]  - [   0.0000067000000000,  0.0000576000000000,  0.0014942500000000 ]  - [   0.0000000000000000,  0.0001914800000000,  0.0015561200000000 ]  - [   0.0000196800000000, -0.0000600500000000,  0.0015608800000000 ]  - [  -0.0000196800000000, -0.0000600500000000,  0.0015608800000000 ]  - [   0.0000000000000000,  0.0000726400000000,  0.0015597500000000 ]  - [   0.0000180700000000,  0.0000580900000000,  0.0015634500000000 ]  - [  -0.0000180700000000,  0.0000580900000000,  0.0015634500000000 ]  - [   0.0001290000000000,  0.0004550000000000,  0.0022619500000000 ]  - [  -0.0001290000000000,  0.0004550000000000,  0.0022619500000000 ]  - [   0.0000000000000000,  0.0000192100000000,  0.0015517500000000 ]  - [  -0.0001437800000000,  0.0004657500000000,  0.0007259600000000 ]  - [   0.0001437800000000,  0.0004657500000000,  0.0007259600000000 ]  - [   0.0000000000000000,  0.0000172300000000,  0.0014814000000000 ]  - [   0.0001592000000000,  0.0004645300000000,  0.0011818000000000 ]  - [  -0.0001592000000000,  0.0004645300000000,  0.0011818000000000 ]  - [   0.0000000000000000,  0.0000197900000000,  0.0014969900000000 ]  - [  -0.0001187400000000,  0.0004635500000000,  0.0019432500000000 ]  - [   0.0001187400000000,  0.0004635500000000,  0.0019432500000000 ]  - [   0.0000000000000000,  0.0000177300000000,  0.0016244700000000 ]  - [   0.0000075700000000,  0.0000032600000000,  0.0016359000000000 ]  - [  -0.0000075700000000,  0.0000032600000000,  0.0016359000000000 ]  - [   0.0000000000000000,  0.0000010800000000,  0.0016034200000000 ]  - [  -0.0000030000000000,  0.0000033600000000,  0.0016408700000000 ]  - [   0.0000030000000000,  0.0000033600000000,  0.0016408700000000 ]  - [   0.0000000000000000,  0.0000001100000000,  0.0016083400000000 ]- atom:  109  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0362726800000000 ]  - [   0.0000289500000000,  0.0000000000000000, -0.0060366900000000 ]  - [  -0.0000289500000000,  0.0000000000000000, -0.0060366900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0060138300000000 ]  - [   0.0000248700000000,  0.0000000000000000, -0.0060043600000000 ]  - [  -0.0000248700000000,  0.0000000000000000, -0.0060043600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0243978300000000 ]  - [   0.0000119700000000,  0.0000000000000000, -0.0053112300000000 ]  - [  -0.0000119700000000,  0.0000000000000000, -0.0053112300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056800800000000 ]  - [  -0.0000693500000000,  0.0000000000000000, -0.0056928400000000 ]  - [   0.0000693500000000,  0.0000000000000000, -0.0056928400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0053849000000000 ]  - [   0.0000708900000000,  0.0000000000000000, -0.0056768800000000 ]  - [  -0.0000708900000000,  0.0000000000000000, -0.0056768800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057767300000000 ]  - [   0.0000236900000000,  0.0000000000000000, -0.0057774600000000 ]  - [  -0.0000236900000000,  0.0000000000000000, -0.0057774600000000 ]  - [  -0.0001865400000000,  0.0006575200000000, -0.0067915300000000 ]  - [   0.0001865400000000,  0.0006575200000000, -0.0067915300000000 ]  - [   0.0000000000000000,  0.0001632100000000, -0.0059635400000000 ]  - [  -0.0001865400000000, -0.0006575200000000, -0.0067915300000000 ]  - [   0.0001865400000000, -0.0006575200000000, -0.0067915300000000 ]  - [   0.0000000000000000, -0.0001632100000000, -0.0059635400000000 ]  - [  -0.0000194200000000, -0.0005109700000000, -0.0056418700000000 ]  - [   0.0000194200000000, -0.0005109700000000, -0.0056418700000000 ]  - [   0.0000000000000000, -0.0000789200000000, -0.0056900400000000 ]  - [  -0.0000194200000000,  0.0005109700000000, -0.0056418700000000 ]  - [   0.0000194200000000,  0.0005109700000000, -0.0056418700000000 ]  - [   0.0000000000000000,  0.0000789200000000, -0.0056900400000000 ]  - [  -0.0001642100000000,  0.0004070200000000, -0.0058055800000000 ]  - [   0.0001642100000000,  0.0004070200000000, -0.0058055800000000 ]  - [   0.0000000000000000,  0.0001083800000000, -0.0058492600000000 ]  - [  -0.0001642100000000, -0.0004070200000000, -0.0058055800000000 ]  - [   0.0001642100000000, -0.0004070200000000, -0.0058055800000000 ]  - [   0.0000000000000000, -0.0001083800000000, -0.0058492600000000 ]  - [   0.0000000000000000,  0.0034726900000000,  0.0141620400000000 ]  - [  -0.0001010200000000, -0.0020523200000000,  0.0021701600000000 ]  - [   0.0001010200000000, -0.0020523200000000,  0.0021701600000000 ]  - [   0.0000000000000000, -0.0023560300000000,  0.0021338100000000 ]  - [  -0.0000235300000000, -0.0023029800000000,  0.0021611600000000 ]  - [   0.0000235300000000, -0.0023029800000000,  0.0021611600000000 ]  - [   0.0000000000000000, -0.0022801000000000,  0.0017329800000000 ]  - [  -0.0000411700000000, -0.0022970000000000,  0.0019483100000000 ]  - [   0.0000411700000000, -0.0022970000000000,  0.0019483100000000 ]  - [   0.0000000000000000, -0.0022921100000000,  0.0019669200000000 ]  - [  -0.0000211900000000, -0.0022933800000000,  0.0020052300000000 ]  - [   0.0000211900000000, -0.0022933800000000,  0.0020052300000000 ]  - [   0.0000000000000000, -0.0080294900000000,  0.0050797100000000 ]  - [   0.0000614500000000, -0.0024662600000000,  0.0021997000000000 ]  - [  -0.0000614500000000, -0.0024662600000000,  0.0021997000000000 ]  - [   0.0000000000000000, -0.0022241700000000,  0.0022872100000000 ]  - [   0.0000300300000000, -0.0022522200000000,  0.0022217700000000 ]  - [  -0.0000300300000000, -0.0022522200000000,  0.0022217700000000 ]  - [   0.0000000000000000, -0.0034726900000000,  0.0141620400000000 ]  - [  -0.0001010200000000,  0.0020523200000000,  0.0021701600000000 ]  - [   0.0001010200000000,  0.0020523200000000,  0.0021701600000000 ]  - [   0.0000000000000000,  0.0023560300000000,  0.0021338100000000 ]  - [  -0.0000235300000000,  0.0023029800000000,  0.0021611600000000 ]  - [   0.0000235300000000,  0.0023029800000000,  0.0021611600000000 ]  - [   0.0000000000000000,  0.0022801000000000,  0.0017329800000000 ]  - [  -0.0000411700000000,  0.0022970000000000,  0.0019483100000000 ]  - [   0.0000411700000000,  0.0022970000000000,  0.0019483100000000 ]  - [   0.0000000000000000,  0.0022921100000000,  0.0019669200000000 ]  - [  -0.0000211900000000,  0.0022933800000000,  0.0020052300000000 ]  - [   0.0000211900000000,  0.0022933800000000,  0.0020052300000000 ]  - [   0.0000000000000000,  0.0080294900000000,  0.0050797100000000 ]  - [   0.0000614500000000,  0.0024662600000000,  0.0021997000000000 ]  - [  -0.0000614500000000,  0.0024662600000000,  0.0021997000000000 ]  - [   0.0000000000000000,  0.0022241700000000,  0.0022872100000000 ]  - [   0.0000300300000000,  0.0022522200000000,  0.0022217700000000 ]  - [  -0.0000300300000000,  0.0022522200000000,  0.0022217700000000 ]  - [   0.0011634900000000, -0.0021769100000000,  0.0028337600000000 ]  - [  -0.0011634900000000, -0.0021769100000000,  0.0028337600000000 ]  - [   0.0000000000000000, -0.0023746500000000,  0.0023638800000000 ]  - [  -0.0002164100000000, -0.0022700100000000,  0.0025608900000000 ]  - [   0.0002164100000000, -0.0022700100000000,  0.0025608900000000 ]  - [   0.0000000000000000, -0.0021281200000000,  0.0022011800000000 ]  - [   0.0002056500000000, -0.0020003100000000,  0.0015830100000000 ]  - [  -0.0002056500000000, -0.0020003100000000,  0.0015830100000000 ]  - [   0.0000000000000000, -0.0022352600000000,  0.0019884000000000 ]  - [   0.0000148200000000, -0.0026189800000000,  0.0021607000000000 ]  - [  -0.0000148200000000, -0.0026189800000000,  0.0021607000000000 ]  - [   0.0000000000000000, -0.0023258200000000,  0.0020625000000000 ]  - [  -0.0001093900000000, -0.0025762300000000,  0.0021353600000000 ]  - [   0.0001093900000000, -0.0025762300000000,  0.0021353600000000 ]  - [   0.0000000000000000, -0.0023673700000000,  0.0021322400000000 ]  - [   0.0000674100000000, -0.0020022600000000,  0.0018632200000000 ]  - [  -0.0000674100000000, -0.0020022600000000,  0.0018632200000000 ]  - [   0.0000000000000000, -0.0022167900000000,  0.0020524400000000 ]  - [   0.0011634900000000,  0.0021769100000000,  0.0028337600000000 ]  - [  -0.0011634900000000,  0.0021769100000000,  0.0028337600000000 ]  - [   0.0000000000000000,  0.0023746500000000,  0.0023638800000000 ]  - [  -0.0002164100000000,  0.0022700100000000,  0.0025608900000000 ]  - [   0.0002164100000000,  0.0022700100000000,  0.0025608900000000 ]  - [   0.0000000000000000,  0.0021281200000000,  0.0022011800000000 ]  - [   0.0002056500000000,  0.0020003100000000,  0.0015830100000000 ]  - [  -0.0002056500000000,  0.0020003100000000,  0.0015830100000000 ]  - [   0.0000000000000000,  0.0022352600000000,  0.0019884000000000 ]  - [   0.0000148200000000,  0.0026189800000000,  0.0021607000000000 ]  - [  -0.0000148200000000,  0.0026189800000000,  0.0021607000000000 ]  - [   0.0000000000000000,  0.0023258200000000,  0.0020625000000000 ]  - [  -0.0001093900000000,  0.0025762300000000,  0.0021353600000000 ]  - [   0.0001093900000000,  0.0025762300000000,  0.0021353600000000 ]  - [   0.0000000000000000,  0.0023673700000000,  0.0021322400000000 ]  - [   0.0000674100000000,  0.0020022600000000,  0.0018632200000000 ]  - [  -0.0000674100000000,  0.0020022600000000,  0.0018632200000000 ]  - [   0.0000000000000000,  0.0022167900000000,  0.0020524400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1012284100000000 ]  - [  -0.0005143800000000,  0.0000000000000000,  0.0014070800000000 ]  - [   0.0005143800000000,  0.0000000000000000,  0.0014070800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014132600000000 ]  - [   0.0000176000000000,  0.0000000000000000,  0.0015066000000000 ]  - [  -0.0000176000000000,  0.0000000000000000,  0.0015066000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020435100000000 ]  - [   0.0001459800000000,  0.0000000000000000,  0.0016592400000000 ]  - [  -0.0001459800000000,  0.0000000000000000,  0.0016592400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016026700000000 ]  - [   0.0000452500000000,  0.0000000000000000,  0.0015714800000000 ]  - [  -0.0000452500000000,  0.0000000000000000,  0.0015714800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020959600000000 ]  - [  -0.0001376200000000,  0.0000000000000000,  0.0017233300000000 ]  - [   0.0001376200000000,  0.0000000000000000,  0.0017233300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016503600000000 ]  - [  -0.0000162900000000,  0.0000000000000000,  0.0016409600000000 ]  - [   0.0000162900000000,  0.0000000000000000,  0.0016409600000000 ]  - [   0.0002951000000000,  0.0003831800000000,  0.0014635100000000 ]  - [  -0.0002951000000000,  0.0003831800000000,  0.0014635100000000 ]  - [   0.0000000000000000,  0.0000644700000000,  0.0014592100000000 ]  - [   0.0002951000000000, -0.0003831800000000,  0.0014635100000000 ]  - [  -0.0002951000000000, -0.0003831800000000,  0.0014635100000000 ]  - [   0.0000000000000000, -0.0000644700000000,  