# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/8291aa10-6fce-453d-a545-2ea1515cff7b/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 Y2Se3 / I-42d (122) / materials id 673656](https://mdr.nims.go.jp/datasets/6f08a126-063e-4a44-8292-a1291a0e67ef)

## Fulltext

phonopy:  version: 2.17.1  frequency_unit_conversion_factor: 15.633302  symmetry_tolerance: 1.00000e-05  configuration:    save_params: ".true."physical_unit:  atomic_mass: "AMU"  length: "angstrom"  force_constants: "eV/angstrom^2"space_group:  type: "I-42d"  number: 122  Hall_symbol: "I -4 2bw"primitive_matrix:- [ -0.500000000000000,  0.500000000000000,  0.500000000000000 ]- [  0.500000000000000, -0.500000000000000,  0.500000000000000 ]- [  0.500000000000000,  0.500000000000000, -0.500000000000000 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [    -4.273843020000000,     4.273843020000000,    12.836728315000000 ] # a  - [     4.273843020000000,    -4.273843020000000,    12.836728315000000 ] # b  - [     4.273843020000000,     4.273843020000000,   -12.836728315000000 ] # c  points:  - symbol: Y  # 1    coordinates: [  0.583176630000000,  0.083176630000000,  0.500000000000000 ]    mass: 88.905850  - symbol: Y  # 2    coordinates: [  0.875000000000000,  0.508332660000000,  0.133332660000000 ]    mass: 88.905850  - symbol: Y  # 3    coordinates: [  0.578232550000000,  0.468265990000000,  0.625870440000000 ]    mass: 88.905850  - symbol: Y  # 4    coordinates: [  0.166823370000000,  0.166823370000000,  0.000000000000000 ]    mass: 88.905850  - symbol: Y  # 5    coordinates: [  0.842395550000000,  0.952362110000000,  0.374129560000000 ]    mass: 88.905850  - symbol: Y  # 6    coordinates: [  0.375000000000000,  0.741667340000000,  0.866667340000000 ]    mass: 88.905850  - symbol: Y  # 7    coordinates: [  0.531734010000000,  0.157604450000000,  0.109966560000000 ]    mass: 88.905850  - symbol: Y  # 8    coordinates: [  0.258332660000000,  0.125000000000000,  0.633332660000000 ]    mass: 88.905850  - symbol: Y  # 9    coordinates: [  0.833176630000000,  0.833176630000000,  0.000000000000000 ]    mass: 88.905850  - symbol: Y  # 10    coordinates: [  0.047637890000000,  0.421767450000000,  0.890033440000000 ]    mass: 88.905850  - symbol: Y  # 11    coordinates: [  0.491667340000000,  0.625000000000000,  0.366667340000000 ]    mass: 88.905850  - symbol: Y  # 12    coordinates: [  0.916823370000000,  0.416823370000000,  0.500000000000000 ]    mass: 88.905850  - symbol: Y  # 13    coordinates: [  0.218265990000000,  0.828232550000000,  0.125870440000000 ]    mass: 88.905850  - symbol: Y  # 14    coordinates: [  0.907604450000000,  0.781734010000000,  0.609966560000000 ]    mass: 88.905850  - symbol: Y  # 15    coordinates: [  0.702362110000000,  0.092395550000000,  0.874129560000000 ]    mass: 88.905850  - symbol: Y  # 16    coordinates: [  0.171767450000000,  0.297637890000000,  0.390033440000000 ]    mass: 88.905850  - symbol: Se # 17    coordinates: [  0.242842400000000,  0.996346210000000,  0.106213010000000 ]    mass: 78.960000  - symbol: Se # 18    coordinates: [  0.675891710000000,  0.784663800000000,  0.252458290000000 ]    mass: 78.960000  - symbol: Se # 19    coordinates: [  0.890133200000000,  0.136629390000000,  0.893786990000000 ]    mass: 78.960000  - symbol: Se # 20    coordinates: [  0.859866800000000,  0.253653790000000,  0.746496190000000 ]    mass: 78.960000  - symbol: Se # 21    coordinates: [  0.507157600000000,  0.113370610000000,  0.253503810000000 ]    mass: 78.960000  - symbol: Se # 22    coordinates: [  0.532205510000000,  0.423433420000000,  0.747541710000000 ]    mass: 78.960000  - symbol: Se # 23    coordinates: [  0.910468730000000,  0.654635910000000,  0.097513360000000 ]    mass: 78.960000  - symbol: Se # 24    coordinates: [  0.217794490000000,  0.465336200000000,  0.391227910000000 ]    mass: 78.960000  - symbol: Se # 25    coordinates: [  0.345364090000000,  0.442877450000000,  0.255832820000000 ]    mass: 78.960000  - symbol: Se # 26    coordinates: [  0.557122550000000,  0.812955370000000,  0.902486640000000 ]    mass: 78.960000  - symbol: Se # 27    coordinates: [  0.074108290000000,  0.826566580000000,  0.608772090000000 ]    mass: 78.960000  - symbol: Se # 28    coordinates: [  0.534663800000000,  0.925891710000000,  0.752458290000000 ]    mass: 78.960000  - symbol: Se # 29    coordinates: [  0.173433420000000,  0.782205510000000,  0.247541710000000 ]    mass: 78.960000  - symbol: Se # 30    coordinates: [  0.187044630000000,  0.089531270000000,  0.744167180000000 ]    mass: 78.960000  - symbol: Se # 31    coordinates: [  0.576566580000000,  0.324108290000000,  0.108772090000000 ]    mass: 78.960000  - symbol: Se # 32    coordinates: [  0.886629390000000,  0.140133200000000,  0.393786990000000 ]    mass: 78.960000  - symbol: Se # 33    coordinates: [  0.003653790000000,  0.109866800000000,  0.246496190000000 ]    mass: 78.960000  - symbol: Se # 34    coordinates: [  0.215336200000000,  0.467794490000000,  0.891227910000000 ]    mass: 78.960000  - symbol: Se # 35    coordinates: [  0.746346210000000,  0.492842400000000,  0.606213010000000 ]    mass: 78.960000  - symbol: Se # 36    coordinates: [  0.192877450000000,  0.595364090000000,  0.755832820000000 ]    mass: 78.960000  - symbol: Se # 37    coordinates: [  0.839531270000000,  0.437044630000000,  0.244167180000000 ]    mass: 78.960000  - symbol: Se # 38    coordinates: [  0.863370610000000,  0.757157600000000,  0.753503810000000 ]    mass: 78.960000  - symbol: Se # 39    coordinates: [  0.562955370000000,  0.807122550000000,  0.402486640000000 ]    mass: 78.960000  - symbol: Se # 40    coordinates: [  0.404635910000000,  0.160468730000000,  0.597513360000000 ]    mass: 78.960000  reciprocal_lattice: # without 2pi  - [     0.000000000000000,     0.116990726533517,     0.038950734776846 ] # a*  - [     0.116990726533517,     0.000000000000000,     0.038950734776846 ] # b*  - [     0.116990726533517,     0.116990726533517,     0.000000000000000 ] # c*unit_cell:  lattice:  - [     8.547686040000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     8.547686040000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    25.673456630000000 ] # c  points:  - symbol: Y  # 1    coordinates: [  0.000000000000000,  0.500000000000000,  0.083176630000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 2    coordinates: [  0.383332660000000,  0.750000000000000,  0.125000000000000 ]    mass: 88.905850    reduced_to: 2  - symbol: Y  # 3    coordinates: [  0.257951940000000,  0.367918500000000,  0.210314050000000 ]    mass: 88.905850    reduced_to: 3  - symbol: Y  # 4    coordinates: [  0.000000000000000,  0.000000000000000,  0.166823370000000 ]    mass: 88.905850    reduced_to: 4  - symbol: Y  # 5    coordinates: [  0.742048060000000,  0.632081500000000,  0.210314050000000 ]    mass: 88.905850    reduced_to: 5  - symbol: Y  # 6    coordinates: [  0.616667340000000,  0.250000000000000,  0.125000000000000 ]    mass: 88.905850    reduced_to: 6  - symbol: Y  # 7    coordinates: [  0.867918500000000,  0.242048060000000,  0.289685950000000 ]    mass: 88.905850    reduced_to: 7  - symbol: Y  # 8    coordinates: [  0.750000000000000,  0.883332660000000,  0.375000000000000 ]    mass: 88.905850    reduced_to: 8  - symbol: Y  # 9    coordinates: [  0.500000000000000,  0.500000000000000,  0.333176630000000 ]    mass: 88.905850    reduced_to: 9  - symbol: Y  # 10    coordinates: [  0.132081500000000,  0.757951940000000,  0.289685950000000 ]    mass: 88.905850    reduced_to: 10  - symbol: Y  # 11    coordinates: [  0.250000000000000,  0.116667340000000,  0.375000000000000 ]    mass: 88.905850    reduced_to: 11  - symbol: Y  # 12    coordinates: [  0.000000000000000,  0.500000000000000,  0.416823370000000 ]    mass: 88.905850    reduced_to: 12  - symbol: Y  # 13    coordinates: [  0.367918500000000,  0.757951940000000,  0.460314050000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 14    coordinates: [  0.242048060000000,  0.367918500000000,  0.539685950000000 ]    mass: 88.905850    reduced_to: 14  - symbol: Y  # 15    coordinates: [  0.632081500000000,  0.242048060000000,  0.460314050000000 ]    mass: 88.905850    reduced_to: 15  - symbol: Y  # 16    coordinates: [  0.757951940000000,  0.632081500000000,  0.539685950000000 ]    mass: 88.905850    reduced_to: 16  - symbol: Y  # 17    coordinates: [  0.500000000000000,  0.000000000000000,  0.583176630000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 18    coordinates: [  0.883332660000000,  0.250000000000000,  0.625000000000000 ]    mass: 88.905850    reduced_to: 2  - symbol: Y  # 19    coordinates: [  0.757951940000000,  0.867918500000000,  0.710314050000000 ]    mass: 88.905850    reduced_to: 3  - symbol: Y  # 20    coordinates: [  0.500000000000000,  0.500000000000000,  0.666823370000000 ]    mass: 88.905850    reduced_to: 4  - symbol: Y  # 21    coordinates: [  0.242048060000000,  0.132081500000000,  0.710314050000000 ]    mass: 88.905850    reduced_to: 5  - symbol: Y  # 22    coordinates: [  0.116667340000000,  0.750000000000000,  0.625000000000000 ]    mass: 88.905850    reduced_to: 6  - symbol: Y  # 23    coordinates: [  0.367918500000000,  0.742048060000000,  0.789685950000000 ]    mass: 88.905850    reduced_to: 7  - symbol: Y  # 24    coordinates: [  0.250000000000000,  0.383332660000000,  0.875000000000000 ]    mass: 88.905850    reduced_to: 8  - symbol: Y  # 25    coordinates: [  0.000000000000000,  0.000000000000000,  0.833176630000000 ]    mass: 88.905850    reduced_to: 9  - symbol: Y  # 26    coordinates: [  0.632081500000000,  0.257951940000000,  0.789685950000000 ]    mass: 88.905850    reduced_to: 10  - symbol: Y  # 27    coordinates: [  0.750000000000000,  0.616667340000000,  0.875000000000000 ]    mass: 88.905850    reduced_to: 11  - symbol: Y  # 28    coordinates: [  0.500000000000000,  0.000000000000000,  0.916823370000000 ]    mass: 88.905850    reduced_to: 12  - symbol: Y  # 29    coordinates: [  0.867918500000000,  0.257951940000000,  0.960314050000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 30    coordinates: [  0.742048060000000,  0.867918500000000,  0.039685950000000 ]    mass: 88.905850    reduced_to: 14  - symbol: Y  # 31    coordinates: [  0.132081500000000,  0.742048060000000,  0.960314050000000 ]    mass: 88.905850    reduced_to: 15  - symbol: Y  # 32    coordinates: [  0.257951940000000,  0.132081500000000,  0.039685950000000 ]    mass: 88.905850    reduced_to: 16  - symbol: Se # 33    coordinates: [  0.929858410000000,  0.176354600000000,  0.066487800000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 34    coordinates: [  0.680615190000000,  0.571843100000000,  0.104048610000000 ]    mass: 78.960000    reduced_to: 34  - symbol: Se # 35    coordinates: [  0.070141590000000,  0.823645400000000,  0.066487800000000 ]    mass: 78.960000    reduced_to: 35  - symbol: Se # 36    coordinates: [  0.070141590000000,  0.676354600000000,  0.183512200000000 ]    mass: 78.960000    reduced_to: 36  - symbol: Se # 37    coordinates: [  0.929858410000000,  0.323645400000000,  0.183512200000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 38    coordinates: [  0.319384810000000,  0.428156900000000,  0.104048610000000 ]    mass: 78.960000    reduced_to: 38  - symbol: Se # 39    coordinates: [  0.420840270000000,  0.676673090000000,  0.233795640000000 ]    mass: 78.960000    reduced_to: 39  - symbol: Se # 40    coordinates: [  0.319384810000000,  0.071843100000000,  0.145951390000000 ]    mass: 78.960000    reduced_to: 40  - symbol: Se # 41    coordinates: [  0.176673090000000,  0.079159730000000,  0.266204360000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 42    coordinates: [  0.579159730000000,  0.323326910000000,  0.233795640000000 ]    mass: 78.960000    reduced_to: 42  - symbol: Se # 43    coordinates: [  0.680615190000000,  0.928156900000000,  0.145951390000000 ]    mass: 78.960000    reduced_to: 43  - symbol: Se # 44    coordinates: [  0.571843100000000,  0.180615190000000,  0.354048610000000 ]    mass: 78.960000    reduced_to: 44  - symbol: Se # 45    coordinates: [  0.428156900000000,  0.819384810000000,  0.354048610000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Se # 46    coordinates: [  0.823326910000000,  0.920840270000000,  0.266204360000000 ]    mass: 78.960000    reduced_to: 46  - symbol: Se # 47    coordinates: [  0.928156900000000,  0.180615190000000,  0.395951390000000 ]    mass: 78.960000    reduced_to: 47  - symbol: Se # 48    coordinates: [  0.823645400000000,  0.570141590000000,  0.316487800000000 ]    mass: 78.960000    reduced_to: 48  - symbol: Se # 49    coordinates: [  0.676354600000000,  0.570141590000000,  0.433512200000000 ]    mass: 78.960000    reduced_to: 49  - symbol: Se # 50    coordinates: [  0.071843100000000,  0.819384810000000,  0.395951390000000 ]    mass: 78.960000    reduced_to: 50  - symbol: Se # 51    coordinates: [  0.176354600000000,  0.429858410000000,  0.316487800000000 ]    mass: 78.960000    reduced_to: 51  - symbol: Se # 52    coordinates: [  0.079159730000000,  0.676673090000000,  0.516204360000000 ]    mass: 78.960000    reduced_to: 52  - symbol: Se # 53    coordinates: [  0.920840270000000,  0.323326910000000,  0.516204360000000 ]    mass: 78.960000    reduced_to: 53  - symbol: Se # 54    coordinates: [  0.323645400000000,  0.429858410000000,  0.433512200000000 ]    mass: 78.960000    reduced_to: 54  - symbol: Se # 55    coordinates: [  0.323326910000000,  0.079159730000000,  0.483795640000000 ]    mass: 78.960000    reduced_to: 55  - symbol: Se # 56    coordinates: [  0.676673090000000,  0.920840270000000,  0.483795640000000 ]    mass: 78.960000    reduced_to: 56  - symbol: Se # 57    coordinates: [  0.429858410000000,  0.676354600000000,  0.566487800000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 58    coordinates: [  0.180615190000000,  0.071843100000000,  0.604048610000000 ]    mass: 78.960000    reduced_to: 34  - symbol: Se # 59    coordinates: [  0.570141590000000,  0.323645400000000,  0.566487800000000 ]    mass: 78.960000    reduced_to: 35  - symbol: Se # 60    coordinates: [  0.570141590000000,  0.176354600000000,  0.683512200000000 ]    mass: 78.960000    reduced_to: 36  - symbol: Se # 61    coordinates: [  0.429858410000000,  0.823645400000000,  0.683512200000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 62    coordinates: [  0.819384810000000,  0.928156900000000,  0.604048610000000 ]    mass: 78.960000    reduced_to: 38  - symbol: Se # 63    coordinates: [  0.920840270000000,  0.176673090000000,  0.733795640000000 ]    mass: 78.960000    reduced_to: 39  - symbol: Se # 64    coordinates: [  0.819384810000000,  0.571843100000000,  0.645951390000000 ]    mass: 78.960000    reduced_to: 40  - symbol: Se # 65    coordinates: [  0.676673090000000,  0.579159730000000,  0.766204360000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 66    coordinates: [  0.079159730000000,  0.823326910000000,  0.733795640000000 ]    mass: 78.960000    reduced_to: 42  - symbol: Se # 67    coordinates: [  0.180615190000000,  0.428156900000000,  0.645951390000000 ]    mass: 78.960000    reduced_to: 43  - symbol: Se # 68    coordinates: [  0.071843100000000,  0.680615190000000,  0.854048610000000 ]    mass: 78.960000    reduced_to: 44  - symbol: Se # 69    coordinates: [  0.928156900000000,  0.319384810000000,  0.854048610000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Se # 70    coordinates: [  0.323326910000000,  0.420840270000000,  0.766204360000000 ]    mass: 78.960000    reduced_to: 46  - symbol: Se # 71    coordinates: [  0.428156900000000,  0.680615190000000,  0.895951390000000 ]    mass: 78.960000    reduced_to: 47  - symbol: Se # 72    coordinates: [  0.323645400000000,  0.070141590000000,  0.816487800000000 ]    mass: 78.960000    reduced_to: 48  - symbol: Se # 73    coordinates: [  0.176354600000000,  0.070141590000000,  0.933512200000000 ]    mass: 78.960000    reduced_to: 49  - symbol: Se # 74    coordinates: [  0.571843100000000,  0.319384810000000,  0.895951390000000 ]    mass: 78.960000    reduced_to: 50  - symbol: Se # 75    coordinates: [  0.676354600000000,  0.929858410000000,  0.816487800000000 ]    mass: 78.960000    reduced_to: 51  - symbol: Se # 76    coordinates: [  0.579159730000000,  0.176673090000000,  0.016204360000000 ]    mass: 78.960000    reduced_to: 52  - symbol: Se # 77    coordinates: [  0.420840270000000,  0.823326910000000,  0.016204360000000 ]    mass: 78.960000    reduced_to: 53  - symbol: Se # 78    coordinates: [  0.823645400000000,  0.929858410000000,  0.933512200000000 ]    mass: 78.960000    reduced_to: 54  - symbol: Se # 79    coordinates: [  0.823326910000000,  0.579159730000000,  0.983795640000000 ]    mass: 78.960000    reduced_to: 55  - symbol: Se # 80    coordinates: [  0.176673090000000,  0.420840270000000,  0.983795640000000 ]    mass: 78.960000    reduced_to: 56supercell:  lattice:  - [     8.547686040000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     8.547686040000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    25.673456630000000 ] # c  points:  - symbol: Y  # 1    coordinates: [  0.000000000000000,  0.500000000000000,  0.083176630000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 2    coordinates: [  0.383332660000000,  0.750000000000000,  0.125000000000000 ]    mass: 88.905850    reduced_to: 2  - symbol: Y  # 3    coordinates: [  0.257951940000000,  0.367918500000000,  0.210314050000000 ]    mass: 88.905850    reduced_to: 3  - symbol: Y  # 4    coordinates: [  0.000000000000000,  0.000000000000000,  0.166823370000000 ]    mass: 88.905850    reduced_to: 4  - symbol: Y  # 5    coordinates: [  0.742048060000000,  0.632081500000000,  0.210314050000000 ]    mass: 88.905850    reduced_to: 5  - symbol: Y  # 6    coordinates: [  0.616667340000000,  0.250000000000000,  0.125000000000000 ]    mass: 88.905850    reduced_to: 6  - symbol: Y  # 7    coordinates: [  0.867918500000000,  0.242048060000000,  0.289685950000000 ]    mass: 88.905850    reduced_to: 7  - symbol: Y  # 8    coordinates: [  0.750000000000000,  0.883332660000000,  0.375000000000000 ]    mass: 88.905850    reduced_to: 8  - symbol: Y  # 9    coordinates: [  0.500000000000000,  0.500000000000000,  0.333176630000000 ]    mass: 88.905850    reduced_to: 9  - symbol: Y  # 10    coordinates: [  0.132081500000000,  0.757951940000000,  0.289685950000000 ]    mass: 88.905850    reduced_to: 10  - symbol: Y  # 11    coordinates: [  0.250000000000000,  0.116667340000000,  0.375000000000000 ]    mass: 88.905850    reduced_to: 11  - symbol: Y  # 12    coordinates: [  0.000000000000000,  0.500000000000000,  0.416823370000000 ]    mass: 88.905850    reduced_to: 12  - symbol: Y  # 13    coordinates: [  0.367918500000000,  0.757951940000000,  0.460314050000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 14    coordinates: [  0.242048060000000,  0.367918500000000,  0.539685950000000 ]    mass: 88.905850    reduced_to: 14  - symbol: Y  # 15    coordinates: [  0.632081500000000,  0.242048060000000,  0.460314050000000 ]    mass: 88.905850    reduced_to: 15  - symbol: Y  # 16    coordinates: [  0.757951940000000,  0.632081500000000,  0.539685950000000 ]    mass: 88.905850    reduced_to: 16  - symbol: Y  # 17    coordinates: [  0.500000000000000,  0.000000000000000,  0.583176630000000 ]    mass: 88.905850    