# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/0327ac9e-3a02-465e-96e7-3132696e8ce8/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 TiAs2O7 / C2/c (15) / materials id 557146](https://mdr.nims.go.jp/datasets/ab9886d6-fa8b-404e-9890-ac4a61a0193e)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "C2/c"  number: 15  Hall_symbol: "-C 2yc"primitive_matrix:- [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]- [ -0.500000000000000,  0.500000000000000,  0.000000000000000 ]- [  0.000000000000000,  0.000000000000000,  1.000000000000000 ]supercell_matrix:- [   2,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     3.457447205000000,    -3.988879430000000,     0.002682140000000 ] # a  - [     3.457447205000000,     3.988879430000000,     0.002682140000000 ] # b  - [    -2.279925220000000,     0.000000000000000,     9.183023929999999 ] # c  points:  - symbol: Ti # 1    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 47.867000  - symbol: Ti # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 47.867000  - symbol: As # 3    coordinates: [  0.561246280000000,  0.829742080000000,  0.199197520000000 ]    mass: 74.921600  - symbol: As # 4    coordinates: [  0.829742080000000,  0.561246280000000,  0.699197520000000 ]    mass: 74.921600  - symbol: As # 5    coordinates: [  0.170257920000000,  0.438753720000000,  0.300802480000000 ]    mass: 74.921600  - symbol: As # 6    coordinates: [  0.438753720000000,  0.170257920000000,  0.800802480000000 ]    mass: 74.921600  - symbol: O  # 7    coordinates: [  0.286855760000000,  0.925567800000000,  0.130168740000000 ]    mass: 15.999400  - symbol: O  # 8    coordinates: [  0.248565930000000,  0.231871470000000,  0.922690190000000 ]    mass: 15.999400  - symbol: O  # 9    coordinates: [  0.033185230000000,  0.709290510000000,  0.854332730000000 ]    mass: 15.999400  - symbol: O  # 10    coordinates: [  0.290709490000000,  0.966814770000000,  0.645667270000000 ]    mass: 15.999400  - symbol: O  # 11    coordinates: [  0.472339080000000,  0.527660920000000,  0.250000000000000 ]    mass: 15.999400  - symbol: O  # 12    coordinates: [  0.925567800000000,  0.286855760000000,  0.630168740000000 ]    mass: 15.999400  - symbol: O  # 13    coordinates: [  0.231871470000000,  0.248565930000000,  0.422690190000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.768128530000000,  0.751434070000000,  0.577309810000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.751434070000000,  0.768128530000000,  0.077309810000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.966814770000000,  0.290709490000000,  0.145667270000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.713144240000000,  0.074432200000000,  0.869831260000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.709290510000000,  0.033185230000000,  0.354332730000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.074432200000000,  0.713144240000000,  0.369831260000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.527660920000000,  0.472339080000000,  0.750000000000000 ]    mass: 15.999400  reciprocal_lattice: # without 2pi  - [     0.144587520187065,    -0.125348486655060,     0.035897623297574 ] # a*  - [     0.144587520187065,     0.125348486655060,     0.035897623297574 ] # b*  - [    -0.000084461060834,    -0.000000000000000,     0.108875621224402 ] # c*unit_cell:  lattice:  - [     6.914894410000000,     0.000000000000000,     0.005364280000000 ] # a  - [     0.000000000000000,     7.977758860000000,     0.000000000000000 ] # b  - [    -2.279925220000000,     0.000000000000000,     9.183023929999999 ] # c  points:  - symbol: Ti # 1    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 47.867000    reduced_to: 1  - symbol: Ti # 2    coordinates: [  0.500000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 47.867000    reduced_to: 2  - symbol: Ti # 3    coordinates: [  0.500000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 47.867000    reduced_to: 1  - symbol: Ti # 4    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 47.867000    reduced_to: 2  - symbol: As # 5    coordinates: [  0.695494180000000,  0.134247900000000,  0.199197520000000 ]    mass: 74.921600    reduced_to: 5  - symbol: As # 6    coordinates: [  0.695494180000000,  0.865752100000000,  0.699197520000000 ]    mass: 74.921600    reduced_to: 6  - symbol: As # 7    coordinates: [  0.304505820000000,  0.134247900000000,  0.300802480000000 ]    mass: 74.921600    reduced_to: 7  - symbol: As # 8    coordinates: [  0.304505820000000,  0.865752100000000,  0.800802480000000 ]    mass: 74.921600    reduced_to: 8  - symbol: As # 9    coordinates: [  0.195494180000000,  0.634247900000000,  0.199197520000000 ]    mass: 74.921600    reduced_to: 5  - symbol: As # 10    coordinates: [  0.195494180000000,  0.365752100000000,  0.699197520000000 ]    mass: 74.921600    reduced_to: 6  - symbol: As # 11    coordinates: [  0.804505820000000,  0.634247900000000,  0.300802480000000 ]    mass: 74.921600    reduced_to: 7  - symbol: As # 12    coordinates: [  0.804505820000000,  0.365752100000000,  0.800802480000000 ]    mass: 74.921600    reduced_to: 8  - symbol: O  # 13    coordinates: [  0.606211780000000,  0.319356020000000,  0.130168740000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 14    coordinates: [  0.240218700000000,  0.991652770000000,  0.922690190000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 15    coordinates: [  0.371237870000000,  0.338052640000000,  0.854332730000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 16    coordinates: [  0.628762130000000,  0.338052640000000,  0.645667270000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 17    coordinates: [  0.500000000000000,  0.027660920000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 18    coordinates: [  0.606211780000000,  0.680643980000000,  0.630168740000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 19    coordinates: [  0.240218700000000,  0.008347230000000,  0.422690190000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 20    coordinates: [  0.759781300000000,  0.991652770000000,  0.577309810000000 ]    mass: 15.999400    reduced_to: 20  - symbol: O  # 21    coordinates: [  0.759781300000000,  0.008347230000000,  0.077309810000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 22    coordinates: [  0.628762130000000,  0.661947360000000,  0.145667270000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 23    coordinates: [  0.393788220000000,  0.680643980000000,  0.869831260000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 24    coordinates: [  0.371237870000000,  0.661947360000000,  0.354332730000000 ]    mass: 15.999400    reduced_to: 24  - symbol: O  # 25    coordinates: [  0.393788220000000,  0.319356020000000,  0.369831260000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.500000000000000,  0.972339080000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 26  - symbol: O  # 27    coordinates: [  0.106211780000000,  0.819356020000000,  0.130168740000000 ]    mass: 15.999400    reduced_to: 13  - symbol: O  # 28    coordinates: [  0.740218700000000,  0.491652770000000,  0.922690190000000 ]    mass: 15.999400    reduced_to: 14  - symbol: O  # 29    coordinates: [  0.871237870000000,  0.838052640000000,  0.854332730000000 ]    mass: 15.999400    reduced_to: 15  - symbol: O  # 30    coordinates: [  0.128762130000000,  0.838052640000000,  0.645667270000000 ]    mass: 15.999400    reduced_to: 16  - symbol: O  # 31    coordinates: [  0.000000000000000,  0.527660920000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 17  - symbol: O  # 32    coordinates: [  0.106211780000000,  0.180643980000000,  0.630168740000000 ]    mass: 15.999400    reduced_to: 18  - symbol: O  # 33    coordinates: [  0.740218700000000,  0.508347230000000,  0.422690190000000 ]    mass: 15.999400    reduced_to: 19  - symbol: O  # 34    coordinates: [  0.259781300000000,  0.491652770000000,  0.577309810000000 ]    mass: 15.999400    reduced_to: 20  - symbol: O  # 35    coordinates: [  0.259781300000000,  0.508347230000000,  0.077309810000000 ]    mass: 15.999400    reduced_to: 21  - symbol: O  # 36    coordinates: [  0.128762130000000,  0.161947360000000,  0.145667270000000 ]    mass: 15.999400    reduced_to: 22  - symbol: O  # 37    coordinates: [  0.893788220000000,  0.180643980000000,  0.869831260000000 ]    mass: 15.999400    reduced_to: 23  - symbol: O  # 38    coordinates: [  0.871237870000000,  0.161947360000000,  0.354332730000000 ]    mass: 15.999400    reduced_to: 24  - symbol: O  # 39    coordinates: [  0.893788220000000,  0.819356020000000,  0.369831260000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 40    coordinates: [  0.000000000000000,  0.472339080000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 26supercell:  lattice:  - [    13.829788819999999,     0.000000000000000,     0.010728560000000 ] # a  - [     0.000000000000000,     7.977758860000000,     0.000000000000000 ] # b  - [    -2.279925220000000,     0.000000000000000,     9.183023929999999 ] # c  points:  - symbol: Ti # 1    coordinates: [  0.000000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 47.867000    reduced_to: 1  - symbol: Ti # 2    coordinates: [  0.500000000000000,  0.000000000000000,  0.000000000000000 ]    mass: 47.867000    reduced_to: 1  - symbol: Ti # 3    coordinates: [  0.250000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 47.867000    reduced_to: 3  - symbol: Ti # 4    coordinates: [  0.750000000000000,  0.500000000000000,  0.500000000000000 ]    mass: 47.867000    reduced_to: 3  - symbol: Ti # 5    coordinates: [  0.250000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 47.867000    reduced_to: 1  - symbol: Ti # 6    coordinates: [  0.750000000000000,  0.500000000000000,  0.000000000000000 ]    mass: 47.867000    reduced_to: 1  - symbol: Ti # 7    coordinates: [  0.000000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 47.867000    reduced_to: 3  - symbol: Ti # 8    coordinates: [  0.500000000000000,  0.000000000000000,  0.500000000000000 ]    mass: 47.867000    reduced_to: 3  - symbol: As # 9    coordinates: [  0.347747090000000,  0.134247900000000,  0.199197520000000 ]    mass: 74.921600    reduced_to: 9  - symbol: As # 10    coordinates: [  0.847747090000000,  0.134247900000000,  0.199197520000000 ]    mass: 74.921600    reduced_to: 9  - symbol: As # 11    coordinates: [  0.347747090000000,  0.865752100000000,  0.699197520000000 ]    mass: 74.921600    reduced_to: 11  - symbol: As # 12    coordinates: [  0.847747090000000,  0.865752100000000,  0.699197520000000 ]    mass: 74.921600    reduced_to: 11  - symbol: As # 13    coordinates: [  0.152252910000000,  0.134247900000000,  0.300802480000000 ]    mass: 74.921600    reduced_to: 13  - symbol: As # 14    coordinates: [  0.652252910000000,  0.134247900000000,  0.300802480000000 ]    mass: 74.921600    reduced_to: 13  - symbol: As # 15    coordinates: [  0.152252910000000,  0.865752100000000,  0.800802480000000 ]    mass: 74.921600    reduced_to: 15  - symbol: As # 16    coordinates: [  0.652252910000000,  0.865752100000000,  0.800802480000000 ]    mass: 74.921600    reduced_to: 15  - symbol: As # 17    coordinates: [  0.097747090000000,  0.634247900000000,  0.199197520000000 ]    mass: 74.921600    reduced_to: 9  - symbol: As # 18    coordinates: [  0.597747090000000,  0.634247900000000,  0.199197520000000 ]    mass: 74.921600    reduced_to: 9  - symbol: As # 19    coordinates: [  0.097747090000000,  0.365752100000000,  0.699197520000000 ]    mass: 74.921600    reduced_to: 11  - symbol: As # 20    coordinates: [  0.597747090000000,  0.365752100000000,  0.699197520000000 ]    mass: 74.921600    reduced_to: 11  - symbol: As # 21    coordinates: [  0.402252910000000,  0.634247900000000,  0.300802480000000 ]    mass: 74.921600    reduced_to: 13  - symbol: As # 22    coordinates: [  0.902252910000000,  0.634247900000000,  0.300802480000000 ]    mass: 74.921600    reduced_to: 13  - symbol: As # 23    coordinates: [  0.402252910000000,  0.365752100000000,  0.800802480000000 ]    mass: 74.921600    reduced_to: 15  - symbol: As # 24    coordinates: [  0.902252910000000,  0.365752100000000,  0.800802480000000 ]    mass: 74.921600    reduced_to: 15  - symbol: O  # 25    coordinates: [  0.303105890000000,  0.319356020000000,  0.130168740000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 26    coordinates: [  0.803105890000000,  0.319356020000000,  0.130168740000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 27    coordinates: [  0.120109350000000,  0.991652770000000,  0.922690190000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 28    coordinates: [  0.620109350000000,  0.991652770000000,  0.922690190000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 29    coordinates: [  0.185618935000000,  0.338052640000000,  0.854332730000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 30    coordinates: [  0.685618935000000,  0.338052640000000,  0.854332730000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 31    coordinates: [  0.314381065000000,  0.338052640000000,  0.645667270000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 32    coordinates: [  0.814381065000000,  0.338052640000000,  0.645667270000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 33    coordinates: [  0.250000000000000,  0.027660920000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 34    coordinates: [  0.750000000000000,  0.027660920000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 35    coordinates: [  0.303105890000000,  0.680643980000000,  0.630168740000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 36    coordinates: [  0.803105890000000,  0.680643980000000,  0.630168740000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 37    coordinates: [  0.120109350000000,  0.008347230000000,  0.422690190000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.620109350000000,  0.008347230000000,  0.422690190000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 39    coordinates: [  0.379890650000000,  0.991652770000000,  0.577309810000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.879890650000000,  0.991652770000000,  0.577309810000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 41    coordinates: [  0.379890650000000,  0.008347230000000,  0.077309810000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.879890650000000,  0.008347230000000,  0.077309810000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 43    coordinates: [  0.314381065000000,  0.661947360000000,  0.145667270000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.814381065000000,  0.661947360000000,  0.145667270000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 45    coordinates: [  0.196894110000000,  0.680643980000000,  0.869831260000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.696894110000000,  0.680643980000000,  0.869831260000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 47    coordinates: [  0.185618935000000,  0.661947360000000,  0.354332730000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.685618935000000,  0.661947360000000,  0.354332730000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 49    coordinates: [  0.196894110000000,  0.319356020000000,  0.369831260000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 50    coordinates: [  0.696894110000000,  0.319356020000000,  0.369831260000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 51    coordinates: [  0.250000000000000,  0.972339080000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 52    coordinates: [  0.750000000000000,  0.972339080000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 53    coordinates: [  0.053105890000000,  0.819356020000000,  0.130168740000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 54    coordinates: [  0.553105890000000,  0.819356020000000,  0.130168740000000 ]    mass: 15.999400    reduced_to: 25  - symbol: O  # 55    coordinates: [  0.370109350000000,  0.491652770000000,  0.922690190000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 56    coordinates: [  0.870109350000000,  0.491652770000000,  0.922690190000000 ]    mass: 15.999400    reduced_to: 27  - symbol: O  # 57    coordinates: [  0.435618935000000,  0.838052640000000,  0.854332730000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 58    coordinates: [  0.935618935000000,  0.838052640000000,  0.854332730000000 ]    mass: 15.999400    reduced_to: 29  - symbol: O  # 59    coordinates: [  0.064381065000000,  0.838052640000000,  0.645667270000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 60    coordinates: [  0.564381065000000,  0.838052640000000,  0.645667270000000 ]    mass: 15.999400    reduced_to: 31  - symbol: O  # 61    coordinates: [  0.000000000000000,  0.527660920000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 62    coordinates: [  0.500000000000000,  0.527660920000000,  0.250000000000000 ]    mass: 15.999400    reduced_to: 33  - symbol: O  # 63    coordinates: [  0.053105890000000,  0.180643980000000,  0.630168740000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 64    coordinates: [  0.553105890000000,  0.180643980000000,  0.630168740000000 ]    mass: 15.999400    reduced_to: 35  - symbol: O  # 65    coordinates: [  0.370109350000000,  0.508347230000000,  0.422690190000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 66    coordinates: [  0.870109350000000,  0.508347230000000,  0.422690190000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 67    coordinates: [  0.129890650000000,  0.491652770000000,  0.577309810000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 68    coordinates: [  0.629890650000000,  0.491652770000000,  0.577309810000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 69    coordinates: [  0.129890650000000,  0.508347230000000,  0.077309810000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 70    coordinates: [  0.629890650000000,  0.508347230000000,  0.077309810000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 71    coordinates: [  0.064381065000000,  0.161947360000000,  0.145667270000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 72    coordinates: [  0.564381065000000,  0.161947360000000,  0.145667270000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 73    coordinates: [  0.446894110000000,  0.180643980000000,  0.869831260000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 74    coordinates: [  0.946894110000000,  0.180643980000000,  0.869831260000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 75    coordinates: [  0.435618935000000,  0.161947360000000,  0.354332730000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 76    coordinates: [  0.935618935000000,  0.161947360000000,  0.354332730000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 77    coordinates: [  0.446894110000000,  0.819356020000000,  0.369831260000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 78    coordinates: [  0.946894110000000,  0.819356020000000,  0.369831260000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 79    coordinates: [  0.000000000000000,  0.472339080000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 80    coordinates: [  0.500000000000000,  0.472339080000000,  0.750000000000000 ]    mass: 15.999400    reduced_to: 51displacements:- atom:    1  displacement:    [   0.0099999969910042,  0.0000000000000000,  0.0000077575709300 ]  forces:  - [  -0.1893490000000000,  0.0101493100000000, -0.0150685700000000 ]  - [   0.0157929900000000,  0.0016388300000000,  0.0053887700000000 ]  - [   0.0021484100000000, -0.0008199500000000,  0.0035693100000000 ]  - [   0.0021804400000000, -0.0008323600000000,  0.0036231600000000 ]  - [   0.0086985000000000, -0.0085979700000000,  0.0086907200000000 ]  - [   0.0087532800000000, -0.0085356300000000,  0.0085907300000000 ]  - [  -0.0283372500000000,  0.0166244600000000, -0.0240930400000000 ]  - [   0.0128928100000000, -0.0011209200000000,  0.0055031700000000 ]  - [   0.0131512700000000,  0.0003863500000000,  0.0046651800000000 ]  - [   0.0324582000000000, -0.0389018800000000, -0.0529717900000000 ]  - [   0.0147623600000000, -0.0034598700000000, -0.0011990000000000 ]  - [   0.0045116400000000,  0.0021955400000000,  0.0253845000000000 ]  - [   0.0038926300000000,  0.0026154000000000,  0.0250355200000000 ]  - [   0.0142472600000000, -0.0029987300000000, -0.0014330000000000 ]  - [   0.0324751800000000, -0.0397377500000000, -0.0538292600000000 ]  - [   0.0126844800000000, -0.0000581400000000,  0.0043376400000000 ]  - [  -0.0031429000000000, -0.0171648800000000,  0.0111093900000000 ]  - [   0.0092592300000000, -0.0015555400000000, -0.0004845200000000 ]  - [  -0.0137479500000000,  0.0023453800000000, -0.0051922800000000 ]  - [   0.0090222600000000,  0.0005936400000000,  0.0034874100000000 ]  - [   0.0085305800000000,  0.0010287300000000,  0.0032274700000000 ]  - [  -0.0141421200000000,  0.0027518900000000, -0.0054609800000000 ]  - [   0.0087829100000000, -0.0019875100000000, -0.0007755100000000 ]  - [  -0.0035040200000000, -0.0177679500000000,  0.0109620600000000 ]  - [  -0.0037240900000000,  0.0011959700000000, -0.0021107000000000 ]  - [  -0.0094269000000000,  0.0191696400000000, -0.0021670600000000 ]  - [   0.0429221300000000,  0.0098302500000000, -0.0018417800000000 ]  - [  -0.0074354700000000,  0.0005217200000000, -0.0001627900000000 ]  - [   0.0012266600000000, -0.0012447700000000,  0.0028718200000000 ]  - [  -0.0044868700000000, -0.0019926500000000, -0.0050157300000000 ]  - [  -0.0015026400000000,  0.0000448900000000, -0.0009429000000000 ]  - [   0.0000235000000000,  0.0014812600000000, -0.0021444600000000 ]  - [  -0.0045521900000000, -0.0002022900000000, -0.0028658700000000 ]  - [  -0.0154552900000000,  0.0042458700000000,  0.0079213100000000 ]  - [  -0.0025665000000000,  0.0019331900000000,  0.0007231100000000 ]  - [  -0.0020576100000000, -0.0025442100000000, -0.0039826800000000 ]  - [   0.0085772400000000,  0.0021115300000000, -0.0072400300000000 ]  - [  -0.0068861400000000, -0.0007671900000000,  0.0015705500000000 ]  - [  -0.0077745300000000, -0.0014440300000000,  0.0035748100000000 ]  - [   0.0076898200000000,  0.0014282000000000, -0.0052706200000000 ]  - [  -0.0083692400000000,  0.0011897700000000,  0.0018321800000000 ]  - [   0.0382205600000000,  0.0106570900000000,  0.0016891300000000 ]  - [  -0.0028034300000000, -0.0001797000000000, -0.0033470700000000 ]  - [   0.0029198200000000,  0.0005692000000000,  0.0045825600000000 ]  - [  -0.0084575400000000,  0.0208192200000000, -0.0024953700000000 ]  - [  -0.0026970400000000,  0.0027045200000000, -0.0024073000000000 ]  - [  -0.0016276300000000,  0.0032411800000000, -0.0037758600000000 ]  - [  -0.0032111000000000,  0.0018397000000000, -0.0026675600000000 ]  - [  -0.0010134900000000, -0.0040478500000000, -0.0042690200000000 ]  - [  -0.0015382000000000,  0.0004238500000000,  0.0004098600000000 ]  - [  -0.0154732400000000,  0.0024803700000000,  0.0079404300000000 ]  - [  -0.0046156300000000, -0.0019712500000000, -0.0028479800000000 ]  - [   0.0132043300000000, -0.0050318400000000,  0.0048787000000000 ]  - [  -0.0038229000000000,  0.0016509500000000, -0.0017349100000000 ]  - [  -0.0054326800000000,  0.0017060100000000,  0.0008853400000000 ]  - [   0.0006205200000000,  0.0016149900000000, -0.0021457200000000 ]  - [  -0.0061525200000000, -0.0024800100000000, -0.0050096100000000 ]  - [   0.0135074400000000,  0.0132236400000000,  0.0079025600000000 ]  - [   0.0099161300000000, -0.0031807100000000,  0.0261513100000000 ]  - [  -0.0035535200000000,  0.0008181500000000, -0.0035950700000000 ]  - [   0.0107794600000000,  0.0043010100000000, -0.0035270800000000 ]  - [  -0.0058760900000000,  0.0010043600000000,  0.0006450600000000 ]  - [   0.0053355500000000,  0.0011488400000000,  0.0062112500000000 ]  - [  -0.0034746100000000, -0.0015717200000000, -0.0022331900000000 ]  - [  -0.0025970600000000, -0.0001494700000000, -0.0009433700000000 ]  - [   0.0033452000000000,  0.0010109100000000, -0.0011812200000000 ]  - [   0.0024437600000000,  0.0003132100000000,  0.0008576100000000 ]  - [  -0.0035069400000000, -0.0008167800000000,  0.0010550900000000 ]  - [  -0.0001858900000000,  0.0022376200000000, -0.0001768800000000 ]  - [  -0.0063388000000000,  0.0023867500000000,  0.0029025300000000 ]  - [   0.0149433500000000,  0.0150921000000000,  0.0096346700000000 ]  - [  -0.0044590700000000, -0.0006756100000000, -0.0033170000000000 ]  - [  -0.0027973600000000,  0.0031655300000000, -0.0020358900000000 ]  - [   0.0143387800000000, -0.0036654300000000,  0.0046623000000000 ]  - [  -0.0052384000000000,  0.0026203800000000, -0.0052944200000000 ]  - [   0.0082031800000000, -0.0013831100000000,  0.0243347400000000 ]  - [  -0.0024298200000000, -0.0030432700000000, -0.0025247500000000 ]  - [   0.0063383900000000, -0.0003495100000000,  0.0058879400000000 ]  - [   0.0108726800000000,  0.0025452100000000, -0.0035768200000000 ]  - [  -0.0059092900000000, -0.0007761200000000,  0.0006587400000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0101541800000000, -0.1970899400000000, -0.0098813600000000 ]  - [   0.0016378500000000, -0.0002512600000000, -0.0013921000000000 ]  - [   0.0008249200000000,  0.0142234900000000, -0.0019841300000000 ]  - [   0.0008199700000000,  0.0141963300000000, -0.0019976300000000 ]  - [  -0.0085452700000000,  0.0077965300000000,  0.0036928200000000 ]  - [  -0.0085956000000000,  0.0077562800000000,  0.0037383400000000 ]  - [  -0.0166252600000000, -0.0131958800000000,  0.0042408900000000 ]  - [   0.0011221300000000, -0.0021595600000000,  0.0022944600000000 ]  - [   0.0078302000000000,  0.0045466900000000, -0.0025809600000000 ]  - [  -0.0118192600000000,  0.0005108000000000,  0.0091272900000000 ]  - [  -0.0004088900000000, -0.0005289800000000,  0.0004992500000000 ]  - [   0.0265216400000000, -0.0092713700000000,  0.0432490600000000 ]  - [   0.0262009800000000, -0.0088818200000000,  0.0433172700000000 ]  - [  -0.0008854800000000, -0.0000978000000000,  0.0002203400000000 ]  - [  -0.0123964700000000,  0.0001722700000000,  0.0088958600000000 ]  - [   0.0073115600000000,  0.0041081600000000, -0.0028363400000000 ]  - [  -0.0189442600000000,  0.0628790500000000, -0.0300646800000000 ]  - [  -0.0001273500000000,  0.0003848100000000,  0.0003887800000000 ]  - [   0.0124489900000000,  0.0002384300000000, -0.0043815800000000 ]  - [  -0.0014697800000000, -0.0000361500000000, -0.0011044500000000 ]  - [  -0.0019484300000000,  0.0003974000000000, -0.0013709200000000 ]  - [   0.0119304000000000,  0.0006963500000000, -0.0046109500000000 ]  - [  -0.0006096700000000, -0.0000481600000000,  0.0001140100000000 ]  - [  -0.0195416600000000,  0.0626706000000000, -0.0306099600000000 ]  - [  -0.0005630800000000, -0.0047569500000000,  0.0021561400000000 ]  - [   0.0006670100000000, -0.0004324300000000, -0.0007674100000000 ]  - [   0.0023599900000000,  0.0080178900000000, -0.0028027000000000 ]  - [  -0.0013256100000000, -0.0001541700000000,  0.0003118500000000 ]  - [  -0.0039198100000000, -0.0033986100000000, -0.0033463200000000 ]  - [   0.0004161500000000, -0.0013680100000000, -0.0003863400000000 ]  - [   0.0011716800000000, -0.0016450300000000,  0.0016376700000000 ]  - [   0.0092154300000000, -0.0121950100000000,  0.0159125000000000 ]  - [  -0.0138657600000000,  0.0043490500000000, -0.0013121300000000 ]  - [   0.0014860700000000,  0.0011403600000000, -0.0006655200000000 ]  - [  -0.0003768200000000, -0.0001123400000000,  0.0001471000000000 ]  - [  -0.0068805800000000, -0.0108685300000000, -0.0113811100000000 ]  - [   0.0067371500000000,  0.0083898600000000, -0.0132237400000000 ]  - [   0.0004383900000000,  0.0006424500000000, -0.0014964700000000 ]  - [  -0.0004618300000000, -0.0000373000000000,  0.0005087900000000 ]  - [   0.0058083900000000,  0.0076952700000000, -0.0111787200000000 ]  - [  -0.0022561900000000,  0.0005555500000000,  0.0023553200000000 ]  - [   0.0019800200000000,  0.0086551400000000, -0.0010348400000000 ]  - [   0.0021133200000000,  0.0004359900000000,  0.0013368700000000 ]  - [  -0.0021932200000000, -0.0015930900000000, -0.0016212500000000 ]  - [   0.0017031300000000,  0.0010426800000000, -0.0010775600000000 ]  - [   0.0004628600000000, -0.0032099000000000,  0.0018264500000000 ]  - [   0.0075375700000000, -0.0104150000000000,  0.0142211200000000 ]  - [  -0.0005507400000000,  0.0001624200000000, -0.0001180600000000 ]  - [  -0.0058540200000000, -0.0123932900000000, -0.0117086600000000 ]  - [   0.0006488500000000, -0.0016164100000000, -0.0001596700000000 ]  - [   0.0014666300000000, -0.0006817500000000, -0.0006587600000000 ]  - [  -0.0138381700000000,  0.0025223700000000, -0.0012955500000000 ]  - [  -0.0032790900000000,  0.0211772700000000, -0.0139002100000000 ]  - [  -0.0003938500000000, -0.0011186700000000,  0.0004398000000000 ]  - [   0.0014921900000000, -0.0012908100000000, -0.0018445000000000 ]  - [   0.0116540700000000, -0.0154001800000000, -0.0055786700000000 ]  - [  -0.0007260700000000, -0.0007711500000000, -0.0006563100000000 ]  - [   0.0018591500000000,  0.0328631800000000,  0.0104288100000000 ]  - [   0.0033148900000000,  0.0017952700000000, -0.0032167600000000 ]  - [  -0.0008951900000000, -0.0008297300000000, -0.0004428200000000 ]  - [  -0.0083160200000000, -0.0082002400000000,  0.0060342100000000 ]  - [   0.0005821100000000,  0.0007785100000000,  0.0000036900000000 ]  - [  -0.0017657600000000,  0.0043140600000000,  0.0041236400000000 ]  - [  -0.0005832700000000,  0.0011190300000000,  0.0001346900000000 ]  - [   0.0006561100000000, -0.0008222600000000, -0.0003290200000000 ]  - [  -0.0021014100000000, -0.0009979500000000,  0.0002953400000000 ]  - [  -0.0030334100000000, -0.0017061300000000,  0.0023387600000000 ]  - [  -0.0002645500000000, -0.0015169300000000,  0.0017033900000000 ]  - [   0.0106973900000000, -0.0147425300000000, -0.0035712900000000 ]  - [   0.0005635100000000, -0.0005760400000000,  0.0001981500000000 ]  - [   0.0040952200000000,  0.0358037700000000,  0.0134665700000000 ]  - [   0.0009633200000000,  0.0010340600000000,  0.0010470300000000 ]  - [   0.0006213000000000,  0.0004364500000000,  0.0001074800000000 ]  - [  -0.0030943900000000,  0.0250508800000000, -0.0164524300000000 ]  - [  -0.0026162900000000,  0.0009748600000000, -0.0021882900000000 ]  - [   0.0016039800000000,  0.0036120200000000, -0.0049228500000000 ]  - [   0.0004358100000000, -0.0004166000000000, -0.0001930400000000 ]  - [  -0.0007463900000000,  0.0027373300000000,  0.0037731400000000 ]  - [  -0.0083022400000000, -0.0099926400000000,  0.0060491900000000 ]  - [   0.0005666200000000, -0.0010623200000000,  0.0000100100000000 ]- atom:    1  displacement:    [  -0.0024096060369692,  0.0000000000000000,  0.0097053489760339 ]  forces:  - [   0.0311002600000000, -0.0120599200000000, -0.2132874300000000 ]  - [   0.0014305700000000, -0.0017471100000000, -0.0021868300000000 ]  - [   0.0029574000000000,  0.0021350700000000,  0.0166837300000000 ]  - [   0.0029520300000000,  0.0021286300000000,  0.0166816500000000 ]  - [   0.0062786800000000,  0.0056751400000000, -0.0178727200000000 ]  - [   0.0063155800000000,  0.0056689000000000, -0.0178957200000000 ]  - [  -0.0165814300000000, -0.0081208200000000,  0.0389785700000000 ]  - [   0.0022254900000000, -0.0019507600000000,  0.0056795200000000 ]  - [   0.0104206300000000,  0.0033529800000000, -0.0051610700000000 ]  - [  -0.0344168500000000,  0.0289119000000000,  0.0321603800000000 ]  - [  -0.0048589400000000,  0.0052254900000000,  0.0040372400000000 ]  - [   0.0311068000000000,  0.0024011700000000,  0.0492005400000000 ]  - [   0.0308526900000000,  0.0029295800000000,  0.0491339000000000 ]  - [  -0.0053635400000000,  0.0056709100000000,  0.0037714800000000 ]  - [  -0.0346579600000000,  0.0283154600000000,  0.0318003700000000 ]  - [   0.0099210100000000,  0.0028982600000000, -0.0054156900000000 ]  - [   0.0136967000000000, -0.0403404000000000,  0.0180096400000000 ]  - [   0.0017955100000000,  0.0003267400000000,  0.0022686300000000 ]  - [  -0.0141011100000000, -0.0016352100000000,  0.0085479400000000 ]  - [   0.0040664400000000,  0.0005857300000000, -0.0008085100000000 ]  - [   0.0035726800000000,  0.0010230200000000, -0.0010853600000000 ]  - [  -0.0145914600000000, -0.0012287300000000,  0.0082681200000000 ]  - [   0.0013051400000000, -0.0001034000000000,  0.0020067800000000 ]  - [   0.0131299900000000, -0.0406029600000000,  0.0177499900000000 ]  - [  -0.0021302200000000, -0.0032024100000000,  0.0029268000000000 ]  - [   0.0062467200000000, -0.0167821900000000,  0.0055877200000000 ]  - [  -0.0154419300000000, -0.0088269700000000,  0.0077716200000000 ]  - [  -0.0014227800000000,  0.0004837400000000,  0.0014429800000000 ]  - [   0.0024711100000000,  0.0017334600000000,  0.0024291600000000 ]  - [  -0.0017943800000000, -0.0003651700000000,  0.0006522800000000 ]  - [  -0.0007189400000000,  0.0006794400000000, -0.0029955500000000 ]  - [  -0.0047805000000000,  0.0063512400000000, -0.0100003200000000 ]  - [  -0.0149704900000000,  0.0021742600000000,  0.0002103700000000 ]  - [   0.0100444900000000, -0.0013644100000000, -0.0054289800000000 ]  - [  -0.0012900400000000, -0.0041286400000000, -0.0041171900000000 ]  - [  -0.0062282300000000, -0.0085385400000000, -0.0113095400000000 ]  - [   0.0092944300000000,  0.0039497000000000, -0.0166434200000000 ]  - [   0.0014477900000000,  0.0005236400000000, -0.0028257600000000 ]  - [   0.0004847900000000, -0.0002013600000000, -0.0007680800000000 ]  - [   0.0083617900000000,  0.0032422400000000, -0.0146026800000000 ]  - [  -0.0023875000000000,  0.0012052600000000,  0.0034996700000000 ]  - [  -0.0176575200000000, -0.0081200900000000,  0.0101317300000000 ]  - [  -0.0000591700000000,  0.0014539700000000,  0.0024420300000000 ]  - [   0.0042018100000000,  0.0035680900000000,  0.0042124700000000 ]  - [   0.0072547700000000, -0.0152178400000000,  0.0052424300000000 ]  - [  -0.0011238900000000, -0.0016196700000000,  0.0025802000000000 ]  - [  -0.0064979100000000,  0.0081722900000000, -0.0117321300000000 ]  - [  -0.0024356600000000,  0.0025008400000000, -0.0047514500000000 ]  - [  -0.0052149800000000, -0.0100935600000000, -0.0116224000000000 ]  - [  -0.0002809100000000, -0.0057019100000000, -0.0044574300000000 ]  - [   0.0100434300000000, -0.0031904100000000, -0.0054383700000000 ]  - [  -0.0149598100000000,  0.0003534200000000,  0.0002117900000000 ]  - [  -0.0000949500000000, -0.0088428600000000,  0.0223474600000000 ]  - [  -0.0008521400000000, -0.0002490200000000, -0.0001495600000000 ]  - [   0.0005630800000000, -0.0006870000000000, -0.0005764800000000 ]  - [  -0.0129511300000000,  0.0090103800000000,  0.0068405900000000 ]  - [   0.0001538400000000, -0.0010638100000000, -0.0004018500000000 ]  - [  -0.0024524100000000,  0.0222909100000000,  0.0160912900000000 ]  - [   0.0017916700000000,  0.0023024600000000, -0.0164786800000000 ]  - [  -0.0021374400000000, -0.0002675800000000, -0.0014780300000000 ]  - [   0.0086229700000000,  0.0053280300000000, -0.0055619200000000 ]  - [  -0.0017965100000000,  0.0008353800000000,  0.0001816300000000 ]  - [   0.0017950600000000, -0.0018389600000000, -0.0088420500000000 ]  - [  -0.0016597600000000, -0.0001032100000000, -0.0008068900000000 ]  - [  -0.0024352000000000, -0.0003935600000000, -0.0006218800000000 ]  - [   0.0067113700000000,  0.0015594100000000, -0.0060162700000000 ]  - [   0.0057418200000000,  0.0008331500000000, -0.0039586600000000 ]  - [  -0.0034097600000000, -0.0011271800000000,  0.0014486000000000 ]  - [  -0.0138552200000000,  0.0096706400000000,  0.0088557800000000 ]  - [  -0.0004038100000000,  0.0000285100000000,  0.0014787200000000 ]  - [  -0.0001942100000000,  0.0253742600000000,  0.0188416200000000 ]  - [   0.0018819300000000,  0.0007487600000000,  0.0013702400000000 ]  - [   0.0001608900000000,  0.0012984300000000, -0.0004790000000000 ]  - [   0.0005547900000000, -0.0063258500000000,  0.0212423200000000 ]  - [  -0.0038641700000000,  0.0015416400000000, -0.0032440500000000 ]  - [   0.0000796400000000,  0.0041110300000000, -0.0182412200000000 ]  - [  -0.0006545400000000, -0.0016799900000000, -0.0011445300000000 ]  - [   0.0028109600000000, -0.0033919700000000, -0.0091907900000000 ]  - [   0.0086637400000000,  0.0035311200000000, -0.0055944000000000 ]  - [  -0.0017830900000000, -0.0009912200000000,  0.0001749500000000 ]- atom:    9  displacement:    [   0.0099999969910042,  0.0000000000000000,  0.0000077575709300 ]  forces:  - [   0.0128909200000000,  0.0075468100000000,  0.0136611800000000 ]  - [   0.0323736300000000, -0.0122113700000000, -0.0276399100000000 ]  - [  -0.0139062700000000, -0.0121508700000000, -0.0181899100000000 ]  - [   0.0087704700000000,  0.0017224100000000,  0.0061279100000000 ]  - [  -0.0032882400000000, -0.0192959700000000,  0.0130306300000000 ]  - [   0.0090145600000000, -0.0003697100000000,  0.0038328100000000 ]  - [   0.0145186600000000,  0.0006538800000000, -0.0016547900000000 ]  - [   0.0041365000000000, -0.0263603900000000,  0.0330129200000000 ]  - [  -0.3729168400000000,  0.0641459200000000, -0.0148418000000000 ]  - [   0.0128383500000000, -0.0006014700000000,  0.0001514200000000 ]  - [  -0.0134295900000000, -0.0047933000000000, -0.0073220100000000 ]  - [   0.0095196100000000,  0.0011855800000000,  0.0026070000000000 ]  - [   0.0747887300000000, -0.0190262200000000, -0.0249776400000000 ]  - [   0.0186548800000000,  0.0018643100000000,  0.0081379700000000 ]  - [  -0.0074224400000000, -0.0007745300000000,  0.0031426300000000 ]  - [   0.0095101700000000, -0.0021777900000000,  0.0021030100000000 ]  - [   0.0042816300000000,  0.0034968300000000,  0.0001377200000000 ]  - [   0.0042663000000000, -0.0061665800000000,  0.0027682700000000 ]  - [   0.0030409000000000, -0.0010960900000000,  0.0003511200000000 ]  - [   0.0030015300000000,  0.0063765700000000,  0.0036434200000000 ]  - [  -0.0173902000000000, -0.0081756400000000, -0.0065482800000000 ]  - [   0.0077592900000000,  0.0025159100000000,  0.0008020600000000 ]  - [  -0.0118360500000000,  0.0110807000000000, -0.0048192500000000 ]  - [   0.0069110800000000, -0.0036857000000000,  0.0025139200000000 ]  - [   0.0408111500000000, -0.0500935600000000,  0.0193614700000000 ]  - [  -0.0035620800000000,  0.0012972300000000, -0.0013673200000000 ]  - [   0.0003933400000000, -0.0021310600000000, -0.0048257000000000 ]  - [  -0.0052207000000000,  0.0009434100000000,  0.0012894700000000 ]  - [  -0.0012199600000000, -0.0008744300000000, -0.0031492600000000 ]  - [  -0.0028591300000000, -0.0025674700000000, -0.0031185100000000 ]  - [   0.0056900700000000, -0.0041063900000000,  0.0065070200000000 ]  - [  -0.0021868200000000,  0.0006889100000000, -0.0024977400000000 ]  - [   0.1057848100000000,  0.0625055100000000, -0.0253579200000000 ]  - [  -0.0091014700000000,  0.0012385700000000,  0.0005680000000000 ]  - [   0.0041059300000000,  0.0080164100000000,  0.0053841400000000 ]  - [  -0.0032397600000000, -0.0019280400000000, -0.0021050500000000 ]  - [  -0.0165867800000000, -0.0022361000000000,  0.0083673000000000 ]  - [  -0.0053061700000000,  0.0006751500000000, -0.0027401700000000 ]  - [   0.0101641900000000,  0.0023134700000000, -0.0009539700000000 ]  - [  -0.0058368300000000, -0.0015981800000000,  0.0025157500000000 ]  - [   0.0625204000000000, -0.0664522200000000, -0.0694697300000000 ]  - [  -0.0074518700000000,  0.0008615700000000,  0.0023458500000000 ]  - [   0.0070715800000000,  0.0072333800000000,  0.0059946700000000 ]  - [  -0.0022622200000000, -0.0004752100000000, -0.0019586900000000 ]  - [   0.0019204700000000,  0.0031103900000000, -0.0020139100000000 ]  - [  -0.0023809100000000,  0.0039844600000000, -0.0025349600000000 ]  - [  -0.0003395900000000, -0.0002613600000000,  0.0013571200000000 ]  - [  -0.0031405500000000,  0.0026243500000000, -0.0035917200000000 ]  - [  -0.0023385100000000,  0.0217879300000000,  0.0153822800000000 ]  - [  -0.0033776000000000, -0.0056115500000000, -0.0042112100000000 ]  - [   0.0070525000000000, -0.0001084700000000, -0.0000309500000000 ]  - [  -0.0063396000000000, -0.0007832900000000,  0.0005804700000000 ]  - [  -0.0031565600000000, -0.0024543400000000, -0.0010913300000000 ]  - [  -0.0040113500000000,  0.0063615300000000, -0.0024980800000000 ]  - [   0.0092499800000000, -0.0019533000000000, -0.0052666100000000 ]  - [  -0.0037797600000000,  0.0007893200000000, -0.0001638200000000 ]  - [   0.0025646100000000,  0.0039271000000000,  0.0078578200000000 ]  - [  -0.0049766700000000, -0.0033216100000000, -0.0058019000000000 ]  - [   0.0008362100000000, -0.0011583500000000,  0.0006189400000000 ]  - [  -0.0026090000000000,  0.0033314700000000, -0.0058283500000000 ]  - [  -0.0041594500000000,  0.0007100500000000,  0.0007875900000000 ]  - [   0.0029920900000000,  0.0010020900000000, -0.0000009200000000 ]  - [  -0.0017596000000000,  0.0011991700000000,  0.0004216000000000 ]  - [  -0.0035437500000000, -0.0046099000000000, -0.0054181900000000 ]  - [   0.0092500000000000,  0.0032541700000000, -0.0022708500000000 ]  - [  -0.0039707500000000, -0.0008656100000000,  0.0001184500000000 ]  - [  -0.0006637600000000,  0.0005807400000000,  0.0022934800000000 ]  - [  -0.0029693900000000, -0.0014576100000000,  0.0010407100000000 ]  - [   0.0002695900000000,  0.0009147800000000,  0.0006521400000000 ]  - [  -0.0040904000000000,  0.0016377400000000,  0.0020765500000000 ]  - [  -0.0143430500000000, -0.0016187800000000, -0.0093132900000000 ]  - [  -0.0095643100000000,  0.0020595500000000, -0.0008122900000000 ]  - [   0.0023451500000000, -0.0091309700000000,  0.0085812100000000 ]  - [  -0.0024887200000000,  0.0044497000000000, -0.0038861900000000 ]  - [   0.0813177900000000,  0.0283324200000000,  0.0905669600000000 ]  - [  -0.0051472800000000,  0.0021152200000000, -0.0035938900000000 ]  - [   0.0066187800000000,  0.0109586300000000,  0.0032398300000000 ]  - [  -0.0024532100000000, -0.0037720200000000, -0.0019568000000000 ]  - [  -0.0032818400000000, -0.0004554400000000,  0.0001346000000000 ]  - [   0.0026732000000000, -0.0025824800000000, -0.0002445500000000 ]- atom:    9  displacement:    [  -0.0099999969910042,  0.0000000000000000, -0.0000077575709300 ]  forces:  - [  -0.0129318100000000, -0.0075828600000000, -0.0137081300000000 ]  - [  -0.0325107900000000,  0.0119982900000000,  0.0273753400000000 ]  - [   0.0139646700000000,  0.0122236500000000,  0.0182754400000000 ]  - [  -0.0087687900000000, -0.0017006200000000, -0.0061060600000000 ]  - [   0.0033657200000000,  0.0192383300000000, -0.0129893600000000 ]  - [  -0.0090215500000000,  0.0003869800000000, -0.0038526800000000 ]  - [  -0.0144915300000000, -0.0006532700000000,  0.0016654700000000 ]  - [  -0.0042514900000000,  0.0264249300000000, -0.0329944200000000 ]  - [   0.3790801800000000, -0.0584139400000000,  0.0111211400000000 ]  - [  -0.0123391500000000,  0.0010591400000000,  0.0001176700000000 ]  - [   0.0139183400000000,  0.0043571800000000,  0.0076041400000000 ]  - [  -0.0090484400000000, -0.0016201100000000, -0.0023433300000000 ]  - [  -0.0759166800000000,  0.0191936600000000,  0.0250273400000000 ]  - [  -0.0189949900000000, -0.0014435800000000, -0.0082663100000000 ]  - [   0.0069884600000000,  0.0002923900000000, -0.0034224300000000 ]  - [  -0.0100242500000000,  0.0017389000000000, -0.0024046600000000 ]  - [  -0.0037868500000000, -0.0030572900000000,  0.0001315400000000 ]  - [  -0.0037820800000000,  0.0066123900000000, -0.0024996000000000 ]  - [  -0.0025318200000000,  0.0006480500000000, -0.0000501900000000 ]  - [  -0.0025542000000000, -0.0068483300000000, -0.0033880400000000 ]  - [   0.0168734400000000,  0.0086407500000000,  0.0062555100000000 ]  - [  -0.0082529100000000, -0.0020728200000000, -0.0010704100000000 ]  - [   0.0113507100000000, -0.0115203300000000,  0.0045547300000000 ]  - [  -0.0073956800000000,  0.0032577900000000, -0.0027947200000000 ]  - [  -0.0413151200000000,  0.0487738400000000, -0.0191537100000000 ]  - [   0.0025326100000000, -0.0028217700000000,  0.0016793000000000 ]  - [   0.0005345700000000,  0.0014616800000000,  0.0028331900000000 ]  - [   0.0061375800000000, -0.0016238300000000, -0.0032972700000000 ]  - [  -0.0005069100000000, -0.0009496700000000,  0.0013989300000000 ]  - [   0.0011551600000000,  0.0007749500000000,  0.0013938600000000 ]  - [  -0.0040063200000000,  0.0022985600000000, -0.0048289600000000 ]  - [   0.0038831800000000, -0.0024966000000000,  0.0042085900000000 ]  - [  -0.1119266000000000, -0.0645738800000000,  0.0276126400000000 ]  - [   0.0090609500000000,  0.0005800100000000, -0.0005757400000000 ]  - [  -0.0051379300000000, -0.0065153200000000, -0.0050865400000000 ]  - [   0.0022202200000000,  0.0034588800000000,  0.0024233000000000 ]  - [   0.0174189300000000,  0.0029381900000000, -0.0103392100000000 ]  - [   0.0062659000000000,  0.0000518200000000,  0.0006422700000000 ]  - [  -0.0110982600000000, -0.0029924600000000,  0.0029526300000000 ]  - [   0.0048964400000000,  0.0008961000000000, -0.0004761500000000 ]  - [  -0.0633789100000000,  0.0654073300000000,  0.0696419800000000 ]  - [   0.0065369300000000, -0.0001689700000000, -0.0003186500000000 ]  - [  -0.0053635900000000, -0.0053921600000000, -0.0042614500000000 ]  - [   0.0039506900000000,  0.0022767100000000,  0.0036560400000000 ]  - [  -0.0009265900000000, -0.0015026500000000,  0.0016496400000000 ]  - [   0.0034169100000000, -0.0024892100000000,  0.0022451800000000 ]  - [  -0.0013790100000000,  0.0020654100000000, -0.0030996800000000 ]  - [   0.0014312500000000, -0.0008252000000000,  0.0018621800000000 ]  - [   0.0034147900000000, -0.0233579000000000, -0.0157725900000000 ]  - [   0.0043807800000000,  0.0040588100000000,  0.0038633900000000 ]  - [  -0.0070821700000000, -0.0017021800000000,  0.0000332300000000 ]  - [   0.0063613600000000, -0.0010255800000000, -0.0005833500000000 ]  - [   0.0021332800000000,  0.0009434500000000,  0.0013980300000000 ]  - [   0.0029968500000000, -0.0078872200000000,  0.0028313200000000 ]  - [  -0.0083292000000000,  0.0012765400000000,  0.0032603200000000 ]  - [   0.0046931900000000, -0.0014757800000000, -0.0018524900000000 ]  - [  -0.0042503200000000, -0.0057344500000000, -0.0095868200000000 ]  - [   0.0032742700000000,  0.0015246400000000,  0.0040814100000000 ]  - [   0.0008660200000000, -0.0006396800000000,  0.0011168400000000 ]  - [   0.0043415900000000, -0.0051625000000000,  0.0076063400000000 ]  - [   0.0041768700000000,  0.0010875700000000, -0.0007923500000000 ]  - [  -0.0029556700000000,  0.0007882100000000, -0.0000098600000000 ]  - [   0.0007258000000000,  0.0003017700000000, -0.0001276100000000 ]  - [   0.0025623700000000,  0.0062005500000000,  0.0057957200000000 ]  - [  -0.0083468900000000, -0.0025818300000000,  0.0002630700000000 ]  - [   0.0048847700000000,  0.0015398300000000, -0.0021312600000000 ]  - [  -0.0002551600000000, -0.0012742200000000, -0.0002958800000000 ]  - [   0.0020450600000000,  0.0007576100000000,  0.0009927300000000 ]  - [  -0.0012237600000000, -0.0002284100000000,  0.0014021900000000 ]  - [   0.0031687900000000, -0.0009469700000000, -0.0000443300000000 ]  - [   0.0160784800000000,  0.0034586400000000,  0.0110079400000000 ]  - [   0.0111300800000000, -0.0001483400000000,  0.0026148800000000 ]  - [  -0.0013026700000000,  0.0106332400000000, -0.0088694900000000 ]  - [   0.0035193500000000, -0.0029538900000000,  0.0035902200000000 ]  - [  -0.0822992100000000, -0.0261591700000000, -0.0888208200000000 ]  - [   0.0034383800000000, -0.0003097900000000,  0.0018601900000000 ]  - [  -0.0055883000000000, -0.0124803700000000, -0.0035829000000000 ]  - [   0.0034816800000000,  0.0022714700000000,  0.0016516400000000 ]  - [   0.0032597500000000, -0.0013441600000000, -0.0001336400000000 ]  - [  -0.0026407500000000,  0.0007790500000000,  0.0002335600000000 ]- atom:    9  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0001650200000000,  0.0043234400000000,  0.0032565500000000 ]  - [  -0.0393701100000000,  0.0003592200000000,  0.0197024500000000 ]  - [  -0.0026083900000000,  0.0004789100000000,  0.0008920400000000 ]  - [  -0.0007964300000000,  0.0001798200000000, -0.0010142600000000 ]  - [  -0.0174808500000000,  0.0627712900000000, -0.0460761100000000 ]  - [  -0.0017616200000000,  0.0001687300000000, -0.0003283100000000 ]  - [   0.0032419200000000, -0.0003125000000000, -0.0048029300000000 ]  - [  -0.0023984900000000, -0.0089517300000000, -0.0033269100000000 ]  - [   0.0634791900000000, -0.4254480700000000, -0.0156416700000000 ]  - [  -0.0005769900000000, -0.0003894000000000, -0.0000884200000000 ]  - [   0.0048160100000000,  0.0035626300000000,  0.0039962100000000 ]  - [  -0.0011624900000000,  0.0007255600000000,  0.0002735900000000 ]  - [   0.0189066500000000, -0.0272877100000000, -0.0059159000000000 ]  - [  -0.0019145900000000, -0.0007424400000000, -0.0049456200000000 ]  - [  -0.0007782900000000,  0.0102253400000000, -0.0012555900000000 ]  - [  -0.0022079100000000,  