0.0014592100000000 ]  - [  -0.0005039000000000, -0.0007721500000000,  0.0015325800000000 ]  - [   0.0005039000000000, -0.0007721500000000,  0.0015325800000000 ]  - [   0.0000000000000000, -0.0000354300000000,  0.0015073100000000 ]  - [  -0.0005039000000000,  0.0007721500000000,  0.0015325800000000 ]  - [   0.0005039000000000,  0.0007721500000000,  0.0015325800000000 ]  - [   0.0000000000000000,  0.0000354300000000,  0.0015073100000000 ]  - [   0.0000049300000000,  0.0000025500000000,  0.0018666600000000 ]  - [  -0.0000049300000000,  0.0000025500000000,  0.0018666600000000 ]  - [   0.0000000000000000,  0.0000020300000000,  0.0017336400000000 ]  - [   0.0000049300000000, -0.0000025500000000,  0.0018666600000000 ]  - [  -0.0000049300000000, -0.0000025500000000,  0.0018666600000000 ]  - [   0.0000000000000000, -0.0000020300000000,  0.0017336400000000 ]- atom:  109  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0502940400000000 ]  - [  -0.0000326000000000,  0.0000000000000000, -0.0056409200000000 ]  - [   0.0000326000000000,  0.0000000000000000, -0.0056409200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056552600000000 ]  - [  -0.0000245100000000,  0.0000000000000000, -0.0056694600000000 ]  - [   0.0000245100000000,  0.0000000000000000, -0.0056694600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0351191300000000 ]  - [  -0.0000091000000000,  0.0000000000000000, -0.0062986500000000 ]  - [   0.0000091000000000,  0.0000000000000000, -0.0062986500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059415800000000 ]  - [   0.0000692000000000,  0.0000000000000000, -0.0059276400000000 ]  - [  -0.0000692000000000,  0.0000000000000000, -0.0059276400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0062842900000000 ]  - [  -0.0000716900000000,  0.0000000000000000, -0.0059955200000000 ]  - [   0.0000716900000000,  0.0000000000000000, -0.0059955200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0058947200000000 ]  - [  -0.0000245500000000,  0.0000000000000000, -0.0058898500000000 ]  - [   0.0000245500000000,  0.0000000000000000, -0.0058898500000000 ]  - [   0.0001911400000000, -0.0006547100000000, -0.0048629600000000 ]  - [  -0.0001911400000000, -0.0006547100000000, -0.0048629600000000 ]  - [   0.0000000000000000, -0.0001408500000000, -0.0056995700000000 ]  - [   0.0001911400000000,  0.0006547100000000, -0.0048629600000000 ]  - [  -0.0001911400000000,  0.0006547100000000, -0.0048629600000000 ]  - [   0.0000000000000000,  0.0001408500000000, -0.0056995700000000 ]  - [   0.0000199200000000,  0.0005011000000000, -0.0060261100000000 ]  - [  -0.0000199200000000,  0.0005011000000000, -0.0060261100000000 ]  - [   0.0000000000000000,  0.0000817100000000, -0.0059802900000000 ]  - [   0.0000199200000000, -0.0005011000000000, -0.0060261100000000 ]  - [  -0.0000199200000000, -0.0005011000000000, -0.0060261100000000 ]  - [   0.0000000000000000, -0.0000817100000000, -0.0059802900000000 ]  - [   0.0001612500000000, -0.0004047800000000, -0.0058116300000000 ]  - [  -0.0001612500000000, -0.0004047800000000, -0.0058116300000000 ]  - [   0.0000000000000000, -0.0001065000000000, -0.0057691800000000 ]  - [   0.0001612500000000,  0.0004047800000000, -0.0058116300000000 ]  - [  -0.0001612500000000,  0.0004047800000000, -0.0058116300000000 ]  - [   0.0000000000000000,  0.0001065000000000, -0.0057691800000000 ]  - [   0.0000000000000000, -0.0076631100000000, -0.0091238200000000 ]  - [   0.0000847100000000, -0.0025310900000000,  0.0021227500000000 ]  - [  -0.0000847100000000, -0.0025310900000000,  0.0021227500000000 ]  - [   0.0000000000000000, -0.0022155300000000,  