reduced_to: 1  - symbol: Y  # 18    coordinates: [  0.883332660000000,  0.250000000000000,  0.625000000000000 ]    mass: 88.905850    reduced_to: 2  - symbol: Y  # 19    coordinates: [  0.757951940000000,  0.867918500000000,  0.710314050000000 ]    mass: 88.905850    reduced_to: 3  - symbol: Y  # 20    coordinates: [  0.500000000000000,  0.500000000000000,  0.666823370000000 ]    mass: 88.905850    reduced_to: 4  - symbol: Y  # 21    coordinates: [  0.242048060000000,  0.132081500000000,  0.710314050000000 ]    mass: 88.905850    reduced_to: 5  - symbol: Y  # 22    coordinates: [  0.116667340000000,  0.750000000000000,  0.625000000000000 ]    mass: 88.905850    reduced_to: 6  - symbol: Y  # 23    coordinates: [  0.367918500000000,  0.742048060000000,  0.789685950000000 ]    mass: 88.905850    reduced_to: 7  - symbol: Y  # 24    coordinates: [  0.250000000000000,  0.383332660000000,  0.875000000000000 ]    mass: 88.905850    reduced_to: 8  - symbol: Y  # 25    coordinates: [  0.000000000000000,  0.000000000000000,  0.833176630000000 ]    mass: 88.905850    reduced_to: 9  - symbol: Y  # 26    coordinates: [  0.632081500000000,  0.257951940000000,  0.789685950000000 ]    mass: 88.905850    reduced_to: 10  - symbol: Y  # 27    coordinates: [  0.750000000000000,  0.616667340000000,  0.875000000000000 ]    mass: 88.905850    reduced_to: 11  - symbol: Y  # 28    coordinates: [  0.500000000000000,  0.000000000000000,  0.916823370000000 ]    mass: 88.905850    reduced_to: 12  - symbol: Y  # 29    coordinates: [  0.867918500000000,  0.257951940000000,  0.960314050000000 ]    mass: 88.905850    reduced_to: 13  - symbol: Y  # 30    coordinates: [  0.742048060000000,  0.867918500000000,  0.039685950000000 ]    mass: 88.905850    reduced_to: 14  - symbol: Y  # 31    coordinates: [  0.132081500000000,  0.742048060000000,  0.960314050000000 ]    mass: 88.905850    reduced_to: 15  - symbol: Y  # 32    coordinates: [  0.257951940000000,  0.132081500000000,  0.039685950000000 ]    mass: 88.905850    reduced_to: 16  - symbol: Se # 33    coordinates: [  0.929858410000000,  0.176354600000000,  0.066487800000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 34    coordinates: [  0.680615190000000,  0.571843100000000,  0.104048610000000 ]    mass: 78.960000    reduced_to: 34  - symbol: Se # 35    coordinates: [  0.070141590000000,  0.823645400000000,  0.066487800000000 ]    mass: 78.960000    reduced_to: 35  - symbol: Se # 36    coordinates: [  0.070141590000000,  0.676354600000000,  0.183512200000000 ]    mass: 78.960000    reduced_to: 36  - symbol: Se # 37    coordinates: [  0.929858410000000,  0.323645400000000,  0.183512200000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 38    coordinates: [  0.319384810000000,  0.428156900000000,  0.104048610000000 ]    mass: 78.960000    reduced_to: 38  - symbol: Se # 39    coordinates: [  0.420840270000000,  0.676673090000000,  0.233795640000000 ]    mass: 78.960000    reduced_to: 39  - symbol: Se # 40    coordinates: [  0.319384810000000,  0.071843100000000,  0.145951390000000 ]    mass: 78.960000    reduced_to: 40  - symbol: Se # 41    coordinates: [  0.176673090000000,  0.079159730000000,  0.266204360000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 42    coordinates: [  0.579159730000000,  0.323326910000000,  0.233795640000000 ]    mass: 78.960000    reduced_to: 42  - symbol: Se # 43    coordinates: [  0.680615190000000,  0.928156900000000,  0.145951390000000 ]    mass: 78.960000    reduced_to: 43  - symbol: Se # 44    coordinates: [  0.571843100000000,  0.180615190000000,  0.354048610000000 ]    mass: 78.960000    reduced_to: 44  - symbol: Se # 45    coordinates: [  0.428156900000000,  0.819384810000000,  0.354048610000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Se # 46    coordinates: [  0.823326910000000,  0.920840270000000,  0.266204360000000 ]    mass: 78.960000    reduced_to: 46  - symbol: Se # 47    coordinates: [  0.928156900000000,  0.180615190000000,  0.395951390000000 ]    mass: 78.960000    reduced_to: 47  - symbol: Se # 48    coordinates: [  0.823645400000000,  0.570141590000000,  0.316487800000000 ]    mass: 78.960000    reduced_to: 48  - symbol: Se # 49    coordinates: [  0.676354600000000,  0.570141590000000,  0.433512200000000 ]    mass: 78.960000    reduced_to: 49  - symbol: Se # 50    coordinates: [  0.071843100000000,  0.819384810000000,  0.395951390000000 ]    mass: 78.960000    reduced_to: 50  - symbol: Se # 51    coordinates: [  0.176354600000000,  0.429858410000000,  0.316487800000000 ]    mass: 78.960000    reduced_to: 51  - symbol: Se # 52    coordinates: [  0.079159730000000,  0.676673090000000,  0.516204360000000 ]    mass: 78.960000    reduced_to: 52  - symbol: Se # 53    coordinates: [  0.920840270000000,  0.323326910000000,  0.516204360000000 ]    mass: 78.960000    reduced_to: 53  - symbol: Se # 54    coordinates: [  0.323645400000000,  0.429858410000000,  0.433512200000000 ]    mass: 78.960000    reduced_to: 54  - symbol: Se # 55    coordinates: [  0.323326910000000,  0.079159730000000,  0.483795640000000 ]    mass: 78.960000    reduced_to: 55  - symbol: Se # 56    coordinates: [  0.676673090000000,  0.920840270000000,  0.483795640000000 ]    mass: 78.960000    reduced_to: 56  - symbol: Se # 57    coordinates: [  0.429858410000000,  0.676354600000000,  0.566487800000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 58    coordinates: [  0.180615190000000,  0.071843100000000,  0.604048610000000 ]    mass: 78.960000    reduced_to: 34  - symbol: Se # 59    coordinates: [  0.570141590000000,  0.323645400000000,  0.566487800000000 ]    mass: 78.960000    reduced_to: 35  - symbol: Se # 60    coordinates: [  0.570141590000000,  0.176354600000000,  0.683512200000000 ]    mass: 78.960000    reduced_to: 36  - symbol: Se # 61    coordinates: [  0.429858410000000,  0.823645400000000,  0.683512200000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 62    coordinates: [  0.819384810000000,  0.928156900000000,  0.604048610000000 ]    mass: 78.960000    reduced_to: 38  - symbol: Se # 63    coordinates: [  0.920840270000000,  0.176673090000000,  0.733795640000000 ]    mass: 78.960000    reduced_to: 39  - symbol: Se # 64    coordinates: [  0.819384810000000,  0.571843100000000,  0.645951390000000 ]    mass: 78.960000    reduced_to: 40  - symbol: Se # 65    coordinates: [  0.676673090000000,  0.579159730000000,  0.766204360000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 66    coordinates: [  0.079159730000000,  0.823326910000000,  0.733795640000000 ]    mass: 78.960000    reduced_to: 42  - symbol: Se # 67    coordinates: [  0.180615190000000,  0.428156900000000,  0.645951390000000 ]    mass: 78.960000    reduced_to: 43  - symbol: Se # 68    coordinates: [  0.071843100000000,  0.680615190000000,  0.854048610000000 ]    mass: 78.960000    reduced_to: 44  - symbol: Se # 69    coordinates: [  0.928156900000000,  0.319384810000000,  0.854048610000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Se # 70    coordinates: [  0.323326910000000,  0.420840270000000,  0.766204360000000 ]    mass: 78.960000    reduced_to: 46  - symbol: Se # 71    coordinates: [  0.428156900000000,  0.680615190000000,  0.895951390000000 ]    mass: 78.960000    reduced_to: 47  - symbol: Se # 72    coordinates: [  0.323645400000000,  0.070141590000000,  0.816487800000000 ]    mass: 78.960000    reduced_to: 48  - symbol: Se # 73    coordinates: [  0.176354600000000,  0.070141590000000,  0.933512200000000 ]    mass: 78.960000    reduced_to: 49  - symbol: Se # 74    coordinates: [  0.571843100000000,  0.319384810000000,  0.895951390000000 ]    mass: 78.960000    reduced_to: 50  - symbol: Se # 75    coordinates: [  0.676354600000000,  0.929858410000000,  0.816487800000000 ]    mass: 78.960000    reduced_to: 51  - symbol: Se # 76    coordinates: [  0.579159730000000,  0.176673090000000,  0.016204360000000 ]    mass: 78.960000    reduced_to: 52  - symbol: Se # 77    coordinates: [  0.420840270000000,  0.823326910000000,  0.016204360000000 ]    mass: 78.960000    reduced_to: 53  - symbol: Se # 78    coordinates: [  0.823645400000000,  0.929858410000000,  0.933512200000000 ]    mass: 78.960000    reduced_to: 54  - symbol: Se # 79    coordinates: [  0.823326910000000,  0.579159730000000,  0.983795640000000 ]    mass: 78.960000    reduced_to: 55  - symbol: Se # 80    coordinates: [  0.176673090000000,  0.420840270000000,  0.983795640000000 ]    mass: 78.960000    reduced_to: 56displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0726556600000000, -0.0004242400000000, -0.0002004200000000 ]  - [   0.0072809700000000,  0.0049851000000000,  0.0016024400000000 ]  - [  -0.0013379200000000, -0.0011042100000000,  0.0067216700000000 ]  - [  -0.0025378700000000,  0.0016009900000000,  0.0000602800000000 ]  - [  -0.0012008900000000, -0.0010914100000000, -0.0066425500000000 ]  - [   0.0071368700000000,  0.0048884300000000, -0.0015770900000000 ]  - [   0.0007700600000000,  0.0001030600000000, -0.0004450600000000 ]  - [  -0.0000459000000000, -0.0000504100000000,  0.0000715600000000 ]  - [   0.0000800500000000,  0.0000035200000000, -0.0000640200000000 ]  - [   0.0007878500000000, -0.0000139400000000,  0.0004060500000000 ]  - [  -0.0000485300000000, -0.0001554100000000, -0.0000681900000000 ]  - [  -0.0001930200000000, -0.0000000200000000,  0.0000720700000000 ]  - [   0.0000178800000000, -0.0000509900000000,  0.0000190200000000 ]  - [   0.0000520200000000, -0.0000181600000000, -0.0000080700000000 ]  - [   0.0000318100000000,  0.0000677000000000,  0.0000117000000000 ]  - [  -0.0000669900000000, -0.0000050700000000, -0.0000140800000000 ]  - [   0.0000061400000000, -0.0000000900000000, -0.0000657100000000 ]  - [   0.0000391200000000,  0.0000055700000000,  0.0000083400000000 ]  - [  -0.0000953500000000, -0.0000650800000000,  0.0000801100000000 ]  - [   0.0001405800000000,  0.0000534300000000,  0.0000708900000000 ]  - [   0.0000248200000000, -0.0000509300000000, -0.0000500200000000 ]  - [  -0.0000660200000000,  0.0000054100000000, -0.0000041500000000 ]  - [  -0.0000384400000000,  0.0001222600000000,  0.0000164400000000 ]  - [   0.0007473300000000,  0.0003382300000000, -0.0019393300000000 ]  - [  -0.0004508200000000,  0.0000035700000000, -0.0000670700000000 ]  - [  -0.0000273900000000,  0.0000049500000000, -0.0000396400000000 ]  - [   0.0007398200000000,  0.0002392200000000,  0.0019629700000000 ]  - [   0.0007153800000000, -0.0000000700000000,  0.0000620400000000 ]  - [  -0.0014657200000000,  0.0024977600000000,  0.0027766000000000 ]  - [   0.0000424600000000, -0.0059968200000000,  0.0020576900000000 ]  - [  -0.0014667300000000,  0.0026115900000000, -0.0027411600000000 ]  - [  -0.0000994200000000, -0.0060453600000000, -0.0021255800000000 ]  - [   0.0038629600000000,  0.0051596900000000,  0.0010750000000000 ]  - [   0.0193752400000000, -0.0070843600000000, -0.0029312400000000 ]  - [   0.0037418700000000,  0.0052210300000000, -0.0010048900000000 ]  - [   0.0025517200000000,  0.0008642500000000,  0.0010832800000000 ]  - [   0.0026315100000000,  0.0009612000000000, -0.0011044700000000 ]  - [   0.0205806200000000, -0.0074434600000000,  0.0029860600000000 ]  - [  -0.0009655700000000, -0.0004245500000000, -0.0001646400000000 ]  - [   0.0012385600000000,  0.0016809700000000, -0.0006371100000000 ]  - [   0.0004814500000000, -0.0001938700000000,  0.0003919500000000 ]  - [  -0.0009256200000000, -0.0004613600000000,  0.0000974300000000 ]  - [   0.0012054100000000,  0.0016690300000000,  0.0008311500000000 ]  - [  -0.0000290000000000, -0.0000709900000000, -0.0000922700000000 ]  - [  -0.0000075400000000, -0.0000507500000000, -0.0001103600000000 ]  - [   0.0004385800000000, -0.0002380800000000, -0.0003422200000000 ]  - [   0.0000892900000000, -0.0000105900000000,  0.0001758300000000 ]  - [   0.0003901800000000, -0.0001718900000000,  0.0006053600000000 ]  - [  -0.0000715900000000, -0.0000315300000000,  0.0000124300000000 ]  - [   0.0000646000000000,  0.0000114700000000,  0.0000255800000000 ]  - [   0.0002943900000000, -0.0000921400000000, -0.0005769800000000 ]  - [   0.0000270100000000,  0.0000161800000000,  0.0000271500000000 ]  - [  -0.0000093900000000, -0.0000229300000000,  0.0000225100000000 ]  - [   0.0000304500000000,  0.0000484600000000, -0.0000566200000000 ]  - [  -0.0000134700000000,  0.0000243300000000, -0.0000180100000000 ]  - [   0.0000265800000000, -0.0000108300000000, -0.0000377000000000 ]  - [   0.0000345600000000, -0.0000548400000000,  0.0000128700000000 ]  - [  -0.0000112800000000, -0.0000040800000000, -0.0000903300000000 ]  - [  -0.0000458900000000,  0.0000468700000000,  0.0000245300000000 ]  - [  -0.0000718700000000, -0.0000452700000000, -0.0000181400000000 ]  - [   0.0000080100000000,  0.0000571900000000, -0.0000254400000000 ]  - [   0.0000105900000000,  0.0000160500000000, -0.0001104800000000 ]  - [   0.0000112600000000,  0.0000198400000000, -0.0000460900000000 ]  - [   0.0000284300000000, -0.0000188400000000,  0.0000639200000000 ]  - [  -0.0002352600000000, -0.0001428200000000, -0.0004927400000000 ]  - [   0.0000467700000000, -0.0000204900000000, -0.0000086300000000 ]  - [   0.0000058700000000,  0.0000019800000000,  0.0001327500000000 ]  - [   0.0006903600000000, -0.0002079300000000, -0.0000001500000000 ]  - [   0.0007150900000000, -0.0001861300000000, -0.0001973000000000 ]  - [  -0.0002729600000000, -0.0001779400000000,  0.0005372200000000 ]  - [  -0.0004565000000000, -0.0002069100000000,  0.0002848700000000 ]  - [  -0.0000241300000000,  0.0000444900000000,  0.0001170800000000 ]  - [  -0.0001724400000000,  0.0005447800000000,  0.0004779500000000 ]  - [  -0.0004768000000000, -0.0001896800000000, -0.0000882500000000 ]  - [  -0.0001254600000000,  0.0001257600000000, -0.0000781500000000 ]  - [  -0.0005595600000000,  0.0005464800000000,  0.0003382200000000 ]  - [  -0.0005725600000000,  0.0004988800000000, -0.0002753400000000 ]  - [  -0.0000756100000000,  0.0006281800000000, -0.0005134300000000 ]  - [   0.0047895900000000, -0.0014996800000000,  0.0017280200000000 ]  - [   0.0049350700000000, -0.0015837600000000, -0.0019779400000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0004333700000000, -0.0761752100000000,  0.0000313100000000 ]  - [   0.0055034700000000, -0.0002052600000000,  0.0017065700000000 ]  - [  -0.0015579200000000, -0.0010050400000000, -0.0019295600000000 ]  - [  -0.0016013000000000,  0.0070071400000000,  0.0001079300000000 ]  - [  -0.0014424700000000, -0.0009963100000000,  0.0019477300000000 ]  - [   0.0053361300000000, -0.0001771600000000, -0.0016698000000000 ]  - [  -0.0001425300000000,  0.0006122100000000, -0.0016546500000000 ]  - [  -0.0000754700000000,  0.0000564500000000,  0.0000547900000000 ]  - [  -0.0001051600000000, -0.0004506500000000, -0.0000677500000000 ]  - [  -0.0001254800000000,  0.0005010800000000,  0.0016096000000000 ]  - [  -0.0000780400000000, -0.0000505500000000, -0.0000584200000000 ]  - [  -0.0000000700000000, -0.0001930100000000,  0.0000667900000000 ]  - [   0.0000333600000000, -0.0000808600000000,  0.0000726600000000 ]  - [   0.0000518000000000, -0.0000093800000000, -0.0000222800000000 ]  - [   0.0000471600000000,  0.0000377800000000, -0.0000494700000000 ]  - [  -0.0000671200000000,  0.0000042100000000, -0.0000069900000000 ]  - [   0.0000000300000000,  0.0000023500000000, -0.0000698300000000 ]  - [   0.0000709600000000, -0.0000029600000000, -0.0000040500000000 ]  - [  -0.0000775900000000,  0.0000285400000000,  0.0000076800000000 ]  - [  -0.0000533600000000, -0.0000209200000000,  0.0000666000000000 ]  - [   0.0000422900000000,  0.0000423100000000,  0.0000147100000000 ]  - [  -0.0000343500000000, -0.0000042100000000,  0.0000004600000000 ]  - [   0.0000726400000000, -0.0000091500000000, -0.0000068200000000 ]  - [  -0.0001269300000000,  0.0006462000000000,  0.0007982300000000 ]  - [  -0.0001052800000000,  0.0000801100000000, -0.0000704700000000 ]  - [   0.0000858500000000, -0.0001256000000000, -0.0000233500000000 ]  - [  -0.0001267200000000,  0.0005483000000000, -0.0007856900000000 ]  - [  -0.0000001100000000,  0.0007154800000000,  0.0000615100000000 ]  - [   0.0017814700000000, -0.0009488900000000,  0.0072505800000000 ]  - [  -0.0045854200000000,  0.0068941800000000, -0.0017747100000000 ]  - [   0.0017968100000000, -0.0008457000000000, -0.0072876100000000 ]  - [  -0.0046183700000000,  0.0068591800000000,  0.0017306100000000 ]  - [   0.0063820900000000,  0.0191805600000000,  0.0049048600000000 ]  - [  -0.0053833300000000,  0.0037320800000000,  0.0002721500000000 ]  - [   0.0066738800000000,  0.0204545700000000, -0.0050978200000000 ]  - [   0.0013090900000000,  0.0028512100000000,  0.0023132200000000 ]  - [   0.0013506600000000,  0.0028408700000000, -0.0021761100000000 ]  - [  -0.0054018000000000,  0.0037926500000000, -0.0004824800000000 ]  - [  -0.0004937600000000,  0.0003064100000000, -0.0004706900000000 ]  - [  -0.0005148200000000, -0.0010412000000000, -0.0003371200000000 ]  - [   0.0001016100000000, -0.0006575100000000,  0.0002147100000000 ]  - [  -0.0004548600000000,  0.0002635100000000,  0.0004134700000000 ]  - [  -0.0005287300000000, -0.0009893900000000,  0.0005264300000000 ]  - [  -0.0001081700000000, -0.0000472900000000, -0.0000259900000000 ]  - [  -0.0000863600000000, -0.0000258900000000, -0.0001705100000000 ]  - [   0.0000570400000000, -0.0006951200000000, -0.0001611000000000 ]  - [   0.0002281500000000, -0.0000479900000000,  0.0004929600000000 ]  - [   0.0002193000000000,  0.0005224100000000, -0.0000912000000000 ]  - [  -0.0000464100000000, -0.0000070900000000, -0.0000493200000000 ]  - [   0.0002052700000000, -0.0000259000000000, -0.0002887100000000 ]  - [   0.0001171400000000,  0.0006079200000000,  0.0001308200000000 ]  - [   0.0000233300000000,  0.0000401500000000,  0.0000021600000000 ]  - [  -0.0000123200000000, -0.0000002500000000,  0.0000533200000000 ]  - [   0.0000554100000000,  0.0000735100000000,  0.0000096900000000 ]  - [  -0.0000278700000000, -0.0000016700000000, -0.0000200000000000 ]  - [   0.0000118400000000, -0.0000381300000000, -0.0000299600000000 ]  - [   0.0000409100000000, -0.0000424900000000,  0.0000156000000000 ]  - [  -0.0000074100000000, -0.0000167000000000, -0.0000979400000000 ]  - [  -0.0000389100000000,  0.0000593700000000,  0.0000273000000000 ]  - [  -0.0000393300000000, -0.0000425900000000, -0.0000067400000000 ]  - [   0.0000412500000000,  0.0000603400000000, -0.0000316200000000 ]  - [   0.0000148600000000,  0.0000042500000000, -0.0000987500000000 ]  - [  -0.0000138100000000,  0.0000084500000000, -0.0000455200000000 ]  - [   0.0000132900000000, -0.0000026900000000,  0.0001055400000000 ]  - [   0.0000952300000000,  0.0000899600000000,  0.0002319900000000 ]  - [   0.0000227100000000, -0.0000308900000000, -0.0000038100000000 ]  - [  -0.0000089400000000,  0.0000173300000000,  0.0000946200000000 ]  - [   0.0000242500000000,  0.0001651300000000,  0.0002827600000000 ]  - [   0.0000450000000000,  0.0001851200000000, -0.0004746700000000 ]  - [   0.0000568100000000,  0.0000560700000000, -0.0001815100000000 ]  - [   0.0001150300000000,  0.0003300100000000, -0.0000171700000000 ]  - [   0.0001150500000000, -0.0000481700000000,  0.0000728000000000 ]  - [   0.0003679200000000, -0.0006302800000000,  0.0000879300000000 ]  - [   0.0000980900000000,  0.0003495900000000,  0.0002192500000000 ]  - [   0.0000134500000000,  0.0000324700000000, -0.0000262200000000 ]  - [  -0.0012097800000000, -0.0003872000000000, -0.0013488600000000 ]  - [  -0.0012723000000000, -0.0004280200000000,  0.0014118900000000 ]  - [   0.0004756400000000, -0.0005544900000000, -0.0001172800000000 ]  - [  -0.0010673500000000,  0.0035202800000000, -0.0003486600000000 ]  - [  -0.0010229600000000,  0.0034820900000000,  0.0002700200000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0473860600000000 ]  - [   0.0018281800000000,  0.0021401800000000, -0.0033600600000000 ]  - [   0.0046332600000000, -0.0022332400000000,  0.0019307800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059392200000000 ]  - [  -0.0046332600000000,  0.0022332400000000,  0.0019307800000000 ]  - [  -0.0018281800000000, -0.0021401800000000, -0.0033600600000000 ]  - [  -0.0002087100000000,  0.0002016100000000,  0.0032577500000000 ]  - [  -0.0003356600000000,  0.0000272300000000,  0.0016925400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010914500000000 ]  - [   0.0002087100000000, -0.0002016100000000,  0.0032577500000000 ]  - [   0.0003356600000000, -0.0000272300000000,  0.0016925400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017124500000000 ]  - [  -0.0000356100000000, -0.0000361000000000,  0.0014719200000000 ]  - [   0.0000652300000000,  0.0000276100000000,  0.0014379400000000 ]  - [   0.0000356100000000,  0.0000361000000000,  0.0014719200000000 ]  - [  -0.0000652300000000, -0.0000276100000000,  0.0014379400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016481800000000 ]  - [   0.0000690800000000, -0.0001617300000000,  0.0016133100000000 ]  - [  -0.0000328700000000, -0.0000951700000000,  0.0013953800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018945400000000 ]  - [   0.0000328700000000,  0.0000951700000000,  0.0013953800000000 ]  - [  -0.0000690800000000,  0.0001617300000000,  0.0016133100000000 ]  - [   0.0000246600000000, -0.0000780100000000,  0.0014476800000000 ]  - [  -0.0003479300000000,  0.0001309500000000,  0.0038802500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010897600000000 ]  - [  -0.0000246600000000,  0.0000780100000000,  0.0014476800000000 ]  - [   0.0003479300000000, -0.0001309500000000,  0.0038802500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011055200000000 ]  - [   0.0032992600000000,  0.0069820200000000,  0.0026628700000000 ]  - [   0.0019318000000000, -0.0028236400000000, -0.0044435500000000 ]  - [  -0.0032992600000000, -0.0069820200000000,  0.0026628700000000 ]  - [  -0.0019318000000000,  0.0028236400000000, -0.0044435500000000 ]  - [   0.0016256100000000,  0.0051641100000000,  0.0066954500000000 ]  - [  -0.0059725700000000,  0.0007904500000000,  0.0041086400000000 ]  - [  -0.0016256100000000, -0.0051641100000000,  0.0066954500000000 ]  - [   0.0011154600000000,  0.0016195000000000,  0.0065228300000000 ]  - [  -0.0011154600000000, -0.0016195000000000,  0.0065228300000000 ]  - [   0.0059725700000000, -0.0007904500000000,  0.0041086400000000 ]  - [  -0.0012087400000000, -0.0001178600000000,  0.0001176600000000 ]  - [   0.0000434000000000,  0.0008163600000000,  0.0022036500000000 ]  - [  -0.0005818900000000,  0.0002295500000000, -0.0011100800000000 ]  - [   0.0012087400000000,  0.0001178600000000,  0.0001176600000000 ]  - [  -0.0000434000000000, -0.0008163600000000,  0.0022036500000000 ]  - [   0.0003051400000000, -0.0000245100000000, -0.0008541500000000 ]  - [  -0.0003051400000000,  0.0000245100000000, -0.0008541500000000 ]  - [   0.0005818900000000, -0.0002295500000000, -0.0011100800000000 ]  - [  -0.0000732000000000, -0.0000613200000000, -0.0010607300000000 ]  - [   0.0003676000000000, -0.0000587500000000, -0.0008119300000000 ]  - [  -0.0000705200000000,  0.0001093600000000, -0.0011302900000000 ]  - [   0.0000732000000000,  0.0000613200000000, -0.0010607300000000 ]  - [  -0.0003676000000000,  0.0000587500000000, -0.0008119300000000 ]  - [   0.0001915600000000, -0.0001362800000000, -0.0012091900000000 ]  - [  -0.0001915600000000,  0.0001362800000000, -0.0012091900000000 ]  - [   0.0000705200000000, -0.0001093600000000, -0.0011302900000000 ]  - [  -0.0001879200000000, -0.0001544300000000, -0.0012460400000000 ]  - [   0.0001879200000000,  0.0001544300000000, -0.0012460400000000 ]  - [   0.0001654100000000,  0.0000030400000000, -0.0010464500000000 ]  - [   0.0001059400000000,  0.0001859200000000, -0.0008912200000000 ]  - [  -0.0001654100000000, -0.0000030400000000, -0.0010464500000000 ]  - [   0.0000850400000000, -0.0001368200000000, -0.0010821400000000 ]  - [  -0.0000850400000000,  0.0001368200000000, -0.0010821400000000 ]  - [  -0.0001059400000000, -0.0001859200000000, -0.0008912200000000 ]  - [   0.0001709200000000,  0.0001467800000000, -0.0012708800000000 ]  - [   0.0001445100000000, -0.0001843900000000, -0.0007144700000000 ]  - [  -0.0002870600000000,  0.0000462400000000, -0.0015880800000000 ]  - [  -0.0001709200000000, -0.0001467800000000, -0.0012708800000000 ]  - [  -0.0001445100000000,  0.0001843900000000, -0.0007144700000000 ]  - [   0.0002952800000000,  0.0006609000000000, -0.0007369100000000 ]  - [  -0.0002952800000000, -0.0006609000000000, -0.0007369100000000 ]  - [   0.0002870600000000, -0.0000462400000000, -0.0015880800000000 ]  - [   0.0003866800000000,  0.0007558100000000, -0.0007251000000000 ]  - [  -0.0000136800000000, -0.0002912100000000, -0.0007173300000000 ]  - [   0.0006992500000000, -0.0014393200000000,  0.0002227700000000 ]  - [  -0.0003866800000000, -0.0007558100000000, -0.0007251000000000 ]  - [   0.0000136800000000,  0.0002912100000000, -0.0007173300000000 ]  - [  -0.0006021900000000,  0.0003377000000000,  0.0027001300000000 ]  - [   0.0006021900000000, -0.0003377000000000,  0.0027001300000000 ]  - [  -0.0006992500000000,  0.0014393200000000,  0.0002227700000000 ]  - [   0.0027736000000000, -0.0004918400000000,  0.0041342500000000 ]  - [  -0.0027736000000000,  0.0004918400000000,  0.0041342500000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0471872800000000 ]  - [  -0.0017134200000000, -0.0021629400000000,  0.0033326300000000 ]  - [  -0.0047054500000000,  0.0021940700000000, -0.0018682100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0060567500000000 ]  - [   0.0047054500000000, -0.0021940700000000, -0.0018682100000000 ]  - [   0.0017134200000000,  0.0021629400000000,  0.0033326300000000 ]  - [   0.0001899700000000, -0.0000843400000000, -0.0032866800000000 ]  - [   0.0003393800000000,  0.0000776200000000, -0.0016943500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012251700000000 ]  - [  -0.0001899700000000,  0.0000843400000000, -0.0032866800000000 ]  - [  -0.0003393800000000, -0.0000776200000000, -0.0016943500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015807200000000 ]  - [   0.0000227200000000, -0.0000832300000000, -0.0014479100000000 ]  - [   0.0000544300000000, -0.0000400500000000, -0.0014657000000000 ]  - [  -0.0000227200000000,  0.0000832300000000, -0.0014479100000000 ]  - [  -0.0000544300000000,  0.0000400500000000, -0.0014657000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017864400000000 ]  - [   0.0000357500000000,  0.0001631800000000, -0.0016162600000000 ]  - [  -0.0000887600000000,  0.0000821600000000, -0.0013720400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017612100000000 ]  - [   0.0000887600000000, -0.0000821600000000, -0.0013720400000000 ]  - [  -0.0000357500000000, -0.0001631800000000, -0.0016162600000000 ]  - [  -0.0000354600000000,  0.0001949300000000, -0.0014780400000000 ]  - [   0.0003530900000000, -0.0000371700000000, -0.0038900100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012267400000000 ]  - [   0.0000354600000000, -0.0001949300000000, -0.0014780400000000 ]  - [  -0.0003530900000000,  0.0000371700000000, -0.0038900100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0012479700000000 ]  - [  -0.0033572800000000, -0.0071796700000000, -0.0027029400000000 ]  - [  -0.0017993200000000,  0.0028252400000000,  0.0044684100000000 ]  - [   0.0033572800000000,  0.0071796700000000, -0.0027029400000000 ]  - [   0.0017993200000000, -0.0028252400000000,  0.0044684100000000 ]  - [  -0.0015489700000000, -0.0051967100000000, -0.0065826300000000 ]  - [   0.0059755900000000, -0.0007915700000000, -0.0043488500000000 ]  - [   0.0015489700000000,  0.0051967100000000, -0.0065826300000000 ]  - [  -0.0011024200000000, -0.0014813700000000, -0.0060936000000000 ]  - [   0.0011024200000000,  0.0014813700000000, -0.0060936000000000 ]  - [  -0.0059755900000000,  0.0007915700000000, -0.0043488500000000 ]  - [   0.0011511500000000,  0.0001561400000000, -0.0001778300000000 ]  - [  -0.0000265300000000, -0.0008342300000000, -0.0019968700000000 ]  - [   0.0006240800000000, -0.0001908300000000,  0.0011591400000000 ]  - [  -0.0011511500000000, -0.0001561400000000, -0.0001778300000000 ]  - [   0.0000265300000000,  0.0008342300000000, -0.0019968700000000 ]  - [  -0.0003267700000000,  0.0000037000000000,  0.0006565400000000 ]  - [   0.0003267700000000, -0.0000037000000000,  0.0006565400000000 ]  - [  -0.0006240800000000,  0.0001908300000000,  0.0011591400000000 ]  - [   0.0000968400000000,  0.0000397300000000,  0.0012654800000000 ]  - [  -0.0002644800000000, -0.0000226900000000,  0.0008525400000000 ]  - [  -0.0000316200000000, -0.0001896800000000,  0.0010886900000000 ]  - [  -0.0000968400000000, -0.0000397300000000,  0.0012654800000000 ]  - [   0.0002644800000000,  0.0000226900000000,  0.0008525400000000 ]  - [  -0.0001546900000000,  0.0001763300000000,  0.0012638100000000 ]  - [   0.0001546900000000, -0.0001763300000000,  0.0012638100000000 ]  - [   0.0000316200000000,  0.0001896800000000,  0.0010886900000000 ]  - [   0.0001483400000000,  0.0001917400000000,  0.0011958300000000 ]  - [  -0.0001483400000000, -0.0001917400000000,  0.0011958300000000 ]  - [  -0.0000854900000000, -0.0001050300000000,  0.0010893300000000 ]  - [  -0.0001276000000000, -0.0002065400000000,  0.0006944300000000 ]  - [   0.0000854900000000,  0.0001050300000000,  0.0010893300000000 ]  - [  -0.0001653300000000,  0.0000341600000000,  0.0010421900000000 ]  - [   0.0001653300000000, -0.0000341600000000,  0.0010421900000000 ]  - [   0.0001276000000000,  0.0002065400000000,  0.0006944300000000 ]  - [  -0.0002085800000000, -0.0001071000000000,  0.0012226400000000 ]  - [  -0.0001227800000000,  0.0001648400000000,  0.0009139900000000 ]  - [   0.0003243400000000, -0.0000118100000000,  0.0016361400000000 ]  - [   0.0002085800000000,  0.0001071000000000,  0.0012226400000000 ]  - [   0.0001227800000000, -0.0001648400000000,  0.0009139900000000 ]  - [  -0.0003206900000000, -0.0006869000000000,  0.0005447300000000 ]  - [   0.0003206900000000,  0.0006869000000000,  0.0005447300000000 ]  - [  -0.0003243400000000,  0.0000118100000000,  0.0016361400000000 ]  - [  -0.0003694500000000, -0.0007789700000000,  0.0009310500000000 ]  - [   0.0001149600000000,  0.0002107600000000,  0.0007604500000000 ]  - [  -0.0008117300000000,  0.0013784300000000, -0.0002583000000000 ]  - [   0.0003694500000000,  0.0007789700000000,  0.0009310500000000 ]  - [  -0.0001149600000000, -0.0002107600000000,  0.0007604500000000 ]  - [   0.0006397400000000, -0.0002961900000000, -0.0026653100000000 ]  - [  -0.0006397400000000,  0.0002961900000000, -0.0026653100000000 ]  - [   0.0008117300000000, -0.0013784300000000, -0.0002583000000000 ]  - [  -0.0030401900000000,  0.0006152000000000, -0.0046283300000000 ]  - [   0.0030401900000000, -0.0006152000000000, -0.0046283300000000 ]- atom:    2  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0071933100000000,  0.0053851700000000,  0.0016901100000000 ]  - [  -0.0424516400000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0001352900000000,  0.0017417900000000, -0.0015292500000000 ]  - [   0.0071933100000000, -0.0053851700000000, -0.0016901100000000 ]  - [   0.0081288900000000, -0.0025628700000000,  0.0076945500000000 ]  - [  -0.0043866600000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0001385400000000,  0.0003747800000000,  0.0001188700000000 ]  - [  -0.0000585900000000,  0.0000113000000000,  0.0002073300000000 ]  - [   0.0005917700000000,  0.0002902800000000,  0.0000127700000000 ]  - [  -0.0015322300000000, -0.0005580900000000, -0.0028299500000000 ]  - [   0.0000270100000000, -0.0000121100000000, -0.0001057700000000 ]  - [   0.0000039100000000,  0.0001023500000000,  0.0000928200000000 ]  - [  -0.0000324500000000, -0.0000880200000000,  0.0000141400000000 ]  - [   0.0000773900000000, -0.0000091200000000, -0.0000432100000000 ]  - [  -0.0000567600000000,  0.0001318400000000,  0.0000071400000000 ]  - [  -0.0000770700000000, -0.0000043000000000, -0.0000427900000000 ]  - [  -0.0000133400000000,  0.0000182500000000, -0.0000511900000000 ]  - [   0.0000455100000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0000770700000000,  0.0000043000000000,  0.0000427900000000 ]  - [  -0.0000133400000000, -0.0000182500000000,  0.0000511900000000 ]  - [   0.0000773900000000,  0.0000091200000000,  0.0000432100000000 ]  - [  -0.0000425000000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0000324500000000,  0.0000880200000000, -0.0000141400000000 ]  - [   0.0000270100000000,  0.0000121100000000,  0.0001057700000000 ]  - [   0.0000039100000000, -0.0001023500000000, -0.0000928200000000 ]  - [  -0.0000567600000000, -0.0001318400000000, -0.0000071400000000 ]  - [  -0.0000585900000000, -0.0000113000000000, -0.0002073300000000 ]  - [   0.0005917700000000, -0.0002902800000000, -0.0000127700000000 ]  - [  -0.0001385400000000, -0.0003747800000000, -0.0001188700000000 ]  - [   0.0081288900000000,  0.0025628700000000, -0.0076945500000000 ]  - [  -0.0015322300000000,  0.0005580900000000,  0.0028299500000000 ]  - [  -0.0001352900000000, -0.0017417900000000,  0.0015292500000000 ]  - [  -0.0014329000000000,  0.0004505500000000,  0.0006080100000000 ]  - [   0.0045176800000000, -0.0029054700000000, -0.0026290100000000 ]  - [  -0.0006414200000000, -0.0002811900000000, -0.0004465300000000 ]  - [  -0.0006414200000000,  0.0002811900000000,  0.0004465300000000 ]  - [  -0.0014329000000000, -0.0004505500000000, -0.0006080100000000 ]  - [   0.0044911900000000,  0.0063444400000000,  0.0020240900000000 ]  - [   0.0030636800000000, -0.0011651400000000,  0.0034584400000000 ]  - [   0.0044911900000000, -0.0063444400000000, -0.0020240900000000 ]  - [   0.0000253700000000,  0.0003158300000000,  0.0000327300000000 ]  - [   0.0007923100000000,  0.0001044800000000, -0.0004645900000000 ]  - [   0.0045176800000000,  0.0029054700000000,  0.0026290100000000 ]  - [  -0.0000076600000000, -0.0000155500000000, -0.0000889200000000 ]  - [   0.0000236500000000,  0.0000354000000000, -0.0001168400000000 ]  - [  -0.0007938500000000,  0.0002065300000000, -0.0004304100000000 ]  - [  -0.0000157500000000, -0.0000306500000000,  0.0000294200000000 ]  - [  -0.0005014200000000, -0.0002154500000000,  0.0000558800000000 ]  - [  -0.0000538600000000, -0.0000436800000000,  0.0000969100000000 ]  - [  -0.0002755800000000,  0.0000496100000000,  0.0002706900000000 ]  - [   0.0001622700000000,  0.0001721100000000, -0.0000795100000000 ]  - [   0.0000231300000000,  0.0000347000000000,  0.0000125900000000 ]  - [  -0.0000173100000000, -0.0000272500000000,  0.0000184300000000 ]  - [   0.0000504000000000,  0.0000427700000000,  0.0000979800000000 ]  - [  -0.0000095400000000,  0.0000113800000000, -0.0000180900000000 ]  - [   0.0000380400000000, -0.0000286900000000, -0.0000961600000000 ]  - [   0.0000407500000000, -0.0000449500000000,  0.0000167100000000 ]  - [  -0.0000130200000000, -0.0000195000000000, -0.0000971500000000 ]  - [  -0.0000348400000000,  0.0000365700000000,  0.0000281400000000 ]  - [  -0.0000348400000000, -0.0000365700000000, -0.0000281400000000 ]  - [   0.0000407500000000,  0.0000449500000000, -0.0000167100000000 ]  - [   0.0000083400000000,  0.0000189600000000, -0.0001110200000000 ]  - [  -0.0000173100000000,  0.0000272500000000, -0.0000184300000000 ]  - [   0.0000083400000000, -0.0000189600000000,  0.0001110200000000 ]  - [   0.0000380400000000,  0.0000286900000000,  0.0000961600000000 ]  - [   0.0000231300000000, -0.0000347000000000, -0.0000125900000000 ]  - [  -0.0000130200000000,  0.0000195000000000,  0.0000971500000000 ]  - [  -0.0002755800000000, -0.0000496100000000, -0.0002706900000000 ]  - [  -0.0000157500000000,  0.0000306500000000, -0.0000294200000000 ]  - [  -0.0000095400000000, -0.0000113800000000,  0.0000180900000000 ]  - [   0.0000236500000000, -0.0000354000000000,  0.0001168400000000 ]  - [   0.0000504000000000, -0.0000427700000000, -0.0000979800000000 ]  - [   0.0001622700000000, -0.0001721100000000,  0.0000795100000000 ]  - [  -0.0000076600000000,  0.0000155500000000,  0.0000889200000000 ]  - [  -0.0000538600000000,  0.0000436800000000, -0.0000969100000000 ]  - [   0.0007923100000000, -0.0001044800000000,  0.0004645900000000 ]  - [   0.0030636800000000,  0.0011651400000000, -0.0034584400000000 ]  - [  -0.0005014200000000,  0.0002154500000000, -0.0000558800000000 ]  - [  -0.0007938500000000, -0.0002065300000000,  0.0004304100000000 ]  - [   0.0000253700000000, -0.0003158300000000, -0.0000327300000000 ]- atom:    2  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0072261600000000, -0.0054538900000000, -0.0018516100000000 ]  - [   0.0421504200000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0000460800000000, -0.0017738900000000,  0.0015281800000000 ]  - [  -0.0072261600000000,  0.0054538900000000,  0.0018516100000000 ]  - [  -0.0079212400000000,  0.0025438800000000, -0.0075753800000000 ]  - [   0.0042611700000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0001280400000000, -0.0002515500000000, -0.0001385200000000 ]  - [   0.0000524500000000,  0.0000945600000000, -0.0001978100000000 ]  - [  -0.0006036200000000, -0.0002871400000000, -0.0001554400000000 ]  - [   0.0015583400000000,  0.0004360700000000,  0.0028161100000000 ]  - [  -0.0000266000000000, -0.0000954100000000,  0.0001034200000000 ]  - [  -0.0000029900000000, -0.0001032800000000,  0.0000424400000000 ]  - [   0.0000202100000000, -0.0000303200000000,  0.0000112800000000 ]  - [   0.0000418100000000, -0.0000044800000000,  0.0000167600000000 ]  - [   0.0000699000000000, -0.0000125200000000,  0.0000194200000000 ]  - [  -0.0000424500000000,  0.0000177300000000,  0.0000164000000000 ]  - [   0.0000128200000000, -0.0000183000000000, -0.0000844500000000 ]  - [   0.0000598100000000,  0.0000000000000000,  0.0000000000000000 ]  - [  -0.0000424500000000, -0.0000177300000000, -0.0000164000000000 ]  - [   0.0000128200000000,  0.0000183000000000,  0.0000844500000000 ]  - [   0.0000418100000000,  0.0000044800000000, -0.0000167600000000 ]  - [  -0.0000628700000000,  0.0000000000000000,  0.0000000000000000 ]  - [   0.0000202100000000,  0.0000303200000000, -0.0000112800000000 ]  - [  -0.0000266000000000,  0.0000954100000000, -0.0001034200000000 ]  - [  -0.0000029900000000,  0.0001032800000000, -0.0000424400000000 ]  - [   0.0000699000000000,  0.0000125200000000, -0.0000194200000000 ]  - [   0.0000524500000000, -0.0000945600000000,  0.0001978100000000 ]  - [  -0.0006036200000000,  0.0002871400000000,  0.0001554400000000 ]  - [   0.0001280400000000,  0.0002515500000000,  0.0001385200000000 ]  - [  -0.0079212400000000, -0.0025438800000000,  0.0075753800000000 ]  - [   0.0015583400000000, -0.0004360700000000, -0.0028161100000000 ]  - [   0.0000460800000000,  0.0017738900000000, -0.0015281800000000 ]  - [   