0.0042859500000000,  0.0044685800000000 ]  - [  -0.0061611200000000,  0.0093712600000000,  0.0070528600000000 ]  - [   0.0035716100000000,  0.0093899600000000, -0.0038080100000000 ]  - [  -0.0063666600000000, -0.0026866300000000, -0.0079121200000000 ]  - [   0.0011203600000000, -0.0026754700000000,  0.0005171200000000 ]  - [   0.0081624900000000,  0.0245424000000000,  0.0092535300000000 ]  - [  -0.0025555500000000,  0.0016600200000000, -0.0001523900000000 ]  - [   0.0110689700000000, -0.0141036100000000, -0.0061509900000000 ]  - [  -0.0037053200000000, -0.0022925700000000,  0.0004884500000000 ]  - [  -0.0510458800000000,  0.1886826000000000, -0.0621295100000000 ]  - [  -0.0001919600000000, -0.0004348600000000,  0.0000829300000000 ]  - [   0.0007225700000000, -0.0019148200000000, -0.0030340000000000 ]  - [   0.0078336700000000, -0.0024231200000000, -0.0057773000000000 ]  - [   0.0047137700000000,  0.0025547600000000,  0.0102891900000000 ]  - [  -0.0008616400000000, -0.0004974200000000, -0.0010483900000000 ]  - [  -0.0002741800000000,  0.0004042600000000,  0.0014736800000000 ]  - [   0.0017608700000000, -0.0009382000000000,  0.0015895700000000 ]  - [   0.0471156100000000,  0.0653789400000000, -0.0136341400000000 ]  - [   0.0011778800000000,  0.0008856000000000,  0.0003053800000000 ]  - [  -0.0017016700000000, -0.0024683500000000, -0.0013411800000000 ]  - [  -0.0002725700000000,  0.0002641600000000,  0.0000036400000000 ]  - [  -0.0096262400000000,  0.0000221800000000,  0.0047119000000000 ]  - [  -0.0012955700000000,  0.0010047700000000, -0.0001715400000000 ]  - [   0.0004782800000000, -0.0001235100000000,  0.0011496200000000 ]  - [  -0.0002993500000000, -0.0004515100000000,  0.0012763900000000 ]  - [  -0.0446548300000000,  0.1094918100000000,  0.0912114400000000 ]  - [  -0.0003102700000000, -0.0000834500000000,  0.0007977800000000 ]  - [  -0.0036184700000000, -0.0150710700000000, -0.0074866500000000 ]  - [   0.0015873900000000,  0.0008978300000000,  0.0014430800000000 ]  - [   0.0040911300000000, -0.0128003400000000,  0.0083097400000000 ]  - [   0.0009976100000000, -0.0006350500000000, -0.0002069900000000 ]  - [  -0.0004362400000000, -0.0004315500000000, -0.0020775800000000 ]  - [  -0.0011816000000000, -0.0002766500000000, -0.0000134100000000 ]  - [   0.0033556000000000,  0.0114178800000000,  0.0029316300000000 ]  - [   0.0009032700000000,  0.0006174900000000,  0.0010757900000000 ]  - [  -0.0025892800000000, -0.0026679300000000, -0.0002772000000000 ]  - [   0.0016226900000000, -0.0014246300000000, -0.0008308800000000 ]  - [   0.0007984200000000, -0.0061428900000000,  0.0009025500000000 ]  - [   0.0033152000000000, -0.0099598600000000,  0.0044636500000000 ]  - [  -0.0112714300000000, -0.0002357600000000,  0.0107826600000000 ]  - [   0.0019338000000000, -0.0004253000000000, -0.0014662700000000 ]  - [  -0.0025568700000000, -0.0045888400000000, -0.0066188000000000 ]  - [  -0.0005587100000000, -0.0013272500000000, -0.0009763600000000 ]  - [   0.0018839800000000, -0.0030092300000000,  0.0032281400000000 ]  - [  -0.0003789800000000,  0.0003858400000000, -0.0029172500000000 ]  - [   0.0027467000000000,  0.0002261300000000, -0.0009835000000000 ]  - [  -0.0048517300000000, -0.0033748700000000, -0.0002631500000000 ]  - [   0.0011223100000000,  0.0047488700000000,  0.0036420400000000 ]  - [   0.0000116400000000,  0.0019310800000000,  0.0013838400000000 ]  - [   0.0007277200000000, -0.0039770200000000, -0.0044038600000000 ]  - [   0.0013845700000000,  0.0003631600000000, -0.0011797700000000 ]  - [  -0.0010672000000000, -0.0010013100000000,  0.0039759200000000 ]  - [  -0.0008745700000000, -0.0002362300000000,  0.0010200000000000 ]  - [   0.0113263000000000, -0.0070162800000000, -0.0040031800000000 ]  - [  -0.0005286700000000, -0.0009636100000000,  0.0009817900000000 ]  - [  -0.0067201100000000,  0.0028330600000000, -0.0050153200000000 ]  - [   0.0050351300000000,  0.0059373200000000,  0.0063193300000000 ]  - [  -0.0008022600000000,  0.0144331300000000, -0.0084450200000000 ]  - [   0.0008391900000000,  0.0018878400000000, -0.0012723300000000 ]  - [   0.0123572500000000,  0.0315016100000000,  0.0202757300000000 ]  - [  -0.0007134800000000,  0.0008137600000000, -0.0002100300000000 ]  - [   0.0020473000000000, -0.0074951700000000,  0.0033810100000000 ]  - [   0.0005671500000000, -0.0016214200000000, -0.0003258000000000 ]  - [   0.0040720400000000, -0.0006226000000000,  0.0002112000000000 ]  - [  -0.0025326500000000,  0.0008016500000000,  0.0004076000000000 ]- atom:    9  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0001639200000000, -0.0043283800000000, -0.0032616600000000 ]  - [   0.0393002400000000, -0.0003281600000000, -0.0197320800000000 ]  - [   0.0025019500000000, -0.0004593600000000, -0.0007938800000000 ]  - [   0.0008255900000000, -0.0001857300000000,  0.0010372200000000 ]  - [   0.0173843800000000, -0.0627780800000000,  0.0459860400000000 ]  - [   0.0017818400000000, -0.0001607500000000,  0.0003225000000000 ]  - [  -0.0032261100000000,  0.0003081200000000,  0.0048063900000000 ]  - [   0.0024007000000000,  0.0092030300000000,  0.0033560900000000 ]  - [  -0.0593033800000000,  0.4170438000000000,  0.0267513400000000 ]  - [   0.0010729900000000,  0.0008224700000000,  0.0003630200000000 ]  - [  -0.0043296800000000, -0.0039807400000000, -0.0036779600000000 ]  - [   0.0016480900000000, -0.0011419100000000,  0.0000017700000000 ]  - [  -0.0193307100000000,  0.0275324800000000,  0.0056238400000000 ]  - [   0.0014038100000000,  0.0011729800000000,  0.0046504900000000 ]  - [   0.0002918500000000, -0.0107111800000000,  0.0009691800000000 ]  - [   0.0017163200000000, -0.0046872500000000, -0.0047151700000000 ]  - [   0.0066214700000000, -0.0089306700000000, -0.0068273800000000 ]  - [  -0.0029808600000000, -0.0089080900000000,  0.0040441900000000 ]  - [   0.0068430900000000,  0.0022191900000000,  0.0082097000000000 ]  - [  -0.0006188100000000,  0.0022285400000000, -0.0002332800000000 ]  - [  -0.0086343600000000, -0.0240909200000000, -0.0095040500000000 ]  - [   0.0020575600000000, -0.0011892800000000, -0.0001194200000000 ]  - [  -0.0115392400000000,  0.0136594300000000,  0.0058798900000000 ]  - [   0.0032351600000000,  0.0018561900000000, -0.0007565900000000 ]  - [   0.0458270200000000, -0.1788899700000000,  0.0564879200000000 ]  - [  -0.0008400500000000, -0.0010753800000000,  0.0002211500000000 ]  - [   0.0002008800000000,  0.0012335800000000,  0.0010199400000000 ]  - [  -0.0068435000000000,  0.0016908000000000,  0.0036881100000000 ]  - [  -0.0064135400000000, -0.0043989800000000, -0.0120042500000000 ]  - [  -0.0008409100000000, -0.0013047700000000, -0.0006780200000000 ]  - [   0.0019880100000000, -0.0021894600000000,  0.0002337800000000 ]  - [  -0.0000523900000000, -0.0008617500000000,  0.0001415200000000 ]  - [  -0.0488716500000000, -0.0637674900000000,  0.0141246700000000 ]  - [  -0.0011815900000000,  0.0009384700000000, -0.0003027400000000 ]  - [   0.0006763000000000,  0.0039510800000000,  0.0016190900000000 ]  - [  -0.0007677800000000,  0.0012049100000000,  0.0002837000000000 ]  - [   0.0104867100000000,  0.0006916000000000, -0.0067069000000000 ]  - [   0.0022473800000000, -0.0003220700000000, -0.0018650600000000 ]  - [  -0.0014108600000000, -0.0005863300000000,  0.0008712600000000 ]  - [  -0.0006056900000000, -0.0002186900000000,  0.0007272700000000 ]  - [   0.0465975600000000, -0.1109421600000000, -0.0935123200000000 ]  - [  -0.0006081500000000,  0.0007761400000000,  0.0012247800000000 ]  - [   0.0053921900000000,  0.0169939000000000,  0.0093406800000000 ]  - [   0.0001180500000000,  0.0009012200000000,  0.0002841100000000 ]  - [  -0.0030905600000000,  0.0144385900000000, -0.0086886000000000 ]  - [   0.0000259200000000,  0.0021586700000000, -0.0001084000000000 ]  - [  -0.0012693100000000,  0.0022277800000000,  0.0003280600000000 ]  - [  -0.0005694900000000,  0.0020786600000000, -0.0017605400000000 ]  - [  -0.0022814100000000, -0.0129066600000000, -0.0032810300000000 ]  - [   0.0001186600000000, -0.0021300600000000, -0.0013896700000000 ]  - [   0.0025950800000000,  0.0008519700000000,  0.0002746100000000 ]  - [  -0.0016570800000000, -0.0003939500000000,  0.0008385600000000 ]  - [  -0.0018089200000000,  0.0045916600000000, -0.0005697500000000 ]  - [  -0.0043495500000000,  0.0083467000000000, -0.0040821200000000 ]  - [   0.0122612000000000, -0.0005096200000000, -0.0128137900000000 ]  - [  -0.0010116300000000, -0.0002781900000000, -0.0005732200000000 ]  - [   0.0008388600000000,  0.0027512100000000,  0.0048553100000000 ]  - [  -0.0011273400000000, -0.0004752700000000, -0.0007082100000000 ]  - [  -0.0001846500000000,  0.0012234000000000, -0.0015211900000000 ]  - [   0.0020979300000000, -0.0021914200000000,  0.0046540400000000 ]  - [  -0.0027212400000000,  0.0016201300000000,  0.0009822900000000 ]  - [   0.0047910600000000,  0.0051649100000000,  0.0002714600000000 ]  - [  -0.0021498800000000, -0.0032180700000000, -0.0033329600000000 ]  - [  -0.0010413700000000, -0.0004134700000000, -0.0010763000000000 ]  - [   0.0002625800000000,  0.0046267800000000,  0.0023036200000000 ]  - [  -0.0004654100000000,  0.0003363100000000, -0.0008567000000000 ]  - [   0.0001730100000000,  0.0003105300000000, -0.0019723300000000 ]  - [  -0.0000576600000000, -0.0004538300000000,  0.0010017600000000 ]  - [  -0.0123163800000000,  0.0077448400000000,  0.0061202100000000 ]  - [  -0.0004345200000000,  0.0016813100000000,  0.0010878400000000 ]  - [   0.0084199400000000, -0.0010078000000000,  0.0067349300000000 ]  - [  -0.0033168800000000, -0.0041108100000000, -0.0045568600000000 ]  - [   0.0017980300000000, -0.0128566100000000,  0.0081159000000000 ]  - [   0.0001809900000000, -0.0003518200000000,  0.0009506700000000 ]  - [  -0.0145425300000000, -0.0300478100000000, -0.0227978100000000 ]  - [  -0.0009958900000000,  0.0009914400000000, -0.0015131100000000 ]  - [  -0.0011094500000000,  0.0059550000000000, -0.0038752400000000 ]  - [   0.0004554800000000,  0.0000875200000000,  0.0000040100000000 ]  - [  -0.0040879900000000, -0.0012136600000000, -0.0002130900000000 ]  - [   0.0025144400000000, -0.0026187700000000, -0.0004112200000000 ]- atom:    9  displacement:    [  -0.0024096060369692,  0.0000000000000000,  0.0097053489760339 ]  forces:  - [   0.0012503800000000, -0.0044454300000000, -0.0074916500000000 ]  - [  -0.0596271100000000,  0.0115562700000000,  0.0257319900000000 ]  - [  -0.0018296800000000,  0.0073360800000000,  0.0115394000000000 ]  - [   0.0011461700000000,  0.0007936000000000, -0.0016076400000000 ]  - [   0.0114908700000000, -0.0248217200000000,  0.0174597000000000 ]  - [  -0.0027889300000000,  0.0003467300000000,  0.0010558100000000 ]  - [  -0.0047799600000000, -0.0005058800000000,  0.0039865600000000 ]  - [   0.0235157500000000, -0.0356491700000000,  0.0473557200000000 ]  - [   0.0748154300000000, -0.0321835800000000, -0.4347921300000000 ]  - [  -0.0027698300000000,  0.0001958600000000, -0.0003124200000000 ]  - [  -0.0036887800000000, -0.0028622200000000,  0.0177174800000000 ]  - [   0.0004046300000000, -0.0006883200000000,  0.0005715800000000 ]  - [  -0.0427587800000000,  0.0103458100000000,  0.0082044500000000 ]  - [   0.0032004500000000,  0.0044772600000000, -0.0179130300000000 ]  - [   0.0046529000000000, -0.0011929600000000,  0.0063355800000000 ]  - [  -0.0004216600000000,  0.0047226300000000,  0.0134873700000000 ]  - [   0.0018350500000000, -0.0043861500000000, -0.0062736900000000 ]  - [  -0.0007191300000000,  0.0085092900000000, -0.0069003800000000 ]  - [   0.0029630400000000, -0.0003784600000000,  0.0076480200000000 ]  - [  -0.0002332700000000,  0.0060040100000000,  0.0068466300000000 ]  - [  -0.0023039900000000, -0.0068586400000000, -0.0183764400000000 ]  - [  -0.0012637400000000, -0.0003170700000000, -0.0008868900000000 ]  - [  -0.0019844100000000, -0.0087554500000000,  0.0156883500000000 ]  - [   0.0006090600000000,  0.0012237500000000, -0.0001782300000000 ]  - [   0.0100271000000000, -0.0563733100000000,  0.0430586600000000 ]  - [   0.0002279600000000, -0.0012540300000000,  0.0005392300000000 ]  - [  -0.0045700900000000, -0.0002600500000000, -0.0006178200000000 ]  - [   0.0119292200000000, -0.0039668900000000, -0.0089210300000000 ]  - [  -0.0042682500000000, -0.0015045600000000, -0.0067325300000000 ]  - [  -0.0011017000000000, -0.0018146500000000, -0.0029185300000000 ]  - [  -0.0008108800000000,  0.0010235500000000, -0.0061988800000000 ]  - [   0.0005621900000000, -0.0011289600000000,  0.0007639100000000 ]  - [  -0.0524016900000000, -0.0329875700000000,  0.0331019300000000 ]  - [   0.0020255300000000,  0.0002266200000000,  0.0015530900000000 ]  - [  -0.0001410100000000, -0.0004648000000000, -0.0037893200000000 ]  - [  -0.0005841400000000,  0.0010710400000000,  0.0003355600000000 ]  - [   0.0080111900000000,  0.0017386100000000, -0.0052068600000000 ]  - [  -0.0122618100000000,  0.0010287100000000,  0.0028636000000000 ]  - [   0.0066893100000000,  0.0041997700000000, -0.0087957600000000 ]  - [   0.0001054700000000, -0.0000350700000000,  0.0003887600000000 ]  - [  -0.0638331500000000,  0.1101817600000000,  0.1402101400000000 ]  - [   0.0007223000000000,  0.0006729400000000,  0.0012348300000000 ]  - [   0.0025040000000000,  0.0068057500000000,  0.0081179800000000 ]  - [   0.0014956100000000,  0.0010673400000000,  0.0013928800000000 ]  - [  -0.0015439200000000,  0.0041426000000000, -0.0031399200000000 ]  - [   0.0005804900000000,  0.0007065800000000, -0.0022702900000000 ]  - [  -0.0000044300000000,  0.0009419500000000,  0.0006582700000000 ]  - [   0.0001348700000000, -0.0004510300000000,  0.0022108700000000 ]  - [   0.0048356900000000, -0.0124410800000000, -0.0064952200000000 ]  - [   0.0001668400000000, -0.0008707400000000,  0.0020148300000000 ]  - [   0.0012039200000000, -0.0013792300000000, -0.0041926500000000 ]  - [   0.0004450700000000, -0.0013286600000000, -0.0016739300000000 ]  - [  -0.0002439900000000,  0.0015040600000000,  0.0014081800000000 ]  - [   0.0061003300000000, -0.0125447300000000,  0.0072962500000000 ]  - [   0.0022526100000000,  0.0013702500000000, -0.0054777100000000 ]  - [   0.0007484600000000, -0.0005743100000000, -0.0012069100000000 ]  - [  -0.0023946600000000, -0.0048461900000000, -0.0134296600000000 ]  - [  -0.0009410400000000, -0.0004505200000000, -0.0002765300000000 ]  - [  -0.0003207400000000,  0.0002351400000000, -0.0019844200000000 ]  - [  -0.0043362600000000,  0.0050853100000000, -0.0114554700000000 ]  - [   0.0001300500000000,  0.0011388300000000,  0.0005748000000000 ]  - [  -0.0023078100000000,  0.0010370100000000,  0.0038682800000000 ]  - [  -0.0010778200000000, -0.0010511400000000, -0.0022974000000000 ]  - [  -0.0029848400000000, -0.0060074600000000, -0.0077548200000000 ]  - [   0.0016363900000000, -0.0013884200000000,  0.0008226200000000 ]  - [   0.0005482000000000,  0.0003465700000000, -0.0008656700000000 ]  - [   0.0021898600000000,  0.0002557100000000, -0.0030327800000000 ]  - [  -0.0017497400000000, -0.0011698800000000,  0.0007007900000000 ]  - [  -0.0075092600000000,  0.0037672600000000,  0.0044891100000000 ]  - [   0.0018987400000000, -0.0012151500000000,  0.0006354200000000 ]  - [   0.0096287800000000,  0.0012394900000000,  0.0089102800000000 ]  - [   0.0095148800000000,  0.0046736300000000,  0.0135663200000000 ]  - [   0.0034281100000000,  0.0095055800000000, -0.0111641300000000 ]  - [   0.0005498400000000,  0.0000016500000000,  0.0009404000000000 ]  - [   0.0707444000000000,  0.0379024700000000,  0.1470340600000000 ]  - [   0.0002139400000000,  0.0008272500000000, -0.0004529800000000 ]  - [   0.0003847000000000,  0.0117284800000000,  0.0063049000000000 ]  - [   0.0011276000000000, -0.0000198400000000,  0.0001480300000000 ]  - [  -0.0016385800000000, -0.0009955500000000, -0.0005098900000000 ]  - [   0.0035476800000000, -0.0003683000000000, -0.0031790100000000 ]- atom:    9  displacement:    [   0.0024096060369692,  0.0000000000000000, -0.0097053489760339 ]  forces:  - [  -0.0012730600000000,  0.0044616100000000,  0.0075153600000000 ]  - [   0.0597155400000000, -0.0117700100000000, -0.0257449500000000 ]  - [   0.0018008100000000, -0.0072697500000000, -0.0115032000000000 ]  - [  -0.0011445900000000, -0.0007872800000000,  0.0016099700000000 ]  - [  -0.0115139200000000,  0.0247937900000000, -0.0173559100000000 ]  - [   0.0027798200000000, -0.0003302100000000, -0.0010642500000000 ]  - [   0.0047724500000000,  0.0005059200000000, -0.0039948500000000 ]  - [  -0.0233143400000000,  0.0356719700000000, -0.0472197900000000 ]  - [  -0.0818124200000000,  0.0387538200000000,  0.4341734300000000 ]  - [   0.0032561400000000,  0.0002370200000000,  0.0005805400000000 ]  - [   0.0042188300000000,  0.0023829500000000, -0.0174107700000000 ]  - [   0.0000693200000000,  0.0002552500000000, -0.0002905500000000 ]  - [   0.0420935500000000, -0.0100642800000000, -0.0086204600000000 ]  - [  -0.0036738100000000, -0.0040403800000000,  0.0176702200000000 ]  - [  -0.0051808900000000,  0.0007033800000000, -0.0066247900000000 ]  - [  -0.0000707600000000, -0.0051466500000000, -0.0137488600000000 ]  - [  -0.0013451700000000,  0.0048203500000000,  0.0065214100000000 ]  - [   0.0012096700000000, -0.0080379700000000,  0.0071646300000000 ]  - [  -0.0025074800000000, -0.0000672400000000, -0.0073684300000000 ]  - [   0.0007269300000000, -0.0064587700000000, -0.0065706400000000 ]  - [   0.0018386400000000,  0.0073012100000000,  0.0180498800000000 ]  - [   0.0007724100000000,  0.0007596000000000,  0.0006114400000000 ]  - [   0.0015480000000000,  0.0083730700000000, -0.0159791200000000 ]  - [  -0.0010998600000000, -0.0016608200000000, -0.0000888200000000 ]  - [  -0.0113671700000000,  0.0554061000000000, -0.0423455700000000 ]  - [  -0.0012420700000000, -0.0003103300000000, -0.0001977100000000 ]  - [   0.0055540500000000, -0.0004226700000000, -0.0014109200000000 ]  - [  -0.0109437300000000,  0.0032525900000000,  0.0068610400000000 ]  - [   0.0025594000000000, -0.0003400100000000,  0.0049783000000000 ]  - [  -0.0006211100000000,  0.0000049300000000,  0.0011642200000000 ]  - [   0.0025254200000000, -0.0028505100000000,  0.0079320900000000 ]  - [   0.0011577300000000, -0.0006845600000000,  0.0009900000000000 ]  - [   0.0508939600000000,  0.0338805400000000, -0.0330733000000000 ]  - [  -0.0020228500000000,  0.0016193900000000, -0.0015535300000000 ]  - [  -0.0008795700000000,  0.0020132700000000,  0.0041150300000000 ]  - [  -0.0004370200000000,  0.0004531400000000, -0.0000157600000000 ]  - [  -0.0071071900000000, -0.0010295000000000,  0.0032219100000000 ]  - [   0.0132294200000000, -0.0003282900000000, -0.0049323800000000 ]  - [  -0.0076772500000000, -0.0048652000000000,  0.0107980100000000 ]  - [  -0.0010344900000000, -0.0006566600000000,  0.0016382700000000 ]  - [   0.0673914500000000, -0.1160223500000000, -0.1436640400000000 ]  - [  -0.0016768600000000,  0.0000347600000000,  0.0008175800000000 ]  - [  -0.0007864800000000, -0.0049520100000000, -0.0063562700000000 ]  - [   0.0002294900000000,  0.0007429600000000,  0.0003708800000000 ]  - [   0.0025539300000000, -0.0025547500000000,  0.0027869300000000 ]  - [   0.0004414400000000,  0.0008308400000000,  0.0019514900000000 ]  - [  -0.0017169600000000,  0.0008558600000000, -0.0024109100000000 ]  - [  -0.0018531300000000,  0.0022584900000000, -0.0039521100000000 ]  - [  -0.0037442400000000,  0.0109101400000000,  0.0061916100000000 ]  - [   0.0008493600000000, -0.0006821100000000, -0.0023461100000000 ]  - [  -0.0011800800000000, -0.0004298600000000,  0.0042062100000000 ]  - [  -0.0004455300000000, -0.0005028400000000,  0.0016758100000000 ]  - [  -0.0007682900000000, -0.0030753400000000, -0.0010630000000000 ]  - [  -0.0071131500000000,  0.0109594600000000, -0.0069221300000000 ]  - [  -0.0012720500000000, -0.0021006700000000,  0.0034215600000000 ]  - [   0.0002024800000000, -0.0001363700000000, -0.0008377300000000 ]  - [   0.0006418900000000,  0.0030174300000000,  0.0116014700000000 ]  - [  -0.0007582900000000, -0.0013621100000000, -0.0014478200000000 ]  - [   0.0020429300000000, -0.0020460700000000,  0.0037392300000000 ]  - [   0.0060658100000000, -0.0069145400000000,  0.0132319100000000 ]  - [  -0.0001182600000000,  0.0007135500000000, -0.0005706100000000 ]  - [   0.0023010100000000,  0.0007864600000000, -0.0038581100000000 ]  - [   0.0000649300000000,  0.0025998700000000,  0.0026297700000000 ]  - [   0.0019651600000000,  0.0075967600000000,  0.0081356800000000 ]  - [  -0.0007025500000000,  0.0020415400000000, -0.0028403200000000 ]  - [   0.0004084000000000,  0.0003675200000000, -0.0011838100000000 ]  - [  -0.0031176900000000, -0.0009598200000000,  0.0050624300000000 ]  - [   0.0007905400000000,  0.0004621000000000,  0.0013495700000000 ]  - [   0.0065270000000000, -0.0030376300000000, -0.0024068400000000 ]  - [  -0.0028458200000000,  0.0019122500000000,  0.0014081900000000 ]  - [  -0.0079517800000000,  0.0005882800000000, -0.0071912600000000 ]  - [  -0.0078589600000000, -0.0028430700000000, -0.0118018500000000 ]  - [  -0.0024953100000000, -0.0079009100000000,  0.0108263500000000 ]  - [   0.0004699800000000,  0.0015434700000000, -0.0012702100000000 ]  - [  -0.0676433600000000, -0.0351369700000000, -0.1430182700000000 ]  - [  -0.0019337000000000,  0.0009837700000000, -0.0012985400000000 ]  - [   0.0006037600000000, -0.0132301000000000, -0.0066589900000000 ]  - [  -0.0001112600000000, -0.0015357400000000, -0.0004778700000000 ]  - [   0.0016494700000000, -0.0008385800000000,  0.0005071300000000 ]  - [  -0.0035586000000000, -0.0014725200000000,  0.0031818200000000 ]- atom:   25  displacement:    [   0.0099999969910042,  0.0000000000000000,  0.0000077575709300 ]  forces:  - [  -0.0032130600000000, -0.0000433700000000, -0.0024790100000000 ]  - [  -0.0089501500000000,  0.0011918000000000,  0.0047510800000000 ]  - [   0.0058450000000000,  0.0012432800000000,  0.0038159400000000 ]  - [  -0.0029473200000000,  0.0000670900000000, -0.0019321200000000 ]  - [   0.0138458900000000, -0.0031482400000000,  0.0036236600000000 ]  - [  -0.0033162700000000,  0.0001249800000000, -0.0011838000000000 ]  - [  -0.0020545700000000, -0.0001397000000000, -0.0013255000000000 ]  - [  -0.0015398200000000,  0.0063849000000000, -0.0062980100000000 ]  - [   0.0409909400000000, -0.0482554400000000,  0.0214106700000000 ]  - [  -0.0028071900000000,  0.0005359000000000,  0.0001362500000000 ]  - [   0.0048744300000000,  0.0009772700000000,  0.0016628400000000 ]  - [  -0.0024918300000000, -0.0004759100000000, -0.0006137700000000 ]  - [  -0.0031027200000000, -0.0025919500000000,  0.0035517800000000 ]  - [  -0.0041364100000000, -0.0001705300000000, -0.0014528300000000 ]  - [   0.0011825000000000,  0.0033929800000000, -0.0019028200000000 ]  - [  -0.0031451800000000,  0.0002731300000000, -0.0007865200000000 ]  - [  -0.0032824100000000,  0.0040676700000000,  0.0060900800000000 ]  - [  -0.0024027700000000,  0.0015202900000000, -0.0002478300000000 ]  - [  -0.0028032700000000, -0.0007435900000000, -0.0031848200000000 ]  - [  -0.0009937100000000, -0.0018626500000000, -0.0007639600000000 ]  - [   0.0058834300000000, -0.0013668800000000,  0.0012790500000000 ]  - [  -0.0032176200000000,  0.0001571400000000, -0.0002363800000000 ]  - [   0.0016198700000000, -0.0015669800000000,  0.0033376000000000 ]  - [  -0.0032582600000000,  0.0001090500000000, -0.0008449100000000 ]  - [  -0.0599288500000000,  0.0769370400000000, -0.0370883700000000 ]  - [   0.0003695200000000, -0.0013968900000000,  0.0006296200000000 ]  - [   0.0007556100000000, -0.0005888400000000, -0.0007509600000000 ]  - [   0.0022394900000000, -0.0008393700000000, -0.0017492200000000 ]  - [   0.0014485200000000,  0.0002461300000000,  0.0073352000000000 ]  - [  -0.0001087800000000, -0.0004234900000000, -0.0001306300000000 ]  - [  -0.0009309700000000, -0.0001455300000000, -0.0011507400000000 ]  - [   0.0019759500000000, -0.0013866400000000,  0.0020242200000000 ]  - [  -0.0055194200000000,  0.0063245000000000, -0.0030575600000000 ]  - [   0.0021683200000000,  0.0008958800000000, -0.0001933800000000 ]  - [  -0.0020990700000000, -0.0008857600000000, -0.0011439700000000 ]  - [   0.0003154300000000,  0.0014319500000000,  0.0008106900000000 ]  - [   0.0009040300000000,  0.0006414300000000, -0.0014037700000000 ]  - [   0.0019809400000000,  0.0002500100000000, -0.0009074200000000 ]  - [  -0.0027712200000000, -0.0010888900000000,  0.0017364300000000 ]  - [   