0.0021531700000000 ]  - [   0.0000119900000000, -0.0022815900000000,  0.0021338600000000 ]  - [  -0.0000119900000000, -0.0022815900000000,  0.0021338600000000 ]  - [   0.0000000000000000, -0.0022817100000000,  0.0024983600000000 ]  - [   0.0000285700000000, -0.0022710400000000,  0.0022763100000000 ]  - [  -0.0000285700000000, -0.0022710400000000,  0.0022763100000000 ]  - [   0.0000000000000000, -0.0022642100000000,  0.0022649200000000 ]  - [   0.0000095300000000, -0.0022710500000000,  0.0022178600000000 ]  - [  -0.0000095300000000, -0.0022710500000000,  0.0022178600000000 ]  - [   0.0000000000000000,  0.0036377300000000, -0.0011374200000000 ]  - [  -0.0000598900000000, -0.0020978000000000,  0.0020548000000000 ]  - [   0.0000598900000000, -0.0020978000000000,  0.0020548000000000 ]  - [   0.0000000000000000, -0.0023291000000000,  0.0019661900000000 ]  - [  -0.0000305100000000, -0.0023157300000000,  0.0020341400000000 ]  - [   0.0000305100000000, -0.0023157300000000,  0.0020341400000000 ]  - [   0.0000000000000000,  0.0076631100000000, -0.0091238200000000 ]  - [   0.0000847100000000,  0.0025310900000000,  0.0021227500000000 ]  - [  -0.0000847100000000,  0.0025310900000000,  0.0021227500000000 ]  - [   0.0000000000000000,  0.0022155300000000,  0.0021531700000000 ]  - [   0.0000119900000000,  0.0022815900000000,  0.0021338600000000 ]  - [  -0.0000119900000000,  0.0022815900000000,  0.0021338600000000 ]  - [   0.0000000000000000,  0.0022817100000000,  0.0024983600000000 ]  - [   0.0000285700000000,  0.0022710400000000,  0.0022763100000000 ]  - [  -0.0000285700000000,  0.0022710400000000,  0.0022763100000000 ]  - [   0.0000000000000000,  0.0022642100000000,  0.0022649200000000 ]  - [   0.0000095300000000,  0.0022710500000000,  0.0022178600000000 ]  - [  -0.0000095300000000,  0.0022710500000000,  0.0022178600000000 ]  - [   0.0000000000000000, -0.0036377300000000, -0.0011374200000000 ]  - [  -0.0000598900000000,  0.0020978000000000,  0.0020548000000000 ]  - [   0.0000598900000000,  0.0020978000000000,  0.0020548000000000 ]  - [   0.0000000000000000,  0.0023291000000000,  0.0019661900000000 ]  - [  -0.0000305100000000,  0.0023157300000000,  0.0020341400000000 ]  - [   0.0000305100000000,  0.0023157300000000,  0.0020341400000000 ]  - [  -0.0011732900000000, -0.0023942100000000,  0.0014184700000000 ]  - [   0.0011732900000000, -0.0023942100000000,  0.0014184700000000 ]  - [   0.0000000000000000, -0.0022280900000000,  0.0018944000000000 ]  - [   0.0002021100000000, -0.0022783000000000,  0.0016550800000000 ]  - [  -0.0002021100000000, -0.0022783000000000,  0.0016550800000000 ]  - [   0.0000000000000000, -0.0023763700000000,  0.0020108000000000 ]  - [  -0.0002084500000000, -0.0025408500000000,  0.0026540400000000 ]  - [   0.0002084500000000, -0.0025408500000000,  0.0026540400000000 ]  - [   0.0000000000000000, -0.0023328700000000,  0.0022695200000000 ]  - [  -0.0000169000000000, -0.0019641300000000,  0.0020976000000000 ]  - [   0.0000169000000000, -0.0019641300000000,  0.0020976000000000 ]  - [   0.0000000000000000, -0.0022194100000000,  0.0021836800000000 ]  - [   0.0000947400000000, -0.0019943800000000,  0.0021539400000000 ]  - [  -0.0000947400000000, -0.0019943800000000,  0.0021539400000000 ]  - [   0.0000000000000000, -0.0022063900000000,  0.0021582200000000 ]  - [  -0.0000783100000000, -0.0025881200000000,  0.0024359600000000 ]  - [   0.0000783100000000, -0.0025881200000000,  0.0024359600000000 ]  - [   0.0000000000000000, -0.0023515500000000,  0.0022354900000000 ]  - [  -0.0011732900000000,  0.0023942100000000,  0.0014184700000000 ]  - [   0.0011732900000000,  