0.0015112600000000, -0.0005715700000000, -0.0005630400000000 ]  - [  -0.0040341700000000,  0.0026252300000000,  0.0023045200000000 ]  - [   0.0002136500000000,  0.0004373300000000,  0.0003464300000000 ]  - [   0.0002136500000000, -0.0004373300000000, -0.0003464300000000 ]  - [   0.0015112600000000,  0.0005715700000000,  0.0005630400000000 ]  - [  -0.0044067000000000, -0.0062916600000000, -0.0022536700000000 ]  - [  -0.0031778500000000,  0.0012196400000000, -0.0036077100000000 ]  - [  -0.0044067000000000,  0.0062916600000000,  0.0022536700000000 ]  - [   0.0000098600000000, -0.0002839200000000,  0.0000215400000000 ]  - [  -0.0007468000000000, -0.0001466500000000,  0.0004066500000000 ]  - [  -0.0040341700000000, -0.0026252300000000, -0.0023045200000000 ]  - [  -0.0000115600000000, -0.0000077200000000, -0.0001106500000000 ]  - [  -0.0000028200000000, -0.0000098400000000, -0.0000753200000000 ]  - [   0.0007487200000000, -0.0002474700000000,  0.0004602300000000 ]  - [   0.0000336100000000,  0.0000069400000000,  0.0001683000000000 ]  - [   0.0006035500000000,  0.0001391700000000, -0.0000215900000000 ]  - [  -0.0000472400000000, -0.0000366700000000, -0.0001374400000000 ]  - [   0.0002550600000000, -0.0000273800000000, -0.0000752400000000 ]  - [  -0.0002745200000000, -0.0000923300000000,  0.0001260100000000 ]  - [   0.0000122700000000,  0.0000054400000000,  0.0000398800000000 ]  - [  -0.0000187600000000, -0.0000129400000000,  0.0000340300000000 ]  - [   0.0000512500000000,  0.0000373100000000, -0.0001384200000000 ]  - [  -0.0000305200000000,  0.0000250100000000, -0.0000337500000000 ]  - [   0.0000025900000000, -0.0000075600000000,  0.0000420400000000 ]  - [   0.0000396900000000, -0.0000570000000000,  0.0000241000000000 ]  - [  -0.0000092900000000, -0.0000011800000000, -0.0001011900000000 ]  - [  -0.0000455200000000,  0.0000653300000000,  0.0000123300000000 ]  - [  -0.0000455200000000, -0.0000653300000000, -0.0000123300000000 ]  - [   0.0000396900000000,  0.0000570000000000, -0.0000241000000000 ]  - [   0.0000134000000000,  0.0000023400000000, -0.0000874900000000 ]  - [  -0.0000187600000000,  0.0000129400000000, -0.0000340300000000 ]  - [   0.0000134000000000, -0.0000023400000000,  0.0000874900000000 ]  - [   0.0000025900000000,  0.0000075600000000, -0.0000420400000000 ]  - [   0.0000122700000000, -0.0000054400000000, -0.0000398800000000 ]  - [  -0.0000092900000000,  0.0000011800000000,  0.0001011900000000 ]  - [   0.0002550600000000,  0.0000273800000000,  0.0000752400000000 ]  - [   0.0000336100000000, -0.0000069400000000, -0.0001683000000000 ]  - [  -0.0000305200000000, -0.0000250100000000,  0.0000337500000000 ]  - [  -0.0000028200000000,  0.0000098400000000,  0.0000753200000000 ]  - [   0.0000512500000000, -0.0000373100000000,  0.0001384200000000 ]  - [  -0.0002745200000000,  0.0000923300000000, -0.0001260100000000 ]  - [  -0.0000115600000000,  0.0000077200000000,  0.0001106500000000 ]  - [  -0.0000472400000000,  0.0000366700000000,  0.0001374400000000 ]  - [  -0.0007468000000000,  0.0001466500000000, -0.0004066500000000 ]  - [  -0.0031778500000000, -0.0012196400000000,  0.0036077100000000 ]  - [   0.0006035500000000, -0.0001391700000000,  0.0000215900000000 ]  - [   0.0007487200000000,  0.0002474700000000, -0.0004602300000000 ]  - [   0.0000098600000000,  0.0002839200000000, -0.0000215400000000 ]- atom:    2  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0048966200000000, -0.0001870100000000,  0.0020799200000000 ]  - [   0.0001887100000000, -0.0724995100000000,  0.0007839000000000 ]  - [   0.0018182100000000,  0.0066459300000000, -0.0044838200000000 ]  - [  -0.0049766800000000, -0.0001958600000000,  0.0022232000000000 ]  - [  -0.0028063000000000, -0.0013582200000000, -0.0022678600000000 ]  - [  -0.0000093600000000,  0.0079898000000000, -0.0015335000000000 ]  - [  -0.0004028500000000,  0.0005181000000000, -0.0000819100000000 ]  - [  -0.0002703000000000,  0.0000779300000000,  0.0001084500000000 ]  - [  -0.0001283900000000,  0.0007496800000000, -0.0004201300000000 ]  - [   0.0009388900000000, -0.0012623700000000, -0.0007241200000000 ]  - [   0.0002705300000000, -0.0001090800000000,  0.0004834700000000 ]  - [   0.0000760500000000, -0.0000468100000000, -0.0002700600000000 ]  - [   0.0000462500000000, -0.0000629800000000, -0.0002380500000000 ]  - [   0.0000768400000000, -0.0000075400000000, -0.0001815100000000 ]  - [  -0.0000565700000000,  0.0000779200000000, -0.0001090400000000 ]  - [  -0.0000720400000000,  0.0000250000000000, -0.0001635300000000 ]  - [   0.0000058700000000, -0.0000034000000000, -0.0002296300000000 ]  - [   0.0000522600000000,  0.0000186100000000, -0.0001475100000000 ]  - [  -0.0000482600000000,  0.0000130000000000, -0.0001369700000000 ]  - [  -0.0000055000000000, -0.0000034600000000, -0.0000955800000000 ]  - [   0.0000440100000000,  0.0000045800000000, -0.0001554500000000 ]  - [  -0.0000523500000000, -0.0000473000000000, -0.0001793600000000 ]  - [  -0.0000574300000000,  0.0000563200000000, -0.0002631900000000 ]  - [  -0.0002668100000000, -0.0000029800000000,  0.0004769200000000 ]  - [  -0.0000775400000000, -0.0000472600000000, -0.0004049600000000 ]  - [   0.0000680900000000, -0.0000428700000000, -0.0001358100000000 ]  - [   0.0002673000000000, -0.0000254700000000,  0.0001077200000000 ]  - [   0.0001248100000000,  0.0007376400000000, -0.0002806700000000 ]  - [   0.0003906800000000,  0.0003980100000000, -0.0000595000000000 ]  - [   0.0029235100000000, -0.0013733300000000, -0.0022962500000000 ]  - [  -0.0009147400000000, -0.0011244400000000, -0.0006815600000000 ]  - [  -0.0019705500000000,  0.0066822000000000, -0.0046171400000000 ]  - [   0.0000778200000000, -0.0014134500000000,  0.0006139400000000 ]  - [  -0.0025949700000000,  0.0037848400000000,  0.0013090000000000 ]  - [  -0.0013521100000000,  0.0027235300000000, -0.0004771900000000 ]  - [   0.0012360200000000,  0.0026262300000000, -0.0005037800000000 ]  - [   0.0000174600000000, -0.0013062400000000,  0.0005689400000000 ]  - [   0.0052249500000000,  0.0192781700000000,  0.0075397700000000 ]  - [  -0.0011249200000000,  0.0017361600000000, -0.0031800400000000 ]  - [  -0.0054419000000000,  0.0203983400000000,  0.0081223400000000 ]  - [   0.0002718000000000,  0.0003403700000000, -0.0013729000000000 ]  - [  -0.0002665400000000, -0.0006359200000000, -0.0003462000000000 ]  - [   0.0027836100000000,  0.0039298800000000,  0.0015519400000000 ]  - [  -0.0000224700000000, -0.0001031100000000,  0.0000287500000000 ]  - [   0.0000328800000000,  0.0003480200000000,  0.0004744500000000 ]  - [  -0.0002164600000000,  0.0006211700000000, -0.0004767200000000 ]  - [   0.0000850800000000, -0.0001886600000000,  0.0001001100000000 ]  - [   0.0002070800000000, -0.0002587000000000,  0.0003590800000000 ]  - [  -0.0000396500000000, -0.0000502400000000,  0.0000758400000000 ]  - [  -0.0000481600000000,  0.0001788900000000,  0.0001427100000000 ]  - [  -0.0004674000000000,  0.0000951400000000,  0.0008892800000000 ]  - [  -0.0000140100000000,  0.0000555800000000,  0.0001535300000000 ]  - [  -0.0000134700000000, -0.0000681700000000,  0.0001160700000000 ]  - [   0.0000472000000000,  0.0000212100000000,  0.0001270800000000 ]  - [  -0.0000476300000000,  0.0001324800000000, -0.0000071800000000 ]  - [   0.0000540300000000, -0.0000483400000000,  0.0000606300000000 ]  - [   0.0000365500000000, -0.0000452000000000,  0.0001597100000000 ]  - [  -0.0000166500000000, -0.0000211400000000, -0.0000220400000000 ]  - [  -0.0000238700000000,  0.0000455200000000,  0.0001314500000000 ]  - [  -0.0000565300000000, -0.0000557000000000,  0.0000898500000000 ]  - [   0.0000436100000000,  0.0000564900000000,  0.0001179900000000 ]  - [   0.0000142900000000,  0.0000271900000000, -0.0000181900000000 ]  - [  -0.0000238200000000, -0.0000292600000000,  0.0000636300000000 ]  - [   0.0000062000000000,  0.0000059400000000,  0.0001789500000000 ]  - [  -0.0000151300000000, -0.0000114800000000,  0.0001133400000000 ]  - [   0.0000510400000000,  0.0000169600000000,  0.0001008000000000 ]  - [  -0.0000042000000000, -0.0000006900000000,  0.0001752300000000 ]  - [   0.0000277700000000,  0.0001570500000000, -0.0000547600000000 ]  - [  -0.0000633900000000, -0.0001677000000000, -0.0000955300000000 ]  - [   0.0000082100000000,  0.0000944600000000,  0.0000467500000000 ]  - [  -0.0000131700000000,  0.0003251800000000,  0.0006682300000000 ]  - [   0.0000535100000000, -0.0000587700000000,  0.0001683500000000 ]  - [   0.0003688600000000,  0.0000216000000000,  0.0008568500000000 ]  - [   0.0000021100000000, -0.0000807600000000,  0.0002268300000000 ]  - [  -0.0000611700000000,  0.0000305800000000,  0.0001155700000000 ]  - [   0.0003054000000000, -0.0005694800000000, -0.0002805400000000 ]  - [   0.0010540500000000,  0.0016892300000000, -0.0031107200000000 ]  - [  -0.0001083400000000, -0.0001734200000000,  0.0003164800000000 ]  - [   0.0001807100000000,  0.0006557500000000, -0.0005233300000000 ]  - [  -0.0002272500000000,  0.0002956400000000, -0.0014008400000000 ]- atom:    2  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0015909800000000,  0.0016863500000000, -0.0034102300000000 ]  - [  -0.0000312300000000,  0.0007924400000000, -0.0594617700000000 ]  - [  -0.0024025500000000, -0.0063290200000000, -0.0031611100000000 ]  - [  -0.0015884200000000,  0.0016896100000000, -0.0032828500000000 ]  - [   0.0080967300000000, -0.0017035500000000, -0.0016851000000000 ]  - [  -0.0000581300000000,  0.0015334100000000, -0.0048029800000000 ]  - [   0.0001606800000000, -0.0001206700000000, -0.0003248300000000 ]  - [   0.0004803500000000,  0.0001575100000000,  0.0010008800000000 ]  - [   0.0007883900000000, -0.0019480800000000,  0.0038239500000000 ]  - [  -0.0039185500000000,  0.0014870000000000,  0.0029714400000000 ]  - [  -0.0001077800000000,  0.0001488300000000,  0.0010006100000000 ]  - [  -0.0000575400000000,  0.0000703600000000,  0.0017624700000000 ]  - [  -0.0001254200000000, -0.0001365100000000,  0.0016406700000000 ]  - [   0.0000587000000000,  0.0000533000000000,  0.0013772700000000 ]  - [   0.0000593600000000,  0.0000427700000000,  0.0012712400000000 ]  - [  -0.0000574900000000, -0.0000709900000000,  0.0013848200000000 ]  - [   0.0000063900000000, -0.0000021300000000,  0.0015465100000000 ]  - [   0.0000527000000000, -0.0001478000000000,  0.0014976000000000 ]  - [  -0.0000619000000000, -0.0000839800000000,  0.0014115000000000 ]  - [  -0.0000063200000000, -0.0000022500000000,  0.0016823200000000 ]  - [   0.0000607700000000,  0.0000666000000000,  0.0014034600000000 ]  - [  -0.0000525900000000,  0.0001797500000000,  0.0015547400000000 ]  - [   0.0001129300000000, -0.0000175100000000,  0.0016140700000000 ]  - [   0.0001084200000000,  0.0002561900000000,  0.0010011200000000 ]  - [   0.0000556200000000,  0.0000694400000000,  0.0016240000000000 ]  - [  -0.0000465700000000, -0.0000768700000000,  0.0012447700000000 ]  - [  -0.0004797100000000,  0.0000515000000000,  0.0010007500000000 ]  - [  -0.0007956200000000, -0.0019542200000000,  0.0039455400000000 ]  - [  -0.0001721000000000, -0.0002406200000000, -0.0002963800000000 ]  - [  -0.0078826100000000, -0.0017074000000000, -0.0017024500000000 ]  - [   0.0038886800000000,  0.0016031600000000,  0.0029904000000000 ]  - [   0.0022567700000000, -0.0062544600000000, -0.0031563700000000 ]  - [  -0.0008929600000000, -0.0000415600000000,  0.0021984800000000 ]  - [  -0.0025221500000000,  0.0002091200000000,  0.0046768500000000 ]  - [   0.0006299300000000, -0.0007110200000000,  0.0038760100000000 ]  - [  -0.0008334100000000, -0.0008395300000000,  0.0039153400000000 ]  - [   0.0009760800000000,  0.0000649000000000,  0.0021653600000000 ]  - [   0.0022400100000000,  0.0068170300000000,  0.0043627700000000 ]  - [   0.0052945000000000, -0.0029943800000000,  0.0174072400000000 ]  - [  -0.0021975100000000,  0.0067526700000000,  0.0044864500000000 ]  - [   0.0001346800000000, -0.0008639600000000,  0.0009612700000000 ]  - [  -0.0011632800000000,  0.0021489800000000,  0.0022317000000000 ]  - [   0.0025121400000000,  0.0002224300000000,  0.0048753000000000 ]  - [  -0.0000975800000000,  0.0002777800000000, -0.0004064400000000 ]  - [  -0.0002545300000000, -0.0004519600000000, -0.0010951200000000 ]  - [  -0.0001288400000000, -0.0004761500000000,  0.0005828200000000 ]  - [   0.0004135600000000,  0.0001139200000000, -0.0004388100000000 ]  - [  -0.0003613800000000,  0.0001116100000000, -0.0007581000000000 ]  - [  -0.0002825800000000,  0.0000577300000000, -0.0010819500000000 ]  - [  -0.0002032400000000, -0.0000193300000000, -0.0007133000000000 ]  - [   0.0008384200000000,  0.0013344400000000, -0.0010090100000000 ]  - [   0.0002194100000000, -0.0001348500000000, -0.0011574000000000 ]  - [  -0.0001672100000000,  0.0001617900000000, -0.0010777400000000 ]  - [   0.0002342700000000,  0.0000136500000000, -0.0010366700000000 ]  - [  -0.0001560200000000, -0.0002959500000000, -0.0011434700000000 ]  - [   0.0000861100000000,  0.0000857300000000, -0.0011534900000000 ]  - [   0.0001352900000000, -0.0000049200000000, -0.0010369600000000 ]  - [   0.0000983900000000,  0.0001650600000000, -0.0008743200000000 ]  - [  -0.0001683900000000,  0.0000163100000000, -0.0009543600000000 ]  - [   0.0000882300000000, -0.0000855600000000, -0.0009949900000000 ]  - [  -0.0000552000000000,  0.0000969400000000, -0.0010776300000000 ]  - [  -0.0000926600000000, -0.0001602400000000, -0.0008696000000000 ]  - [   0.0001314600000000,  0.0002018300000000, -0.0011303300000000 ]  - [   0.0001146600000000, -0.0001815500000000, -0.0006706300000000 ]  - [  -0.0000461600000000,  0.0001212500000000, -0.0011003400000000 ]  - [  -0.0001833100000000, -0.0001751200000000, -0.0012099400000000 ]  - [  -0.0001206100000000,  0.0001857500000000, -0.0006756300000000 ]  - [   0.0001815100000000, -0.0000404000000000, -0.0009100400000000 ]  - [  -0.0003910500000000,  0.0001342100000000, -0.0006371100000000 ]  - [   0.0001158100000000, -0.0003314800000000, -0.0010910600000000 ]  - [   0.0002723000000000, -0.0004796500000000, -0.0008978000000000 ]  - [  -0.0001323400000000, -0.0000661700000000, -0.0009966100000000 ]  - [  -0.0009372500000000,  0.0012439000000000, -0.0010423900000000 ]  - [   0.0000772300000000,  0.0003023000000000, -0.0002096700000000 ]  - [   0.0001810000000000,  0.0001370900000000, -0.0010433500000000 ]  - [   0.0011824000000000,  0.0021596700000000,  0.0022764000000000 ]  - [  -0.0051517400000000, -0.0027279500000000,  0.0163872800000000 ]  - [   0.0004611000000000,  0.0001918500000000, -0.0007970400000000 ]  - [   0.0000842300000000, -0.0004401400000000,  0.0005269300000000 ]  - [  -0.0000963200000000, -0.0008982500000000,  0.0008950100000000 ]- atom:    3  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0012580600000000, -0.0014853800000000,  0.0045782200000000 ]  - [  -0.0000408100000000,  0.0018959300000000, -0.0023297100000000 ]  - [  -0.0703166200000000, -0.0042592400000000,  0.0048921300000000 ]  - [  -0.0000222200000000,  0.0045590500000000,  0.0019299700000000 ]  - [   0.0063598600000000,  0.0009409100000000, -0.0016916400000000 ]  - [   0.0080060300000000, -0.0028849700000000, -0.0080558400000000 ]  - [   0.0074467400000000,  0.0008931800000000, -0.0042248100000000 ]  - [   0.0004589200000000, -0.0002620600000000, -0.0001778600000000 ]  - [  -0.0009080100000000,  0.0025727500000000,  0.0070471500000000 ]  - [  -0.0012370600000000, -0.0009063400000000, -0.0014975000000000 ]  - [  -0.0012023200000000,  0.0004481800000000, -0.0015542000000000 ]  - [   0.0005616400000000, -0.0000454200000000,  0.0002106100000000 ]  - [   0.0000043500000000, -0.0003019900000000,  0.0000082800000000 ]  - [   0.0000735000000000,  0.0000667200000000, -0.0001007500000000 ]  - [   0.0001707200000000,  0.0002915900000000,  0.0004187800000000 ]  - [  -0.0000355400000000, -0.0000692800000000,  0.0000464800000000 ]  - [  -0.0000350200000000, -0.0000176500000000, -0.0000393400000000 ]  - [   0.0000351300000000,  0.0000120000000000, -0.0000017300000000 ]  - [  -0.0000720400000000, -0.0000049400000000,  0.0000378800000000 ]  - [  -0.0000072000000000,  0.0000078600000000,  0.0000736700000000 ]  - [   0.0000406300000000,  0.0000021700000000,  0.0000235800000000 ]  - [  -0.0000348400000000, -0.0000167800000000, -0.0000006500000000 ]  - [   0.0000125800000000,  0.0000839200000000, -0.0000042500000000 ]  - [  -0.0000035100000000,  0.0000242200000000, -0.0000760600000000 ]  - [  -0.0000212700000000,  0.0000083600000000, -0.0000442200000000 ]  - [  -0.0000051100000000, -0.0000838200000000, -0.0000181500000000 ]  - [   0.0000172600000000,  0.0000192800000000,  0.0000172300000000 ]  - [  -0.0000674200000000, -0.0000645500000000, -0.0000676100000000 ]  - [   0.0001326900000000, -0.0002993100000000,  0.0005846100000000 ]  - [   0.0002996700000000,  0.0003025400000000,  0.0001037400000000 ]  - [   0.0000443700000000,  0.0002890600000000,  0.0001532400000000 ]  - [  -0.0007840700000000, -0.0005112700000000, -0.0006332500000000 ]  - [   0.0003532800000000, -0.0004732000000000, -0.0015178300000000 ]  - [  -0.0007883600000000,  0.0003834400000000, -0.0002360600000000 ]  - [   0.0006329400000000,  0.0005159100000000, -0.0004459900000000 ]  - [   0.0013096900000000,  0.0003203900000000,  0.0005514900000000 ]  - [   0.0134255500000000,  0.0039756000000000,  0.0052091600000000 ]  - [   0.0045186600000000,  0.0010184900000000, -0.0055292000000000 ]  - [   0.0050084700000000,  0.0032861200000000,  0.0013322800000000 ]  - [   0.0032085300000000, -0.0015332100000000, -0.0009472200000000 ]  - [   0.0013880000000000,  0.0013484700000000, -0.0001327400000000 ]  - [   0.0206344100000000, -0.0076109800000000,  0.0075903100000000 ]  - [  -0.0009768900000000, -0.0002744300000000,  0.0002817300000000 ]  - [   0.0003372900000000,  0.0007862600000000, -0.0011476100000000 ]  - [   0.0006043700000000, -0.0006628200000000, -0.0000380600000000 ]  - [  -0.0006764800000000,  0.0000348500000000,  0.0009382600000000 ]  - [  -0.0001683000000000, -0.0000323900000000,  0.0004820500000000 ]  - [  -0.0009880800000000, -0.0007130600000000, -0.0008880300000000 ]  - [  -0.0001482800000000, -0.0001411900000000, -0.0000110900000000 ]  - [  -0.0004605900000000, -0.0001456100000000,  0.0003303100000000 ]  - [   0.0042970900000000, -0.0016069400000000, -0.0068589500000000 ]  - [   0.0000110500000000,  0.0000045100000000,  0.0000426600000000 ]  - [  -0.0000601200000000, -0.0000182900000000,  0.0000509800000000 ]  - [   0.0004090000000000,  0.0001571400000000,  0.0003750200000000 ]  - [   0.0001319100000000,  0.0000132800000000,  0.0000064500000000 ]  - [  -0.0000270100000000,  0.0000736200000000, -0.0000886600000000 ]  - [   0.0000568600000000, -0.0000201200000000,  0.0000342000000000 ]  - [   0.0000072000000000, -0.0000180400000000, -0.0001228200000000 ]  - [   0.0000303800000000,  0.0000321200000000, -0.0000464300000000 ]  - [  -0.0000288600000000, -0.0000437900000000, -0.0000271700000000 ]  - [   0.0000396100000000,  0.0000452800000000, -0.0000222700000000 ]  - [  -0.0000000300000000,  0.0000121000000000, -0.0001346200000000 ]  - [  -0.0000020900000000,  0.0000132200000000, -0.0000340500000000 ]  - [   0.0000091600000000, -0.0000010600000000,  0.0000928400000000 ]  - [   0.0000219900000000,  0.0000177900000000,  0.0000291300000000 ]  - [   0.0000141400000000, -0.0000154600000000, -0.0000298200000000 ]  - [   0.0000069900000000,  0.0000090900000000,  0.0001189700000000 ]  - [  -0.0000269500000000, -0.0000447800000000, -0.0001154100000000 ]  - [   0.0001031900000000,  0.0000267700000000, -0.0001793100000000 ]  - [  -0.0000184900000000, -0.0000255700000000,  0.0000575400000000 ]  - [   0.0000255600000000, -0.0000012200000000,  0.0000888700000000 ]  - [   0.0000783600000000, -0.0000429100000000, -0.0000188800000000 ]  - [   0.0001343900000000, -0.0001019800000000, -0.0000865200000000 ]  - [  -0.0000591800000000, -0.0000172500000000,  0.0001284400000000 ]  - [  -0.0000731700000000,  0.0000484500000000, -0.0000339400000000 ]  - [   0.0000531100000000,  0.0002765700000000,  0.0008177200000000 ]  - [  -0.0000977100000000, -0.0000503400000000,  0.0002629600000000 ]  - [  -0.0000409600000000,  0.0000056100000000, -0.0001083200000000 ]  - [  -0.0000795700000000,  0.0001276600000000,  0.0001200800000000 ]  - [   0.0002569600000000, -0.0001428100000000,  0.0002515500000000 ]- atom:    3  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0012802000000000,  0.0015151800000000, -0.0047604400000000 ]  - [   0.0001407200000000, -0.0018924500000000,  0.0023296500000000 ]  - [   0.0699542200000000,  0.0043810300000000, -0.0049147000000000 ]  - [   0.0000339600000000, -0.0046443300000000, -0.0018012900000000 ]  - [  -0.0062437700000000, -0.0008459300000000,  0.0017159300000000 ]  - [  -0.0080435800000000,  0.0028449900000000,  0.0079241500000000 ]  - [  -0.0074881900000000, -0.0008047600000000,  0.0042978900000000 ]  - [  -0.0004576000000000,  0.0003642800000000,  0.0001836400000000 ]  - [   0.0008860600000000, -0.0025365700000000, -0.0071144900000000 ]  - [   0.0012509000000000,  0.0007913400000000,  0.0014663400000000 ]  - [   0.0011837800000000, -0.0005460900000000,  0.0015359000000000 ]  - [  -0.0005523800000000,  0.0000437000000000, -0.0000755600000000 ]  - [  -0.0000177800000000,  0.0001807500000000,  0.0000178800000000 ]  - [   0.0000468000000000, -0.0000789400000000,  0.0000742100000000 ]  - [  -0.0001565800000000, -0.0001688000000000, -0.0003858800000000 ]  - [  -0.0000827300000000,  0.0000815600000000, -0.0000713100000000 ]  - [   0.0000350800000000,  0.0000178900000000, -0.0000949200000000 ]  - [   0.0000699400000000, -0.0000116400000000,  0.0000025400000000 ]  - [  -0.0000470700000000, -0.0000081600000000, -0.0000109400000000 ]  - [   0.0000071900000000, -0.0000075400000000,  0.0000625600000000 ]  - [   0.0000791600000000,  0.0000110900000000,  0.0000033800000000 ]  - [  -0.0000703300000000,  0.0000163700000000,  0.0000011800000000 ]  - [  -0.0000256700000000,  0.0000350700000000, -0.0000214400000000 ]  - [   0.0000025700000000,  0.0000819700000000,  0.0000778500000000 ]  - [   0.0000213000000000, -0.0000081600000000, -0.0000912300000000 ]  - [   0.0000184800000000, -0.0000350300000000, -0.0000078600000000 ]  - [  -0.0000180000000000, -0.0001252000000000, -0.0000171100000000 ]  - [   0.0000667600000000,  0.0000626800000000,  0.0002052300000000 ]  - [  -0.0001473300000000,  0.0001831900000000, -0.0005637800000000 ]  - [  -0.0001827600000000, -0.0003152600000000, -0.0001333300000000 ]  - [  -0.0000294800000000, -0.0001713400000000, -0.0001237900000000 ]  - [   0.0006806900000000,  0.0005274300000000,  0.0006248900000000 ]  - [  -0.0002844000000000,  0.0003817100000000,  0.0015850100000000 ]  - [   0.0007823100000000, -0.0004090100000000,  0.0000416800000000 ]  - [  -0.0007192700000000, -0.0004129100000000,  0.0004891200000000 ]  - [  -0.0015010600000000, -0.0002766800000000, -0.0006297300000000 ]  - [  -0.0143306700000000, -0.0040314000000000, -0.0055882700000000 ]  - [  -0.0045559300000000, -0.0010282600000000,  0.0054080900000000 ]  - [  -0.0049466800000000, -0.0030925700000000, -0.0013551900000000 ]  - [  -0.0031952400000000,  0.0014921600000000,  0.0011286900000000 ]  - [  -0.0013348000000000, -0.0013106500000000,  0.0001829000000000 ]  - [  -0.0193676400000000,  0.0073199100000000, -0.0072624000000000 ]  - [   0.0009498900000000,  0.0003011500000000, -0.0000810200000000 ]  - [  -0.0003544700000000, -0.0007949100000000,  0.0009285900000000 ]  - [  -0.0005795700000000,  0.0006847200000000, -0.0001610400000000 ]  - [   0.0006327400000000, -0.0000570100000000, -0.0008916900000000 ]  - [   0.0001819700000000,  0.0000110600000000, -0.0002880200000000 ]  - [   0.0010654700000000,  0.0006305900000000,  0.0009173800000000 ]  - [   0.0000440200000000,  0.0000605800000000, -0.0000319000000000 ]  - [   0.0004316900000000,  0.0001625400000000, -0.0001287500000000 ]  - [  -0.0043455700000000,  0.0016614800000000,  0.0068785900000000 ]  - [   0.0000243400000000,  0.0000353100000000,  0.0000116300000000 ]  - [   0.0000226500000000, -0.0000215300000000,  0.0000016500000000 ]  - [  -0.0003031800000000, -0.0000762900000000, -0.0004107600000000 ]  - [  -0.0001705500000000,  0.0000234600000000, -0.0000603900000000 ]  - [   0.0000678900000000, -0.0001076600000000,  0.0000333800000000 ]  - [   0.0000241900000000, -0.0000812500000000,  0.0000062600000000 ]  - [  -0.0000291800000000, -0.0000024700000000, -0.0000764700000000 ]  - [  -0.0001100900000000,  0.0000696800000000,  0.0000858100000000 ]  - [  -0.0000514200000000, -0.0000580100000000, -0.0000140700000000 ]  - [   0.0000406400000000,  0.0000569000000000, -0.0000185000000000 ]  - [   0.0000217100000000,  0.0000086100000000, -0.0000646600000000 ]  - [  -0.0000337100000000,  0.0000270100000000, -0.0000191200000000 ]  - [   0.0000126500000000, -0.0000193400000000,  0.0001057300000000 ]  - [   0.0000178900000000,  0.0000183200000000,  0.0000231700000000 ]  - [   0.0000215600000000, -0.0000244900000000, -0.0000235500000000 ]  - [  -0.0000292100000000,  0.0000114700000000,  0.0000794200000000 ]  - [   0.0000056900000000,  0.0000232500000000, -0.0000836400000000 ]  - [  -0.0000835000000000, -0.0000048000000000, -0.0000188500000000 ]  - [  -0.0000215800000000, -0.0000106300000000, -0.0000052500000000 ]  - [  -0.0000046900000000, -0.0000210000000000,  0.0001080300000000 ]  - [   0.0000234300000000, -0.0000371700000000,  0.0000592900000000 ]  - [  -0.0002379700000000,  0.0000235000000000,  0.0000457700000000 ]  - [   0.0000389600000000,  0.0000391000000000,  0.0000702900000000 ]  - [  -0.0000284400000000,  0.0000321200000000,  0.0000746700000000 ]  - [  -0.0000149800000000, -0.0002350000000000, -0.0007599100000000 ]  - [   0.0000664300000000,  0.0000088200000000, -0.0002169900000000 ]  - [   0.0001430800000000,  0.0000757900000000,  0.0000688300000000 ]  - [   0.0000384800000000, -0.0000930100000000, -0.0001730400000000 ]  - [  -0.0002184600000000,  0.0001084900000000, -0.0003059000000000 ]- atom:    3  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0010927900000000, -0.0010156300000000, -0.0022820800000000 ]  - [   0.0018252500000000,  0.0066945900000000, -0.0063298100000000 ]  - [  -0.0043475100000000, -0.0449733400000000,  0.0006349300000000 ]  - [   0.0059919800000000,  0.0068442700000000,  0.0028730000000000 ]  - [   0.0009553900000000, -0.0023054800000000,  0.0002899600000000 ]  - [  -0.0026068000000000, -0.0013437400000000,  0.0017134600000000 ]  - [   0.0028977800000000, -0.0011644700000000, -0.0006096700000000 ]  - [   0.0003991100000000, -0.0000809600000000, -0.0001607200000000 ]  - [   0.0017863400000000, -0.0014866700000000,  0.0032623300000000 ]  - [  -0.0029295500000000,  0.0074380400000000,  0.0056500800000000 ]  - [  -0.0009270700000000, -0.0015965300000000, -0.0038909200000000 ]  - [   0.0001399500000000,  0.0007776200000000,  0.0002607500000000 ]  - [  -0.0001483700000000,  0.0000773500000000,  0.0000480000000000 ]  - [  -0.0000127700000000, -0.0000833300000000,  0.0000556800000000 ]  - [   0.0001243300000000,  0.0000980800000000, -0.0000691500000000 ]  - [   0.0000159200000000, -0.0000694800000000, -0.0000095300000000 ]  - [  -0.0000575200000000,  0.0000357000000000, -0.0001552300000000 ]  - [   0.0000633600000000,  0.0000194800000000, -0.0000771600000000 ]  - [  -0.0000580800000000, -0.0000164700000000, -0.0000230000000000 ]  - [   0.0000115000000000, -0.0000022800000000,  0.0000342500000000 ]  - [   0.0000554400000000,  0.0000113900000000, -0.0000275400000000 ]  - [  -0.0000500400000000, -0.0000014600000000, -0.0000597800000000 ]  - [  -0.0000017700000000,  0.0000476000000000, -0.0000307600000000 ]  - [   0.0000512500000000,  0.0000264500000000, -0.0001175000000000 ]  - [   0.0000399900000000,  0.0000253900000000, -0.0000968700000000 ]  - [   0.0000019000000000, -0.0000403900000000, -0.0000379800000000 ]  - [  -0.0000624300000000, -0.0001160300000000, -0.0000528100000000 ]  - [  -0.0000794300000000, -0.0000325800000000,  0.0000384100000000 ]  - [  -0.0001452900000000, -0.0000483900000000, -0.0000056400000000 ]  - [  -0.0002505300000000, -0.0002109300000000, -0.0000186300000000 ]  - [   0.0001267200000000,  0.0002205000000000, -0.0000395200000000 ]  - [   0.0004616000000000, -0.0021339100000000,  0.0022309600000000 ]  - [  -0.0001442000000000,  0.0004009500000000,  0.0000216200000000 ]  - [  -0.0002762400000000,  0.0006782600000000, -0.0000418700000000 ]  - [  -0.0003860500000000, -0.0011020300000000,  0.0003906100000000 ]  - [   0.0006508700000000, -0.0012259000000000, -0.0001647500000000 ]  - [   0.0040184000000000,  0.0027360300000000,  0.0011889100000000 ]  - [   0.0009647800000000,  0.0063989300000000, -0.0068984700000000 ]  - [   0.0021185000000000,  0.0078562600000000,  0.0017728900000000 ]  - [  -0.0011962100000000,  0.0033123900000000,  0.0008531600000000 ]  - [   0.0015410000000000,  0.0118994000000000, -0.0042692900000000 ]  - [  -0.0071233100000000,  0.0031792700000000, -0.0020371800000000 ]  - [   0.0005793700000000, -0.0012810200000000,  0.0006710500000000 ]  - [  -0.0000061900000000,  0.0004072700000000, -0.0001156400000000 ]  - [   0.0002587400000000, -0.0009670700000000, -0.0005003100000000 ]  - [  -0.0013965600000000, -0.0020233900000000, -0.0007386600000000 ]  - [  -0.0000634400000000,  0.0005926400000000,  0.0000264600000000 ]  - [   0.0002697700000000,  0.0006341600000000, -0.0002032500000000 ]  - [  -0.0000775300000000, -0.0000955300000000, -0.0001205800000000 ]  - [  -0.0002256700000000, -0.0005712200000000,  0.0002587200000000 ]  - [  -0.0019465800000000,  0.0043301600000000,  0.0063726000000000 ]  - [   0.0000568400000000, -0.0000033100000000,  0.0001046700000000 ]  - [   0.0000065800000000,  0.0000009400000000,  0.0002038100000000 ]  - [   0.0001012900000000,  0.0000449200000000, -0.0004889100000000 ]  - [   0.0001473100000000, -0.0001982600000000,  0.0003792600000000 ]  - [   0.0000214100000000, -0.0000613700000000, -0.0000587100000000 ]  - [   0.0000256300000000, -0.0000846900000000,  0.0000174100000000 ]  - [  -0.0000094400000000, -0.0000020800000000, -0.0000812800000000 ]  - [  -0.0000544900000000,  0.0000739400000000,  0.0000386400000000 ]  - [  -0.0000435800000000, -0.0000480800000000,  0.0000055400000000 ]  - [   0.0000437400000000,  0.0000453400000000, -0.0000090200000000 ]  - [   0.0000121200000000,  0.0000051100000000, -0.0000888800000000 ]  - [  -0.0000160000000000,  0.0000133700000000,  0.0000080400000000 ]  - [  -0.0000061800000000,  0.0000119300000000,  0.0001185300000000 ]  - [   0.0000289100000000,  0.0000210500000000,  0.0000552100000000 ]  - [   0.0000129000000000, -0.0000174600000000,  0.0000165900000000 ]  - [   0.0000021700000000, -0.0000087700000000,  0.0001019400000000 ]  - [  -0.0000065000000000, -0.0000579500000000, -0.0000475300000000 ]  - [   0.0000384300000000,  0.0000292100000000, -0.0000830300000000 ]  - [  -0.0000326000000000, -0.0000248700000000,  0.0000747000000000 ]  - [  -0.0000067100000000, -0.0000518500000000,  0.0000412900000000 ]  - [   0.0000395100000000, -0.0000300800000000,  0.0000671600000000 ]  - [  -0.0001491300000000, -0.0002144600000000, -0.0002281700000000 ]  - [  -0.0000145800000000,  0.0000288600000000,  0.0000442500000000 ]  - [  -0.0000511200000000,  0.0000343600000000,  0.0000649000000000 ]  - [   0.0001217600000000,  0.0002217100000000,  0.0001269500000000 ]  - [   0.0000614900000000, -0.0004243900000000, -0.0002192000000000 ]  - [   0.0000480800000000,  0.0000175400000000,  0.0000717600000000 ]  - [  -0.0000867100000000, -0.0000875400000000,  0.0000131300000000 ]  - [  -0.0000284300000000,  0.0000129500000000,  0.0002874500000000 ]- atom:    3  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0011028900000000,  0.0009850900000000,  0.0021448900000000 ]  - [  -0.0016908400000000, -0.0066349100000000,  0.0062537400000000 ]  - [   0.0042957500000000,  0.0451511700000000, -0.0007414500000000 ]  - [  -0.0060499700000000, -0.0069104800000000, -0.0027761900000000 ]  - [  -0.0008313000000000,  0.0023022100000000, -0.0002692100000000 ]  - [   0.0024996100000000,  0.0013872400000000, -0.0016977600000000 ]  - [  -0.0029310500000000,  0.0013235800000000,  0.0005670800000000 ]  - [  -0.0003942200000000,  0.0001857400000000,  0.0001722000000000 ]  - [  -0.0017918400000000,  0.0014452300000000, -0.0033937400000000 ]  - [   0.0028994900000000, -0.0074978100000000, -0.0056064900000000 ]  - [   0.0009268200000000,  0.0014940600000000,  0.0039161000000000 ]  - [  -0.0001279100000000, -0.0007809800000000, -0.0001381100000000 ]  - [   0.0001328000000000, -0.0002028800000000, -0.0000133200000000 ]  - [   0.0001327900000000,  0.0000721500000000, -0.0000843200000000 ]  - [  -0.0001146200000000,  0.0000243100000000,  0.0000972600000000 ]  - [  -0.0001349600000000,  0.0000817800000000, -0.0000163700000000 ]  - [   0.0000584900000000, -0.0000357500000000,  0.0000219100000000 ]  - [   0.0000413500000000, -0.0000190400000000,  0.0000779200000000 ]  - [  -0.0000612100000000,  0.0000034800000000,  0.0000499100000000 ]  - [  -0.0000116600000000,  0.0000020300000000,  0.0001017500000000 ]  - [   0.0000643500000000,  0.0000017000000000,  0.0000545100000000 ]  - [  -0.0000547100000000,  0.0000005100000000,  0.0000602500000000 ]  - [  -0.0000113700000000,  0.0000711200000000,  0.0000047300000000 ]  - [  -0.0000524400000000,  0.0000792200000000,  0.0001207600000000 ]  - [  -0.0000405800000000, -0.0000250100000000, -0.0000386900000000 ]  - [   0.0000115100000000, -0.0000788500000000,  0.0000120200000000 ]  - [   0.0000621800000000,  0.0000107000000000,  0.0000530400000000 ]  - [   0.0000790300000000,  0.0000325900000000,  0.0000985200000000 ]  - [   0.0001360700000000, -0.0000705900000000,  0.0000316600000000 ]  - [   0.0003672700000000,  0.0001961600000000, -0.0000139600000000 ]  - [  -0.0001121600000000, -0.0001068400000000,  0.0000604200000000 ]  - [  -0.0005771700000000,  0.0021516400000000, -0.0022666400000000 ]  - [   0.0002270200000000, -0.0005080400000000,  0.0000181200000000 ]  - [   0.0002556500000000, -0.0006832900000000, -0.0001535600000000 ]  - [   0.0003076100000000,  0.0012010900000000, -0.0003316000000000 ]  - [  -0.0008689800000000,  0.0014322400000000,  0.0000782200000000 ]  - [  -0.0038612000000000, -0.0025540000000000, -0.0012185500000000 ]  - [  -0.0009472900000000, -0.0064839000000000,  0.0067322900000000 ]  - [  -0.0019171900000000, -0.0072942600000000, -0.0017303800000000 ]  - [   0.0012848200000000, -0.0037545900000000, -0.0008720400000000 ]  - [  -0.0016445800000000, -0.0125344100000000,  0.0046567700000000 ]  - [   0.0070703900000000, -0.0031172400000000,  0.0019690000000000 ]  - [  -0.0006175600000000,  0.0013043800000000, -0.0004666800000000 ]  - [  -0.0000148500000000, -0.0004338200000000, -0.0000834900000000 ]  - [  -0.0002427900000000,  0.0009878900000000,  0.0002785900000000 ]  - [   0.0013760700000000,  0.0020045000000000,  0.0007809500000000 ]  - [   0.0000875500000000, -0.0006242400000000,  0.0001694800000000 ]  - [  -0.0001666400000000, -0.0007044600000000,  0.0002417300000000 ]  - [  -0.0000260600000000,  0.0000169600000000,  0.0000794700000000 ]  - [   0.0002044600000000,  0.0005957900000000, -0.0000621500000000 ]  - [   0.0018330800000000, -0.0043154500000000, -0.0063402000000000 ]  - [  -0.0000200900000000,  0.0000440800000000, -0.0000507400000000 ]  - [  -0.0000430700000000, -0.0000422000000000, -0.0001514200000000 ]  - [   0.0000080700000000,  0.0000346700000000,  0.0004576200000000 ]  - [  -0.0001893800000000,  0.0002342400000000, -0.0004402700000000 ]  - [   0.0000182500000000,  0.0000245300000000,  0.0000027300000000 ]  - [   0.0000550700000000, -0.0000158100000000,  0.0000223500000000 ]  - [  -0.0000119800000000, -0.0000190400000000, -0.0001177900000000 ]  - [  -0.0000249900000000,  0.0000273500000000,  0.0000021200000000 ]  - [  -0.0000365800000000, -0.0000538600000000, -0.0000462600000000 ]  - [   0.0000366100000000,  0.0000567600000000, -0.0000317200000000 ]  - [   0.0000094100000000,  0.0000155600000000, -0.0001102200000000 ]  - [  -0.0000196700000000,  0.0000264600000000, -0.0000615000000000 ]  - [   0.0000281100000000, -0.0000328300000000,  0.0000799600000000 ]  - [   0.0000109000000000,  0.0000149100000000, -0.0000027400000000 ]  - [   0.0000228800000000, -0.0000223500000000, -0.0000698000000000 ]  - [  -0.0000241300000000,  0.0000296700000000,  0.0000965400000000 ]  - [  -0.0000141500000000,  0.0000365400000000, -0.0001506600000000 ]  - [  -0.0000190000000000, -0.0000081700000000, -0.0001166100000000 ]  - [  -0.0000070800000000, -0.0000108700000000, -0.0000227900000000 ]  - [   0.0000274000000000,  0.0000299800000000,  0.0001565100000000 ]  - [   0.0000623600000000, -0.0000503700000000, -0.0000267100000000 ]  - [   0.0000488500000000,  0.0001352100000000,  0.0001916700000000 ]  - [  -0.0000060800000000, -0.0000073300000000,  0.0001548900000000 ]  - [  -0.0000504200000000,  0.0000460800000000, -0.0000240400000000 ]  - [  -0.0000881500000000, -0.0001878400000000, -0.0000753600000000 ]  - [  -0.0000991900000000,  0.0003841600000000,  0.0002728700000000 ]  - [   0.0000548300000000,  0.0000611700000000, -0.0001111800000000 ]  - [   0.0000458600000000,  0.0001247500000000, -0.0000659400000000 ]  - [   0.0000634600000000, -0.0000491200000000, -0.0003499200000000 ]- atom:    3  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0066372800000000, -0.0019226000000000,  0.0018099100000000 ]  - [  -0.0014740900000000, -0.0045199300000000, -0.0031507900000000 ]  - [   0.0048381400000000,  0.0005547600000000, -0.0889391400000000 ]  - [   0.0020907000000000,  0.0017516900000000, -0.0043858900000000 ]  - [   0.0017596400000000, -0.0002771700000000, -0.0047709600000000 ]  - [  -0.0076524900000000,  0.0022659900000000, -0.0016835000000000 ]  - [  -0.0056628700000000, -0.0014329900000000, -0.0029082000000000 ]  - [  -0.0000696100000000, -0.0000767800000000, -0.0003104300000000 ]  - [   0.0073271400000000,  0.0027820000000000,  0.0026437400000000 ]  - [  -0.0005821100000000,  0.0042298700000000, -0.0029006700000000 ]  - [   0.0007003400000000, -0.0028938000000000,  0.0029788700000000 ]  - [  -0.0016249900000000,  0.0004241900000000,  0.0033391600000000 ]  - [  -0.0000262200000000,  0.0005153300000000,  0.0010370900000000 ]  - [  -0.0000280300000000, -0.0000762400000000,  0.0015632500000000 ]  - [   0.0000552900000000, -0.0000782600000000,  0.0011303200000000 ]  - [  -0.0001180700000000,  0.0000094900000000,  0.0011242000000000 ]  - [   0.0000654600000000, -0.0000032000000000,  0.0013157200000000 ]  - [   0.0000823700000000, -0.0001500400000000,  0.0013987300000000 ]  - [  -0.0000351100000000, -0.0000424600000000,  0.0012013700000000 ]  - [   0.0000029400000000,  0.0000076900000000,  0.0015193900000000 ]  - [   0.0000500300000000,  0.0000471800000000,  0.0012356200000000 ]  - [  -0.0000826700000000,  