0.0007990300000000, -0.0000888400000000,  0.0008105100000000 ]  - [   0.0051651900000000, -0.0114103200000000, -0.0019253100000000 ]  - [   0.0013101700000000,  0.0000084100000000,  0.0005825800000000 ]  - [  -0.0046799500000000, -0.0021785500000000, -0.0030762200000000 ]  - [   0.0019484300000000,  0.0012997100000000,  0.0017781500000000 ]  - [   0.0018532200000000, -0.0058787400000000,  0.0041341600000000 ]  - [   0.0014658200000000, -0.0002899100000000,  0.0006426200000000 ]  - [  -0.0015906300000000,  0.0010673800000000, -0.0029193200000000 ]  - [   0.0003363700000000,  0.0003173900000000,  0.0003133700000000 ]  - [   0.0020135400000000, -0.0019466900000000, -0.0049660300000000 ]  - [   0.0015198000000000,  0.0002924100000000,  0.0007655600000000 ]  - [  -0.0026753100000000, -0.0015741700000000,  0.0005035200000000 ]  - [   0.0018577800000000, -0.0009480900000000, -0.0001797400000000 ]  - [   0.0008531600000000, -0.0033439900000000,  0.0004897600000000 ]  - [   0.0008450500000000, -0.0023449400000000,  0.0009137100000000 ]  - [  -0.0009580100000000,  0.0052273000000000, -0.0071775500000000 ]  - [   0.0021621600000000, -0.0006645600000000, -0.0013408800000000 ]  - [  -0.0017538400000000, -0.0019504100000000, -0.0033061000000000 ]  - [   0.0002853600000000, -0.0004262700000000,  0.0003718000000000 ]  - [   0.0013059800000000, -0.0016949100000000,  0.0019823300000000 ]  - [   0.0021758500000000, -0.0020649400000000,  0.0030608800000000 ]  - [   0.0021481700000000,  0.0006820800000000, -0.0008544900000000 ]  - [   0.0007594800000000,  0.0027332700000000,  0.0005139400000000 ]  - [   0.0002876700000000,  0.0018818300000000,  0.0012848300000000 ]  - [   0.0002898900000000,  0.0020730000000000,  0.0015806300000000 ]  - [  -0.0024995600000000,  0.0006487200000000, -0.0001150800000000 ]  - [   0.0020375600000000,  0.0006330900000000, -0.0014109100000000 ]  - [  -0.0016019700000000, -0.0011145300000000,  0.0026756000000000 ]  - [   0.0005100600000000, -0.0000499500000000,  0.0009301100000000 ]  - [   0.0097438300000000, -0.0087947700000000, -0.0006981800000000 ]  - [   0.0010369000000000, -0.0000708400000000,  0.0005894100000000 ]  - [   0.0020832200000000,  0.0019687900000000,  0.0009287300000000 ]  - [   0.0026870300000000,  0.0008419700000000,  0.0017810400000000 ]  - [   0.0003341500000000,  0.0026343500000000, -0.0022473200000000 ]  - [   0.0014336800000000,  0.0000589600000000,  0.0005300500000000 ]  - [   0.0028832100000000, -0.0109773600000000,  0.0127833400000000 ]  - [   0.0001310300000000,  0.0005698500000000, -0.0000845700000000 ]  - [  -0.0008106200000000, -0.0029473400000000, -0.0012310200000000 ]  - [   0.0012265300000000, -0.0003524900000000,  0.0001807100000000 ]  - [   0.0018952200000000, -0.0008531900000000,  0.0001350600000000 ]  - [  -0.0001936700000000, -0.0006244900000000, -0.0000964800000000 ]- atom:   25  displacement:    [  -0.0099999969910042,  0.0000000000000000, -0.0000077575709300 ]  forces:  - [   0.0032119700000000,  0.0000590900000000,  0.0024714100000000 ]  - [   0.0089422400000000, -0.0011756100000000, -0.0047268900000000 ]  - [  -0.0058428500000000, -0.0012597300000000, -0.0038182200000000 ]  - [   0.0029482700000000, -0.0000722600000000,  0.0019202400000000 ]  - [  -0.0137044200000000,  0.0032281500000000, -0.0037185800000000 ]  - [   0.0033110800000000, -0.0001132600000000,  0.0011797600000000 ]  - [   0.0020485000000000,  0.0001318300000000,  0.0013216600000000 ]  - [   0.0015362500000000, -0.0063667700000000,  0.0062732800000000 ]  - [  -0.0411392100000000,  0.0486301800000000, -0.0210954400000000 ]  - [   0.0032795600000000, -0.0000948900000000,  0.0001337500000000 ]  - [  -0.0043809600000000, -0.0014051000000000, -0.0013926300000000 ]  - [   0.0029657100000000,  0.0000393400000000,  0.0008837700000000 ]  - [   0.0026331300000000,  0.0030475000000000, -0.0038508700000000 ]  - [   0.0036312400000000,  0.0006023100000000,  0.0011727300000000 ]  - [  -0.0016602100000000, -0.0037959300000000,  0.0016218100000000 ]  - [   0.0026534300000000, -0.0007088300000000,  0.0005194100000000 ]  - [   0.0037343500000000, -0.0035967200000000, -0.0057930300000000 ]  - [   0.0028755400000000, -0.0010682600000000,  0.0005290800000000 ]  - [   0.0032878100000000,  0.0003093200000000,  0.0034379700000000 ]  - [   0.0014857600000000,  0.0014081500000000,  0.0010282600000000 ]  - [  -0.0063212100000000,  0.0017996200000000, -0.0015266000000000 ]  - [   0.0027284800000000,  0.0002751300000000, -0.0000357900000000 ]  - [  -0.0020486200000000,  0.0010462600000000, -0.0036558200000000 ]  - [   0.0027664400000000, -0.0005529500000000,  0.0005739300000000 ]  - [   0.0595108400000000, -0.0782214500000000,  0.0372726100000000 ]  - [  -0.0013857800000000, -0.0001465400000000, -0.0003022400000000 ]  - [   0.0001756700000000, -0.0001198200000000, -0.0012847200000000 ]  - [  -0.0013153100000000,  0.0001415600000000, -0.0002788100000000 ]  - [  -0.0031690300000000, -0.0020603800000000, -0.0091280400000000 ]  - [  -0.0016115600000000, -0.0013842300000000, -0.0016304500000000 ]  - [   0.0026378300000000, -0.0016635900000000,  0.0028966000000000 ]  - [  -0.0002676200000000, -0.0004304300000000, -0.0002888700000000 ]  - [   0.0055104300000000, -0.0045559200000000,  0.0030872700000000 ]  - [  -0.0021775800000000,  0.0009563400000000,  0.0002007800000000 ]  - [   0.0010777000000000,  0.0024180100000000,  0.0014694400000000 ]  - [  -0.0013287600000000,  0.0001108900000000, -0.0004836200000000 ]  - [   0.0000346300000000,  0.0000616400000000, -0.0006332700000000 ]  - [  -0.0010332500000000,  0.0004635200000000, -0.0011409000000000 ]  - [   0.0018288200000000,  0.0003812300000000,  0.0003034600000000 ]  - [  -0.0017306300000000, -0.0006165100000000,  0.0012254600000000 ]  - [  -0.0060978200000000,  0.0119576700000000,  0.0039252100000000 ]  - [  -0.0022379700000000,  0.0006911400000000,  0.0014503700000000 ]  - [   0.0064053300000000,  0.0039395300000000,  0.0048055600000000 ]  - [  -0.0002378800000000,  0.0005118100000000, -0.0000410300000000 ]  - [  -0.0008447500000000,  0.0074132800000000, -0.0044513100000000 ]  - [  -0.0004441400000000,  0.0018132000000000, -0.0009584400000000 ]  - [  -0.0001335100000000,  0.0007434300000000,  0.0011413600000000 ]  - [  -0.0020493600000000,  0.0014927000000000, -0.0020681100000000 ]  - [  -0.0010253800000000,  0.0004155100000000,  0.0047019700000000 ]  - [  -0.0005013800000000, -0.0018448400000000, -0.0010925900000000 ]  - [   0.0026754300000000, -0.0002640100000000, -0.0005034900000000 ]  - [  -0.0018492300000000, -0.0008884400000000,  0.0001774600000000 ]  - [  -0.0018557000000000,  0.0017677800000000, -0.0001485200000000 ]  - [  -0.0018577600000000,  0.0007901000000000, -0.0005860700000000 ]  - [   0.0017991400000000, -0.0058882000000000,  0.0052166200000000 ]  - [  -0.0012280500000000, -0.0000301400000000, -0.0006867700000000 ]  - [   0.0000408700000000,  0.0001343400000000,  0.0015586600000000 ]  - [  -0.0019921500000000, -0.0013846800000000, -0.0021137100000000 ]  - [   0.0004006700000000, -0.0001151700000000, -0.0002476200000000 ]  - [  -0.0004672600000000,  0.0002475700000000, -0.0013232800000000 ]  - [  -0.0021283000000000,  0.0011696700000000,  0.0008496900000000 ]  - [  -0.0007343700000000, -0.0008601900000000, -0.0005076000000000 ]  - [  -0.0012982100000000, -0.0003166700000000, -0.0009503600000000 ]  - [  -0.0012967400000000, -0.0005035100000000, -0.0012388700000000 ]  - [   0.0034249000000000,  0.0000514600000000, -0.0019278600000000 ]  - [  -0.0010980600000000,  0.0000664800000000, -0.0006214700000000 ]  - [   0.0006533300000000,  0.0003951300000000, -0.0006209400000000 ]  - [  -0.0014580600000000, -0.0006660600000000,  0.0011246000000000 ]  - [  -0.0107536700000000,  0.0095852100000000,  0.0027186800000000 ]  - [  -0.0019749900000000,  0.0007835400000000,  0.0014556500000000 ]  - [  -0.0003832400000000, -0.0001691300000000,  0.0008193000000000 ]  - [  -0.0009582800000000,  0.0009520400000000, -0.0000305700000000 ]  - [   0.0006770100000000, -0.0010799400000000,  0.0019187300000000 ]  - [  -0.0004104700000000,  0.0014719200000000, -0.0008495300000000 ]  - [  -0.0045648000000000,  0.0126748500000000, -0.0143477700000000 ]  - [  -0.0018350800000000,  0.0012407200000000, -0.0016483000000000 ]  - [   0.0018217400000000,  0.0013929400000000,  0.0008993800000000 ]  - [  -0.0002032200000000, -0.0011831400000000, -0.0004982300000000 ]  - [  -0.0018636600000000, -0.0009962900000000, -0.0001405100000000 ]  - [   0.0001863900000000, -0.0012125000000000,  0.0001018300000000 ]- atom:   25  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0019686300000000, -0.0039956000000000, -0.0019999800000000 ]  - [   0.0199730400000000,  0.0002853300000000, -0.0115164200000000 ]  - [  -0.0004122800000000,  0.0035640700000000,  0.0026222600000000 ]  - [   0.0022877800000000,  0.0003698600000000,  0.0014847800000000 ]  - [  -0.0047610700000000,  0.0241389500000000, -0.0099218200000000 ]  - [   0.0024123300000000, -0.0003537100000000,  0.0011407100000000 ]  - [  -0.0011804500000000, -0.0008859700000000,  0.0047782100000000 ]  - [   0.0033063500000000, -0.0116351000000000,  0.0104399300000000 ]  - [  -0.0470918500000000,  0.1783398100000000, -0.0668015600000000 ]  - [   0.0022816300000000,  0.0005634200000000,  0.0001506100000000 ]  - [  -0.0070572400000000, -0.0034173000000000, -0.0003826000000000 ]  - [   0.0029223200000000, -0.0006546300000000,  0.0004703700000000 ]  - [  -0.0228170500000000,  0.0123011500000000,  0.0063055400000000 ]  - [   0.0046026100000000,  0.0015758900000000,  0.0011621100000000 ]  - [   0.0020815000000000, -0.0138745200000000,  0.0039131300000000 ]  - [   0.0030066000000000, -0.0016283200000000,  0.0006142500000000 ]  - [   0.0073807100000000, -0.0089595900000000, -0.0102553100000000 ]  - [  -0.0014536800000000, -0.0051230800000000,  0.0020774100000000 ]  - [   0.0056016000000000,  0.0009430400000000,  0.0084841500000000 ]  - [  -0.0002281200000000,  0.0037701200000000,  0.0019012700000000 ]  - [  -0.0119557900000000, -0.0064235000000000, -0.0159002400000000 ]  - [   0.0027945800000000, -0.0006301600000000, -0.0001645600000000 ]  - [  -0.0101391400000000,  0.0134665600000000,  0.0063818500000000 ]  - [   0.0034691300000000,  0.0008996900000000,  0.0000093200000000 ]  - [   0.0752227100000000, -0.2958522100000000,  0.1289712500000000 ]  - [  -0.0011345500000000, -0.0007089800000000,  0.0000142900000000 ]  - [  -0.0014602100000000,  0.0026370600000000,  0.0007610800000000 ]  - [  -0.0024585500000000,  0.0006660600000000,  0.0005243300000000 ]  - [  -0.0057417300000000, -0.0073642400000000, -0.0109356400000000 ]  - [  -0.0011252300000000, -0.0015424400000000, -0.0013590000000000 ]  - [   0.0017045100000000, -0.0020477600000000, -0.0012491800000000 ]  - [  -0.0003127500000000, -0.0006375300000000, -0.0002189400000000 ]  - [   0.0199506900000000,  0.0150778900000000, -0.0147546400000000 ]  - [  -0.0020623200000000,  0.0008799800000000,  0.0001656700000000 ]  - [   0.0011359500000000,  0.0029512800000000,  0.0002385800000000 ]  - [  -0.0011845400000000,  0.0006622600000000, -0.0000957100000000 ]  - [   0.0063980100000000,  0.0005803900000000, -0.0041526800000000 ]  - [  -0.0020950800000000,  0.0007556800000000, -0.0012143700000000 ]  - [   0.0023109700000000,  0.0010066100000000, -0.0008659700000000 ]  - [  -0.0013735600000000, -0.0003343700000000,  0.0008829600000000 ]  - [  -0.0265130500000000,  0.0230801300000000,  0.0109661300000000 ]  - [  -0.0014436800000000,  0.0008910400000000,  0.0015293300000000 ]  - [   0.0073583700000000,  0.0273980100000000,  0.0112347200000000 ]  - [  -0.0001347600000000,  0.0006915800000000,  0.0000301300000000 ]  - [  -0.0061521200000000,  0.0237692900000000, -0.0148685700000000 ]  - [  -0.0005272000000000,  0.0025457700000000, -0.0013358700000000 ]  - [  -0.0005655500000000,  0.0013773500000000,  0.0018660400000000 ]  - [  -0.0009188000000000,  0.0016759000000000, -0.0014248000000000 ]  - [   0.0017202900000000, -0.0081093600000000, -0.0044681800000000 ]  - [  -0.0005330900000000, -0.0024952500000000, -0.0013128100000000 ]  - [   0.0041171000000000,  0.0014090400000000, -0.0013036100000000 ]  - [  -0.0020157800000000, -0.0007210800000000,  0.0002548300000000 ]  - [  -0.0020936400000000,  0.0043611400000000, -0.0001428300000000 ]  - [  -0.0030726300000000,  0.0043701000000000, -0.0023241000000000 ]  - [   0.0173742000000000, -0.0024902500000000, -0.0177486600000000 ]  - [  -0.0012905000000000, -0.0001432300000000, -0.0006575800000000 ]  - [   0.0006289600000000,  0.0015051600000000,  0.0031844300000000 ]  - [  -0.0016515900000000, -0.0007403500000000, -0.0012558800000000 ]  - [  -0.0010924000000000,  0.0020977200000000, -0.0028986400000000 ]  - [  -0.0009924500000000,  0.0007927400000000, -0.0021220100000000 ]  - [  -0.0031109700000000,  0.0015564800000000,  0.0013607000000000 ]  - [   0.0046409000000000,  0.0019937700000000,  0.0007476600000000 ]  - [  -0.0017851300000000, -0.0019867500000000, -0.0027119400000000 ]  - [  -0.0016105900000000, -0.0020165800000000, -0.0026369200000000 ]  - [   0.0009861000000000,  0.0002241200000000,  0.0026018900000000 ]  - [  -0.0010344300000000,  0.0001220800000000, -0.0006297800000000 ]  - [   0.0008928000000000, -0.0002089700000000, -0.0018434600000000 ]  - [  -0.0007424100000000, -0.0007600900000000,  0.0008577100000000 ]  - [  -0.0186510700000000,  0.0095318900000000,  0.0070927100000000 ]  - [  -0.0006784100000000,  0.0010776700000000,  0.0011469600000000 ]  - [   0.0049974100000000,  0.0014090300000000,  0.0040195800000000 ]  - [  -0.0016345900000000, -0.0000158500000000, -0.0004654800000000 ]  - [   0.0023859500000000, -0.0073409600000000,  0.0043378000000000 ]  - [  -0.0001903000000000,  0.0005717500000000,  0.0001187300000000 ]  - [  -0.0130908100000000,  0.0123890800000000, -0.0224612100000000 ]  - [  -0.0014416900000000,  0.0012780900000000, -0.0019150000000000 ]  - [   0.0026865500000000,  0.0056643700000000,  0.0034487500000000 ]  - [   0.0001037000000000, -0.0004087700000000, -0.0003042300000000 ]  - [  -0.0030759100000000, -0.0012596900000000, -0.0003788500000000 ]  - [   0.0033847400000000, -0.0024522000000000, -0.0012931400000000 ]- atom:   25  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0019478600000000,  0.0039649300000000,  0.0019980100000000 ]  - [  -0.0200344000000000, -0.0003117900000000,  0.0115179800000000 ]  - [   0.0004013400000000, -0.0035108500000000, -0.0025708100000000 ]  - [  -0.0022865700000000, -0.0003647100000000, -0.0014853700000000 ]  - [   0.0039429100000000, -0.0220730400000000,  0.0078806000000000 ]  - [  -0.0024124000000000,  0.0003461000000000, -0.0011416000000000 ]  - [   0.0011889900000000,  0.0008604600000000, -0.0047671300000000 ]  - [  -0.0033012900000000,  0.0116187700000000, -0.0104043600000000 ]  - [   0.0517687100000000, -0.1892507800000000,  0.0730392400000000 ]  - [  -0.0017919300000000, -0.0001291000000000,  0.0001189200000000 ]  - [   0.0075001000000000,  0.0029931000000000,  0.0006784500000000 ]  - [  -0.0024409600000000,  0.0002257800000000, -0.0001926800000000 ]  - [   0.0223413700000000, -0.0120226200000000, -0.0065626500000000 ]  - [  -0.0050773600000000, -0.0011373000000000, -0.0014351900000000 ]  - [  -0.0025349400000000,  0.0133649100000000, -0.0041519400000000 ]  - [  -0.0034726900000000,  0.0012034900000000, -0.0008728700000000 ]  - [  -0.0068736700000000,  0.0093395700000000,  0.0104369800000000 ]  - [   0.0019669600000000,  0.0055912800000000, -0.0018112400000000 ]  - [  -0.0051419500000000, -0.0014057600000000, -0.0081919100000000 ]  - [   0.0007065000000000, -0.0042048200000000, -0.0016148700000000 ]  - [   0.0114458800000000,  0.0070144400000000,  0.0155782300000000 ]  - [  -0.0032551500000000,  0.0010585200000000, -0.0001133400000000 ]  - [   0.0096563100000000, -0.0138346000000000, -0.0066514900000000 ]  - [  -0.0039506700000000, -0.0013393700000000, -0.0002695300000000 ]  - [  -0.0798292500000000,  0.3039051300000000, -0.1328386600000000 ]  - [   0.0000978800000000, -0.0007926000000000,  0.0002948900000000 ]  - [   0.0023656600000000, -0.0032960500000000, -0.0027804700000000 ]  - [   0.0033905300000000, -0.0013476400000000, -0.0025451300000000 ]  - [   0.0040746700000000,  0.0055082600000000,  0.0092959500000000 ]  - [  -0.0005657200000000, -0.0002633100000000, -0.0003398200000000 ]  - [  -0.0000027400000000,  0.0002484800000000,  0.0029469900000000 ]  - [   0.0020221800000000, -0.0011659000000000,  0.0019438700000000 ]  - [  -0.0202808900000000, -0.0135200000000000,  0.0150197500000000 ]  - [   0.0020368700000000,  0.0009842000000000, -0.0001574500000000 ]  - [  -0.0021668500000000, -0.0014648600000000,  0.0000479100000000 ]  - [   0.0001551900000000,  0.0008539600000000,  0.0004080800000000 ]  - [  -0.0054805100000000,  0.0001225800000000,  0.0021239400000000 ]  - [   0.0030270200000000, -0.0000560300000000, -0.0008316300000000 ]  - [  -0.0032279500000000, -0.0016866400000000,  0.0028816300000000 ]  - [   0.0004363900000000, -0.0003600600000000,  0.0011520100000000 ]  - [   0.0259710600000000, -0.0228221700000000, -0.0090991200000000 ]  - [   0.0005148800000000, -0.0002174200000000,  0.0004879700000000 ]  - [  -0.0055680900000000, -0.0251674500000000, -0.0093598000000000 ]  - [   0.0018520600000000,  0.0011116000000000,  0.0017111600000000 ]  - [   0.0071174400000000, -0.0220077000000000,  0.0144026000000000 ]  - [   0.0015601600000000, -0.0010384500000000,  0.0010171700000000 ]  - [  -0.0011293400000000,  0.0004125900000000, -0.0035506900000000 ]  - [  -0.0007840700000000,  0.0001128300000000, -0.0002761900000000 ]  - [  -0.0006407900000000,  0.0065945900000000,  0.0040897400000000 ]  - [   0.0015589300000000,  0.0009558800000000,  0.0009932900000000 ]  - [  -0.0040849100000000, -0.0032510800000000,  0.0012845400000000 ]  - [   0.0020236800000000, -0.0011249200000000, -0.0002598500000000 ]  - [   0.0010539600000000, -0.0058707300000000,  0.0004693200000000 ]  - [   0.0020325000000000, -0.0058725500000000,  0.0026306800000000 ]  - [  -0.0162902700000000,  0.0016753800000000,  0.0156229900000000 ]  - [   0.0022256600000000, -0.0005424500000000, -0.0013728200000000 ]  - [  -0.0023280700000000, -0.0033044300000000, -0.0049035700000000 ]  - [  -0.0000641800000000, -0.0010698900000000, -0.0004804100000000 ]  - [   0.0027768100000000, -0.0038776500000000,  0.0045856100000000 ]  - [   0.0026852200000000, -0.0026083700000000,  0.0038175700000000 ]  - [   0.0030806500000000,  0.0003148300000000, -0.0013448900000000 ]  - [  -0.0046935200000000, -0.0001655300000000, -0.0007319100000000 ]  - [   0.0007645000000000,  0.0035286500000000,  0.0030372200000000 ]  - [   0.0005714500000000,  0.0034958700000000,  0.0029317700000000 ]  - [  -0.0000441600000000,  0.0004323200000000, -0.0046514600000000 ]  - [   0.0019588400000000,  0.0005774400000000, -0.0014117000000000 ]  - [  -0.0018106500000000, -0.0004984500000000,  0.0038882800000000 ]  - [  -0.0001560200000000,  0.0000866400000000,  0.0011461100000000 ]  - [   0.0175032200000000, -0.0087954400000000, -0.0050001600000000 ]  - [  -0.0002423000000000, -0.0004070800000000,  0.0008671900000000 ]  - [  -0.0032722400000000,  0.0004161800000000, -0.0022757200000000 ]  - [   0.0033473000000000,  0.0018173700000000,  0.0022148500000000 ]  - [  -0.0013603500000000,  0.0088545800000000, -0.0046465400000000 ]  - [   0.0012161000000000,  0.0009648300000000, -0.0004508500000000 ]  - [   0.0115029700000000, -0.0105530800000000,  0.0208986500000000 ]  - [  -0.0002592500000000,  0.0005321700000000,  0.0001986800000000 ]  - [  -0.0016515500000000, -0.0072055100000000, -0.0037609700000000 ]  - [   0.0009163400000000, -0.0011306400000000, -0.0000228700000000 ]  - [   0.0030963200000000, -0.0006072600000000,  0.0003759300000000 ]  - [  -0.0034000200000000,  0.0005883600000000,  0.0012949100000000 ]- atom:   25  displacement:    [  -0.0024096060369692,  0.0000000000000000,  0.0097053489760339 ]  forces:  - [  -0.0014238700000000,  0.0019373000000000,  0.0027946000000000 ]  - [  -0.0000648000000000, -0.0011847300000000,  0.0036771500000000 ]  - [   0.0044679000000000, -0.0041502300000000, -0.0084663600000000 ]  - [  -0.0015840400000000,  0.0000058600000000, -0.0010745400000000 ]  - [   0.0010806500000000, -0.0134022700000000,  0.0217808500000000 ]  - [  -0.0010341900000000,  0.0002368800000000, -0.0004849900000000 ]  - [   0.0010460800000000,  0.0000428900000000, -0.0038217900000000 ]  - [  -0.0036401400000000,  0.0096713700000000, -0.0109375400000000 ]  - [   0.0092017800000000, -0.0460104900000000,  0.0421882500000000 ]  - [  -0.0004773900000000,  0.0000571100000000,  0.0001405600000000 ]  - [   0.0042060000000000,  0.0009182800000000, -0.0029275400000000 ]  - [  -0.0012878800000000, -0.0000308000000000, -0.0000429400000000 ]  - [   0.0155576800000000, -0.0021001800000000, -0.0036043600000000 ]  - [  -0.0032237900000000, -0.0008716900000000,  0.0013945900000000 ]  - [  -0.0023554900000000,  0.0071557000000000, -0.0031228100000000 ]  - [  -0.0018638500000000, -0.0003667900000000, -0.0026703200000000 ]  - [  -0.0014919400000000,  0.0034402400000000,  0.0051815700000000 ]  - [  -0.0003119200000000,  0.0005990100000000,  0.0011698300000000 ]  - [  -0.0044379700000000, -0.0012759300000000, -0.0083464300000000 ]  - [   0.0008136500000000, -0.0032051400000000, -0.0020376400000000 ]  - [   0.0015781600000000, -0.0029280300000000,  0.0068392700000000 ]  - [  -0.0012690700000000,  0.0003815700000000, -0.0002421100000000 ]  - [   0.0077735200000000, -0.0078975200000000, -0.0098688700000000 ]  - [  -0.0031310700000000, -0.0013703700000000,  0.0002254000000000 ]  - [  -0.0221580000000000,  0.1073977700000000, -0.0989218700000000 ]  - [  -0.0002723400000000, -0.0007686500000000,  0.0001833900000000 ]  - [   0.0025083600000000, -0.0016462300000000, -0.0021142700000000 ]  - [   0.0002429900000000, -0.0001924800000000, -0.0006781700000000 ]  - [   0.0073530900000000,  0.0018520600000000,  0.0145790000000000 ]  - [  -0.0007525200000000, -0.0004762400000000, -0.0003536400000000 ]  - [   0.0008721300000000, -0.0010959900000000,  0.0046056000000000 ]  - [   0.0017698800000000, -0.0010628900000000,  0.0016547300000000 ]  - [  -0.0099944900000000, -0.0107597400000000,  0.0050470600000000 ]  - [   0.0009115600000000,  0.0010264400000000, -0.0002987300000000 ]  - [  -0.0014049100000000,  0.0010458200000000,  0.0021058200000000 ]  - [  -0.0000846700000000,  0.0008271500000000,  0.0003541700000000 ]  - [  -0.0034728800000000, -0.0003687500000000,  0.0011119300000000 ]  - [   0.0033084300000000,  0.0001434000000000, -0.0014362500000000 ]  - [  -0.0029205200000000, -0.0013961200000000,  0.0032166200000000 ]  - [   0.0000779800000000, -0.0003027900000000,  0.0011099400000000 ]  - [   0.0020498000000000,  0.0006534600000000, -0.0065774200000000 ]  - [  -0.0001234600000000,  0.0000837000000000,  0.0007100400000000 ]  - [  -0.0019976900000000, -0.0040018900000000, -0.0080835200000000 ]  - [   0.0011778300000000,  0.0009949300000000,  0.0011275700000000 ]  - [   0.0043286900000000, -0.0117854800000000,  0.0080445900000000 ]  - [   0.0010494300000000, -0.0001036000000000,  0.0007707900000000 ]  - [  -0.0016594800000000,  0.0009236800000000, -0.0020475000000000 ]  - [  -0.0004746800000000,  0.0007037500000000, -0.0007290100000000 ]  - [  -0.0045871600000000,  0.0036753400000000,  0.0073460600000000 ]  - [   0.0011660100000000,  0.0001190600000000,  0.0002174300000000 ]  - [  -0.0023220100000000, -0.0017667900000000,  0.0013802500000000 ]  - [   0.0009979800000000, -0.0009452600000000,  0.0001012500000000 ]  - [  -0.0001038000000000, -0.0025596600000000, -0.0002075100000000 ]  - [  -0.0005408200000000, -0.0006679300000000, -0.0003238900000000 ]  - [  -0.0130586300000000, -0.0056248900000000,  0.0146114100000000 ]  - [   0.0015214200000000, -0.0004695300000000, -0.0013690100000000 ]  - [  -0.0015874500000000, -0.0016474500000000, -0.0008880700000000 ]  - [  -0.0003968800000000, -0.0010445200000000, -0.0008040900000000 ]  - [   0.0020871800000000, -0.0026164300000000,  0.0033617200000000 ]  - [   0.0027336200000000, -0.0026760700000000,  0.0045688800000000 ]  - [   0.0010002100000000,  0.0006848900000000, -0.0005570200000000 ]  - [   0.0001944300000000,  0.0015413400000000, -0.0011426500000000 ]  - [   0.0006543400000000,  0.0032042500000000,  0.0029375500000000 ]  - [   0.0003708900000000,  0.0032248000000000,  0.0028601700000000 ]  - [  -0.0011123400000000,  0.0036936800000000,  0.0017347700000000 ]  - [   0.0011672800000000,  0.0004181800000000, -0.0011002600000000 ]  - [  -0.0034117400000000, -0.0011543500000000,  0.0058878300000000 ]  - [  -0.0001413500000000, -0.0000696400000000,  0.0012988900000000 ]  - [   0.0057189400000000, -0.0016813000000000, -0.0045975000000000 ]  - [  -0.0003750300000000,  0.0002126900000000,  0.0007241500000000 ]  - [  -0.0019388100000000, -0.0000151700000000, -0.0018458600000000 ]  - [   0.0011514500000000,  0.0006479900000000, -0.0003189400000000 ]  - [  -0.0014610500000000,  0.0046258500000000, -0.0011302600000000 ]  - [   0.0009663400000000,  0.0011894700000000, -0.0006162300000000 ]  - [   0.0123206300000000, -0.0168293500000000,  0.0171871900000000 ]  - [  -0.0006493200000000,  0.0006314600000000, -0.0002279700000000 ]  - [  -0.0001974300000000, -0.0037278000000000, -0.0021781700000000 ]  - [   0.0006755900000000, -0.0006980400000000,  0.0001294200000000 ]  - [   0.0035270800000000, -0.0009148100000000,  0.0002909900000000 ]  - [  -0.0028321100000000, -0.0001033300000000,  0.0015447700000000 ]- atom:   25  displacement:    [   0.0024096060369692,  0.0000000000000000, -0.0097053489760339 ]  forces:  - [   0.0014291400000000, -0.0019475700000000, -0.0028125600000000 ]  - [   0.0001499900000000,  0.0011839900000000, -0.0037420200000000 ]  - [  -0.0044825300000000,  0.0041254800000000,  0.0084814900000000 ]  - [   0.0015997300000000, -0.0000057100000000,  0.0010876400000000 ]  - [  -0.0015221500000000,  0.0144888900000000, -0.0223450900000000 ]  - [   0.0010451900000000, -0.0002378400000000,  0.0004900800000000 ]  - [  -0.0010457200000000, -0.0000395800000000,  0.0038471200000000 ]  - [   0.0036293600000000, -0.0096716200000000,  0.0109487700000000 ]  - [  -0.0083411600000000,  0.0456826200000000, -0.0422735800000000 ]  - [   0.0009696100000000,  0.0003629200000000,  0.0001353300000000 ]  - [  -0.0037580900000000, -0.0013688400000000,  0.0031857600000000 ]  - [   0.0017724700000000, -0.0003952100000000,  0.0003142600000000 ]  - [  -0.0160561900000000,  0.0025650700000000,  0.0033651500000000 ]  - [   0.0027590800000000,  0.0013039400000000, -0.0016495600000000 ]  - [   0.0018913000000000, -0.0076167100000000,  0.0028516700000000 ]  - [   0.0013933600000000, -0.0000548000000000,  0.0023953000000000 ]  - [   0.0019762800000000, -0.0030080900000000, -0.0048888300000000 ]  - [   0.0008102400000000, -0.0001927600000000, -0.0008879700000000 ]  - [   0.0049340200000000,  0.0008667300000000,  0.0086403300000000 ]  - [  -0.0003483000000000,  0.0027886100000000,  0.0023132300000000 ]  - [  -0.0020655200000000,  0.0033453200000000, -0.0070656600000000 ]  - [   0.0008151100000000,  0.0000424600000000, -0.0000298700000000 ]  - [  -0.0082955000000000,  0.0075522200000000,  0.0096107200000000 ]  - [   0.0026919600000000,  0.0009584300000000, -0.0005099200000000 ]  - [   0.0210751100000000, -0.1092163900000000,  0.1002457100000000 ]  - [  -0.0007566400000000, -0.0007609100000000,  0.0001311700000000 ]  - [  -0.0015963900000000,  0.0009714500000000,  0.0001012500000000 ]  - [   0.0006815200000000, -0.0005073200000000, -0.0013537500000000 ]  - [  -0.0091766700000000, -0.0036853900000000, -0.0165078800000000 ]  - [  -0.0009404300000000, -0.0013287000000000, -0.0013469100000000 ]  - [   0.0008162800000000, -0.0007134700000000, -0.0029260900000000 ]  - [  -0.0000854000000000, -0.0007426900000000,  0.0000380000000000 ]  - [   0.0099611500000000,  0.0124686100000000, -0.0050822700000000 ]  - [  -0.0008904200000000,  0.0008284200000000,  0.0002887900000000 ]  - [   0.0003756900000000,  0.0004648000000000, -0.0018006900000000 ]  - [  -0.0009500600000000,  0.0006712900000000, -0.0000582900000000 ]  - [   0.0044197800000000,  0.0010633400000000, -0.0031547900000000 ]  - [  -0.0024025100000000,  0.0005288700000000, -0.0005691700000000 ]  - [   0.0020224200000000,  0.0007285400000000, -0.0012190400000000 ]  - [  -0.0009979800000000, -0.0003751000000000,  0.0008995500000000 ]  - [  -0.0030666600000000,  0.0000998700000000,  0.0086430100000000 ]  - [  -0.0008129700000000,  0.0006139600000000,  0.0013247400000000 ]  - [   0.0037057300000000,  0.0057174400000000,  0.0098571300000000 ]  - [   0.0005084300000000,  0.0008001300000000,  0.0005615500000000 ]  - [  -0.0033310100000000,  0.0133995000000000, -0.0084278700000000 ]  - [  -0.0000304500000000,  0.0016430400000000, -0.0010897200000000 ]  - [  -0.0000478500000000,  0.0008822900000000,  0.0003133300000000 ]  - [  -0.0012340500000000,  0.0011018900000000, -0.0009924200000000 ]  - [   0.0055403300000000, -0.0051901000000000, -0.0075924100000000 ]  - [  -0.0001384800000000, -0.0016257400000000, -0.0005247200000000 ]  - [   0.0023203000000000, -0.0000632400000000, -0.0013758300000000 ]  - [  -0.0010327600000000, -0.0009004000000000, -0.0000915300000000 ]  - [  -0.0009253800000000,  0.0010424200000000,  0.0005122700000000 ]  - [  -0.0005055100000000, -0.0008185400000000,  0.0006183200000000 ]  - [   0.0141749300000000,  0.0050806900000000, -0.0167954200000000 ]  - [  -0.0006220700000000, -0.0001980500000000, -0.0006263200000000 ]  - [  -0.0000953800000000, -0.0001408400000000, -0.0007796300000000 ]  - [  -0.0012924600000000, -0.0007555000000000, -0.0008860500000000 ]  - [  -0.0003862500000000,  0.0008254000000000, -0.0016448900000000 ]  - [  -0.0010189700000000,  0.0008783800000000, -0.0028328100000000 ]  - [  -0.0009883800000000,  0.0011639300000000,  0.0005497300000000 ]  - [  -0.0002125300000000,  0.0002990800000000,  0.0011408500000000 ]  - [  -0.0016909700000000, -0.0016988200000000, -0.0026442400000000 ]  - [  -0.0014069200000000, -0.0017376100000000, -0.0025661700000000 ]  - [   0.0020440900000000, -0.0029601300000000, -0.0037239200000000 ]  - [  -0.0002607000000000,  0.0002576100000000, -0.0009082200000000 ]  - [   0.0024902600000000,  0.0004664900000000, -0.0038806700000000 ]  - [  -0.0007815200000000, -0.0006126100000000,  0.0007157200000000 ]  - [  -0.0066120800000000,  0.0023282300000000,  0.0066633900000000 ]  - [  -0.0005459700000000,  0.0004717600000000,  0.0012925600000000 ]  - [   0.0036545800000000,  0.0018182100000000,  0.0035696600000000 ]  - [   0.0005248400000000,  0.0011538700000000,  0.0020035300000000 ]  - [   0.0025088400000000, -0.0031812400000000,  0.0008644700000000 ]  - [   0.0000709300000000,  0.0002934800000000,  0.0003243500000000 ]  - [  -0.0138455100000000,  0.0185039000000000, -0.0187847700000000 ]  - [  -0.0010707700000000,  0.0011732300000000, -0.0015160800000000 ]  - [   0.0012286600000000,  0.0022151200000000,  0.0018656700000000 ]  - [   0.0003545800000000, -0.0008048600000000, -0.0004329500000000 ]  - [  -0.0035398000000000, -0.0009311100000000, -0.0002990500000000 ]  - [   0.0028617900000000, -0.0017344300000000, -0.0015519600000000 ]- atom:   27  displacement:    [   0.0099999969910042,  0.0000000000000000,  0.0000077575709300 ]  forces:  - [   0.0389596700000000,  0.0023437700000000, -0.0061585600000000 ]  - [  -0.0078661800000000, -0.0017876700000000, -0.0039134500000000 ]  - [   0.0028975600000000,  0.0025533300000000,  0.0071024900000000 ]  - [  -0.0030499300000000, -0.0001836700000000, -0.0037511700000000 ]  - [   0.0002434000000000,  0.0111138100000000, -0.0136520900000000 ]  - [  -0.0058526600000000,  0.0010193400000000, -0.0013808100000000 ]  - [   0.0080571000000000, -0.0061671800000000,  0.0109511300000000 ]  - [  -0.0073083300000000,  0.0000056100000000, -0.0008145700000000 ]  - [   0.0001897800000000,  0.0004570400000000, -0.0050703600000000 ]  - [  -0.0054148300000000,  0.0074966400000000,  0.0104301800000000 ]  - [  -0.0167186200000000,  0.0098354300000000,  0.0036906400000000 ]  - [  -0.0055149300000000,  0.0015088800000000, -0.0143133200000000 ]  - [   0.0102983700000000, -0.0006934500000000,  0.0098130300000000 ]  - [  -0.0055940600000000,  0.0000787000000000, -0.0008914300000000 ]  - [   0.0629985100000000, -0.0467591400000000, -0.0531278100000000 ]  - [  -0.0072134600000000, -0.0000521400000000, -0.0006380100000000 ]  - [   0.0089833200000000, -0.0114901000000000,  0.0041273700000000 ]  - [  -0.0039731600000000,  0.0016868600000000, -0.0006244900000000 ]  - [   0.0090040900000000, -0.0004104000000000,  0.0035227300000000 ]  - [  -0.0041701100000000, -0.0011330100000000, -0.0008815300000000 ]  - [  -0.0027500000000000,  0.0006281100000000, -0.0020564000000000 ]  - [  -0.0004670900000000,  0.0008226500000000,  0.0025062500000000 ]  - [  -0.0038506900000000, -0.0002794400000000,  0.0013916100000000 ]  - [   0.0004795000000000,  0.0115328600000000, -0.0071275700000000 ]  - [  -0.0002303300000000, -0.0026595500000000,  0.0023163900000000 ]  - [   0.0012590300000000, -0.0036592600000000,  0.0003661100000000 ]  - [  -0.1607592700000000,  0.0700267700000000,  0.1039027600000000 ]  - [   0.0042803600000000, -0.0008561400000000, -0.0018458400000000 ]  - [  -0.0031967000000000, -0.0011575000000000, -0.0026908000000000 ]  - [   0.0009660500000000, -0.0002566200000000,  0.0007764100000000 ]  - [   0.0009662500000000, -0.0004253700000000, -0.0003672600000000 ]  - [   0.0019792500000000, -0.0028222000000000,  0.0038879000000000 ]  - [  -0.0042182200000000,  0.0015578800000000,  0.0017329700000000 ]  - [   0.0047023600000000,  0.0001630600000000, -0.0019777300000000 ]  - [  -0.0000801200000000, -0.0051860400000000, -0.0038041000000000 ]  - [   0.0009938300000000,  0.0032908200000000,  0.0034376900000000 ]  - [  -0.0005156100000000,  0.0009475900000000, -0.0037494900000000 ]  - [   0.0035645000000000,  0.0010130500000000, -0.0019986500000000 ]  - [   0.0070454400000000,  0.0003979400000000, -0.0026888800000000 ]  - [  -0.0035574700000000, -0.0011006900000000,  0.0040244300000000 ]  - [   0.0029462000000000,  0.0006671100000000,  0.0024616300000000 ]  - [   0.0172991500000000, -0.0052713100000000, -0.0102725900000000 ]  - [   0.0019731300000000,  0.0014139100000000,  0.0035138800000000 ]  - [   0.0012818200000000,  0.0010378200000000,  0.0002620500000000 ]  - [   0.0060614200000000, -0.0254392400000000,  0.0038379800000000 ]  - [   0.0022842700000000, -0.0002079000000000,  0.0006441200000000 ]  - [  -0.0035101900000000,  0.0030714400000000, -0.0045127500000000 ]  - [   0.0006545200000000,  0.0000811000000000,  0.0007970800000000 ]  - [  -0.0017651600000000, -0.0034740800000000, -0.0032354000000000 ]  - [   0.0017657300000000,  0.0001455900000000,  0.0007118700000000 ]  - [   0.0269532600000000, -0.0114550700000000, -0.0171706700000000 ]  - [   0.0050653000000000, -0.0014468900000000,  0.0008051500000000 ]  - [  -0.0018214700000000,  0.0159290600000000, -0.0141144800000000 ]  - [   0.0011759900000000, -0.0025065300000000,  0.0016675500000000 ]  - [   0.0027512200000000, -0.0015338800000000, -0.0015862100000000 ]  - [   0.0027818400000000, -0.0024499200000000, -0.0015496700000000 ]  - [   0.0034771700000000, -0.0002466800000000,  0.0022201400000000 ]  - [   0.0156613900000000,  0.0079066900000000,  0.0132378700000000 ]  - [  -0.0085882500000000,  0.0011642000000000, -0.0116088100000000 ]  - [   0.0032317500000000, -0.0016835300000000,  0.0028166000000000 ]  - [  -0.0003956600000000,  0.0022111100000000, -0.0010793100000000 ]  - [   0.0023314500000000,  0.0007374400000000, -0.0000790500000000 ]  - [  -0.0034635800000000,  0.0001955500000000, -0.0021786100000000 ]  - [   0.0010549900000000,  0.0022529300000000,  0.0012863100000000 ]  - [   0.0004170300000000,  0.0000618600000000, -0.0008648100000000 ]  - [   0.0004187200000000,  0.0002524700000000, -0.0011171500000000 ]  - [  -0.0016116900000000, -0.0009216200000000, -0.0000500200000000 ]  - [   0.0016097700000000,  0.0001297200000000,  0.0006797000000000 ]  - [  -0.0068747100000000,  0.0023907700000000,  0.0043505300000000 ]  - [   0.0021731600000000, -0.0003774300000000,  0.0002842000000000 ]  - [  -0.0028836400000000, -0.0064925100000000, -0.0151440600000000 ]  - [   0.0031722300000000,  0.0019574600000000,  0.0031007300000000 ]  - [   0.0020171200000000,  0.0005101800000000,  0.0003274800000000 ]  - [   0.0106815800000000, -0.0171579000000000,  0.0086639200000000 ]  - [  -0.0001561100000000,  0.0004841700000000,  0.0003092600000000 ]  - [  -0.0021035000000000,  0.0022705200000000, -0.0060898200000000 ]  - [   0.0015003000000000, -0.0004537400000000,  0.0004193400000000 ]  - [  -0.0005808900000000, -0.0020573600000000, -0.0034042100000000 ]  - [  -0.0051473400000000, -0.0022226000000000,  0.0017009000000000 ]  - [   0.0025951400000000, -0.0008734900000000, -0.0004964300000000 ]- atom:   27  displacement:    [  -0.0099999969910042,  0.0000000000000000, -0.0000077575709300 ]  forces:  - [  -0.0421872200000000, -0.0019933300000000,  0.0078188100000000 ]  - [   0.0079220400000000,  0.0017741900000000,  0.0039379700000000 ]  - [  -0.0028807700000000, -0.0025695100000000, -0.0071550500000000 ]  - [   0.0030553600000000,  0.0001931100000000,  0.0037965100000000 ]  - [  -0.0002150300000000, -0.0112381500000000,  0.0138464600000000 ]  - [   0.0059013000000000, -0.0010403900000000,  0.0013812800000000 ]  - [  -0.0082045800000000,  0.0063745600000000, -0.0112536200000000 ]  - [   0.0073441100000000,  0.0000009100000000,  0.0008420500000000 ]  - [   0.0003337200000000, -0.0000506500000000,  0.0053838800000000 ]  - [   0.0059575600000000, -0.0071462900000000, -0.0103098100000000 ]  - [   0.0172721300000000, -0.0102623400000000, -0.0034461200000000 ]  - [   0.0060253500000000, -0.0020049100000000,  0.0148134700000000 ]  - [  -0.0109344600000000,  0.0011848100000000, -0.0102408900000000 ]  - [   0.0051537400000000,  0.0003501900000000,  0.0006220800000000 ]  - [  -0.0628726500000000,  0.0443102300000000,  0.0505449400000000 ]  - [   0.0067958400000000, -0.0003752500000000,  0.0003693100000000 ]  - [  -0.0085611700000000,  0.0120382600000000, -0.0038732200000000 ]  - [   0.0044937700000000, -0.0012565800000000,  0.0009019500000000 ]  - [  -0.0085908000000000,  0.0000387200000000, -0.0032822400000000 ]  - [   0.0046902000000000,  0.0007000100000000,  0.0011658100000000 ]  - [   0.0022950100000000, -0.0001937200000000,  0.0018106400000000 ]  - [  -0.0000461200000000, -0.0004347400000000, -0.0028389700000000 ]  - [   0.0034235400000000, -0.0001754900000000, -0.0016919600000000 ]  - [  -0.0010129900000000, -0.0121195100000000,  0.0069500300000000 ]  - [  -0.0008079500000000,  0.0011649900000000, -0.0020317300000000 ]  - [  -0.0023106300000000,  0.0021963700000000, -0.0000585300000000 ]  - [   0.1647697100000000, -0.0691040400000000, -0.1054037000000000 ]  - [  -0.0033686800000000,  0.0001480800000000, -0.0001985900000000 ]  - [   0.0014939800000000, -0.0006511400000000,  0.0009839300000000 ]  - [  -0.0026796400000000, -0.0015402400000000, -0.0024894700000000 ]  - [   0.0007251300000000, -0.0013718500000000,  0.0020848900000000 ]  - [  -0.0002840200000000,  0.0010568300000000, -0.0022223900000000 ]  - [   0.0042841300000000,  0.0002471200000000, -0.0017684600000000 ]  - [  -0.0047659400000000,  0.0016853000000000,  0.0020104600000000 ]  - [  -0.0009610400000000,  0.0066751200000000,  0.0041131000000000 ]  - [  -0.0020412800000000, -0.0018358700000000, -0.0031907700000000 ]  - [   0.0013826400000000, -0.0003033100000000,  0.0018059600000000 ]  - [  -0.0026431800000000, -0.0003051700000000, -0.0000465600000000 ]  - [  -0.0079595300000000, -0.0010871100000000,  0.0047065000000000 ]  - [   0.0027292900000000,  0.0004409200000000, -0.0020597200000000 ]  - [  -0.0038939300000000,  0.0000434200000000, -0.0004132600000000 ]  - [  -0.0185338700000000,  0.0060000800000000,  0.0124416000000000 ]  - [  -0.0002864000000000,  0.0003670200000000, -0.0018293800000000 ]  - [   0.0004305600000000,  0.0007643100000000,  0.0014706000000000 ]  - [  -0.0051853100000000,  0.0270490600000000, -0.0042377500000000 ]  - [  -0.0012764700000000,  0.0017510200000000, -0.0009668900000000 ]  - [   0.0018236100000000, -0.0012958300000000,  0.0028256900000000 ]  - [  -0.0023561000000000,  0.0017127300000000, -0.0025004600000000 ]  - [   0.0028258000000000,  0.0020319700000000,  0.0029886100000000 ]  - [  -0.0007488300000000, -0.0016886500000000, -0.0010339700000000 ]  - [  -0.0267223100000000,  0.0096100900000000,  0.0169107200000000 ]  - [  -0.0051428400000000, -0.0003801800000000, -0.0008096000000000 ]  - [   0.0008931300000000, -0.0176628000000000,  0.0145703300000000 ]  - [  -0.0022254800000000,  0.0010366600000000, -0.0013850000000000 ]  - [  -0.0018859400000000,  0.0008745200000000, -0.0004244200000000 ]  - [  -0.0018927400000000,  0.0017921500000000, -0.0004646200000000 ]  - [  -0.0051922800000000, -0.0015606300000000, -0.0039420400000000 ]  - [  -0.0176509700000000, -0.0099547000000000, -0.0152626100000000 ]  - [   0.0103361300000000, -0.0029904600000000,  0.0137347300000000 ]  - [  -0.0015249700000000, -0.0001076500000000, -0.0010845600000000 ]  - [   0.0003990700000000, -0.0003905400000000,  0.0010907800000000 ]  - [  -0.0023748200000000,  0.0010821400000000,  0.0000836800000000 ]  - [   0.0024555800000000,  0.0012566600000000,  0.0025400800000000 ]  - [  -0.0020977000000000, -0.0007669700000000, -0.0009945700000000 ]  - [   0.0004994400000000,  0.0006383600000000, -0.0011760800000000 ]  - [   0.0005091900000000,  0.0004455900000000, -0.0009094000000000 ]  - [   0.0006821900000000,  0.0002337500000000,  0.0020970900000000 ]  - [  -0.0025284200000000, -0.0008181200000000,  0.0013421700000000 ]  - [   0.0060242500000000, -0.0017171300000000, -0.0023654500000000 ]  - [  -0.0030913900000000,  0.0010591500000000,  0.0017309600000000 ]  - [   0.0046410200000000,  0.0084258700000000,  0.0171421700000000 ]  - [  -0.0014644900000000, -0.0001659800000000, -0.0013669000000000 ]  - [  -0.0010020000000000,  0.0010131900000000, -0.0006384400000000 ]  - [  -0.0098000900000000,  0.0189840200000000, -0.0091428000000000 ]  - [  -0.0015707300000000,  0.0013199600000000, -0.0020628600000000 ]  - [   0.0004335200000000, -0.0005130500000000,  0.0044938900000000 ]  - [  -0.0004828300000000, -0.0010722500000000, -0.0007407800000000 ]  - [   0.0016523200000000,  0.0005971400000000,  0.0031856100000000 ]  - [   0.0052249600000000,  0.0004231300000000, -0.0017290100000000 ]  - [  -0.0026207800000000, -0.0009471800000000,  0.0005039100000000 ]- atom:   27  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0103102700000000,  0.0083052800000000, -0.0061984100000000 ]  - [   0.0008442900000000,  0.0002019900000000,  0.0010725800000000 ]  - [  -0.0006458900000000, -0.0013584100000000, -0.0013868700000000 ]  - [   0.0004895700000000, -0.0011834700000000,  0.0009002500000000 ]  - [   0.0019062100000000, -0.0149906300000000,  0.0100259600000000 ]  - [   0.0020376900000000, -0.0009272800000000,  0.0001644600000000 ]  - [  -0.0017613800000000,  0.0080247900000000, -0.0041243100000000 ]  - [   0.0011012600000000,  0.0003005500000000,  0.0001027300000000 ]  - [  -0.0015536300000000, -0.0013502200000000, -0.0002395400000000 ]  - [   0.0015024800000000, -0.0018217500000000, -0.0032366700000000 ]  - [   0.0028159800000000, -0.0005401600000000, -0.0006523100000000 ]  - [  -0.0000913000000000,  0.0004632100000000, -0.0006742100000000 ]  - [  -0.0028655300000000,  0.0004511900000000, -0.0054432000000000 ]  - [   0.0010070500000000,  0.0000860200000000, -0.0001285300000000 ]  - [  -0.0649059600000000,  0.1089946500000000,  0.0979350400000000 ]  - [   0.0002763500000000, -0.0006569000000000,  0.0003219400000000 ]  - [  -0.0013346200000000,  0.0003022600000000,  0.0015219100000000 ]  - [   0.0013637400000000,  0.0001379900000000,  0.0001887700000000 ]  - [  -0.0026672300000000, -0.0045045000000000,  0.0011813900000000 ]  - [   0.0014249500000000, -0.0001967400000000,  0.0004423600000000 ]  - [   0.0008675400000000,  0.0003179900000000,  0.0009739700000000 ]  - [  -0.0011554000000000, -0.0004589400000000, -0.0009808000000000 ]  - [   0.0010476800000000, -0.0015220500000000, -0.0014107700000000 ]  - [   0.0003318400000000, -0.0075937500000000,  0.0034947600000000 ]  - [  -0.0007342800000000,  0.0021528500000000, -0.0012098000000000 ]  - [  -0.0009963200000000,  0.0002044100000000,  0.0002216800000000 ]  - [   0.0685241300000000, -0.1378788000000000, -0.1066112800000000 ]  - [  -0.0000224300000000, -0.0002837800000000, -0.0010613700000000 ]  - [   0.0021823800000000,  0.0066928100000000,  0.0000151400000000 ]  - [  -0.0013951800000000, -0.0009944300000000, -0.0013009800000000 ]  - [   0.0008465700000000, -0.0007957700000000,  0.0012153800000000 ]  - [   0.0000888400000000,  0.0003720900000000, -0.0010427100000000 ]  - [   0.0015196100000000,  0.0008800300000000,  0.0007442900000000 ]  - [  -0.0013691500000000,  0.0011020200000000,  0.0006911500000000 ]  - [  -0.0008033600000000,  0.0009717200000000,  0.0008105700000000 ]  - [  -0.0004212000000000,  0.0011566900000000,  0.0003683400000000 ]  - [  -0.0001921900000000, -0.0005987900000000,  0.0004390700000000 ]  - [  -0.0002142000000000,  0.0001839900000000, -0.0007192800000000 ]  - [  -0.0011936400000000, -0.0004702600000000,  0.0014079900000000 ]  - [   0.0003158200000000, -0.0008665000000000,  0.0009533200000000 ]  - [  -0.0001700900000000,  0.0003082500000000,  0.0010058100000000 ]  - [  -0.0060830000000000,  0.0031393400000000,  0.0051957900000000 ]  - [   0.0000868900000000,  0.0007859000000000, -0.0006917900000000 ]  - [   0.0009826900000000,  0.0011482600000000,  0.0013002000000000 ]  - [  -0.0110013000000000,  0.0234371900000000, -0.0027866200000000 ]  - [   0.0001671100000000,  0.0013225600000000, -0.0005277500000000 ]  - [  -0.0006455300000000,  0.0008279300000000, -0.0007261000000000 ]  - [  -0.0012090400000000,  0.0010959800000000, -0.0012418300000000 ]  - [   0.0012486000000000,  0.0005976800000000,  0.0011353900000000 ]  - [   0.0002666900000000, -0.0007198300000000, -0.0002369500000000 ]  - [  -0.0017860600000000, -0.0036445300000000,  0.0003484700000000 ]  - [   0.0005537600000000, -0.0012883200000000,  0.0000563200000000 ]  - [   0.0050156300000000, -0.0027486300000000, -0.0040279900000000 ]  - [  -0.0008361700000000, -0.0005437800000000, -0.0000757900000000 ]  - [  -0.0016523200000000,  0.0013211100000000, -0.0003691800000000 ]  - [  -0.0007633000000000,  0.0013279400000000, -0.0004678100000000 ]  - [  -0.0013664900000000, -0.0012315800000000, -0.0012263100000000 ]  - [   0.0052900300000000, -0.0020579000000000,  0.0005382200000000 ]  - [   0.0035061700000000, -0.0052180400000000,  0.0118613800000000 ]  - [   0.0005870300000000, -0.0007644300000000,  0.0006081100000000 ]  - [   0.0006325500000000,  0.0010718400000000,  0.0000281600000000 ]  - [  -0.0008580300000000,  0.0008987400000000, -0.0000084700000000 ]  - [  -0.0008130400000000,  0.0006656100000000, -0.0033602900000000 ]  - [  -0.0007936000000000,  0.0005509900000000, -0.0000009900000000 ]  - [   0.0005454000000000,  0.0005666000000000, -0.0013692800000000 ]  - [   0.0007349600000000,  0.0005537700000000, -0.0010484000000000 ]  - [   0.0001095800000000,  0.0004882700000000,  0.0010111200000000 ]  - [  -0.0009513900000000, -0.0003456800000000,  0.0010523000000000 ]  - [   0.0015805500000000,  0.0007517500000000, -0.0006258000000000 ]  - [  -0.0011777500000000,  0.0005436700000000,  0.0012294700000000 ]  - [  -0.0003545000000000,  0.0037341600000000,  0.0091413000000000 ]  - [   0.0004129700000000,  0.0007412000000000,  0.0004073100000000 ]  - [   0.0000992200000000,  0.0014735800000000, -0.0003842300000000 ]  - [  -0.0087070000000000,  0.0099137800000000, -0.0045045500000000 ]  - [  -0.0008492100000000,  0.0010899600000000, -0.0009933600000000 ]  - [  -0.0004715500000000,  0.0001812400000000,  0.0011002500000000 ]  - [   0.0001945900000000, -0.0011840900000000, -0.0005112400000000 ]  - [   0.0012659300000000, -0.0005951600000000,  0.0008616500000000 ]  - [   0.0015179400000000,  0.0002828300000000, -0.0006726400000000 ]  - [  -0.0007903000000000, -0.0007875700000000,  0.0002040700000000 ]- atom:   27  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0101873400000000, -0.0083538200000000,  0.0061667200000000 ]  - [  -0.0008632100000000, -0.0001907300000000, -0.0010862500000000 ]  - [   0.0006601700000000,  0.0013498200000000,  0.0014063500000000 ]  - [  -0.0004895200000000,  0.0011753200000000, -0.0009106500000000 ]  - [  -0.0019284100000000,  0.0151445500000000, -0.0101750700000000 ]  - [  -0.0020500200000000,  0.0009367400000000, -0.0001694300000000 ]  - [   0.0017908400000000, -0.0080677100000000,  0.0041687000000000 ]  - [  -0.0011102300000000, -0.0003058700000000, -0.0001151100000000 ]  - [   0.0020294700000000,  0.0018036800000000,  0.0004973900000000 ]  - [  -0.0010680700000000,  0.0022770000000000,  0.0035638200000000 ]  - [  -0.0023614300000000,  0.0001180500000000,  0.0009309200000000 ]  - [   0.0005317900000000, -0.0008893200000000,  0.0008831700000000 ]  - [   0.0024231000000000, -0.0000121100000000,  0.0052129100000000 ]  - [  -0.0014952800000000,  0.0003452900000000, -0.0001391300000000 ]  - [   0.0671415500000000, -0.1114263300000000, -0.1023109500000000 ]  - [  -0.0007675600000000,  0.0002320700000000, -0.0005975700000000 ]  - [   0.0018676300000000,  0.0000318000000000, -0.0012452600000000 ]  - [  -0.0009005100000000,  0.0002853800000000,  0.0000880200000000 ]  - [   0.0031762100000000,  0.0041044600000000, -0.0008817400000000 ]  - [  -0.0009738700000000, -0.0002140900000000, -0.0001679200000000 ]  - [  -0.0013636100000000,  0.0001039400000000, -0.0012669200000000 ]  - [   0.0006816300000000,  0.0008709900000000,  0.0007227800000000 ]  - [  -0.0015354300000000,  0.0011231500000000,  0.0011597400000000 ]  - [  -0.0008080100000000,  0.0071870400000000, -0.0037865400000000 ]  - [  -0.0002680400000000, -0.0037464800000000,  0.0015655200000000 ]  - [  -0.0000063000000000, -0.0017800200000000,  0.0001159900000000 ]  - [  -0.0707961700000000,  0.1393827600000000,  0.1090917300000000 ]  - [   0.0009756600000000, -0.0004264100000000, -0.0009883000000000 ]  - [  -0.0038827900000000, -0.0084569800000000, -0.0017850200000000 ]  - [  -0.0003155700000000, -0.0008133300000000, -0.0004353200000000 ]  - [   0.0008412500000000, -0.0009980900000000,  0.0004647100000000 ]  - [   0.0016100500000000, -0.0021661600000000,  0.0027530100000000 ]  - [  -0.0014804900000000,  0.0009015800000000, -0.0007607100000000 ]  - [   0.0014441300000000,  0.0006799400000000, -0.0007206200000000 ]  - [  -0.0002173100000000,  0.0005371300000000, -0.0005120600000000 ]  - [  -0.0006030100000000,  0.0003472600000000, -0.0000656500000000 ]  - [   0.0010923200000000,  0.0012794200000000, -0.0024549800000000 ]  - [   0.0011190700000000,  0.0004941200000000, -0.0012867900000000 ]  - [   0.0002841200000000, -0.0002228900000000,  0.0006129200000000 ]  - [  -0.0012323100000000,  0.0001799200000000,  0.0010724000000000 ]  - [  -0.0007781300000000,  0.0004022400000000,  0.0010522600000000 ]  - [   0.0052130700000000, -0.0023979700000000, -0.0031683700000000 ]  - [   0.0016326600000000,  0.0010260100000000,  0.0024473700000000 ]  - [   0.0007058200000000,  0.0006608200000000,  0.0003909100000000 ]  - [   0.0123551600000000, -0.0224759100000000,  0.0024470800000000 ]  - [   0.0008523300000000,  0.0002138000000000,  0.0002072900000000 ]  - [  -0.0010606500000000,  0.0009816200000000, -0.0009920500000000 ]  - [  -0.0004851900000000,  0.0006967500000000, -0.0004596800000000 ]  - [  -0.0002257800000000, -0.0020902100000000, -0.0014349800000000 ]  - [   0.0007693000000000, -0.0007540200000000, -0.0000452800000000 ]  - [   0.0018592100000000,  0.0019143000000000, -0.0003824900000000 ]  - [  -0.0005807300000000, -0.0004958000000000, -0.0000369200000000 ]  - [  -0.0060657000000000,  0.0013640300000000,  0.0042850400000000 ]  - [  -0.0001874600000000, -0.0009565400000000,  0.0003722900000000 ]  - [   0.0025821500000000, -0.0020174700000000, -0.0016472500000000 ]  - [   0.0016818500000000, -0.0020151400000000, -0.0015511000000000 ]  - [  -0.0003231300000000, -0.0005681500000000, -0.0004850200000000 ]  - [  -0.0069514000000000,  0.0003133900000000, -0.0021983200000000 ]  - [  -0.0018338400000000,  0.0034527900000000, -0.0103336600000000 ]  - [   0.0011347700000000, -0.0010429500000000,  0.0011431300000000 ]  - [  -0.0006182500000000,  0.0007002600000000, -0.0000346800000000 ]  - [   0.0008460700000000,  0.0008728900000000,  0.0000181400000000 ]  - [  -0.0002129600000000,  0.0008654400000000,  0.0036572000000000 ]  - [  -0.0002175800000000,  0.0009945000000000,  0.0003305700000000 ]  - [   0.0003868500000000,  0.0001336000000000, -0.0006659400000000 ]  - [   0.0001680500000000,  0.0001263800000000, -0.0009634600000000 ]  - [  -0.0010564800000000, -0.0011994800000000,  0.0010300300000000 ]  - [   0.0000193100000000, -0.0003622300000000,  0.0009954300000000 ]  - [  -0.0025334300000000, -0.0000479100000000,  0.0026755100000000 ]  - [   0.0002686300000000,  0.0001372000000000,  0.0007844600000000 ]  - [   0.0020084300000000, -0.0019303100000000, -0.0074695900000000 ]  - [   0.0012763500000000,  0.0010559300000000,  0.0012824300000000 ]  - [   0.0009423600000000, -0.0000074100000000,  0.0001012500000000 ]  - [   0.0096682400000000, -0.0084141800000000,  0.0042098800000000 ]  - [  -0.0008746000000000,  0.0007117600000000, -0.0007607800000000 ]  - [  -0.0012607500000000,  0.0016318300000000, -0.0028910700000000 ]  - [   0.0008273000000000, -0.0003398000000000,  0.0002033300000000 ]  - [  -0.0002374600000000, -0.0008897100000000, -0.0011665900000000 ]  - [  -0.0015072900000000, -0.0020759200000000,  0.0006634500000000 ]  - [   0.0008484200000000, -0.0009954800000000, -0.0002246200000000 ]- atom:   27  displacement:    [  -0.0024096060369692,  0.0000000000000000,  0.0097053489760339 ]  forces:  - [  -0.0105481600000000, -0.0023136700000000,  0.0107090900000000 ]  - [   0.0027140700000000,  0.0017134400000000,  0.0036098700000000 ]  - [  -0.0008453900000000, -0.0018945000000000, -0.0067458600000000 ]  - [   0.0008031200000000, -0.0006343800000000,  0.0013341000000000 ]  - [  -0.0011813300000000, -0.0071582300000000,  0.0109191500000000 ]  - [   0.0032469500000000, -0.0010455200000000,  0.0012470300000000 ]  - [  -0.0080116200000000,  0.0133221700000000, -0.0197864800000000 ]  - [   0.0042612100000000,  0.0004813000000000, -0.0009712700000000 ]  - [  -0.0034486700000000, -0.0018121600000000,  0.0008800400000000 ]  - [   0.0038475600000000, -0.0061300300000000, -0.0096982000000000 ]  - [   0.0133888600000000, -0.0081499000000000, -0.0026894900000000 ]  - [  -0.0000272400000000, -0.0014430500000000,  0.0070903300000000 ]  - [  -0.0046900200000000,  0.0003146000000000, -0.0128031600000000 ]  - [   0.0025194000000000, -0.0000351800000000, -0.0002007300000000 ]  - [  -0.0808322500000000,  0.0971316400000000,  0.1347990900000000 ]  - [   0.0027447500000000, -0.0004901400000000,  0.0005221100000000 ]  - [  -0.0060366100000000,  0.0145472100000000, -0.0062988400000000 ]  - [   0.0020765900000000, -0.0005681800000000,  0.0003314100000000 ]  - [  -0.0031200900000000,  0.0030755700000000,  0.0007971600000000 ]  - [   0.0023964000000000,  0.0001430000000000,  0.0008080100000000 ]  - [   0.0004006100000000,  0.0001157000000000,  0.0000283700000000 ]  - [   0.0010952000000000, -0.0028153000000000, -0.0045098700000000 ]  - [   0.0016779100000000, -0.0002655200000000, -0.0006457500000000 ]  - [  -0.0007737600000000, -0.0079913600000000,  0.0049027500000000 ]  - [  -0.0003272000000000,  0.0014141300000000, -0.0013937900000000 ]  - [  -0.0016608900000000,  0.0014115900000000,  0.0002896700000000 ]  - [   0.1397658300000000, -0.1184092600000000, -0.1912381200000000 ]  - [  -0.0012514100000000, -0.0002668600000000, -0.0009176200000000 ]  - [  -0.0002567900000000, -0.0016323800000000, -0.0018055900000000 ]  - [  -0.0018301200000000, -0.0012297600000000, -0.0018266400000000 ]  - [   0.0007394000000000, -0.0012691800000000,  0.0017114500000000 ]  - [   0.0002364200000000,  0.0003771600000000, -0.0011625400000000 ]  - [   0.0031224500000000,  0.0016490200000000,  0.0022650200000000 ]  - [  -0.0032145000000000,  0.0016038500000000,  0.0018429900000000 ]  - [  -0.0009856200000000,  0.0052496600000000,  0.0031701100000000 ]  - [  -0.0007775000000000,  0.0003540600000000, -0.0010285400000000 ]  - [  -0.0020014100000000, -0.0011877100000000,  0.0035005100000000 ]  - [  -0.0012281400000000, -0.0000750600000000, -0.0002184600000000 ]  - [  -0.0058559500000000, -0.0009291800000000,  0.0038875200000000 ]  - [   0.0032284200000000, -0.0001167500000000, -0.0005925500000000 ]  - [   0.0000967600000000,  0.0002391000000000,  0.0001981200000000 ]  - [  -0.0158511600000000,  0.0057771900000000,  0.0122259000000000 ]  - [   0.0006139300000000,  0.0002503900000000, -0.0005165900000000 ]  - [   0.0005799900000000,  0.0011222600000000,  0.0017210700000000 ]  - [  -0.0036898600000000,  0.0168457400000000, -0.0094360300000000 ]  - [  -0.0003423700000000,  0.0015209200000000, -0.0007867200000000 ]  - [   0.0012744200000000, -0.0013842100000000,  0.0032046500000000 ]  - [  -0.0014405100000000,  0.0012585200000000, -0.0014695700000000 ]  - [   0.0017556700000000,  0.0016828400000000,  0.0029698800000000 ]  - [   0.0000140900000000, -0.0008734600000000, -0.0003226900000000 ]  - [  -0.0222523000000000,  0.0069575800000000,  0.0100693600000000 ]  - [  -0.0015289700000000, -0.0008950900000000, -0.0006189300000000 ]  - [  -0.0062607700000000, -0.0211770900000000,  0.0179372400000000 ]  - [  -0.0012388700000000, -0.0000178300000000, -0.0006417000000000 ]  - [  -0.0006208700000000,  0.0004667200000000, -0.0010453500000000 ]  - [  -0.0006630400000000,  0.0007614700000000, -0.0010767900000000 ]  - [  -0.0040995700000000, -0.0014310400000000, -0.0035781200000000 ]  - [  -0.0016817000000000, -0.0035576400000000, -0.0101160500000000 ]  - [   0.0068769700000000, -0.0001856300000000,  0.0272768500000000 ]  - [  -0.0002447000000000, -0.0005799100000000,  0.0000600900000000 ]  - [  -0.0017533300000000, -0.0008157000000000,  0.0020417500000000 ]  - [  -0.0008462100000000,  0.0010176700000000,  0.0000780900000000 ]  - [   0.0010735900000000, -0.0025910400000000,  0.0036708400000000 ]  - [  -0.0012737900000000,  0.0000498700000000, -0.0003042700000000 ]  - [   0.0003683300000000,  0.0004690600000000, -0.0006761900000000 ]  - [   0.0006252900000000,  0.0007183300000000, -0.0006077500000000 ]  - [  -0.0012278800000000, -0.0001961500000000,  0.0019392000000000 ]  - [  -0.0013100700000000, -0.0005005900000000,  0.0011255300000000 ]  - [   0.0043408100000000, -0.0017282800000000, -0.0014730400000000 ]  - [  -0.0018253700000000,  0.0007607800000000,  0.0014038300000000 ]  - [   0.0000929700000000,  0.0085197900000000,  0.0164605000000000 ]  - [  -0.0001502600000000,  0.0003983200000000, -0.0002373400000000 ]  - [  -0.0002725300000000,  0.0009779500000000, -0.0006796300000000 ]  - [  -0.0035938700000000,  0.0110135300000000, -0.0083995000000000 ]  - [  -0.0004904100000000,  0.0008914800000000, -0.0005008800000000 ]  - [   0.0009551000000000, -0.0013975300000000,  0.0056618200000000 ]  - [   0.0001657700000000, -0.0007198100000000, -0.0000492800000000 ]  - [   0.0023630700000000,  0.0023088600000000,  0.0058855500000000 ]  - [   0.0033973200000000, -0.0000910700000000, -0.0017127900000000 ]  - [  -0.0012961000000000, -0.0009071400000000,  0.0002066500000000 ]- atom:   27  displacement:    [   0.0024096060369692,  0.0000000000000000, -0.0097053489760339 ]  forces:  - [   0.0091359900000000,  0.0024601100000000, -0.0105311500000000 ]  - [  -0.0027027500000000, -0.0017271700000000, -0.0036261700000000 ]  - [   0.0008452300000000,  0.0019097300000000,  0.0067381400000000 ]  - [  -0.0007922100000000,  0.0006303300000000, -0.0013359400000000 ]  - [   0.0011895300000000,  0.0071067000000000, -0.0108359000000000 ]  - [  -0.0032429100000000,  0.0010387200000000, -0.0012247200000000 ]  - [   0.0080389200000000, -0.0133969400000000,  0.0198266100000000 ]  - [  -0.0042732800000000, -0.0004797200000000,  0.0009797600000000 ]  - [   0.0039556400000000,  0.0022529500000000, -0.0005722900000000 ]  - [  -0.0033524700000000,  0.0065568500000000,  0.0099765300000000 ]  - [  -0.0129574500000000,  0.0077749000000000,  0.0029686600000000 ]  - [   0.0004946100000000,  0.0010163900000000, -0.0069073700000000 ]  - [   0.0041675200000000,  0.0001296000000000,  0.0125584400000000 ]  - [  -0.0029909500000000,  0.0004694100000000, -0.0000663200000000 ]  - [   0.0847941900000000, -0.1041647800000000, -0.1405541300000000 ]  - [  -0.0032401400000000,  0.0000553200000000, -0.0007896700000000 ]  - [   0.0064428300000000, -0.0140235100000000,  0.0065839600000000 ]  - [  -0.0015799400000000,  0.0010006600000000, -0.0000562100000000 ]  - [   0.0035786300000000, -0.0035279800000000, -0.0005913600000000 ]  - [  -0.0019107900000000, -0.0005827600000000, -0.0005366100000000 ]  - [  -0.0008799300000000,  0.0003259100000000, -0.0002756000000000 ]  - [  -0.0015466700000000,  0.0032631300000000,  0.0042381000000000 ]  - [  -0.0021470500000000, -0.0001880800000000,  0.0003536300000000 ]  - [   0.0003023700000000,  0.0075479900000000, -0.0051877600000000 ]  - [  -0.0007111800000000, -0.0029098400000000,  0.0016907200000000 ]  - [   0.0006349100000000, -0.0029448100000000,  0.0000306100000000 ]  - [  -0.1421502700000000,  0.1245675700000000,  0.1946008000000000 ]  - [   0.0021962000000000, -0.0004467400000000, -0.0011373300000000 ]  - [  -0.0014652000000000, -0.0001804400000000,  0.0000696300000000 ]  - [   0.0001029200000000, -0.0005756900000000,  0.0000670400000000 ]  - [   0.0009698000000000, -0.0005461900000000,  0.0000310900000000 ]  - [   0.0014780000000000, -0.0021820000000000,  0.0029073900000000 ]  - [  -0.0031451900000000,  0.0001922800000000, -0.0022431100000000 ]  - [   0.0031992300000000,  0.0002543300000000, -0.0018396500000000 ]  - [  -0.0000282600000000, -0.0037247000000000, -0.0028429900000000 ]  - [  -0.0002505600000000,  0.0011668700000000,  0.0013547000000000 ]  - [   0.0029555800000000,  0.0019087800000000, -0.0055600500000000 ]  - [   0.0021648500000000,  0.0007815100000000, -0.0018253900000000 ]  - [   0.0049573200000000,  0.0002241800000000, -0.0018672000000000 ]  - [  -0.0041625900000000, -0.0005726700000000,  0.0026289600000000 ]  - [  -0.0010350100000000,  0.0004354400000000,  0.0018067200000000 ]  - [   0.0148518200000000, -0.0050451200000000, -0.0100996600000000 ]  - [   0.0010768000000000,  0.0015568100000000,  0.0022135900000000 ]  - [   0.0011257700000000,  0.0006792100000000,  0.0000084400000000 ]  - [   0.0046804300000000, -0.0153154500000000,  0.0091671800000000 ]  - [   0.0013568500000000,  0.0000381600000000,  0.0004528100000000 ]  - [  -0.0029789400000000,  0.0031829100000000, -0.0049409600000000 ]  - [  -0.0002988800000000,  0.0005449700000000, -0.0003090500000000 ]  - [  -0.0007355900000000, -0.0032471200000000, -0.0033077800000000 ]  - [   0.0010007600000000, -0.0006655300000000, -0.0000023300000000 ]  - [   0.0226834200000000, -0.0088824000000000, -0.0102675600000000 ]  - [   0.0015205500000000, -0.0009516600000000,  0.0006357000000000 ]  - [   0.0051643200000000,  0.0193387700000000, -0.0173990700000000 ]  - [   0.0002279400000000, -0.0015601200000000,  0.0009860600000000 ]  - [   0.0015297600000000, -0.0011492000000000, -0.0009775200000000 ]  - [   0.0016007500000000, -0.0014711900000000, -0.0009635200000000 ]  - [   0.0024101200000000, -0.0003792000000000,  0.0018552200000000 ]  - [   0.0001334500000000,  0.0017875200000000,  0.0084404100000000 ]  - [  -0.0052609300000000, -0.0018146700000000, -0.0259871900000000 ]  - [   0.0019738000000000, -0.0012255500000000,  0.0017068800000000 ]  - [   0.0017357900000000,  0.0026360000000000, -0.0020301300000000 ]  - [   0.0008874500000000,  0.0008365600000000, -0.0000964400000000 ]  - [  -0.0020909600000000,  0.0041951800000000, -0.0033496800000000 ]  - [   0.0002618000000000,  0.0015154000000000,  0.0006435400000000 ]  - [   0.0005598500000000,  0.0002166200000000, -0.0013485700000000 ]  - [   0.0002947700000000, -0.0000183700000000, -0.0014230700000000 ]  - [   0.0002843300000000, -0.0005099300000000,  0.0001241900000000 ]  - [   0.0003632100000000, -0.0002184900000000,  0.0009313500000000 ]  - [  -0.0052435900000000,  0.0024236200000000,  0.0034873600000000 ]  - [   0.0008707600000000, -0.0000348600000000,  0.0006593800000000 ]  - [   0.0016046800000000, -0.0066100500000000, -0.0145616800000000 ]  - [   0.0018605500000000,  0.0014095900000000,  0.0019800700000000 ]  - [   0.0012951800000000,  0.0005560900000000,  0.0003616600000000 ]  - [   0.0046617500000000, -0.0094816100000000,  0.0080330300000000 ]  - [  -0.0012098100000000,  0.0009251100000000, -0.0012173800000000 ]  - [  -0.0026785700000000,  0.0032132700000000, -0.0074158700000000 ]  - [   0.0008612200000000, -0.0008011300000000, -0.0002728400000000 ]  - [  -0.0013539700000000, -0.0038656500000000, -0.0062259400000000 ]  - [  -0.0033890900000000, -0.0017562500000000,  0.0017185500000000 ]  - [   0.0013229900000000, -0.0009479100000000, -0.0002137200000000 ]- atom:   29  displacement:    [   0.0099999969910042,  0.0000000000000000,  0.0000077575709300 ]  forces:  - [   0.0020532200000000, -0.0030476600000000,  0.0039348300000000 ]  - [  -0.0036510400000000,  0.0012616100000000, -0.0018588400000000 ]  - [   0.0091109300000000, -0.0024669200000000,  0.0032128800000000 ]  - [  -0.0043920000000000,  0.0017437400000000, -0.0041769300000000 ]  - [   0.0141153300000000,  0.0030702600000000,  0.0022617100000000 ]  - [  -0.0053034900000000,  0.0001255500000000, -0.0002781800000000 ]  - [  -0.0008074700000000, -0.0083782400000000, -0.0060090500000000 ]  - [  -0.0023459900000000, -0.0003051900000000, -0.0022085300000000 ]  - [  -0.0001188500000000,  0.0057909800000000, -0.0034809800000000 ]  - [  -0.0017666600000000,  0.0002047400000000, -0.0006140000000000 ]  - [   0.0007744400000000, -0.0006350300000000,  0.0011595500000000 ]  - [  -0.0020391400000000,  0.0000934800000000,  0.0005967700000000 ]  - [   0.0046006800000000,  0.0013367100000000, -0.0006526900000000 ]  - [  -0.0032860400000000, -0.0006832800000000, -0.0011917300000000 ]  - [   0.0059610400000000, -0.0047177800000000,  0.0031012000000000 ]  - [  -0.0033511300000000,  0.0005160900000000, -0.0002545800000000 ]  - [   0.0036342000000000, -0.0014807600000000, -0.0005829700000000 ]  - [  -0.0038864500000000,  0.0004891400000000, -0.0009941200000000 ]  - [   0.0816836200000000, -0.0134770100000000,  0.0901698200000000 ]  - [  -0.0040505500000000, -0.0003742300000000,  0.0001698400000000 ]  - [  -0.0036985800000000,  0.0014662400000000, -0.0063480600000000 ]  - [  -0.0002780600000000, -0.0008149900000000, -0.0013558700000000 ]  - [  -0.0105903600000000,  0.0039706200000000,  0.0062683000000000 ]  - [  -0.0154106600000000, -0.0077536200000000,  0.0051315900000000 ]  - [   0.0018008300000000, -0.0056898500000000,  0.0093020600000000 ]  - [   0.0002540600000000, -0.0010806100000000,  0.0004636400000000 ]  - [  -0.0018645100000000,  0.0026812300000000, -0.0009854000000000 ]  - [   0.0022855800000000, -0.0008699000000000, -0.0015436900000000 ]  - [  -0.1216522100000000, -0.0020016100000000, -0.1294218000000000 ]  - [   0.0006851200000000, -0.0004260300000000,  0.0001992700000000 ]  - [   0.0032589000000000,  0.0012694400000000, -0.0063449700000000 ]  - [   0.0048363200000000, -0.0012663700000000,  0.0038187800000000 ]  - [  -0.0026138500000000,  0.0003509900000000,  0.0009499000000000 ]  - [   0.0017499500000000,  0.0010237300000000, -0.0000697400000000 ]  - [  -0.0012430500000000,  0.0004892300000000, -0.0008356300000000 ]  - [   0.0006832400000000,  0.0008559200000000,  0.0008612000000000 ]  - [  -0.0021726900000000,  0.0001701600000000,  0.0005013000000000 ]  - [   0.0019633700000000,  0.0006970900000000, -0.0012101600000000 ]  - [  -0.0003422000000000, -0.0003545300000000,  0.0009253400000000 ]  - [   0.0006564100000000,  0.0004070200000000,  0.0006505400000000 ]  - [   0.0006677100000000, -0.0004313700000000,  0.0010424200000000 ]  - [  -0.0000487500000000,  0.0005029000000000,  0.0008560300000000 ]  - [   0.0065786000000000,  0.0053839100000000,  0.0106617300000000 ]  - [   0.0015110800000000,  0.0012211300000000,  0.0015535300000000 ]  - [  -0.0050329500000000,  0.0071961900000000, -0.0044798000000000 ]  - [   0.0016129000000000, -0.0002474500000000,  0.0004708600000000 ]  - [  -0.0026354400000000,  0.0013921500000000, -0.0022986800000000 ]  - [   0.0007031700000000,  0.0001094500000000,  0.0009101700000000 ]  - [  -0.0012748600000000, -0.0016409700000000, -0.0005794200000000 ]  - [   0.0016412500000000,  0.0004250500000000,  0.0010845000000000 ]  - [  -0.0015125400000000, -0.0012319700000000, -0.0003738800000000 ]  - [   0.0018591000000000, -0.0009444100000000, -0.0003856700000000 ]  - [  -0.0014049500000000,  0.0006951700000000, -0.0008282900000000 ]  - [   0.0006229800000000, -0.0015766100000000,  0.0009088800000000 ]  - [   0.0172495900000000,  0.0058356800000000,  0.0022344800000000 ]  - [   0.0047914800000000, -0.0008731400000000, -0.0032783000000000 ]  - [  -0.0006713800000000, -0.0006442400000000, -0.0011348900000000 ]  - [  -0.0006709000000000, -0.0010651900000000, -0.0012564100000000 ]  - [  -0.0011213800000000,  0.0008727200000000, -0.0013161100000000 ]  - [   0.0019129400000000, -0.0014134300000000,  0.0018710500000000 ]  - [  -0.0013127400000000,  0.0011035600000000,  0.0004685500000000 ]  - [   0.0024488200000000,  0.0008351600000000,  0.0004095000000000 ]  - [   0.0031947900000000,  0.0130304800000000,  0.0144973000000000 ]  - [   0.0004717900000000,  0.0013643300000000,  0.0006347400000000 ]  - [  -0.0008025200000000, -0.0000492300000000,  0.0005447600000000 ]  - [   0.0011852000000000,  0.0003333500000000, -0.0004705100000000 ]  - [  -0.0099323800000000, -0.0030222600000000,  0.0049444600000000 ]  - [   0.0019056500000000, -0.0000727400000000,  0.0004640700000000 ]  - [  -0.0042039900000000, -0.0008301900000000, -0.0006927000000000 ]  - [   0.0018477000000000, -0.0000737800000000,  0.0005635400000000 ]  - [  -0.0003509300000000,  0.0004674500000000, -0.0004033600000000 ]  - [   0.0020999700000000,  0.0014310200000000,  0.0021604500000000 ]  - [   0.0023431500000000, -0.0017088700000000,  0.0006095000000000 ]  - [   0.0017358100000000,  0.0048855100000000, -0.0027322000000000 ]  - [  -0.0000652600000000, -0.0000840900000000,  0.0006448000000000 ]  - [  -0.0000764900000000,  0.0005183700000000,  0.0006496600000000 ]  - [   0.0018300300000000,  0.0010602200000000,  0.0020859400000000 ]  - [   0.0009627700000000,  0.0011544600000000,  0.0012096800000000 ]  - [   0.0237002900000000, -0.0048402900000000,  0.0065069300000000 ]  - [   0.0029984400000000, -0.0012584300000000, -0.0010179000000000 ]- atom:   29  displacement:    [  -0.0099999969910042,  0.0000000000000000, -0.0000077575709300 ]  forces:  - [  -0.0020871900000000,  0.0030805800000000, -0.0039741800000000 ]  - [   0.0036607300000000, -0.0012625300000000,  0.0018629900000000 ]  - [  -0.0090463500000000,  0.0024460300000000, -0.0031961700000000 ]  - [   0.0043992100000000, -0.0017555500000000,  0.0041964600000000 ]  - [  -0.0143580500000000, -0.0028985000000000, -0.0020987800000000 ]  - [   0.0053137300000000, -0.0001212800000000,  0.0002628900000000 ]  - [   0.0008015500000000,  0.0083914900000000,  0.0060204100000000 ]  - [   0.0023553500000000,  0.0003116200000000,  0.0022199900000000 ]  - [   0.0006038200000000, -0.0053503900000000,  0.0037498100000000 ]  - [   0.0022623600000000,  0.0002342700000000,  0.0008837300000000 ]  - [  -0.0002680700000000,  0.0002083400000000, -0.0008802900000000 ]  - [   0.0025255700000000, -0.0005310700000000, -0.0003185000000000 ]  - [  -0.0050880600000000, -0.0009189000000000,  0.0003827700000000 ]  - [   0.0027913500000000,  0.0011295500000000,  0.0009190000000000 ]  - [  -0.0064780100000000,  0.0043249700000000, -0.0034131200000000 ]  - [   0.0028670300000000, -0.0009481100000000, -0.0000226000000000 ]  - [  -0.0031859600000000,  0.0019352500000000,  0.0008714200000000 ]  - [   0.0043798400000000, -0.0000527500000000,  0.0012650800000000 ]  - [  -0.0819329400000000,  0.0134724400000000, -0.0932064400000000 ]  - [   0.0045479400000000, -0.0000604600000000,  0.0001013500000000 ]  - [   0.0032552900000000, -0.0010389200000000,  0.0061131400000000 ]  - [  -0.0002379300000000,  0.0012556600000000,  0.0010820400000000 ]  - [   0.0101118100000000, -0.0044080800000000, -0.0065166200000000 ]  - [   0.0150376800000000,  0.0073917800000000, -0.0054471200000000 ]  - [  -0.0028204400000000,  0.0041513400000000, -0.0089225000000000 ]  - [  -0.0012660700000000, -0.0004899300000000, -0.0001208400000000 ]  - [   0.0028326600000000, -0.0033977700000000, -0.0010646400000000 ]  - [  -0.0013807600000000,  0.0001971200000000, -0.0004616100000000 ]  - [   0.1209956500000000, -0.0005711700000000,  0.1311693700000000 ]  - [  -0.0024046500000000, -0.0013831100000000, -0.0019447300000000 ]  - [  -0.0015027200000000, -0.0030511100000000,  0.0079971900000000 ]  - [  -0.0031520100000000, -0.0005459000000000, -0.0020998400000000 ]  - [   0.0025979700000000,  0.0015038400000000, -0.0009443900000000 ]  - [  -0.0017220100000000,  0.0008383700000000,  0.0000606100000000 ]  - [   0.0002040400000000,  0.0010114500000000,  0.0011392600000000 ]  - [  -0.0017026600000000,  0.0007076400000000, -0.0005309700000000 ]  - [   0.0031189400000000,  0.0005386900000000, -0.0025496400000000 ]  - [  -0.0010476000000000, -0.0000088000000000, -0.0008137400000000 ]  - [  -0.0005770300000000, -0.0003271300000000,  0.0010836200000000 ]  - [  -0.0015925300000000, -0.0011156000000000,  0.0013966500000000 ]  - [  -0.0015941600000000,  0.0011194000000000,  0.0009828800000000 ]  - [  -0.0008968300000000,  0.0002081400000000,  0.0011985800000000 ]  - [  -0.0048524800000000, -0.0036127600000000, -0.0089645700000000 ]  - [   0.0002116300000000,  0.0005848900000000,  0.0002032900000000 ]  - [   0.0060427200000000, -0.0057440500000000,  0.0041459400000000 ]  - [  -0.0005845500000000,  0.0017516600000000, -0.0007817400000000 ]  - [   0.0009213000000000,  0.0004190600000000,  0.0005525300000000 ]  - [  -0.0024264400000000,  0.0016974900000000, -0.0026600800000000 ]  - [   0.0022869600000000,  0.0000976000000000,  0.0002529100000000 ]  - [  -0.0006188300000000, -0.0019571600000000, -0.0014060500000000 ]  - [   0.0014724700000000, -0.0006252600000000,  0.0003903600000000 ]  - [  -0.0018177200000000, -0.0009042600000000,  0.0003711200000000 ]  - [   0.0003965000000000, -0.0022594900000000,  0.0011654400000000 ]  - [  -0.0016464400000000,  0.0000346400000000, -0.0005846700000000 ]  - [  -0.0160897300000000, -0.0064056800000000, -0.0041729800000000 ]  - [  -0.0038893100000000,  0.0001744500000000,  0.0012648700000000 ]  - [  -0.0010303700000000, -0.0011653000000000, -0.0005746100000000 ]  - [  -0.0010463100000000, -0.0007394000000000, -0.0004901900000000 ]  - [   0.0028527900000000, -0.0026930200000000,  0.0030829100000000 ]  - [  -0.0002231200000000, -0.0003960700000000, -0.0001718900000000 ]  - [   0.0013097300000000,  0.0007455000000000, -0.0004630800000000 ]  - [  -0.0024517700000000,  0.0010238400000000, -0.0004120200000000 ]  - [  -0.0042489200000000, -0.0116105500000000, -0.0143532800000000 ]  - [  -0.0014926500000000,  0.0001818800000000, -0.0003081800000000 ]  - [   0.0017344900000000,  0.0007562200000000, -0.0025889400000000 ]  - [  -0.0002398800000000,  0.0003769500000000, -0.0015798100000000 ]  - [   0.0090238400000000,  0.0023361500000000, -0.0028897600000000 ]  - [  -0.0028484500000000, -0.0006321300000000,  0.0015749900000000 ]  - [   0.0033328100000000,  0.0015177300000000,  0.0027099500000000 ]  - [  -0.0027848100000000,  0.0007776600000000,  0.0014796500000000 ]  - [   0.0020735200000000,  0.0013455700000000,  0.0021581400000000 ]  - [  -0.0003986200000000,  0.0003707400000000, -0.0004398300000000 ]  - [  -0.0013218800000000,  0.0032577400000000, -0.0009390800000000 ]  - [  -0.0007315100000000, -0.0033821500000000,  0.0024258000000000 ]  - [  -0.0016433900000000,  0.0018937100000000, -0.0023741000000000 ]  - [  -0.0016451500000000,  0.0012924400000000, -0.0024034800000000 ]  - [  -0.0008184500000000, -0.0026150500000000, -0.0024228700000000 ]  - [   0.0000543800000000, -0.0027120800000000, -0.0015432200000000 ]  - [  -0.0241798800000000,  0.0032031900000000, -0.0067015800000000 ]  - [  -0.0030029700000000, -0.0006056100000000,  0.0010155800000000 ]- atom:   29  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0003031800000000, -0.0025105000000000,  0.0026512600000000 ]  - [  -0.0010998000000000, -0.0004635700000000,  0.0002841600000000 ]  - [   0.0023466700000000,  0.0027144200000000, -0.0027672100000000 ]  - [  -0.0017253500000000,  0.0000797300000000, -0.0010948200000000 ]  - [   0.0145238400000000,  0.0347514800000000,  0.0289065900000000 ]  - [  -0.0015913300000000,  0.0001367900000000, -0.0005535100000000 ]  - [  -0.0023544800000000, -0.0113521900000000, -0.0080733200000000 ]  - [  -0.0009452900000000, -0.0007471400000000, -0.0018866700000000 ]  - [   0.0002761200000000,  0.0037164600000000, -0.0004771100000000 ]  - [  -0.0014279000000000,  0.0006157600000000, -0.0012156600000000 ]  - [   0.0013886700000000, -0.0015343000000000,  0.0003953000000000 ]  - [  -0.0014792800000000, -0.0013924100000000,  0.0011113600000000 ]  - [   0.0029734600000000,  0.0015109900000000, -0.0013432300000000 ]  - [  -0.0018458400000000,  0.0001715700000000, -0.0003081700000000 ]  - [   0.0061170500000000, -0.0163091100000000,  0.0075519100000000 ]  - [  -0.0016355000000000, -0.0002190400000000, -0.0003049600000000 ]  - [   0.0050971000000000, -0.0034660300000000, -0.0027408900000000 ]  - [  -0.0021938000000000, -0.0002101100000000,  0.0000039000000000 ]  - [  -0.0267835100000000,  0.0302386400000000, -0.0439927600000000 ]  - [  -0.0009815500000000, -0.0002969000000000, -0.0000747400000000 ]  - [  -0.0044955900000000,  0.0015012800000000, -0.0073986100000000 ]  - [   0.0000107800000000, -0.0018943300000000, -0.0012501800000000 ]  - [   0.0008676400000000,  0.0048177000000000,  0.0040380000000000 ]  - [  -0.0028359600000000,  0.0016707400000000, -0.0004074400000000 ]  - [   0.0006450400000000, -0.0072416400000000,  0.0033194100000000 ]  - [  -0.0000294600000000, -0.0014142300000000,  0.0007220200000000 ]  - [   0.0001594000000000,  0.0072219000000000, -0.0018072800000000 ]  - [   0.0011103600000000, -0.0004429000000000, -0.0011961300000000 ]  - [  -0.0021370200000000, -0.0918744200000000, -0.0132123100000000 ]  - [  -0.0003887700000000, -0.0007281000000000, -0.0004725800000000 ]  - [  -0.0013443300000000, -0.0030641000000000,  0.0016774700000000 ]  - [   0.0012229200000000, -0.0014107200000000,  0.0012284500000000 ]  - [  -0.0016615500000000,  0.0005503500000000,  0.0005614300000000 ]  - [   0.0011790700000000,  0.0009195400000000, -0.0000108100000000 ]  - [  -0.0006722700000000,  0.0012495200000000,  0.0000926300000000 ]  - [   0.0000751000000000,  0.0015431700000000,  0.0005026700000000 ]  - [  -0.0017264200000000,  0.0002807900000000,  0.0008010900000000 ]  - [   0.0012906000000000,  0.0005586500000000, -0.0011869600000000 ]  - [  -0.0009396900000000, -0.0002614300000000,  0.0012767000000000 ]  - [   0.0014838400000000,  0.0009270800000000,  0.0001672900000000 ]  - [   0.0000761400000000,  0.0002237600000000,  0.0004711100000000 ]  - [  -0.0003348500000000,  0.0005953800000000,  0.0012806400000000 ]  - [   0.0053502900000000,  0.0074974200000000,  0.0108703100000000 ]  - [   0.0011748600000000,  0.0013537100000000,  0.0014584100000000 ]  - [  -0.0025657400000000,  0.0273078300000000, -0.0059813000000000 ]  - [   0.0009025100000000,  0.0005547100000000,  0.0000326400000000 ]  - [  -0.0013405500000000,  0.0007593500000000,  0.0013012400000000 ]  - [  -0.0000583800000000,  0.0006668900000000, -0.0001230300000000 ]  - [  -0.0002545300000000, -0.0019121900000000, -0.0001459700000000 ]  - [   0.0009879700000000, -0.0005121200000000,  0.0001225700000000 ]  - [  -0.0007492000000000,  0.0028168000000000, -0.0008367900000000 ]  - [   0.0010246500000000, -0.0008208100000000, -0.0002327200000000 ]  - [  -0.0015590400000000,  0.0016458000000000, -0.0008765600000000 ]  - [  -0.0000244900000000, -0.0006008100000000,  0.0001341100000000 ]  - [   0.0094121200000000, -0.0015310300000000, -0.0015398400000000 ]  - [   0.0011333600000000, -0.0006803000000000, -0.0014013300000000 ]  - [  -0.0010151700000000, -0.0006067300000000, -0.0012069800000000 ]  - [  -0.0005911800000000, -0.0006112000000000, -0.0010278900000000 ]  - [  -0.0009396000000000,  0.0024932900000000, -0.0020376300000000 ]  - [   0.0013685100000000, -0.0011349700000000,  0.0014870900000000 ]  - [  -0.0018133600000000,  0.0014687200000000,  0.0007650600000000 ]  - [   0.0021058600000000,  0.0008232100000000,  0.0002898200000000 ]  - [   0.0112643300000000,  0.0122500900000000,  0.0212628100000000 ]  - [  -0.0001637300000000,  0.0011734900000000,  0.0005398000000000 ]  - [  -0.0009482300000000, -0.0003887600000000,  0.0010439600000000 ]  - [   0.0008887700000000,  0.0005414600000000, -0.0008961600000000 ]  - [  -0.0025802700000000, -0.0047197700000000, -0.0003020800000000 ]  - [   0.0003148200000000, -0.0002321400000000,  0.0009021400000000 ]  - [  -0.0079608200000000,  0.0031767300000000,  0.0069738700000000 ]  - [   0.0006045600000000,  0.0001925300000000,  0.0007605900000000 ]  - [   0.0004102100000000,  0.0007609100000000,  0.0003936000000000 ]  - [   0.0013921300000000,  0.0010226600000000,  0.0012673500000000 ]  - [   0.0004684400000000, -0.0001870600000000, -0.0004199900000000 ]  - [   0.0015803800000000,  0.0012792000000000, -0.0008521100000000 ]  - [  -0.0004634800000000,  0.0003035800000000, -0.0000365200000000 ]  - [   0.0001334400000000,  0.0003097600000000,  0.0011030400000000 ]  - [   0.0016756500000000,  0.0009651600000000,  0.0019763900000000 ]  - [   0.0012965800000000,  0.0022118000000000,  0.0018055200000000 ]  - [  -0.0011543500000000, -0.0055465800000000, -0.0012936600000000 ]  - [   0.0007816200000000, -0.0012532000000000, -0.0005478600000000 ]- atom:   29  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0003626700000000,  0.0024757700000000, -0.0026464900000000 ]  - [   0.0010620900000000,  0.0004640200000000, -0.0002871600000000 ]  - [  -0.0022134000000000, -0.0026861000000000,  0.0027091800000000 ]  - [   0.0017025600000000, -0.0000629100000000,  0.0010721400000000 ]  - [  -0.0137603100000000, -0.0339146500000000, -0.0272145600000000 ]  - [   0.0015633900000000, -0.0001305700000000,  0.0005564700000000 ]  - [   0.0023508900000000,  0.0112675500000000,  0.0080558800000000 ]  - [   0.0009275500000000,  0.0007471500000000,  0.0018576000000000 ]  - [   0.0002220600000000, -0.0032279100000000,  0.0007080600000000 ]  - [   0.0019070200000000, -0.0001859700000000,  0.0014885300000000 ]  - [  -0.0009364000000000,  0.0011182200000000, -0.0000933200000000 ]  - [   0.0019518800000000,  0.0009668200000000, -0.0008257300000000 ]  - [  -0.0034291000000000, -0.0010969600000000,  0.0010508700000000 ]  - [   0.0013461400000000,  0.0002538700000000,  0.0000305800000000 ]  - [  -0.0065042200000000,  0.0157562000000000, -0.0077008000000000 ]  - [   0.0011459200000000, -0.0001958000000000,  0.0000279500000000 ]  - [  -0.0045655900000000,  0.0038889900000000,  0.0029727300000000 ]  - [   0.0026461000000000,  0.0006280200000000,  0.0002743800000000 ]  - [   0.0276341500000000, -0.0313136300000000,  0.0447634700000000 ]  - [   0.0014600600000000, -0.0001403600000000,  0.0003522400000000 ]  - [   0.0039854100000000, -0.0010643400000000,  0.0070616500000000 ]  - [  -0.0005027500000000,  0.0023279700000000,  0.0009629300000000 ]  - [  -0.0013302400000000, -0.0052196500000000, -0.0042656200000000 ]  - [   0.0022445200000000, -0.0021732000000000,  0.0001786100000000 ]  - [  -0.0016605400000000,  0.0056462600000000, -0.0029726500000000 ]  - [  -0.0009909400000000, -0.0001159000000000, -0.0004001900000000 ]  - [   0.0006654300000000, -0.0079239700000000, -0.0001819000000000 ]  - [  -0.0001581400000000, -0.0002606600000000, -0.0008492100000000 ]  - [  -0.0007020100000000,  0.0895746100000000,  0.0091951400000000 ]  - [  -0.0013307700000000, -0.0010777900000000, -0.0012890400000000 ]  - [   0.0029886800000000,  0.0012583300000000,  0.0000229100000000 ]  - [   0.0005022400000000, -0.0003944000000000,  0.0005077100000000 ]  - [   0.0016275100000000,  0.0012733500000000, -0.0005458800000000 ]  - [  -0.0011893800000000,  0.0009169000000000,  0.0000163900000000 ]  - [  -0.0003536100000000,  0.0002604200000000,  0.0002092700000000 ]  - [  -0.0010977700000000, -0.0000412400000000, -0.0001969200000000 ]  - [   0.0026478500000000,  0.0004240000000000, -0.0028298100000000 ]  - [  -0.0003561100000000,  0.0001510900000000, -0.0008556500000000 ]  - [   0.0000212600000000, -0.0004434400000000,  0.0007599500000000 ]  - [  -0.0023939300000000, -0.0016050600000000,  0.0018466100000000 ]  - [  -0.0009777900000000,  0.0004572900000000,  0.0015473300000000 ]  - [  -0.0005983900000000,  0.0001031400000000,  0.0007521400000000 ]  - [  -0.0036273600000000, -0.0056046000000000, -0.0090792900000000 ]  - [   0.0005355500000000,  0.0004543400000000,  0.0002800500000000 ]  - [   0.0035427100000000, -0.0252608700000000,  0.0055604300000000 ]  - [   0.0001194500000000,  0.0009802100000000, -0.0003539100000000 ]  - [  -0.0003717900000000,  0.0010364300000000, -0.0029914000000000 ]  - [  -0.0016377100000000,  0.0011304200000000, -0.0015923100000000 ]  - [   0.0012642500000000,  0.0003932700000000, -0.0001548200000000 ]  - [   0.0000360900000000, -0.0010171900000000, -0.0004337600000000 ]  - [   0.0007924000000000, -0.0046313100000000,  0.0007976900000000 ]  - [  -0.0010415000000000, -0.0010059800000000,  0.0002382800000000 ]  - [   0.0005292000000000, -0.0031636600000000,  0.0011959800000000 ]  - [  -0.0009907000000000, -0.0009258400000000,  0.0001851500000000 ]  - [  -0.0084295100000000,  0.0008228800000000, -0.0004938400000000 ]  - [  -0.0001788600000000, -0.0000122600000000, -0.0006401300000000 ]  - [  -0.0006866800000000, -0.0011976900000000, -0.0005317500000000 ]  - [  -0.0011112400000000, -0.0011935600000000, -0.0006881000000000 ]  - [   0.0026181400000000, -0.0042710500000000,  0.0037179200000000 ]  - [   0.0003479500000000, -0.0006696400000000,  0.0002583500000000 ]  - [   0.0017927500000000,  0.0003543000000000, -0.0007507000000000 ]  - [  -0.0020760200000000,  0.0009924200000000, -0.0002885700000000 ]  - [  -0.0123618100000000, -0.0107008200000000, -0.0210181700000000 ]  - [  -0.0008420100000000,  0.0003908100000000, -0.0002018200000000 ]  - [   0.0018326000000000,  0.0010635300000000, -0.0030273900000000 ]  - [   0.0000435400000000,  0.0001555800000000, -0.0011331300000000 ]  - [   0.0015730400000000,  0.0039660000000000,  0.0023992400000000 ]  - [  -0.0012456900000000, -0.0004873300000000,  0.0011551300000000 ]  - [   0.0069642400000000, -0.0024787600000000, -0.0048985400000000 ]  - [  -0.0015228700000000,  0.0004962500000000,  0.0012665600000000 ]  - [   0.0012896800000000,  0.0010456500000000,  0.0013374400000000 ]  - [   0.0003317700000000,  0.0007863100000000,  0.0004831800000000 ]  - [   0.0005700700000000,  0.0016736900000000,  0.0001145600000000 ]  - [  -0.0005544400000000,  0.0002826700000000,  0.0005164300000000 ]  - [  -0.0012277000000000,  0.0014869500000000, -0.0016612400000000 ]  - [  -0.0018360100000000,  0.0015037600000000, -0.0028284100000000 ]  - [  -0.0006375500000000, -0.0024588000000000, -0.0022633200000000 ]  - [  -0.0002777000000000, -0.0037388300000000, -0.0021209600000000 ]  - [   0.0012903300000000,  0.0036935800000000,  0.0012948100000000 ]  - [  -0.0007306100000000, -0.0005763200000000,  0.0005245800000000 ]- atom:   29  displacement:    [  -0.0024096060369692,  0.0000000000000000,  0.0097053489760339 ]  forces:  - [   0.0031004100000000, -0.0017049000000000,  0.0032949200000000 ]  - [  -0.0031996900000000,  0.0001415100000000,  0.0009849500000000 ]  - [   0.0222884900000000,  0.0045489700000000, -0.0120469200000000 ]  - [  -0.0032560200000000,  0.0008610200000000, -0.0024336200000000 ]  - [   0.0054577800000000,  0.0115310400000000,  0.0195160000000000 ]  - [  -0.0027758500000000,  0.0001649900000000, -0.0004484800000000 ]  - [  -0.0026677700000000, -0.0125879000000000, -0.0101178500000000 ]  - [  -0.0011858800000000, -0.0006581500000000, -0.0037849500000000 ]  - [  -0.0018950100000000,  0.0097061100000000, -0.0054022700000000 ]  - [  -0.0014803800000000,  0.0000415200000000, -0.0022710100000000 ]  - [   0.0022842700000000,  0.0010282900000000,  0.0019572500000000 ]  - [  -0.0018619000000000, -0.0011372200000000,  0.0024408500000000 ]  - [   0.0040916800000000, -0.0006521400000000, -0.0056948700000000 ]  - [  -0.0027658500000000, -0.0002677700000000, -0.0007913700000000 ]  - [   0.0032292400000000, -0.0072987000000000,  0.0075421600000000 ]  - [  -0.0022189600000000,  0.0001642600000000, -0.0002698100000000 ]  - [   0.0079049000000000, -0.0049389700000000, -0.0101010800000000 ]  - [  -0.0035801900000000, -0.0000052300000000, -0.0002137300000000 ]  - [   0.0650714100000000, -0.0174023800000000,  0.1417857100000000 ]  - [  -0.0013902300000000, -0.0008379700000000, -0.0001169500000000 ]  - [  -0.0059354100000000,  0.0036114200000000, -0.0125987800000000 ]  - [  -0.0004697800000000, -0.0018391700000000, -0.0027534600000000 ]  - [   0.0006164300000000,  0.0040745200000000,  0.0105692700000000 ]  - [  -0.0064855200000000, -0.0041096900000000,  0.0042158500000000 ]  - [   0.0069611000000000, -0.0094503600000000,  0.0156077700000000 ]  - [   0.0000406100000000, -0.0012006000000000,  0.0007740000000000 ]  - [  -0.0007391400000000, -0.0002062700000000, -0.0024266500000000 ]  - [   0.0016365500000000, -0.0006499600000000, -0.0014497500000000 ]  - [  -0.0957576400000000, -0.0127567900000000, -0.2205423000000000 ]  - [  -0.0001846600000000, -0.0006094800000000, -0.0003630200000000 ]  - [  -0.0066455400000000, -0.0022409800000000,  0.0013941900000000 ]  - [   0.0027802300000000, -0.0011675200000000,  0.0019325900000000 ]  - [  -0.0031043800000000,  0.0003278200000000,  0.0019640700000000 ]  - [   0.0015251900000000,  0.0009996600000000,  0.0000942600000000 ]  - [  -0.0023088500000000, -0.0017916300000000, -0.0012434900000000 ]  - [   0.0003504300000000,  0.0012997600000000,  0.0004152500000000 ]  - [  -0.0024351300000000,  0.0002976100000000,  0.0018037200000000 ]  - [   0.0017140200000000,  0.0006486000000000, -0.0011449600000000 ]  - [  -0.0016548800000000, -0.0007076000000000,  0.0015687800000000 ]  - [   0.0022265000000000,  0.0013096000000000, -0.0002205100000000 ]  - [   0.0018662000000000, -0.0009863000000000,  0.0002665200000000 ]  - [  -0.0011424600000000,  0.0007627100000000,  0.0017631100000000 ]  - [   0.0090022700000000,  0.0095278400000000,  0.0206652400000000 ]  - [   0.0013551800000000,  0.0013950000000000,  0.0017929300000000 ]  - [  -0.0019746700000000,  0.0091567600000000, -0.0090561900000000 ]  - [   0.0011364100000000,  0.0002045200000000,  0.0001961400000000 ]  - [  -0.0018209500000000, -0.0012863400000000,  0.0084332200000000 ]  - [   0.0005073900000000,  0.0003710700000000,  0.0005114600000000 ]  - [  -0.0010159500000000,  0.0014568900000000,  0.0032123200000000 ]  - [   0.0013733800000000,  0.0000033900000000,  0.0006331200000000 ]  - [  -0.0007889500000000,  0.0006349500000000, -0.0010562900000000 ]  - [   0.0012949500000000, -0.0008751400000000, -0.0004385500000000 ]  - [  -0.0026706100000000,  0.0028191400000000, -0.0002607400000000 ]  - [   0.0004116000000000, -0.0009526200000000,  0.0003196400000000 ]  - [   0.0102453000000000, -0.0005256500000000, -0.0076609800000000 ]  - [   0.0024243600000000, -0.0005908000000000, -0.0024388700000000 ]  - [  -0.0012626000000000, -0.0011253300000000, -0.0020967400000000 ]  - [  -0.0011476400000000, -0.0011867600000000, -0.0020727600000000 ]  - [  -0.0007883900000000,  0.0014556000000000, -0.0026434900000000 ]  - [   0.0016023200000000, -0.0013768800000000,  0.0018846200000000 ]  - [  -0.0028696300000000,  0.0014784800000000,  0.0024725300000000 ]  - [   0.0029594100000000,  0.0006602300000000,  0.0006687800000000 ]  - [   0.0116187900000000,  0.0187481900000000,  0.0178479500000000 ]  - [   0.0000093200000000,  0.0016418000000000,  0.0008930300000000 ]  - [  -0.0043608400000000, -0.0015013500000000,  0.0038837100000000 ]  - [   0.0014527000000000,  0.0004619600000000, -0.0004984600000000 ]  - [  -0.0104812400000000, -0.0103455700000000,  0.0234336900000000 ]  - [   0.0008619900000000, -0.0001536800000000,  0.0007991100000000 ]  - [  -0.0152937300000000,  0.0087354700000000,  0.0130989900000000 ]  - [   0.0011538100000000,  0.0000346600000000,  0.0005548000000000 ]  - [  -0.0001082400000000,  0.0005520900000000,  0.0016647500000000 ]  - [   0.0018331500000000,  0.0011548200000000,  0.0015845200000000 ]  - [   0.0009731700000000,  0.0000644000000000, -0.0012819300000000 ]  - [   0.0002747600000000,  0.0028354600000000, -0.0022475400000000 ]  - [   0.0004484500000000, -0.0007793700000000,  0.0019255600000000 ]  - [   0.0004147100000000,  0.0002017300000000,  0.0019109800000000 ]  - [   0.0023344200000000,  0.0016881600000000,  0.0035222800000000 ]  - [   0.0014810300000000,  0.0023788800000000,  0.0022506400000000 ]  - [   0.0108006800000000, -0.0018631000000000, -0.0048028400000000 ]  - [   0.0006095800000000, -0.0014106500000000, -0.0010600400000000 ]- atom:   29  displacement:    [   0.0024096060369692,  0.0000000000000000, -0.0097053489760339 ]  forces:  - [  -0.0031237200000000,  0.0016672500000000, -0.0032360000000000 ]  - [   0.0031918500000000, -0.0001486400000000, -0.0009821600000000 ]  - [  -0.0223690900000000, -0.0045404900000000,  0.0120463900000000 ]  - [   0.0032479300000000, -0.0008407700000000,  0.0024115700000000 ]  - [  -0.0047099100000000, -0.0102265300000000, -0.0185964600000000 ]  - [   0.0027550000000000, -0.0001587300000000,  0.0004604700000000 ]  - [   0.0026897300000000,  0.0126118600000000,  0.0101276000000000 ]  - [   0.0011670600000000,  0.0006517000000000,  0.0037652500000000 ]  - [   0.0023648800000000, -0.0092456200000000,  0.0056845100000000 ]  - [   0.0019611800000000,  0.0003925800000000,  0.0025514300000000 ]  - [  -0.0017777000000000, -0.0014898800000000, -0.0017079000000000 ]  - [   0.0023413400000000,  0.0007061800000000, -0.0021804500000000 ]  - [  -0.0045539200000000,  0.0011023100000000,  0.0054463400000000 ]  - [   0.0022763800000000,  0.0006974700000000,  0.0005208500000000 ]  - [  -0.0037267200000000,  0.0068764300000000, -0.0078754300000000 ]  - [   0.0017299700000000, -0.0005932900000000, -0.0000073400000000 ]  - [  -0.0073860700000000,  0.0053706300000000,  0.0103843000000000 ]  - [   0.0040430900000000,  0.0004360700000000,  0.0004938600000000 ]  - [  -0.0694294400000000,  0.0179571300000000, -0.1472827600000000 ]  - [   0.0018654000000000,  0.0004026600000000,  0.0003875100000000 ]  - [   0.0054084500000000, -0.0031737700000000,  0.0123102900000000 ]  - [   0.0000052200000000,  0.0022759900000000,  0.0024801500000000 ]  - [  -0.0010319200000000, -0.0045059500000000, -0.0108981400000000 ]  - [   0.0059072100000000,  0.0036335200000000, -0.0044563700000000 ]  - [  -0.0078957800000000,  0.0078497800000000, -0.0150937200000000 ]  - [  -0.0010642900000000, -0.0003320900000000, -0.0004517900000000 ]  - [   0.0017001000000000, -0.0004828400000000,  0.0003805400000000 ]  - [  -0.0007001400000000, -0.0000511400000000, -0.0005916000000000 ]  - [   0.0983989700000000,  0.0086171200000000,  0.2238449200000000 ]  - [  -0.0015204200000000, -0.0012043100000000, -0.0013657900000000 ]  - [   0.0084248700000000,  0.0004288500000000,  0.0003232200000000 ]  - [  -0.0010462600000000, -0.0006469000000000, -0.0001842400000000 ]  - [   0.0030933700000000,  0.0015079800000000, -0.0019641100000000 ]  - [  -0.0015098800000000,  0.0008557900000000, -0.0001003500000000 ]  - [   0.0012836800000000,  0.0033309200000000,  0.0015803100000000 ]  - [  -0.0013746800000000,  0.0002120900000000, -0.0000947600000000 ]  - [   0.0033584800000000,  0.0003938000000000, -0.0038375800000000 ]  - [  -0.0007763100000000,  0.0000440200000000, -0.0008863100000000 ]  - [   0.0007318100000000,  0.0000253600000000,  0.0004594800000000 ]  - [  -0.0031608300000000, -0.0019976400000000,  0.0022485300000000 ]  - [  -0.0027815800000000,  0.0016705200000000,  0.0017510000000000 ]  - [   0.0002146000000000, -0.0000654900000000,  0.0002662800000000 ]  - [  -0.0072599000000000, -0.0076737900000000, -0.0187817100000000 ]  - [   0.0003500400000000,  0.0004144700000000, -0.0000661600000000 ]  - [   0.0029862400000000, -0.0077392900000000,  0.0086920300000000 ]  - [  -0.0001131300000000,  0.0013291900000000, -0.0005197300000000 ]  - [   0.0001052700000000,  0.0031119400000000, -0.0101519500000000 ]  - [  -0.0022053500000000,  0.0014395500000000, -0.0022229500000000 ]  - [   0.0020319400000000, -0.0030020800000000, -0.0035439500000000 ]  - [  -0.0003449400000000, -0.0015292900000000, -0.0009506300000000 ]  - [   0.0007603600000000, -0.0024782700000000,  0.0010784700000000 ]  - [  -0.0013082500000000, -0.0009769700000000,  0.0004451800000000 ]  - [   0.0016261900000000, -0.0043006200000000,  0.0005602800000000 ]  - [  -0.0014391000000000, -0.0005529300000000, -0.0000079000000000 ]  - [  -0.0093954400000000, -0.0002213800000000,  0.0055379900000000 ]  - [  -0.0014752200000000, -0.0001053400000000,  0.0003965800000000 ]  - [  -0.0004401300000000, -0.0006796800000000,  0.0003855300000000 ]  - [  -0.0005483000000000, -0.0006240800000000,  0.0003621700000000 ]  - [   0.0025050300000000, -0.0032804900000000,  0.0044012700000000 ]  - [   0.0001182400000000, -0.0004353400000000, -0.0001380500000000 ]  - [   0.0028477900000000,  0.0003778100000000, -0.0024650500000000 ]  - [  -0.0029510000000000,  0.0011861300000000, -0.0006677500000000 ]  - [  -0.0128825000000000, -0.0174197700000000, -0.0177244000000000 ]  - [  -0.0010306300000000, -0.0001133000000000, -0.0005646600000000 ]  - [   0.0053057900000000,  0.0021945300000000, -0.0059123000000000 ]  - [  -0.0005263200000000,  0.0002274200000000, -0.0015268800000000 ]  - [   0.0095802900000000,  0.0099205900000000, -0.0218165800000000 ]  - [  -0.0017894300000000, -0.0005376300000000,  0.0012342700000000 ]  - [   0.0142098400000000, -0.0079602600000000, -0.0109554400000000 ]  - [  -0.0020685100000000,  0.0006476700000000,  0.0014620100000000 ]  - [   0.0018087500000000,  0.0012518500000000,  0.0000409100000000 ]  - [  -0.0001218900000000,  0.0006577500000000,  0.0001450200000000 ]  - [   0.0000522600000000,  0.0014531400000000,  0.0009719200000000 ]  - [   0.0007625200000000, -0.0012824500000000,  0.0019126400000000 ]  - [  -0.0021444900000000,  0.0025823900000000, -0.0036389200000000 ]  - [  -0.0021294400000000,  0.0016112700000000, -0.0036451800000000 ]  - [  -0.0012947200000000, -0.0031967300000000, -0.0038268800000000 ]  - [  -0.0004652400000000, -0.0039188000000000, -0.0025798100000000 ]  - [  -0.0107413400000000,  0.0000411200000000,  0.0048861500000000 ]  - [  -0.0005972000000000, -0.0004322600000000,  0.0010629200000000 ]- atom:   33  displacement:    [   0.0099999969910042,  0.0000000000000000,  0.0000077575709300 ]  forces:  - [  -0.0045960500000000, -0.0138366300000000, -0.0165385600000000 ]  - [  -0.0154790800000000,  0.0014593200000000,  0.0065256500000000 ]  - [   0.0108424400000000,  0.0083380100000000,  0.0116178700000000 ]  - [  -0.0058830400000000, -0.0005841100000000, -0.0033102000000000 ]  - [   0.0107986800000000, -0.0082536400000000,  0.0115409600000000 ]  - [  -0.0058870400000000,  0.0005889800000000, -0.0033045100000000 ]  - [  -0.0154421300000000, -0.0014859300000000,  0.0064865100000000 ]  - [  -0.0045801900000000,  0.0138830300000000, -0.0165744600000000 ]  - [   0.1120913100000000,  0.0501464800000000, -0.0272248000000000 ]  - [  -0.0088412700000000,  0.0013600200000000, -0.0000230200000000 ]  - [   0.0073217500000000,  0.0023851200000000,  0.0031205500000000 ]  - [  -0.0061115600000000, -0.0018826400000000, -0.0009647100000000 ]  - [   0.1056143200000000, -0.0458758700000000, -0.0251628600000000 ]  - [  -0.0093023900000000, -0.0009278800000000, -0.0002977300000000 ]  - [   0.0068369300000000, -0.0028031200000000,  0.0028252700000000 ]  - [  -0.0065796000000000,  0.0014462100000000, -0.0012417500000000 ]  - [   0.0031825700000000, -0.0045788600000000, -0.0015090700000000 ]  - [  -0.0039250500000000,  0.0029519800000000, -0.0007722300000000 ]  - [   0.0029023400000000,  0.0022995400000000,  0.0044548000000000 ]  - [  -0.0030286600000000, -0.0043040600000000, -0.0023783600000000 ]  - [   0.0027428700000000,  0.0050600200000000, -0.0017687200000000 ]  - [  -0.0044021800000000, -0.0025030300000000, -0.0010463800000000 ]  - [   0.0024502000000000, -0.0027558400000000,  0.0041867900000000 ]  - [  -0.0035071900000000,  0.0038611400000000, -0.0026471800000000 ]  - [  -0.0060485700000000,  0.0193543500000000, -0.0114799300000000 ]  - [   0.0016373200000000, -0.0028039100000000,  0.0015985100000000 ]  - [  -0.0037923500000000,  0.0011434400000000,  0.0011644200000000 ]  - [   0.0051940300000000, -0.0017612400000000, -0.0031383700000000 ]  - [  -0.0034321400000000, -0.0025529100000000, -0.0046779400000000 ]  - [   0.0008655700000000,  0.0002903800000000,  0.0011398900000000 ]  - [  -0.0017518700000000,  0.0007460100000000, -0.0029879800000000 ]  - [   0.0025600400000000, -0.0020945200000000,  0.0028482000000000 ]  - [  -0.2936537700000000, -0.0031626400000000,  0.0734073600000000 ]  - [   0.0048039300000000,  0.0008980600000000, -0.0006169900000000 ]  - [  -0.0031948900000000, -0.0033715000000000, -0.0028956600000000 ]  - [   0.0013435800000000,  0.0027739300000000,  0.0016682500000000 ]  - [   0.0270846900000000,  0.0021534200000000, -0.0172969800000000 ]  - [   0.0055618900000000, -0.0002303300000000, -0.0013247900000000 ]  - [  -0.0047326500000000, -0.0018254300000000,  0.0031709000000000 ]  - [   0.0042592100000000,  0.0010817900000000, -0.0011168800000000 ]  - [   0.0265975400000000, -0.0014869500000000, -0.0156685100000000 ]  - [   0.0046467500000000,  0.0009037000000000,  0.0006853900000000 ]  - [  -0.0006652700000000,  0.0001176400000000, -0.0003065100000000 ]  - [   0.0026759400000000,  0.0019289500000000,  0.0026498000000000 ]  - [  -0.0021631000000000,  0.0048590100000000, -0.0031863700000000 ]  - [   0.0023725800000000, -0.0012751000000000,  0.0013695700000000 ]  - [  -0.0023497500000000,  0.0016686400000000, -0.0020109100000000 ]  - [   0.0009804200000000, -0.0001317800000000,  0.0009464300000000 ]  - [  -0.0049554500000000, -0.0208735300000000, -0.0118094000000000 ]  - [   0.0026659600000000,  0.0013076700000000,  0.0013017200000000 ]  - [  -0.0039014000000000, -0.0008992700000000, -0.0005290400000000 ]  - [   0.0047165500000000, -0.0009000300000000, -0.0006268100000000 ]  - [   0.0002199900000000,  0.0038962000000000,  0.0005279200000000 ]  - [   0.0016178200000000, -0.0038605700000000,  0.0016815700000000 ]  - [   0.0000336000000000,  0.0003015800000000, -0.0028954000000000 ]  - [   0.0028026700000000, -0.0011887600000000, -0.0013066400000000 ]  - [  -0.0021543800000000, -0.0027011600000000, -0.0041218800000000 ]  - [   0.0015967700000000,  0.0011804800000000,  0.0027803100000000 ]  - [  -0.0004510500000000,  0.0008849500000000, -0.0023888400000000 ]  - [   0.0032889800000000, -0.0029896500000000,  0.0044929800000000 ]  - [   0.0009193800000000,  0.0012238500000000, -0.0001373900000000 ]  - [   0.0008953200000000,  0.0005715600000000, -0.0001351700000000 ]  - [  -0.0007164700000000, -0.0026379000000000, -0.0028276600000000 ]  - [   0.0013601100000000,  0.0038333200000000,  0.0042533900000000 ]  - [  -0.0047209400000000, -0.0011758100000000,  0.0012183100000000 ]  - [   0.0030401000000000,  0.0011640500000000, -0.0017031200000000 ]  - [  -0.0008672400000000, -0.0009791800000000, -0.0009083600000000 ]  - [   0.0018841600000000,  0.0005080900000000,  0.0007063000000000 ]  - [  -0.0056247600000000,  0.0018398400000000,  0.0032320800000000 ]  - [   0.0021296700000000, -0.0004840500000000,  0.0003068500000000 ]  - [   0.0245777000000000, -0.0002304800000000,  0.0177539200000000 ]  - [   0.0038503400000000,  0.0016407300000000,  0.0022264800000000 ]  - [   0.0002982200000000,  0.0041679900000000, -0.0031491500000000 ]  - [   0.0023837100000000, -0.0023155100000000,  0.0039352900000000 ]  - [   0.0232867600000000,  0.0022380500000000,  0.0163234700000000 ]  - [   0.0021629700000000,  0.0001753400000000,  0.0005138500000000 ]  - [   0.0012623100000000, -0.0054530400000000,  0.0002275700000000 ]  - [   0.0026402800000000,  0.0023408200000000,  0.0013741200000000 ]  - [  -0.0001257300000000, -0.0015122100000000, -0.0001264600000000 ]  - [  -0.0001330300000000, -0.0002846300000000, -0.0001255600000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0010885600000000,  0.0034282000000000,  0.0010200200000000 ]  - [   0.0033623300000000,  0.0002302600000000, -0.0015092000000000 ]  - [  -0.0034223100000000, -0.0091312000000000, -0.0054214400000000 ]  - [  -0.0001057400000000, -0.0001448200000000,  0.0000548100000000 ]  - [   0.0034223100000000, -0.0091312000000000,  0.0054214400000000 ]  - [   0.0001057400000000, -0.0001448200000000, -0.0000548100000000 ]  - [  -0.0033623300000000,  0.0002302600000000,  0.0015092000000000 ]  - [   0.0010885600000000,  0.0034282000000000, -0.0010200200000000 ]  - [   0.0645739400000000,  0.0647171700000000, -0.0187812400000000 ]  - [   0.0005861300000000,  0.0001937000000000, -0.0005036900000000 ]  - [  -0.0005478600000000, -0.0019811500000000,  0.0004276700000000 ]  - [   0.0001362600000000, -0.0007362700000000,  0.0005345600000000 ]  - [  -0.0645739400000000,  0.0647171700000000,  0.0187812400000000 ]  - [  -0.0005861300000000,  0.0001937000000000,  0.0005036900000000 ]  - [   0.0005478600000000, -0.0019811500000000, -0.0004276700000000 ]  - [  -0.0001362600000000, -0.0007362700000000, -0.0005345600000000 ]  - [   0.0003545000000000, -0.0040783100000000,  0.0003048100000000 ]  - [   0.0000681600000000, -0.0004942500000000,  0.0003083100000000 ]  - [   0.0019286300000000,  0.0015116200000000, -0.0000119800000000 ]  - [  -0.0001816600000000,  0.0000710400000000,  0.0001130900000000 ]  - [  -0.0003545000000000, -0.0040783100000000, -0.0003048100000000 ]  - [  -0.0000681600000000, -0.0004942500000000, -0.0003083100000000 ]  - [  -0.0019286300000000,  0.0015116200000000,  0.0000119800000000 ]  - [   0.0001816600000000,  0.0000710400000000, -0.0001130900000000 ]  - [   0.0050283500000000,  0.0136557300000000, -0.0105602500000000 ]  - [  -0.0005305100000000, -0.0008431800000000,  0.0002537900000000 ]  - [   0.0011233500000000, -0.0003688200000000, -0.0001104900000000 ]  - [  -0.0002898800000000, -0.0001460800000000, -0.0005188000000000 ]  - [  -0.0014509500000000, -0.0012772000000000, -0.0016560600000000 ]  - [  -0.0007583900000000, -0.0009139500000000, -0.0007732700000000 ]  - [   0.0014509500000000, -0.0012772000000000,  0.0016560600000000 ]  - [   0.0007583900000000, -0.0009139500000000,  0.0007732700000000 ]  - [   0.0000000000000000, -0.1359812600000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0009373300000000,  0.0000000000000000 ]  - [   0.0001524900000000,  0.0031134800000000,  0.0012049800000000 ]  - [  -0.0004668900000000,  0.0009780600000000,  0.0001912100000000 ]  - [   0.0109759500000000, -0.0024276700000000, -0.0065314600000000 ]  - [   0.0009969200000000, -0.0000364600000000, -0.0009241700000000 ]  - [  -0.0011233500000000, -0.0003688200000000,  0.0001104900000000 ]  - [   0.0002898800000000, -0.0001460800000000,  0.0005188000000000 ]  - [  -0.0109759500000000, -0.0024276700000000,  0.0065314600000000 ]  - [  -0.0009969200000000, -0.0000364600000000,  0.0009241700000000 ]  - [   0.0005796200000000,  0.0046376900000000,  0.0024435300000000 ]  - [   0.0008330800000000,  0.0009997600000000,  0.0009195100000000 ]  - [  -0.0001524900000000,  0.0031134800000000, -0.0012049800000000 ]  - [   0.0004668900000000,  0.0009780600000000, -0.0001912100000000 ]  - [  -0.0005796200000000,  0.0046376900000000, -0.0024435300000000 ]  - [  -0.0008330800000000,  0.0009997600000000, -0.0009195100000000 ]  - [  -0.0050283500000000,  0.0136557300000000,  0.0105602500000000 ]  - [   0.0005305100000000, -0.0008431800000000, -0.0002537900000000 ]  - [   0.0000000000000000, -0.0004525700000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0008224400000000,  0.0000000000000000 ]  - [   0.0012996200000000,  0.0002659800000000,  0.0012628400000000 ]  - [  -0.0007579500000000, -0.0001326900000000, -0.0001604300000000 ]  - [   0.0017783500000000, -0.0001612200000000, -0.0024976200000000 ]  - [   0.0002855400000000, -0.0003272400000000, -0.0009636500000000 ]  - [  -0.0006839500000000, -0.0003543500000000, -0.0002784600000000 ]  - [  -0.0009570000000000, -0.0009905400000000, -0.0011783900000000 ]  - [   0.0006839500000000, -0.0003543500000000,  0.0002784600000000 ]  - [   0.0009570000000000, -0.0009905400000000,  0.0011783900000000 ]  - [  -0.0002902700000000,  0.0014147800000000, -0.0000421200000000 ]  - [   0.0002902700000000,  0.0014147800000000,  0.0000421200000000 ]  - [  -0.0007918300000000, -0.0007221100000000, -0.0007422200000000 ]  - [  -0.0005863100000000,  0.0004322800000000,  0.0001159700000000 ]  - [   0.0018149300000000,  0.0015530600000000, -0.0015798200000000 ]  - [   0.0004256100000000,  0.0004491900000000, -0.0010355400000000 ]  - [  -0.0017783500000000, -0.0001612200000000,  0.0024976200000000 ]  - [  -0.0002855400000000, -0.0003272400000000,  0.0009636500000000 ]  - [  -0.0018149300000000,  0.0015530600000000,  0.0015798200000000 ]  - [  -0.0004256100000000,  0.0004491900000000,  0.0010355400000000 ]  - [  -0.0031661800000000, -0.0037201400000000, -0.0011017700000000 ]  - [   0.0005349200000000,  0.0005734400000000,  0.0002967500000000 ]  - [   0.0007918300000000, -0.0007221100000000,  0.0007422200000000 ]  - [   0.0005863100000000,  0.0004322800000000, -0.0001159700000000 ]  - [   0.0031661800000000, -0.0037201400000000,  0.0011017700000000 ]  - [  -0.0005349200000000,  0.0005734400000000, -0.0002967500000000 ]  - [  -0.0012996200000000,  0.0002659800000000, -0.0012628400000000 ]  - [   0.0007579500000000, -0.0001326900000000,  0.0001604300000000 ]  - [  -0.0005967800000000, -0.0010783300000000,  0.0000494300000000 ]  - [   0.0005967800000000, -0.0010783300000000, -0.0000494300000000 ]- atom:   33  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0010774800000000, -0.0034441100000000, -0.0010449700000000 ]  - [  -0.0033638000000000, -0.0002359200000000,  0.0015109500000000 ]  - [   0.0034062600000000,  0.0090736100000000,  0.0053940700000000 ]  - [   0.0001069000000000,  0.0001447100000000, -0.0000517300000000 ]  - [  -0.0034062600000000,  0.0090736100000000, -0.0053940700000000 ]  - [  -0.0001069000000000,  0.0001447100000000,  0.0000517300000000 ]  - [   0.0033638000000000, -0.0002359200000000, -0.0015109500000000 ]  - [  -0.0010774800000000, -0.0034441100000000,  0.0010449700000000 ]  - [  -0.0624794900000000, -0.0644157300000000,  0.0185671500000000 ]  - [  -0.0001041800000000,  0.0002529800000000,  0.0007753700000000 ]  - [   0.0010206300000000,  0.0015297800000000, -0.0001515400000000 ]  - [   0.0003510700000000,  0.0002934100000000, -0.0002677000000000 ]  - [   0.0624794900000000, -0.0644157300000000, -0.0185671500000000 ]  - [   0.0001041800000000,  0.0002529800000000, -0.0007753700000000 ]  - [  -0.0010206300000000,  0.0015297800000000,  0.0001515400000000 ]  - [  -0.0003510700000000,  0.0002934100000000,  0.0002677000000000 ]  - [   0.0001311100000000,  0.0044773300000000, -0.0000273800000000 ]  - [   0.0004184800000000,  0.0009311600000000, -0.0000287600000000 ]  - [  -0.0014452100000000, -0.0019283300000000,  0.0002885600000000 ]  - [   0.0006710600000000, -0.0005045900000000,  0.0001635200000000 ]  - [  -0.0001311100000000,  0.0044773300000000,  0.0000273800000000 ]  - [  -0.0004184800000000,  0.0009311600000000,  0.0000287600000000 ]  - [   0.0014452100000000, -0.0019283300000000, -0.0002885600000000 ]  - [  -0.0006710600000000, -0.0005045900000000, -0.0001635200000000 ]  - [  -0.0058668500000000, -0.0149352500000000,  0.0106827600000000 ]  - [  -0.0004773500000000, -0.0007263300000000,  0.0000814200000000 ]  - [  -0.0001861200000000, -0.0003399300000000, -0.0019242000000000 ]  - [   0.0012361800000000, -0.0005703300000000, -0.0015319600000000 ]  - [  -0.0002742500000000, -0.0005417500000000, -0.0001093100000000 ]  - [  -0.0009596200000000, -0.0008929300000000, -0.0009794600000000 ]  - [   0.0002742500000000, -0.0005417500000000,  0.0001093100000000 ]  - [   0.0009596200000000, -0.0008929300000000,  0.0009794600000000 ]  - [   0.0000000000000000,  0.1377928500000000,  0.0000000000000000 ]  - [   0.0000000000000000,  0.0009116500000000,  0.0000000000000000 ]  - [  -0.0011591500000000, -0.0015397500000000, -0.0008638500000000 ]  - [  -0.0005420000000000,  0.0005889100000000,  0.0001460200000000 ]  - [  -0.0100945700000000,  0.0031314200000000,  0.0045689200000000 ]  - [  -0.0000647800000000,  0.0007530500000000, -0.0011219400000000 ]  - [   0.0001861200000000, -0.0003399300000000,  0.0019242000000000 ]  - [  -0.0012361800000000, -0.0005703300000000,  0.0015319600000000 ]  - [   0.0100945700000000,  0.0031314200000000, -0.0045689200000000 ]  - [   0.0000647800000000,  0.0007530500000000,  0.0011219400000000 ]  - [   0.0011723100000000, -0.0028284500000000, -0.0006369800000000 ]  - [   0.0008742200000000,  0.0008081700000000,  0.0008114100000000 ]  - [   0.0011591500000000, -0.0015397500000000,  0.0008638500000000 ]  - [   0.0005420000000000,  0.0005889100000000, -0.0001460200000000 ]  - [  -0.0011723100000000, -0.0028284500000000,  0.0006369800000000 ]  - [  -0.0008742200000000,  0.0008081700000000, -0.0008114100000000 ]  - [   0.0058668500000000, -0.0149352500000000, -0.0106827600000000 ]  - [   0.0004773500000000, -0.0007263300000000, -0.0000814200000000 ]  - [   0.0000000000000000, -0.0013963800000000,  0.0000000000000000 ]  - [   0.0000000000000000, -0.0010293500000000,  0.0000000000000000 ]  - [  -0.0023019300000000, -0.0018814900000000, -0.0009086800000000 ]  - [  -0.0002662000000000, -0.0013964300000000,  0.0004783100000000 ]  - [  -0.0008216500000000, -0.0005541800000000,  0.0004399100000000 ]  - [   0.0006509600000000, -0.0003894300000000, -0.0010794600000000 ]  - [  -0.0010349200000000, -0.0014554000000000, -0.0014804400000000 ]  - [  -0.0007605500000000, -0.0008163200000000, -0.0005737600000000 ]  - [   0.0010349200000000, -0.0014554000000000,  0.0014804400000000 ]  - [   0.0007605500000000, -0.0008163200000000,  0.0005737600000000 ]  - [   0.0003552700000000,  0.0004461900000000,  0.0000195300000000 ]  - [  -0.0003552700000000,  0.0004461900000000, -0.0000195300000000 ]  - [  -0.0002175800000000,  0.0022890800000000,  0.0010818000000000 ]  - [  -0.0004269700000000,  0.0011184200000000,  0.0002078500000000 ]  - [  -0.0008353200000000, -0.0008041800000000, -0.0005113800000000 ]  - [   0.0005011700000000,  0.0002466100000000, -0.0009885500000000 ]  - [   0.0008216500000000, -0.0005541800000000, -0.0004399100000000 ]  - [  -0.0006509600000000, -0.0003894300000000,  0.0010794600000000 ]  - [   0.0008353200000000, -0.0008041800000000,  0.0005113800000000 ]  - [  -0.0005011700000000,  0.0002466100000000,  0.0009885500000000 ]  - [   0.0048640400000000,  0.0055153300000000,  0.0028368800000000 ]  - [   0.0011833100000000,  0.0012370600000000,  0.0014617800000000 ]  - [   0.0002175800000000,  0.0022890800000000, -0.0010818000000000 ]  - [   0.0004269700000000,  0.0011184200000000, -0.0002078500000000 ]  - [  -0.0048640400000000,  0.0055153300000000, -0.0028368800000000 ]  - [  -0.0011833100000000,  0.0012370600000000, -0.0014617800000000 ]  - [   0.0023019300000000, -0.0018814900000000,  0.0009086800000000 ]  - [   0.0002662000000000, -0.0013964300000000, -0.0004783100000000 ]  - [   0.0005954300000000, -0.0007757800000000, -0.0000488400000000 ]  - [  -0.0005954300000000, -0.0007757800000000,  0.0000488400000000 ]- atom:   33  displacement:    [  -0.0024096060369692,  0.0000000000000000,  0.0097053489760339 ]  forces:  - [  -0.0016614900000000,  0.0020465400000000,  0.0034852000000000 ]  - [   0.0113993600000000, -0.0009949000000000, -0.0050813900000000 ]  - [  -0.0060477900000000, -0.0078620100000000, -0.0092219500000000 ]  - [   0.0020509200000000,  0.0001368800000000,  0.0011303600000000 ]  - [  -0.0060558900000000,  0.0078614900000000, -0.0092252500000000 ]  - [   0.0020468600000000, -0.0001342400000000,  0.0011300000000000 ]  - [   0.0114570200000000,  0.0009902500000000, -0.0050961300000000 ]  - [  -0.0016524500000000, -0.0021020000000000,  0.0035401100000000 ]  - [  -0.0508998800000000, -0.0244191800000000,  0.0332114400000000 ]  - [   0.0029727400000000,  0.0002529400000000,  0.0018726200000000 ]  - [  -0.0014972700000000, -0.0005816900000000, -0.0047791800000000 ]  - [   0.0023348400000000,  0.0010012000000000, -0.0011433200000000 ]  - [  -0.0529609000000000,  0.0256455900000000,  0.0328295300000000 ]  - [   0.0025000400000000,  0.0001927400000000,  0.0015822100000000 ]  - [  -0.0019762500000000,  0.0001394600000000, -0.0050615200000000 ]  - [   0.0018521300000000, -0.0014385900000000, -0.0014027700000000 ]  - [  -0.0004722800000000,  0.0011253100000000,  0.0043993900000000 ]  - [   0.0020127900000000, -0.0013796200000000,  0.0011137600000000 ]  - [  -0.0006387900000000, -0.0012436200000000, -0.0041461100000000 ]  - [   0.0011539400000000,  0.0005616900000000,  0.0002681400000000 ]  - [  -0.0009700200000000, -0.0006796900000000,  0.0041212000000000 ]  - [   0.0015236000000000,  0.0018348200000000,  0.0008512200000000 ]  - [  -0.0011279100000000,  0.0007800800000000, -0.0044132500000000 ]  - [   0.0006746100000000, -0.0009961600000000, -0.0000108300000000 ]  - [  -0.0021451800000000, -0.0199974100000000,  0.0073031100000000 ]  - [  -0.0012087700000000, -0.0001215300000000, -0.0005201900000000 ]  - [   0.0031870400000000,  0.0000150900000000,  0.0011139400000000 ]  - [  -0.0025975700000000,  0.0006794500000000,  0.0008457900000000 ]  - [   0.0006888900000000,  0.0000305300000000,  0.0022552800000000 ]  - [  -0.0013185600000000, -0.0012081300000000, -0.0012595300000000 ]  - [   0.0024000000000000, -0.0018404400000000,  0.0039858500000000 ]  - [   0.0003902900000000, -0.0006061500000000,  0.0004741400000000 ]  - [   0.1420093500000000,  0.0000387400000000, -0.0766103700000000 ]  - [  -0.0017498100000000,  0.0009269200000000, -0.0001074700000000 ]  - [   0.0006290400000000,  0.0030312500000000,  0.0023945200000000 ]  - [  -0.0011322200000000,  0.0000340100000000, -0.0001511100000000 ]  - [  -0.0227383500000000, -0.0004599500000000,  0.0091237500000000 ]  - [   0.0000108400000000,  0.0004370000000000, -0.0013597100000000 ]  - [   0.0022689500000000, -0.0007345100000000,  0.0031905700000000 ]  - [  -0.0035507200000000, -0.0013842900000000,  0.0028959800000000 ]  - [  -0.0232875500000000,  0.0011298700000000,  0.0109539600000000 ]  - [  -0.0009049800000000,  0.0002626200000000,  0.0006690100000000 ]  - [   0.0008612100000000,  0.0002991300000000, -0.0000084400000000 ]  - [   0.0000520800000000,  0.0004278900000000, -0.0001009700000000 ]  - [   0.0016413600000000, -0.0014588000000000,  0.0020552500000000 ]  - [  -0.0001116100000000,  0.0015082300000000, -0.0004807100000000 ]  - [  -0.0008495400000000,  0.0015124500000000, -0.0017404400000000 ]  - [  -0.0016573400000000,  0.0013847200000000, -0.0018320400000000 ]  - [  -0.0011719900000000,  0.0186082000000000,  0.0069596300000000 ]  - [  -0.0001907500000000, -0.0014193100000000, -0.0008453200000000 ]  - [   0.0004094100000000, -0.0009357800000000,  0.0013753800000000 ]  - [  -0.0017416500000000, -0.0009248100000000,  0.0006842000000000 ]  - [  -0.0001916300000000, -0.0011580800000000, -0.0009521100000000 ]  - [  -0.0018444600000000,  0.0012895300000000, -0.0009518100000000 ]  - [  -0.0004805700000000, -0.0004837600000000,  0.0012161300000000 ]  - [  -0.0001753900000000, -0.0001560700000000, -0.0008758900000000 ]  - [  -0.0000983700000000,  0.0002545400000000,  0.0024770500000000 ]  - [  -0.0010418200000000, -0.0011218100000000, -0.0009635600000000 ]  - [   0.0016312400000000, -0.0020702400000000,  0.0042517700000000 ]  - [   0.0006691100000000, -0.0006853200000000,  0.0007632500000000 ]  - [  -0.0003705100000000,  0.0008714900000000, -0.0004439600000000 ]  - [  -0.0003666000000000,  0.0009694900000000, -0.0004423200000000 ]  - [  -0.0005505700000000,  0.0028478000000000,  0.0024120800000000 ]  - [  -0.0008258200000000,  0.0003962000000000, -0.0004953400000000 ]  - [   0.0033778600000000,  0.0013612300000000, -0.0028624100000000 ]  - [  -0.0006306500000000, -0.0000587200000000, -0.0007628200000000 ]  - [  -0.0014075300000000, -0.0002159600000000,  0.0032423900000000 ]  - [  -0.0011046300000000, -0.0005372300000000,  0.0011507100000000 ]  - [   0.0024482900000000, -0.0006682400000000, -0.0008355700000000 ]  - [  -0.0015584400000000,  0.0007487800000000,  0.0012644400000000 ]  - [   0.0015382700000000, -0.0000428500000000, -0.0064895900000000 ]  - [  -0.0008576500000000,  0.0002203000000000, -0.0007685100000000 ]  - [   0.0004691900000000, -0.0012959200000000,  0.0020764800000000 ]  - [   0.0001960800000000,  0.0011399000000000, -0.0008141000000000 ]  - [  -0.0002485900000000,  0.0018720200000000, -0.0082352000000000 ]  - [  -0.0025739500000000,  0.0016020100000000, -0.0025239400000000 ]  - [   0.0008255400000000, -0.0003596400000000, -0.0012699600000000 ]  - [  -0.0008332300000000, -0.0028444300000000, -0.0012897800000000 ]  - [  -0.0001054000000000, -0.0007185800000000,  0.0004544600000000 ]  - [  -0.0000995400000000, -0.0011286900000000,  0.0004505400000000 ]