0.0023942100000000,  0.0014184700000000 ]  - [   0.0000000000000000,  0.0022280900000000,  0.0018944000000000 ]  - [   0.0002021100000000,  0.0022783000000000,  0.0016550800000000 ]  - [  -0.0002021100000000,  0.0022783000000000,  0.0016550800000000 ]  - [   0.0000000000000000,  0.0023763700000000,  0.0020108000000000 ]  - [  -0.0002084500000000,  0.0025408500000000,  0.0026540400000000 ]  - [   0.0002084500000000,  0.0025408500000000,  0.0026540400000000 ]  - [   0.0000000000000000,  0.0023328700000000,  0.0022695200000000 ]  - [  -0.0000169000000000,  0.0019641300000000,  0.0020976000000000 ]  - [   0.0000169000000000,  0.0019641300000000,  0.0020976000000000 ]  - [   0.0000000000000000,  0.0022194100000000,  0.0021836800000000 ]  - [   0.0000947400000000,  0.0019943800000000,  0.0021539400000000 ]  - [  -0.0000947400000000,  0.0019943800000000,  0.0021539400000000 ]  - [   0.0000000000000000,  0.0022063900000000,  0.0021582200000000 ]  - [  -0.0000783100000000,  0.0025881200000000,  0.0024359600000000 ]  - [   0.0000783100000000,  0.0025881200000000,  0.0024359600000000 ]  - [   0.0000000000000000,  0.0023515500000000,  0.0022354900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1048357900000000 ]  - [   0.0005308300000000,  0.0000000000000000,  0.0018776600000000 ]  - [  -0.0005308300000000,  0.0000000000000000,  0.0018776600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018061500000000 ]  - [  -0.0000132000000000,  0.0000000000000000,  0.0017812900000000 ]  - [   0.0000132000000000,  0.0000000000000000,  0.0017812900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0009918400000000 ]  - [  -0.0001575700000000,  0.0000000000000000,  0.0013487000000000 ]  - [   0.0001575700000000,  0.0000000000000000,  0.0013487000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014402200000000 ]  - [  -0.0000573300000000,  0.0000000000000000,  0.0014314400000000 ]  - [   0.0000573300000000,  0.0000000000000000,  0.0014314400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010407400000000 ]  - [   0.0001719000000000,  0.0000000000000000,  0.0014106400000000 ]  - [  -0.0001719000000000,  0.0000000000000000,  0.0014106400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014821100000000 ]  - [   0.0000524100000000,  0.0000000000000000,  0.0014974000000000 ]  - [  -0.0000524100000000,  0.0000000000000000,  0.0014974000000000 ]  - [  -0.0003027300000000, -0.0003771800000000,  0.0015386000000000 ]  - [   0.0003027300000000, -0.0003771800000000,  0.0015386000000000 ]  - [   0.0000000000000000, -0.0000644000000000,  0.0015794500000000 ]  - [  -0.0003027300000000,  0.0003771800000000,  0.0015386000000000 ]  - [   0.0003027300000000,  0.0003771800000000,  0.0015386000000000 ]  - [   0.0000000000000000,  0.0000644000000000,  0.0015794500000000 ]  - [   0.0005397100000000,  0.0007634900000000,  0.0016062200000000 ]  - [  -0.0005397100000000,  0.0007634900000000,  0.0016062200000000 ]  - [   0.0000000000000000,  0.0000340800000000,  0.0016261400000000 ]  - [   0.0005397100000000, -0.0007634900000000,  0.0016062200000000 ]  - [  -0.0005397100000000, -0.0007634900000000,  0.0016062200000000 ]  - [   0.0000000000000000, -0.0000340800000000,  0.0016261400000000 ]  - [   0.0000002600000000, -0.0000018100000000,  0.0014260000000000 ]  - [  -0.0000002600000000, -0.0000018100000000,  0.0014260000000000 ]  - [   0.0000000000000000, -0.0000017800000000,  0.0014910500000000 ]  - [   0.0000002600000000,  0.0000018100000000,  0.0014260000000000 ]  - [  -0.0000002600000000,  0.0000018100000000,  0.0014260000000000 ]  - [   0.0000000000000000,  0.0000017800000000,  0.0014910500000000 ]