0.0001683400000000,  0.0013906700000000 ]  - [   0.0000189000000000,  0.0000545000000000,  0.0011882000000000 ]  - [  -0.0002504400000000,  0.0000544200000000,  0.0016273600000000 ]  - [   0.0000608100000000,  0.0000042700000000,  0.0013916400000000 ]  - [  -0.0000115100000000, -0.0000683100000000,  0.0011880900000000 ]  - [   0.0001221600000000, -0.0000469600000000,  0.0012574000000000 ]  - [   0.0000077800000000, -0.0000286400000000,  0.0015309400000000 ]  - [   0.0000248000000000, -0.0000645800000000,  0.0010351000000000 ]  - [   0.0001763900000000, -0.0000023200000000,  0.0003181800000000 ]  - [   0.0000903900000000, -0.0003415900000000,  0.0011281600000000 ]  - [   0.0005725700000000,  0.0022390900000000,  0.0039643600000000 ]  - [  -0.0006842900000000, -0.0003121700000000,  0.0005664000000000 ]  - [   0.0005589300000000,  0.0007077300000000,  0.0017374200000000 ]  - [  -0.0008663300000000,  0.0002779900000000,  0.0001674100000000 ]  - [  -0.0005236000000000,  0.0002476400000000,  0.0045982100000000 ]  - [   0.0044457200000000,  0.0004973400000000,  0.0057028100000000 ]  - [  -0.0084875200000000, -0.0060739200000000,  0.0302764700000000 ]  - [  -0.0000052400000000,  0.0014006600000000,  0.0084005500000000 ]  - [  -0.0021967400000000,  0.0012800000000000,  0.0028863600000000 ]  - [  -0.0007612700000000, -0.0064002800000000,  0.0079855600000000 ]  - [   0.0056891200000000, -0.0006444600000000,  0.0068255300000000 ]  - [   0.0003704400000000, -0.0007619700000000,  0.0012762600000000 ]  - [  -0.0004673300000000,  0.0002813100000000,  0.0003447300000000 ]  - [  -0.0005645900000000, -0.0000756800000000,  0.0000784400000000 ]  - [   0.0007530700000000,  0.0013270000000000,  0.0025848900000000 ]  - [   0.0015029600000000,  0.0006100800000000, -0.0001649500000000 ]  - [   0.0011212500000000, -0.0009813200000000,  0.0017555100000000 ]  - [  -0.0000168200000000, -0.0001557600000000, -0.0003946500000000 ]  - [   0.0002876800000000, -0.0005778000000000, -0.0002689000000000 ]  - [  -0.0076947500000000,  0.0063319700000000,  0.0221585900000000 ]  - [   0.0001699000000000, -0.0002544100000000, -0.0010635600000000 ]  - [  -0.0000512200000000,  0.0002396200000000, -0.0010599500000000 ]  - [  -0.0001695000000000, -0.0002203500000000, -0.0015588800000000 ]  - [  -0.0002415200000000, -0.0000546100000000, -0.0010214900000000 ]  - [   0.0001148200000000,  0.0001974300000000, -0.0007482100000000 ]  - [   0.0000728300000000, -0.0001180000000000, -0.0008634300000000 ]  - [   0.0000711800000000,  0.0001855000000000, -0.0007843500000000 ]  - [  -0.0002562100000000,  0.0000335900000000, -0.0009113900000000 ]  - [   0.0000734600000000, -0.0000790600000000, -0.0009277100000000 ]  - [  -0.0000684900000000,  0.0000900200000000, -0.0009241800000000 ]  - [  -0.0000551800000000, -0.0001468800000000, -0.0007376500000000 ]  - [   0.0001296500000000,  0.0001539400000000, -0.0010678200000000 ]  - [   0.0001014600000000, -0.0001767800000000, -0.0005594200000000 ]  - [  -0.0001105000000000,  0.0001643900000000, -0.0009718700000000 ]  - [  -0.0001267400000000, -0.0001585800000000, -0.0010674700000000 ]  - [  -0.0001158200000000,  0.0001233100000000, -0.0006388400000000 ]  - [   0.0001159600000000,  0.0001434400000000, -0.0007584000000000 ]  - [  -0.0002845400000000, -0.0000950900000000, -0.0007824200000000 ]  - [   0.0001401100000000, -0.0001417700000000, -0.0010713600000000 ]  - [   0.0002021100000000, -0.0000540400000000, -0.0005503400000000 ]  - [   0.0000299600000000, -0.0001639300000000, -0.0008842900000000 ]  - [  -0.0002090600000000,  0.0000610600000000, -0.0010759200000000 ]  - [  -0.0001193500000000,  0.0000699600000000, -0.0004880100000000 ]  - [  -0.0000054100000000,  0.0001492600000000, -0.0008405700000000 ]  - [   0.0009627200000000, -0.0002675200000000, -0.0006799900000000 ]  - [   0.0001358600000000,  0.0000338700000000, -0.0009170700000000 ]  - [   0.0000924000000000, -0.0001595800000000, -0.0007957500000000 ]  - [  -0.0003144800000000, -0.0000218500000000, -0.0007623900000000 ]  - [   0.0001900100000000,  0.0004057700000000, -0.0012718100000000 ]- atom:    3  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0067271900000000,  0.0019552600000000, -0.0019883000000000 ]  - [   0.0015831600000000,  0.0045806000000000,  0.0031665300000000 ]  - [  -0.0049856800000000, -0.0008255000000000,  0.0892429700000000 ]  - [  -0.0020925700000000, -0.0017531700000000,  0.0045262700000000 ]  - [  -0.0016473000000000,  0.0002824500000000,  0.0048009400000000 ]  - [   0.0076172100000000, -0.0022980600000000,  0.0017038900000000 ]  - [   0.0055934500000000,  0.0015306100000000,  0.0028579600000000 ]  - [   0.0000718500000000,  0.0001806600000000,  0.0003104500000000 ]  - [  -0.0072113500000000, -0.0027363200000000, -0.0027211600000000 ]  - [   0.0005946900000000, -0.0042919300000000,  0.0028652800000000 ]  - [  -0.0007055200000000,  0.0027525900000000, -0.0029832700000000 ]  - [   0.0016392000000000, -0.0004269800000000, -0.0032050400000000 ]  - [   0.0000112400000000, -0.0006330600000000, -0.0010089400000000 ]  - [   0.0001470100000000,  0.0000636700000000, -0.0015883500000000 ]  - [  -0.0000445500000000,  0.0001986800000000, -0.0011012800000000 ]  - [  -0.0000005900000000,  0.0000028800000000, -0.0011492000000000 ]  - [  -0.0000649700000000,  0.0000036800000000, -0.0014508900000000 ]  - [   0.0000229900000000,  0.0001503200000000, -0.0013981100000000 ]  - [  -0.0000841500000000,  0.0000300700000000, -0.0011754800000000 ]  - [  -0.0000029500000000, -0.0000076700000000, -0.0013841100000000 ]  - [   0.0000700300000000, -0.0000345300000000, -0.0012096600000000 ]  - [  -0.0000226300000000, -0.0001686600000000, -0.0013906600000000 ]  - [  -0.0000314900000000,  0.0000647600000000, -0.0012142500000000 ]  - [   0.0002505500000000,  0.0000514500000000, -0.0016280500000000 ]  - [  -0.0000613800000000, -0.0000034000000000, -0.0015277700000000 ]  - [   0.0000243100000000, -0.0000510400000000, -0.0012143400000000 ]  - [  -0.0001227000000000, -0.0000589500000000, -0.0012588500000000 ]  - [  -0.0000086800000000,  0.0000275400000000, -0.0013947500000000 ]  - [  -0.0000367900000000, -0.0000547900000000, -0.0010111500000000 ]  - [  -0.0000604900000000, -0.0000075400000000, -0.0003465900000000 ]  - [  -0.0000757800000000,  0.0004630200000000, -0.0011033900000000 ]  - [  -0.0006860000000000, -0.0022580800000000, -0.0039952200000000 ]  - [   0.0007634200000000,  0.0002087900000000, -0.0005386400000000 ]  - [  -0.0005895600000000, -0.0007425900000000, -0.0019436200000000 ]  - [   0.0007885600000000, -0.0001862200000000, -0.0001241000000000 ]  - [   0.0004359000000000, -0.0003273500000000, -0.0046458400000000 ]  - [  -0.0043288300000000, -0.0003714900000000, -0.0057118500000000 ]  - [   0.0088404400000000,  0.0063775700000000, -0.0318364800000000 ]  - [  -0.0000070700000000, -0.0013265400000000, -0.0084485100000000 ]  - [   0.0022645400000000, -0.0014744200000000, -0.0028048000000000 ]  - [   0.0007521400000000,  0.0061938300000000, -0.0078178400000000 ]  - [  -0.0056765300000000,  0.0006289700000000, -0.0069200900000000 ]  - [  -0.0004004500000000,  0.0007858500000000, -0.0010839600000000 ]  - [   0.0004491400000000, -0.0003030100000000, -0.0005331300000000 ]  - [   0.0005817100000000,  0.0000902000000000, -0.0002838400000000 ]  - [  -0.0007858600000000, -0.0013614800000000, -0.0025337200000000 ]  - [  -0.0014685400000000, -0.0006280300000000,  0.0003560900000000 ]  - [  -0.0010003900000000,  0.0008906900000000, -0.0017101000000000 ]  - [  -0.0000894500000000,  0.0000747200000000,  0.0003521600000000 ]  - [  -0.0003108900000000,  0.0005946500000000,  0.0004688200000000 ]  - [   0.0072036300000000, -0.0059865600000000, -0.0209984400000000 ]  - [  -0.0001316000000000,  0.0002939900000000,  0.0011186200000000 ]  - [   0.0000143800000000, -0.0002795900000000,  0.0011130000000000 ]  - [   0.0002785800000000,  0.0002966100000000,  0.0015123600000000 ]  - [   0.0002011100000000,  0.0000910800000000,  0.0009675200000000 ]  - [  -0.0000739000000000, -0.0002334700000000,  0.0006945500000000 ]  - [   0.0000082500000000,  0.0000164100000000,  0.0009039400000000 ]  - [  -0.0000922700000000, -0.0002059600000000,  0.0005858300000000 ]  - [   0.0001754600000000,  0.0000682800000000,  0.0009523600000000 ]  - [  -0.0001538100000000, -0.0000225200000000,  0.0008863100000000 ]  - [   0.0001488800000000,  0.0000119000000000,  0.0008827500000000 ]  - [   0.0000765800000000,  0.0001675300000000,  0.0005392600000000 ]  - [  -0.0001659600000000, -0.0001140700000000,  0.0010149600000000 ]  - [  -0.0000803100000000,  0.0001564700000000,  0.0007574600000000 ]  - [   0.0001502200000000, -0.0001277500000000,  0.0010242900000000 ]  - [   0.0001631200000000,  0.0001188600000000,  0.0010150500000000 ]  - [   0.0000945600000000, -0.0001033500000000,  0.0008365700000000 ]  - [  -0.0001367600000000, -0.0001651500000000,  0.0005603200000000 ]  - [   0.0003047700000000,  0.0001160400000000,  0.0005836900000000 ]  - [  -0.0001801600000000,  0.0001050300000000,  0.0011237600000000 ]  - [  -0.0001822100000000,  0.0000320100000000,  0.0007471800000000 ]  - [   0.0000716900000000,  0.0000837600000000,  0.0009253000000000 ]  - [   0.0001085100000000, -0.0001408900000000,  0.0010367500000000 ]  - [   0.0000987500000000, -0.0000484600000000,  0.0006860200000000 ]  - [  -0.0000961300000000, -0.0000687200000000,  0.0008816900000000 ]  - [  -0.0009326600000000,  0.0003081700000000,  0.0007332600000000 ]  - [  -0.0001718900000000, -0.0000755300000000,  0.0009634300000000 ]  - [   0.0000089400000000,  0.0002397300000000,  0.0007552600000000 ]  - [   0.0002751200000000,  0.0000580800000000,  0.0007103800000000 ]  - [  -0.0001561100000000, -0.0004446200000000,  0.0012205500000000 ]- atom:   33  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0037949300000000,  0.0065321300000000,  0.0015270100000000 ]  - [  -0.0014244100000000,  0.0000306200000000, -0.0009354700000000 ]  - [   0.0002675600000000, -0.0001930400000000, -0.0007142600000000 ]  - [   0.0025996400000000, -0.0013261500000000,  0.0011742600000000 ]  - [   0.0007352500000000, -0.0003401800000000,  0.0008446300000000 ]  - [  -0.0006580400000000, -0.0012627000000000, -0.0006327700000000 ]  - [  -0.0000043900000000, -0.0000581600000000,  0.0002461900000000 ]  - [  -0.0000098100000000,  0.0000560700000000,  0.0000965700000000 ]  - [  -0.0000063900000000,  0.0000846800000000,  0.0001813100000000 ]  - [  -0.0000497500000000,  0.0000425200000000, -0.0001295500000000 ]  - [  -0.0000184900000000, -0.0000550900000000,  0.0000253700000000 ]  - [   0.0000337400000000, -0.0000083800000000,  0.0002165500000000 ]  - [  -0.0000122400000000, -0.0000514200000000,  0.0001215400000000 ]  - [   0.0000712400000000, -0.0000029800000000,  0.0000999700000000 ]  - [   0.0000164100000000,  0.0000570000000000,  0.0001364800000000 ]  - [  -0.0000609400000000,  0.0000029500000000,  0.0000951000000000 ]  - [  -0.0000050600000000,  0.0000007900000000,  0.0000569300000000 ]  - [   0.0000534300000000, -0.0000031400000000,  0.0000944600000000 ]  - [  -0.0000431300000000, -0.0000209700000000,  0.0000445500000000 ]  - [  -0.0000315600000000, -0.0000009200000000,  0.0001919800000000 ]  - [   0.0001303000000000, -0.0000086700000000,  0.0002290600000000 ]  - [  -0.0000471000000000,  0.0000162500000000,  0.0001280400000000 ]  - [  -0.0000276200000000,  0.0000947800000000,  0.0001860000000000 ]  - [   0.0000590100000000,  0.0001839000000000,  0.0012896600000000 ]  - [   0.0005683900000000, -0.0001315100000000, -0.0000491500000000 ]  - [  -0.0001678100000000,  0.0000029500000000,  0.0000862800000000 ]  - [  -0.0002168400000000, -0.0002314100000000, -0.0001555000000000 ]  - [  -0.0005999500000000, -0.0005849600000000, -0.0013343900000000 ]  - [   0.0043344000000000, -0.0016927600000000,  0.0061562500000000 ]  - [   0.0014220700000000, -0.0008231800000000, -0.0005045300000000 ]  - [   0.0006802300000000, -0.0006116900000000,  0.0009533100000000 ]  - [   0.0143007100000000, -0.0040187000000000, -0.0045376100000000 ]  - [  -0.0560640700000000,  0.0017046800000000, -0.0050432200000000 ]  - [   0.0009893900000000, -0.0013892200000000, -0.0004877500000000 ]  - [   0.0014432700000000, -0.0052243400000000, -0.0006735400000000 ]  - [  -0.0002684400000000, -0.0000284900000000,  0.0003498800000000 ]  - [  -0.0014320700000000, -0.0003418100000000, -0.0007306400000000 ]  - [   0.0023859900000000,  0.0011781200000000,  0.0017038800000000 ]  - [   0.0003779200000000,  0.0001599400000000, -0.0000612200000000 ]  - [   0.0026656800000000, -0.0001422900000000,  0.0023188500000000 ]  - [   0.0000258900000000,  0.0001026000000000,  0.0002480800000000 ]  - [   0.0003017200000000, -0.0001949800000000, -0.0009839700000000 ]  - [   0.0022796200000000,  0.0036718900000000, -0.0030079400000000 ]  - [   0.0000358200000000,  0.0000451100000000, -0.0001991600000000 ]  - [   0.0000280600000000, -0.0000100400000000, -0.0001291800000000 ]  - [  -0.0001922600000000, -0.0000379100000000,  0.0002093300000000 ]  - [   0.0000281600000000, -0.0000085700000000,  0.0000557700000000 ]  - [  -0.0000472700000000, -0.0001247100000000, -0.0001880000000000 ]  - [  -0.0000499600000000, -0.0000366700000000, -0.0001185700000000 ]  - [  -0.0000616900000000, -0.0000018900000000,  0.0000635900000000 ]  - [  -0.0000548800000000,  0.0000777800000000, -0.0000473800000000 ]  - [   0.0000298000000000,  0.0000055200000000, -0.0000642500000000 ]  - [  -0.0000484900000000, -0.0000108600000000, -0.0000614600000000 ]  - [   0.0000570400000000,  0.0000368100000000, -0.0001026600000000 ]  - [  -0.0000231500000000,  0.0000023300000000, -0.0000962700000000 ]  - [   0.0000271700000000,  0.0000023500000000, -0.0001026700000000 ]  - [   0.0000521700000000, -0.0000545300000000, -0.0000629100000000 ]  - [  -0.0000063200000000, -0.0000003300000000, -0.0001691500000000 ]  - [  -0.0000431900000000,  0.0000571300000000, -0.0000653100000000 ]  - [   0.0000201200000000, -0.0000655900000000, -0.0001126500000000 ]  - [   0.0000684900000000,  0.0000380600000000, -0.0001242400000000 ]  - [   0.0000072900000000, -0.0000063500000000, -0.0001359300000000 ]  - [  -0.0000181400000000,  0.0000578600000000, -0.0000609400000000 ]  - [   0.0000210800000000, -0.0000185900000000,  0.0000448400000000 ]  - [   0.0000765600000000,  0.0000138100000000, -0.0000185600000000 ]  - [  -0.0000267000000000, -0.0000083400000000, -0.0001359100000000 ]  - [  -0.0000294900000000,  0.0000315500000000,  0.0000297100000000 ]  - [  -0.0002109100000000,  0.0001401000000000, -0.0003587300000000 ]  - [  -0.0008823000000000, -0.0002275000000000,  0.0009648300000000 ]  - [   0.0000205900000000,  0.0000003400000000, -0.0001570600000000 ]  - [   0.0004354700000000,  0.0003815500000000, -0.0002563700000000 ]  - [   0.0001992000000000, -0.0001239900000000, -0.0004490600000000 ]  - [   0.0012024200000000, -0.0007466500000000, -0.0016141000000000 ]  - [   0.0000703700000000,  0.0000596700000000, -0.0003046100000000 ]  - [   0.0000084200000000,  0.0000775500000000,  0.0002398100000000 ]  - [   0.0186902600000000,  0.0021002100000000,  0.0069080100000000 ]  - [   0.0011651800000000, -0.0010717400000000,  0.0003267700000000 ]  - [   0.0001001900000000,  0.0007516000000000,  0.0012475000000000 ]  - [  -0.0005733200000000,  0.0001473500000000,  0.0004509900000000 ]  - [   0.0015355000000000,  0.0033528100000000, -0.0042267200000000 ]- atom:   33  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0038105300000000, -0.0065180000000000, -0.0016478300000000 ]  - [   0.0015194000000000, -0.0000304600000000,  0.0009334500000000 ]  - [  -0.0003697900000000,  0.0001778400000000,  0.0007336100000000 ]  - [  -0.0025845000000000,  0.0013334700000000, -0.0010418400000000 ]  - [  -0.0006170300000000,  0.0003539300000000, -0.0008107800000000 ]  - [   0.0001976100000000,  0.0013253600000000,  0.0008334000000000 ]  - [  -0.0000149200000000,  0.0001755700000000, -0.0002706600000000 ]  - [   0.0000095000000000,  0.0000495600000000, -0.0000978500000000 ]  - [   0.0000085300000000, -0.0000854600000000, -0.0003211600000000 ]  - [   0.0000616000000000, -0.0001591800000000,  0.0001006800000000 ]  - [   0.0000183900000000, -0.0000502000000000, -0.0000277900000000 ]  - [  -0.0000338000000000,  0.0000085900000000, -0.0000824100000000 ]  - [  -0.0000007500000000, -0.0000675800000000, -0.0000963600000000 ]  - [   0.0000483000000000, -0.0000102000000000, -0.0001275500000000 ]  - [  -0.0000036500000000,  0.0000625900000000, -0.0001113500000000 ]  - [  -0.0000584100000000,  0.0000100800000000, -0.0001226800000000 ]  - [   0.0000053400000000, -0.0000004900000000, -0.0001941500000000 ]  - [   0.0000516400000000,  0.0000036900000000, -0.0000956700000000 ]  - [  -0.0000758100000000,  0.0000082100000000, -0.0000199200000000 ]  - [   0.0000314600000000,  0.0000011700000000, -0.0000585600000000 ]  - [  -0.0000101000000000,  0.0000210600000000, -0.0002035600000000 ]  - [  -0.0000578700000000, -0.0000164600000000, -0.0001288200000000 ]  - [   0.0000148900000000,  0.0000246200000000, -0.0002133500000000 ]  - [  -0.0000585100000000, -0.0000800600000000, -0.0012889300000000 ]  - [  -0.0005633800000000,  0.0001323600000000, -0.0000850600000000 ]  - [   0.0001813500000000, -0.0001227800000000, -0.0001158000000000 ]  - [   0.0002141300000000,  0.0001230800000000,  0.0001479500000000 ]  - [   0.0005837100000000,  0.0005877600000000,  0.0014830800000000 ]  - [  -0.0043126900000000,  0.0015749000000000, -0.0061580000000000 ]  - [  -0.0013890700000000,  0.0006987900000000,  0.0004551900000000 ]  - [  -0.0006588300000000,  0.0007323000000000, -0.0009187400000000 ]  - [  -0.0134547300000000,  0.0038637500000000,  0.0042405300000000 ]  - [   0.0557353100000000, -0.0015908300000000,  0.0053486500000000 ]  - [  -0.0010002300000000,  0.0013749800000000,  0.0002811800000000 ]  - [  -0.0015434900000000,  0.0053002300000000,  0.0007065300000000 ]  - [   0.0001854400000000, -0.0000749700000000, -0.0003934400000000 ]  - [   0.0014969800000000,  0.0004203100000000,  0.0006080400000000 ]  - [  -0.0023538800000000, -0.0011234500000000, -0.0018857500000000 ]  - [  -0.0004124300000000, -0.0001180900000000,  0.0000095400000000 ]  - [  -0.0026281600000000,  0.0001103500000000, -0.0020866100000000 ]  - [   0.0000132900000000, -0.0000656000000000, -0.0001905600000000 ]  - [  -0.0002607100000000,  0.0001585900000000,  0.0009440000000000 ]  - [  -0.0022988700000000, -0.0036614800000000,  0.0032177700000000 ]  - [  -0.0000567600000000, -0.0000674400000000,  0.0000024300000000 ]  - [  -0.0000073000000000,  0.0000319600000000, -0.0000683000000000 ]  - [   0.0001520900000000,  0.0000018600000000, -0.0001547900000000 ]  - [  -0.0000087200000000, -0.0000131100000000,  0.0001428300000000 ]  - [   0.0001503300000000,  0.0000439300000000,  0.0002279300000000 ]  - [  -0.0000516800000000, -0.0000435200000000,  0.0000787400000000 ]  - [   0.0000408100000000,  0.0000234100000000,  0.0001359700000000 ]  - [  -0.0000488700000000,  0.0000022800000000,  0.0000885300000000 ]  - [   0.0000062400000000,  0.0000345600000000,  0.0001185300000000 ]  - [   0.0000122200000000, -0.0000292000000000,  0.0001156700000000 ]  - [   0.0000446800000000,  0.0000437100000000,  0.0000629300000000 ]  - [  -0.0000166100000000,  0.0000341200000000,  0.0000449500000000 ]  - [   0.0000126200000000, -0.0000388500000000,  0.0000514100000000 ]  - [   0.0000281100000000, -0.0000472600000000,  0.0001050000000000 ]  - [  -0.0000158200000000, -0.0000205600000000, -0.0000282100000000 ]  - [  -0.0000369900000000,  0.0000450300000000,  0.0001069300000000 ]  - [  -0.0001004300000000, -0.0000359500000000,  0.0000732000000000 ]  - [   0.0000124000000000,  0.0000639300000000,  0.0000850800000000 ]  - [   0.0000145300000000,  0.0000274200000000, -0.0000614500000000 ]  - [  -0.0000186600000000, -0.0000174800000000,  0.0000097900000000 ]  - [   0.0000005900000000, -0.0000021400000000,  0.0001549200000000 ]  - [  -0.0000362400000000,  0.0000222900000000,  0.0000732900000000 ]  - [   0.0000629000000000, -0.0000312300000000,  0.0000837700000000 ]  - [   0.0000075800000000, -0.0000109100000000,  0.0001693900000000 ]  - [   0.0001855300000000, -0.0001618200000000,  0.0001606700000000 ]  - [   0.0008965700000000,  0.0002516400000000, -0.0011583700000000 ]  - [  -0.0000608600000000, -0.0000360600000000,  0.0002120700000000 ]  - [  -0.0004136700000000, -0.0004055500000000,  0.0004532900000000 ]  - [  -0.0000962700000000,  0.0000445500000000,  0.0004894400000000 ]  - [  -0.0013118400000000,  0.0006651900000000,  0.0015504400000000 ]  - [  -0.0000823700000000, -0.0000380400000000,  0.0005113400000000 ]  - [  -0.0001076500000000,  0.0000020300000000, -0.0001960200000000 ]  - [  -0.0188120900000000, -0.0020547100000000, -0.0070005100000000 ]  - [  -0.0011856700000000,  0.0010204400000000, -0.0002777900000000 ]  - [   0.0000083100000000, -0.0006602100000000, -0.0012739900000000 ]  - [   0.0005307400000000, -0.0001301100000000, -0.0004967400000000 ]  - [  -0.0015025200000000, -0.0033719900000000,  0.0041592000000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0053310800000000,  0.0203951300000000,  0.0052254800000000 ]  - [   0.0005630800000000, -0.0013701100000000,  0.0000106500000000 ]  - [  -0.0004881600000000,  0.0004510400000000, -0.0002474400000000 ]  - [  -0.0008959700000000,  0.0027936500000000, -0.0013943000000000 ]  - [   0.0005236500000000, -0.0011491600000000, -0.0002228900000000 ]  - [  -0.0004082200000000,  0.0026890600000000,  0.0007764400000000 ]  - [  -0.0000535500000000,  0.0004155700000000, -0.0002361500000000 ]  - [  -0.0000108000000000,  0.0000490300000000,  0.0002307000000000 ]  - [   0.0000642100000000, -0.0000747900000000, -0.0000042000000000 ]  - [   0.0000328700000000, -0.0001560700000000, -0.0000529300000000 ]  - [   0.0000029600000000, -0.0000531100000000,  0.0001822000000000 ]  - [  -0.0000046300000000, -0.0000209100000000,  0.0000859200000000 ]  - [  -0.0000069900000000, -0.0000823300000000,  0.0000577200000000 ]  - [   0.0000526400000000, -0.0000039100000000,  0.0000143900000000 ]  - [  -0.0000049200000000,  0.0000871700000000,  0.0000331200000000 ]  - [  -0.0000536600000000,  0.0000005700000000,  0.0000250300000000 ]  - [  -0.0000041400000000,  0.0000076000000000, -0.0000150400000000 ]  - [   0.0000587700000000,  0.0000065500000000,  0.0000451400000000 ]  - [  -0.0000289900000000, -0.0000417000000000, -0.0000553300000000 ]  - [  -0.0000056800000000,  0.0000094900000000,  0.0001526000000000 ]  - [   0.0000412500000000,  0.0000300000000000,  0.0000288500000000 ]  - [  -0.0000669700000000, -0.0000053100000000,  0.0000339300000000 ]  - [  -0.0000034600000000, -0.0000337500000000,  0.0000277900000000 ]  - [  -0.0004195700000000,  0.0002728600000000,  0.0008886000000000 ]  - [   0.0001671200000000,  0.0003416600000000, -0.0003860700000000 ]  - [   0.0001061100000000,  0.0001277500000000,  0.0001448300000000 ]  - [   0.0001591800000000, -0.0006070500000000,  0.0004169000000000 ]  - [  -0.0004199200000000, -0.0001275400000000, -0.0006920600000000 ]  - [  -0.0019017000000000,  0.0042549700000000, -0.0074521400000000 ]  - [  -0.0003182700000000, -0.0014874800000000, -0.0003221400000000 ]  - [   0.0002228700000000, -0.0009734800000000, -0.0010412400000000 ]  - [  -0.0040552000000000,  0.0026640800000000,  0.0004253700000000 ]  - [   0.0015247500000000, -0.0619581500000000,  0.0020115200000000 ]  - [  -0.0018978700000000,  0.0020144500000000,  0.0005581000000000 ]  - [  -0.0052397700000000,  0.0186455200000000, -0.0009265500000000 ]  - [  -0.0000610000000000,  0.0009071800000000,  0.0012488600000000 ]  - [   0.0004220200000000,  0.0013031000000000,  0.0068500000000000 ]  - [   0.0016975500000000,  0.0012164000000000,  0.0007928800000000 ]  - [   0.0002300800000000,  0.0004102700000000, -0.0003045400000000 ]  - [  -0.0018462800000000,  0.0001245200000000, -0.0002813900000000 ]  - [  -0.0001843500000000, -0.0002498600000000, -0.0005142000000000 ]  - [   0.0000154700000000, -0.0000453400000000,  0.0000497800000000 ]  - [   0.0033815500000000,  0.0039328800000000, -0.0027436300000000 ]  - [  -0.0000613300000000, -0.0000714900000000, -0.0000646900000000 ]  - [  -0.0000028600000000,  0.0000390300000000, -0.0001299600000000 ]  - [   0.0002208400000000,  0.0000556100000000, -0.0005146100000000 ]  - [   0.0001220500000000, -0.0000413100000000,  0.0001739900000000 ]  - [   0.0000580500000000,  0.0001070300000000,  0.0000692500000000 ]  - [  -0.0000673900000000, -0.0000344500000000, -0.0000201100000000 ]  - [  -0.0000473900000000,  0.0000520500000000,  0.0001019400000000 ]  - [   0.0000783000000000,  0.0000977500000000,  0.0000378400000000 ]  - [   0.0000238300000000,  0.0000196900000000, -0.0000072900000000 ]  - [  -0.0000214200000000, -0.0000128500000000,  0.0000028700000000 ]  - [   0.0000675400000000,  0.0000405900000000,  0.0000043100000000 ]  - [  -0.0000379600000000,  0.0000275000000000, -0.0000811200000000 ]  - [   0.0000395000000000, -0.0000363900000000, -0.0000995400000000 ]  - [   0.0000364300000000, -0.0000378800000000,  0.0000037100000000 ]  - [  -0.0000021700000000, -0.0000022500000000, -0.0001192900000000 ]  - [  -0.0000338900000000,  0.0000365300000000,  0.0000076000000000 ]  - [  -0.0000254700000000, -0.0000968900000000, -0.0000331000000000 ]  - [   0.0000530800000000,  0.0000772800000000, -0.0000247000000000 ]  - [   0.0000028500000000, -0.0000130700000000, -0.0001058000000000 ]  - [  -0.0000092400000000, -0.0000338900000000, -0.0000660200000000 ]  - [   0.0000202100000000, -0.0000031700000000,  0.0000816800000000 ]  - [  -0.0000039400000000,  0.0000306200000000, -0.0001079000000000 ]  - [   0.0000053100000000, -0.0000135900000000, -0.0000539000000000 ]  - [  -0.0000226600000000,  0.0000102300000000,  0.0000795000000000 ]  - [  -0.0001547500000000,  0.0003218200000000,  0.0000471900000000 ]  - [   0.0007190200000000,  0.0001800400000000, -0.0013322600000000 ]  - [   0.0000349300000000,  0.0000213500000000, -0.0001529800000000 ]  - [   0.0002310100000000,  0.0004010900000000, -0.0000155600000000 ]  - [   0.0000570300000000, -0.0001390000000000,  0.0001036900000000 ]  - [  -0.0000317000000000,  0.0000082900000000,  0.0007366200000000 ]  - [  -0.0001811500000000, -0.0001789500000000, -0.0001302300000000 ]  - [   0.0000784200000000,  0.0000368700000000,  0.0004086600000000 ]  - [  -0.0002434200000000, -0.0014900900000000,  0.0010959700000000 ]  - [   0.0013275300000000, -0.0001643100000000,  0.0003081300000000 ]  - [   0.0000284800000000,  0.0013026800000000,  0.0019512700000000 ]  - [  -0.0011635600000000,  0.0020708600000000, -0.0015588400000000 ]  - [   0.0026887700000000,  0.0027221700000000, -0.0040208600000000 ]- atom:   33  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0050523700000000, -0.0192393400000000, -0.0051392800000000 ]  - [  -0.0004596500000000,  0.0013495200000000, -0.0000124600000000 ]  - [   0.0003674300000000, -0.0004580100000000,  0.0002737500000000 ]  - [   0.0009287900000000, -0.0028985000000000,  0.0017028900000000 ]  - [  -0.0004050700000000,  0.0011539100000000,  0.0002412700000000 ]  - [   0.0003085400000000, -0.0026608000000000, -0.0007741800000000 ]  - [   0.0000401100000000, -0.0002959800000000,  0.0002116500000000 ]  - [   0.0000110300000000,  0.0000561300000000, -0.0002324700000000 ]  - [  -0.0000641700000000,  0.0000749500000000, -0.0001329200000000 ]  - [  -0.0000186700000000,  0.0000364300000000,  0.0000196900000000 ]  - [  -0.0000037500000000, -0.0000518800000000, -0.0001841500000000 ]  - [   0.0000044400000000,  0.0000207200000000,  0.0000475700000000 ]  - [  -0.0000060900000000, -0.0000370200000000, -0.0000330200000000 ]  - [   0.0000668800000000, -0.0000094700000000, -0.0000427600000000 ]  - [   0.0000180000000000,  0.0000323700000000, -0.0000084100000000 ]  - [  -0.0000656400000000,  0.0000124700000000, -0.0000532800000000 ]  - [   0.0000045100000000, -0.0000077400000000, -0.0001230200000000 ]  - [   0.0000464500000000, -0.0000056800000000, -0.0000474300000000 ]  - [  -0.0000901700000000,  0.0000279200000000,  0.0000797500000000 ]  - [   0.0000062300000000, -0.0000086400000000, -0.0000190400000000 ]  - [   0.0000788300000000, -0.0000168700000000, -0.0000054800000000 ]  - [  -0.0000381900000000,  0.0000046200000000, -0.0000354900000000 ]  - [  -0.0000099900000000,  0.0001500900000000, -0.0000558000000000 ]  - [   0.0004169000000000, -0.0001642400000000, -0.0008871500000000 ]  - [  -0.0001690100000000, -0.0003432900000000,  0.0002465100000000 ]  - [  -0.0000923400000000, -0.0002443600000000, -0.0001725700000000 ]  - [  -0.0001561600000000,  0.0004984200000000, -0.0004051100000000 ]  - [   0.0004231400000000,  0.0001207100000000,  0.0008191300000000 ]  - [   0.0018776100000000, -0.0043865400000000,  0.0074407400000000 ]  - [   0.0002767300000000,  0.0011712100000000,  0.0002520700000000 ]  - [  -0.0002131600000000,  0.0010803400000000,  0.0010803400000000 ]  - [   0.0039484600000000, -0.0026256300000000, -0.0004436700000000 ]  - [  -0.0017627300000000,  0.0612525900000000, -0.0023104900000000 ]  - [   0.0018393500000000, -0.0020196900000000, -0.0007393000000000 ]  - [   0.0052855400000000, -0.0187205500000000,  0.0009483000000000 ]  - [  -0.0000146300000000, -0.0009980700000000, -0.0012730800000000 ]  - [  -0.0003400900000000, -0.0012191800000000, -0.0068603000000000 ]  - [  -0.0016568100000000, -0.0012066300000000, -0.0009926000000000 ]  - [  -0.0002643900000000, -0.0003694700000000,  0.0002524600000000 ]  - [   0.0018441600000000, -0.0001376900000000,  0.0004607000000000 ]  - [   0.0002267200000000,  0.0002866700000000,  0.0005689100000000 ]  - [   0.0000198200000000,  0.0000049200000000, -0.0001003600000000 ]  - [  -0.0034119600000000, -0.0039076200000000,  0.0029530100000000 ]  - [   0.0000401600000000,  0.0000485500000000, -0.0001323700000000 ]  - [   0.0000237500000000, -0.0000169800000000, -0.0000679200000000 ]  - [  -0.0002627800000000, -0.0000906200000000,  0.0005679100000000 ]  - [  -0.0001009400000000,  0.0000188800000000,  0.0000262000000000 ]  - [   0.0000444500000000, -0.0001876100000000, -0.0000282400000000 ]  - [  -0.0000344000000000, -0.0000461000000000, -0.0000195500000000 ]  - [   0.0000259300000000, -0.0000298000000000,  0.0000989200000000 ]  - [  -0.0001800800000000, -0.0000176000000000,  0.0000038000000000 ]  - [   0.0000119100000000,  0.0000203400000000,  0.0000617100000000 ]  - [  -0.0000143400000000, -0.0000277400000000,  0.0000514600000000 ]  - [   0.0000345800000000,  0.0000396700000000, -0.0000434800000000 ]  - [  -0.0000018600000000,  0.0000085000000000,  0.0000298500000000 ]  - [   0.0000002900000000,  0.0000000800000000,  0.0000485800000000 ]  - [   0.0000437200000000, -0.0000640600000000,  0.0000385700000000 ]  - [  -0.0000203500000000, -0.0000184700000000, -0.0000780100000000 ]  - [  -0.0000460000000000,  0.0000653800000000,  0.0000344200000000 ]  - [  -0.0000550500000000, -0.0000053800000000, -0.0000059700000000 ]  - [   0.0000271900000000,  0.0000251000000000, -0.0000144100000000 ]  - [   0.0000193800000000,  0.0000339400000000, -0.0000917100000000 ]  - [  -0.0000268900000000,  0.0000739300000000,  0.0000161300000000 ]  - [   0.0000019700000000, -0.0000176100000000,  0.0001182900000000 ]  - [   0.0000429200000000,  0.0000047700000000,  0.0001592300000000 ]  - [   0.0000309600000000, -0.0000259900000000,  0.0000021200000000 ]  - [   0.0000004300000000,  0.0000096800000000,  0.0001200700000000 ]  - [   0.0001344100000000, -0.0003435200000000, -0.0002463300000000 ]  - [  -0.0006986700000000, -0.0001534500000000,  0.0011359400000000 ]  - [  -0.0000747700000000, -0.0000568600000000,  0.0002061100000000 ]  - [  -0.0002104800000000, -0.0004209300000000,  0.0002151000000000 ]  - [   0.0000434600000000,  0.0000592300000000, -0.0000564200000000 ]  - [  -0.0000814400000000, -0.0000828600000000, -0.0007603700000000 ]  - [   0.0001611500000000,  0.0001980600000000,  0.0003281600000000 ]  - [  -0.0001799000000000,  0.0000434800000000, -0.0003631100000000 ]  - [   0.0003580800000000,  0.0015250400000000, -0.0010165500000000 ]  - [  -0.0013802200000000,  0.0001357400000000, -0.0002620600000000 ]  - [   0.0000783000000000, -0.0012109500000000, -0.0019989600000000 ]  - [   0.0011208900000000, -0.0020248500000000,  0.0014645300000000 ]  - [  -0.0026204000000000, -0.0027700600000000,  0.0039434200000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0010346100000000,  0.0050007100000000,  0.0065472200000000 ]  - [   0.0006350400000000,  0.0005914900000000,  0.0021802600000000 ]  - [  -0.0016109500000000, -0.0000017700000000,  0.0005770000000000 ]  - [   0.0011429500000000, -0.0023885200000000,  0.0066083000000000 ]  - [   0.0005295100000000, -0.0003549000000000,  0.0001688400000000 ]  - [   0.0002833300000000,  0.0004971600000000,  0.0039272200000000 ]  - [   0.0004681800000000,  0.0004527700000000, -0.0015407600000000 ]  - [   0.0000950800000000, -0.0000656300000000, -0.0010612100000000 ]  - [  -0.0000494700000000, -0.0000974700000000, -0.0008028900000000 ]  - [  -0.0000951700000000, -0.0000703400000000, -0.0003826300000000 ]  - [  -0.0001471300000000,  0.0000664400000000, -0.0010148500000000 ]  - [  -0.0000295800000000, -0.0000351200000000, -0.0010407500000000 ]  - [   0.0000384600000000, -0.0001143300000000, -0.0008473800000000 ]  - [   0.0000535700000000, -0.0000319500000000, -0.0009183200000000 ]  - [  -0.0000408800000000,  0.0000993000000000, -0.0008906600000000 ]  - [  -0.0000578400000000,  0.0000172600000000, -0.0009145400000000 ]  - [  -0.0000056300000000, -0.0000056900000000, -0.0011334800000000 ]  - [   0.0000485800000000,  0.0001389900000000, -0.0010551000000000 ]  - [  -0.0000460900000000, -0.0000085100000000, -0.0008697400000000 ]  - [   0.0000037400000000, -0.0000120400000000, -0.0009939500000000 ]  - [   0.0001267700000000, -0.0000124300000000, -0.0009178800000000 ]  - [  -0.0000599900000000, -0.0001107200000000, -0.0009727500000000 ]  - [  -0.0000971700000000, -0.0000279500000000, -0.0007875500000000 ]  - [   0.0008715800000000, -0.0000522700000000, -0.0010293000000000 ]  - [   0.0001097100000000, -0.0005878900000000, -0.0008989800000000 ]  - [  -0.0002030000000000,  0.0000062400000000, -0.0010660700000000 ]  - [  -0.0003375700000000, -0.0000921700000000, -0.0007787500000000 ]  - [   0.0001027400000000, -0.0004938800000000,  0.0003040200000000 ]  - [   0.0062119000000000, -0.0067662400000000,  0.0210223600000000 ]  - [   0.0006558300000000,  0.0001180800000000,  0.0045974700000000 ]  - [   0.0002284200000000,  0.0009651200000000,  0.0017321600000000 ]  - [  -0.0054382200000000,  0.0012026800000000,  0.0056933000000000 ]  - [  -0.0050227000000000,  0.0020058900000000, -0.0667106400000000 ]  - [  -0.0003790800000000,  0.0014338700000000, -0.0010144900000000 ]  - [   0.0006392600000000,  0.0010174200000000, -0.0035916600000000 ]  - [   0.0003313800000000, -0.0013225800000000, -0.0007674200000000 ]  - [   0.0007182100000000,  0.0069683000000000,  0.0137293800000000 ]  - [  -0.0003226000000000, -0.0000427800000000, -0.0008901000000000 ]  - [  -0.0002346300000000, -0.0000459600000000,  0.0000098400000000 ]  - [   0.0024347300000000, -0.0006044700000000, -0.0002811300000000 ]  - [   0.0003719000000000,  0.0001312100000000,  0.0008447000000000 ]  - [   0.0002159300000000,  0.0001085700000000,  0.0001859200000000 ]  - [  -0.0031935900000000, -0.0037243000000000,  0.0007686300000000 ]  - [  -0.0002541700000000, -0.0000226300000000,  0.0004038500000000 ]  - [   0.0001135000000000,  0.0000292000000000,  0.0003001900000000 ]  - [  -0.0005370700000000, -0.0002717200000000,  0.0009079800000000 ]  - [  -0.0000077400000000,  0.0001043100000000,  0.0007134000000000 ]  - [  -0.0000301500000000,  0.0004304200000000,  0.0007590800000000 ]  - [  -0.0000747900000000, -0.0001230200000000,  0.0007111200000000 ]  - [   0.0001535000000000, -0.0000321100000000,  0.0005147500000000 ]  - [   0.0003372600000000,  0.0002596300000000,  0.0007280200000000 ]  - [  -0.0000869800000000,  0.0001241200000000,  0.0007705600000000 ]  - [   0.0000896300000000, -0.0001161900000000,  0.0008253300000000 ]  - [   0.0000506800000000,  0.0001390200000000,  0.0007114300000000 ]  - [   0.0000832000000000,  0.0001146500000000,  0.0007384000000000 ]  - [  -0.0000843100000000, -0.0001196500000000,  0.0007324000000000 ]  - [  -0.0000433600000000, -0.0000680900000000,  0.0006853000000000 ]  - [  -0.0000957000000000, -0.0001158500000000,  0.0004053900000000 ]  - [   0.0000456800000000,  0.0000641300000000,  0.0006903700000000 ]  - [  -0.0001330800000000, -0.0000370200000000,  0.0006592200000000 ]  - [   0.0001447500000000,  0.0000456200000000,  0.0006365400000000 ]  - [   0.0000807800000000,  0.0001428600000000,  0.0004053600000000 ]  - [  -0.0001360000000000, -0.0000323200000000,  0.0008145900000000 ]  - [  -0.0000531900000000,  0.0001037800000000,  0.0005858600000000 ]  - [   0.0001290700000000, -0.0001497200000000,  0.0007044900000000 ]  - [   0.0001173000000000,  0.0001030600000000,  0.0006936000000000 ]  - [   0.0000544300000000, -0.0001066700000000,  0.0005888100000000 ]  - [  -0.0002798700000000, -0.0002349400000000, -0.0000120000000000 ]  - [  -0.0015508200000000, -0.0004196900000000,  0.0033282600000000 ]  - [  -0.0001364900000000,  0.0000611600000000,  0.0007929400000000 ]  - [  -0.0001645500000000, -0.0003288400000000,  0.0003653700000000 ]  - [   0.0000019000000000,  0.0001669500000000,  0.0007595900000000 ]  - [  -0.0020098200000000,  0.0012137400000000,  0.0008350600000000 ]  - [   0.0007959000000000,  0.0000880700000000,  0.0005319800000000 ]  - [  -0.0000342300000000, -0.0000275000000000,  0.0007272100000000 ]  - [   0.0056957600000000, -0.0002742000000000,  0.0003512500000000 ]  - [  -0.0002127200000000,  0.0003591700000000, -0.0018251200000000 ]  - [   0.0007963100000000,  0.0016072600000000,  0.0008368400000000 ]  - [   0.0001568200000000, -0.0024955900000000, -0.0003000800000000 ]  - [  -0.0029015300000000, -0.0039329500000000,  0.0021990200000000 ]- atom:   33  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0010449200000000, -0.0049983400000000, -0.0067325700000000 ]  - [  -0.0005359900000000, -0.0005910000000000, -0.0021828400000000 ]  - [   0.0014917600000000, -0.0000052500000000, -0.0005276000000000 ]  - [  -0.0010453900000000,  0.0021035900000000, -0.0060064900000000 ]  - [  -0.0004063800000000,  0.0003668000000000, -0.0001224600000000 ]  - [  -0.0005122700000000, -0.0004833100000000, -0.0038640500000000 ]  - [  -0.0004783100000000, -0.0003334700000000,  0.0015297300000000 ]  - [  -0.0000961300000000,  0.0001695700000000,  0.0010641500000000 ]  - [   0.0000493600000000,  0.0000978200000000,  0.0006739600000000 ]  - [   0.0001047500000000, -0.0000493600000000,  0.0003635300000000 ]  - [   0.0001478600000000, -0.0001701700000000,  0.0010184100000000 ]  - [   0.0000293600000000,  0.0000346500000000,  0.0011788800000000 ]  - [  -0.0000505400000000, -0.0000056900000000,  0.0008762900000000 ]  - [   0.0000662800000000,  0.0000193700000000,  0.0008953900000000 ]  - [   0.0000527300000000,  0.0000208800000000,  0.0009195800000000 ]  - [  -0.0000617100000000, -0.0000053000000000,  0.0008916500000000 ]  - [   0.0000061800000000,  0.0000061900000000,  0.0010014600000000 ]  - [   0.0000566200000000, -0.0001392300000000,  0.0010592800000000 ]  - [  -0.0000739000000000, -0.0000029200000000,  0.0008975800000000 ]  - [  -0.0000038700000000,  0.0000128500000000,  0.0011312600000000 ]  - [  -0.0000068600000000,  0.0000243000000000,  0.0009461100000000 ]  - [  -0.0000446700000000,  0.0001106300000000,  0.0009765500000000 ]  - [   0.0000858200000000,  0.0001487900000000,  0.0007626000000000 ]  - [  -0.0008748700000000,  0.0001534600000000,  0.0010215900000000 ]  - [  -0.0001121600000000,  0.0005949400000000,  0.0007647900000000 ]  - [   0.0002167800000000, -0.0001255700000000,  0.0010459300000000 ]  - [   0.0003381900000000, -0.0000145700000000,  0.0007757100000000 ]  - [  -0.0001028400000000,  0.0004981600000000, -0.0001759100000000 ]  - [  -0.0065053800000000,  0.0069757400000000, -0.0221332400000000 ]  - [  -0.0005256300000000, -0.0001242900000000, -0.0046473300000000 ]  - [  -0.0002166800000000, -0.0008406600000000, -0.0017329700000000 ]  - [   0.0053550000000000, -0.0012051200000000, -0.0057216000000000 ]  - [   0.0053812000000000, -0.0023249400000000,  0.0672321400000000 ]  - [   0.0003745300000000, -0.0014706400000000,  0.0008064500000000 ]  - [  -0.0007406900000000, -0.0008572300000000,  0.0036530400000000 ]  - [  -0.0004119000000000,  0.0011988200000000,  0.0007088600000000 ]  - [  -0.0006205100000000, -0.0067427800000000, -0.0135577400000000 ]  - [   0.0003253900000000,  0.0000521000000000,  0.0006831700000000 ]  - [   0.0001995500000000,  0.0000867100000000, -0.0000684800000000 ]  - [  -0.0024136100000000,  0.0005892500000000,  0.0004725900000000 ]  - [  -0.0003341000000000, -0.0000889300000000, -0.0007925000000000 ]  - [  -0.0001773300000000, -0.0001480100000000, -0.0002427400000000 ]  - [   0.0031539600000000,  0.0037389600000000, -0.0005743100000000 ]  - [   0.0002329700000000,  0.0000026900000000, -0.0006027200000000 ]  - [  -0.0000936100000000, -0.0000090000000000, -0.0004997000000000 ]  - [   0.0004971700000000,  0.0002309000000000, -0.0008557900000000 ]  - [   0.0000280000000000, -0.0001238400000000, -0.0005197000000000 ]  - [   0.0001299000000000, -0.0005082000000000, -0.0007204600000000 ]  - [  -0.0000272000000000,  0.0000425700000000, -0.0007549100000000 ]  - [  -0.0001738500000000,  0.0000528300000000, -0.0003196100000000 ]  - [  -0.0004346000000000, -0.0001764300000000, -0.0006870600000000 ]  - [   0.0001250100000000, -0.0000853900000000, -0.0007206000000000 ]  - [  -0.0001273800000000,  0.0000774000000000, -0.0007756400000000 ]  - [   0.0000513900000000, -0.0000584900000000, -0.0007544800000000 ]  - [  -0.0001228400000000, -0.0000774200000000, -0.0007937900000000 ]  - [   0.0001238600000000,  0.0000825700000000, -0.0007872800000000 ]  - [   0.0001243900000000, -0.0000334300000000, -0.0006455900000000 ]  - [   0.0000757400000000,  0.0000956700000000, -0.0006043600000000 ]  - [  -0.0001265400000000,  0.0000372800000000, -0.0006508700000000 ]  - [   0.0000528200000000, -0.0000644300000000, -0.0007032800000000 ]  - [  -0.0000646800000000,  0.0000560000000000, -0.0006800900000000 ]  - [  -0.0000606300000000, -0.0001228600000000, -0.0006042700000000 ]  - [   0.0000992500000000,  0.0000711800000000, -0.0008701100000000 ]  - [   0.0000737000000000, -0.0001248300000000, -0.0003895800000000 ]  - [  -0.0000907100000000,  0.0001882400000000, -0.0006531500000000 ]  - [  -0.0000802200000000, -0.0001428100000000, -0.0007478900000000 ]  - [  -0.0000751000000000,  0.0001275700000000, -0.0003933000000000 ]  - [   0.0002618400000000,  0.0002138200000000, -0.0001814000000000 ]  - [   0.0015887800000000,  0.0004464700000000, -0.0035630600000000 ]  - [   0.0000973300000000, -0.0000993400000000, -0.0007423400000000 ]  - [   0.0001833500000000,  0.0003077100000000, -0.0001665500000000 ]  - [   0.0000995100000000, -0.0002489500000000, -0.0007199900000000 ]  - [   0.0019405700000000, -0.0013080100000000, -0.0008908600000000 ]  - [  -0.0008326400000000, -0.0000666900000000, -0.0003399300000000 ]  - [  -0.0000683200000000,  0.0001080900000000, -0.0006879200000000 ]  - [  -0.0056864000000000,  0.0003235800000000, -0.0002744100000000 ]  - [   0.0001741600000000, -0.0003979100000000,  0.0018883000000000 ]  - [  -0.0007004200000000, -0.0015577800000000, -0.0008888400000000 ]  - [  -0.0001929000000000,  0.0025440700000000,  0.0002676800000000 ]  - [   0.0029596100000000,  0.0039203800000000, -0.0022343100000000 ]- atom:   34  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0205697700000000, -0.0055429600000000, -0.0061866100000000 ]  - [   0.0040757600000000, -0.0025445900000000, -0.0024631800000000 ]  - [  -0.0008507000000000, -0.0002691600000000,  0.0005791200000000 ]  - [   0.0012326300000000,  0.0005181300000000,  0.0000986300000000 ]  - [   0.0045746100000000,  0.0009564200000000,  0.0086669800000000 ]  - [   0.0044097400000000,  0.0053230000000000, -0.0022215500000000 ]  - [   0.0006042200000000,  0.0000805400000000, -0.0006319200000000 ]  - [   0.0001681000000000,  0.0000136700000000, -0.0000276400000000 ]  - [   0.0001733500000000, -0.0001950300000000,  0.0006076400000000 ]  - [  -0.0005750100000000,  0.0000939400000000, -0.0006032900000000 ]  - [  -0.0001784300000000, -0.0000338800000000, -0.0001239600000000 ]  - [  -0.0000352100000000, -0.0000001300000000,  0.0001203400000000 ]  - [  -0.0000539100000000, -0.0000936500000000,  0.0001680200000000 ]  - [   0.0000584000000000,  0.0000109500000000,  0.0000794700000000 ]  - [   0.0000248800000000,  0.0000756400000000,  0.0001198500000000 ]  - [  -0.0000416600000000, -0.0000073300000000,  0.0000938400000000 ]  - [  -0.0000006900000000,  0.0000043600000000,  0.0000511300000000 ]  - [   0.0000502900000000, -0.0000059500000000,  0.0001110500000000 ]  - [  -0.0000420300000000, -0.0000045700000000,  0.0000953100000000 ]  - [   0.0000168600000000, -0.0000021600000000,  0.0002016700000000 ]  - [   0.0000494300000000,  0.0000074300000000,  0.0000795200000000 ]  - [  -0.0000550200000000,  0.0000038200000000,  0.0001052800000000 ]  - [  -0.0000470000000000,  0.0000502200000000,  0.0000316600000000 ]  - [  -0.0000922100000000,  0.0000474700000000,  0.0002938500000000 ]  - [  -0.0000364700000000, -0.0000602300000000, -0.0000797800000000 ]  - [   0.0000242400000000, -0.0000319000000000,  0.0000476300000000 ]  - [   0.0003364400000000, -0.0000297400000000,  0.0004658600000000 ]  - [   0.0003383100000000,  0.0001977900000000, -0.0007024200000000 ]  - [   0.0004168800000000,  0.0007337000000000,  0.0003050000000000 ]  - [   0.0032712200000000,  0.0012378400000000, -0.0022457200000000 ]  - [  -0.0009734000000000, -0.0006149000000000,  0.0001002000000000 ]  - [  -0.0010296500000000, -0.0005905600000000, -0.0003970300000000 ]  - [   0.0010287700000000, -0.0019292200000000, -0.0003538200000000 ]  - [  -0.0626528200000000,  0.0022214900000000,  0.0041420100000000 ]  - [   0.0023345100000000,  0.0017459700000000,  0.0003402900000000 ]  - [   0.0026169300000000,  0.0018027900000000,  0.0024246900000000 ]  - [   0.0023223500000000, -0.0033570400000000,  0.0031670100000000 ]  - [   0.0146209900000000,  0.0041895300000000,  0.0010373500000000 ]  - [   0.0021809600000000,  0.0002400300000000, -0.0023089000000000 ]  - [   0.0002991900000000, -0.0016709300000000,  0.0001016200000000 ]  - [   0.0004385900000000, -0.0002183200000000,  0.0005147200000000 ]  - [   0.0000886200000000,  0.0003129000000000, -0.0011987700000000 ]  - [  -0.0033101700000000, -0.0003927300000000, -0.0005049200000000 ]  - [  -0.0000604100000000,  0.0000976900000000, -0.0002098400000000 ]  - [   0.0000540400000000, -0.0002266200000000, -0.0003982400000000 ]  - [  -0.0000621900000000,  0.0001208300000000,  0.0001717900000000 ]  - [   0.0001267500000000, -0.0000328000000000,  0.0001459000000000 ]  - [   0.0002133500000000, -0.0002763200000000,  0.0004428200000000 ]  - [  -0.0000801500000000, -0.0000425100000000, -0.0001368300000000 ]  - [  -0.0000904000000000,  0.0000331600000000,  0.0001552500000000 ]  - [   0.0002814400000000,  0.0001915000000000, -0.0002033400000000 ]  - [   0.0000336000000000,  0.0000151300000000, -0.0000489200000000 ]  - [  -0.0000413500000000, -0.0000061900000000, -0.0000477600000000 ]  - [   0.0000919200000000,  0.0000529100000000, -0.0000637500000000 ]  - [  -0.0000085700000000, -0.0000236300000000, -0.0000971600000000 ]  - [   0.0000161100000000, -0.0000115500000000, -0.0001233400000000 ]  - [   0.0000449900000000, -0.0000417800000000, -0.0000656100000000 ]  - [   0.0000005500000000,  0.0000082100000000, -0.0001549700000000 ]  - [  -0.0000442800000000,  0.0000427400000000, -0.0000508800000000 ]  - [  -0.0000301800000000, -0.0000596100000000, -0.0000849000000000 ]  - [   0.0000213500000000,  0.0000626300000000, -0.0000861900000000 ]  - [  -0.0000010100000000, -0.0000139200000000, -0.0001580400000000 ]  - [  -0.0000020300000000,  0.0000116300000000, -0.0001319100000000 ]  - [   0.0000169300000000, -0.0000187300000000,  0.0000352600000000 ]  - [  -0.0000601200000000, -0.0000340700000000, -0.0001722000000000 ]  - [   0.0000002500000000, -0.0000109700000000, -0.0001178100000000 ]  - [  -0.0000183200000000,  0.0000173900000000,  0.0000461400000000 ]  - [   0.0001525700000000,  0.0000976600000000, -0.0002267000000000 ]  - [   0.0001375000000000, -0.0002272700000000, -0.0001772200000000 ]  - [   0.0000157500000000, -0.0000110700000000, -0.0000869200000000 ]  - [  -0.0000013000000000,  0.0001391100000000,  0.0001328300000000 ]  - [   0.0000790500000000, -0.0000613300000000,  0.0000008200000000 ]  - [   0.0003605600000000, -0.0004342100000000,  0.0002966500000000 ]  - [  -0.0000983200000000, -0.0001388400000000,  0.0001321400000000 ]  - [  -0.0001107000000000,  0.0000969300000000,  0.0000075700000000 ]  - [  -0.0002818700000000,  0.0006656400000000,  0.0009470700000000 ]  - [   0.0020574400000000, -0.0020510300000000,  0.0028758100000000 ]  - [  -0.0001390500000000, -0.0000077800000000,  0.0000577200000000 ]  - [   0.0006614200000000, -0.0000806800000000, -0.0054244700000000 ]  - [   0.0004130600000000, -0.0001148600000000, -0.0012810100000000 ]- atom:   34  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0193857800000000,  0.0052451000000000,  0.0057648400000000 ]  - [  -0.0044751500000000,  0.0028366100000000,  0.0025722100000000 ]  - [   0.0007204400000000,  0.0002614200000000, -0.0005687800000000 ]  - [  -0.0012114000000000, -0.0005253700000000,  0.0000302000000000 ]  - [  -0.0045000700000000, -0.0009545400000000, -0.0086541400000000 ]  - [  -0.0044893800000000, -0.0053392000000000,  0.0022157300000000 ]  - [  -0.0006136900000000,  0.0000362200000000,  0.0006052900000000 ]  - [  -0.0001686600000000,  0.0000915100000000,  0.0000313700000000 ]  - [  -0.0001781200000000,  0.0001987300000000, -0.0007419800000000 ]  - [   0.0005924700000000, -0.0002140300000000,  0.0005679000000000 ]  - [   0.0001766000000000, -0.0000719200000000,  0.0001243800000000 ]  - [   0.0000381900000000,  0.0000002200000000,  0.0000198000000000 ]  - [   0.0000400800000000, -0.0000252700000000, -0.0001404600000000 ]  - [   0.0000611500000000, -0.0000238900000000, -0.0001034900000000 ]  - [  -0.0000124800000000,  0.0000434900000000, -0.0000906900000000 ]  - [  -0.0000779900000000,  0.0000199100000000, -0.0001170700000000 ]  - [   0.0000005700000000, -0.0000040400000000, -0.0001839200000000 ]  - [   0.0000544800000000,  0.0000059500000000, -0.0001080400000000 ]  - [  -0.0000779700000000, -0.0000079800000000, -0.0000673700000000 ]  - [  -0.0000172900000000,  0.0000024500000000, -0.0000642500000000 ]  - [   0.0000706300000000,  0.0000051500000000, -0.0000514300000000 ]  - [  -0.0000503100000000, -0.0000032800000000, -0.0001026400000000 ]  - [   0.0000343000000000,  0.0000692600000000, -0.0000560100000000 ]  - [   0.0000911900000000,  0.0000556000000000, -0.0002865500000000 ]  - [   0.0000362500000000,  0.0000610300000000, -0.0000530800000000 ]  - [  -0.0000118300000000, -0.0000876100000000, -0.0000720100000000 ]  - [  -0.0003370400000000, -0.0000757100000000, -0.0004655200000000 ]  - [  -0.0003419300000000, -0.0001988200000000,  0.0008334600000000 ]  - [  -0.0004253800000000, -0.0008475100000000, -0.0002787900000000 ]  - [  -0.0031333700000000, -0.0012416900000000,  0.0022139000000000 ]  - [   0.0009817600000000,  0.0007320400000000, -0.0000649000000000 ]  - [   0.0008977800000000,  0.0006074700000000,  0.0003727800000000 ]  - [  -0.0009606900000000,  0.0018074300000000,  0.0003992500000000 ]  - [   0.0621051900000000, -0.0020944700000000, -0.0041511000000000 ]  - [  -0.0024048300000000, -0.0016090300000000, -0.0003083000000000 ]  - [  -0.0026764100000000, -0.0018881700000000, -0.0024238400000000 ]  - [  -0.0022559700000000,  0.0034366700000000, -0.0031801400000000 ]  - [  -0.0147331000000000, -0.0042773800000000, -0.0011986600000000 ]  - [  -0.0022167100000000, -0.0002043800000000,  0.0022704600000000 ]  - [  -0.0002611300000000,  0.0016800700000000,  0.0001023200000000 ]  - [  -0.0004001600000000,  0.0002556200000000, -0.0004618800000000 ]  - [  -0.0000456100000000, -0.0003470300000000,  0.0011324900000000 ]  - [   0.0032837800000000,  0.0003368000000000,  0.0006880000000000 ]  - [   0.0000403000000000, -0.0001178900000000,  0.0000081700000000 ]  - [  -0.0000334000000000,  0.0002480800000000,  0.0002003200000000 ]  - [   0.0000190400000000, -0.0001637200000000, -0.0001210700000000 ]  - [  -0.0001064800000000,  0.0000116800000000,  0.0000510500000000 ]  - [  -0.0001204000000000,  0.0002029400000000, -0.0004240000000000 ]  - [  -0.0000205300000000, -0.0000378500000000,  0.0000917300000000 ]  - [   0.0000675100000000, -0.0000115500000000,  0.0000444300000000 ]  - [  -0.0003843800000000, -0.0001107900000000,  0.0002448600000000 ]  - [   0.0000028100000000,  0.0000237300000000,  0.0000999500000000 ]  - [   0.0000038700000000, -0.0000330700000000,  0.0000985100000000 ]  - [   0.0000098200000000,  0.0000272600000000,  0.0000217400000000 ]  - [  -0.0000312800000000,  0.0000603200000000,  0.0000430300000000 ]  - [   0.0000233600000000, -0.0000244500000000,  0.0000689800000000 ]  - [   0.0000355000000000, -0.0000601000000000,  0.0001052600000000 ]  - [  -0.0000221900000000, -0.0000284500000000, -0.0000442400000000 ]  - [  -0.0000363900000000,  0.0000592800000000,  0.0000899500000000 ]  - [  -0.0000501700000000, -0.0000417600000000,  0.0000422100000000 ]  - [   0.0000585100000000,  0.0000394700000000,  0.0000436100000000 ]  - [   0.0000218700000000,  0.0000342800000000, -0.0000413300000000 ]  - [  -0.0000348500000000,  0.0000281200000000,  0.0000774000000000 ]  - [   0.0000040600000000, -0.0000018700000000,  0.0001618100000000 ]  - [   0.0000985000000000,  0.0000707100000000,  0.0002225700000000 ]  - [   0.0000358600000000, -0.0000284300000000,  0.0000634200000000 ]  - [  -0.0000037900000000,  0.0000033400000000,  0.0001506000000000 ]  - [  -0.0001747300000000, -0.0001180400000000,  0.0000280600000000 ]  - [  -0.0001178100000000,  0.0002474800000000, -0.0000220100000000 ]  - [  -0.0000548500000000, -0.0000253200000000,  0.0001368500000000 ]  - [   0.0000220500000000, -0.0001595200000000,  0.0000638100000000 ]  - [   0.0000227600000000, -0.0000192900000000,  0.0000384700000000 ]  - [  -0.0004620100000000,  0.0003528900000000, -0.0003395500000000 ]  - [   0.0000770000000000,  0.0001593900000000,  0.0000659600000000 ]  - [   0.0000087100000000, -0.0000159800000000,  0.0000323700000000 ]  - [   0.0003182900000000, -0.0006168600000000, -0.0008799700000000 ]  - [  -0.0020929800000000,  0.0020225000000000, -0.0028361600000000 ]  - [   0.0002377000000000,  0.0000895400000000, -0.0000966000000000 ]  - [  -0.0007189200000000,  0.0001128600000000,  0.0053531700000000 ]  - [  -0.0003648100000000,  0.0000736300000000,  0.0012072600000000 ]- atom:   34  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0072477900000000,  0.0037659400000000,  0.0007143500000000 ]  - [  -0.0028128400000000,  0.0039127600000000,  0.0002296000000000 ]  - [   0.0003326900000000,  0.0006659600000000,  0.0007329400000000 ]  - [  -0.0016792800000000, -0.0009964100000000, -0.0007592400000000 ]  - [   0.0010722700000000,  0.0064075600000000,  0.0062300000000000 ]  - [   0.0061400700000000,  0.0192816000000000, -0.0066521900000000 ]  - [   0.0000692900000000, -0.0001157800000000,  0.0014654900000000 ]  - [   0.0000373600000000, -0.0002119800000000,  0.0001942300000000 ]  - [   0.0000348500000000,  0.0006982400000000,  0.0002399600000000 ]  - [   0.0002184500000000, -0.0005016100000000, -0.0003077700000000 ]  - [  -0.0000743100000000, -0.0000774000000000,  0.0004007600000000 ]  - [  -0.0002150300000000,  0.0000770000000000, -0.0000150100000000 ]  - [  -0.0000028400000000, -0.0000763400000000,  0.0001405500000000 ]  - [   0.0000505900000000,  0.0000152500000000,  0.0001542700000000 ]  - [   0.0000351300000000,  0.0001519900000000,  0.0003086800000000 ]  - [  -0.0000585300000000, -0.0000125400000000,  0.0001008700000000 ]  - [   0.0000064500000000, -0.0000059500000000,  0.0001294400000000 ]  - [   0.0000436800000000, -0.0000110600000000,  0.0001765100000000 ]  - [  -0.0000673800000000,  0.0000014800000000,  0.0002097900000000 ]  - [   0.0000081900000000,  0.0000073300000000,  0.0002427200000000 ]  - [   0.0000617400000000,  0.0000008800000000,  0.0001711100000000 ]  - [  -0.0000442300000000,  0.0000160900000000,  0.0001720300000000 ]  - [   0.0000109100000000,  0.0000742400000000,  0.0001794900000000 ]  - [  -0.0000114900000000,  0.0000550900000000, -0.0000863100000000 ]  - [  -0.0000980500000000, -0.0000188300000000,  0.0002508300000000 ]  - [   0.0000104900000000, -0.0001092400000000,  0.0000972200000000 ]  - [   0.0000220200000000, -0.0000381200000000,  0.0002616900000000 ]  - [  -0.0001048400000000, -0.0004643600000000,  0.0004476500000000 ]  - [  -0.0000036000000000,  0.0002756400000000, -0.0004416800000000 ]  - [   0.0016059600000000,  0.0037369700000000, -0.0015203700000000 ]  - [   0.0002591700000000,  0.0006523300000000,  0.0005842900000000 ]  - [   0.0002277800000000, -0.0012838300000000, -0.0007838100000000 ]  - [  -0.0013262700000000,  0.0019582800000000,  0.0014659200000000 ]  - [   0.0023401400000000, -0.0700184900000000, -0.0013787700000000 ]  - [   0.0011102500000000,  0.0012574400000000,  0.0000703600000000 ]  - [   0.0000711000000000,  0.0000750800000000,  0.0005683800000000 ]  - [  -0.0035974500000000,  0.0039648900000000, -0.0037253100000000 ]  - [   0.0042254000000000,  0.0015637900000000, -0.0008598000000000 ]  - [  -0.0007158300000000, -0.0002376300000000,  0.0014590800000000 ]  - [   0.0016745700000000,  0.0013675300000000,  0.0004012500000000 ]  - [  -0.0002931300000000,  0.0007654600000000, -0.0006344300000000 ]  - [   0.0005136700000000,  0.0005665300000000, -0.0030885000000000 ]  - [   0.0003637400000000,  0.0206747000000000,  0.0054551200000000 ]  - [   0.0000778500000000,  0.0001518900000000, -0.0006216000000000 ]  - [  -0.0000246900000000,  0.0001371300000000, -0.0001141200000000 ]  - [  -0.0000925600000000,  0.0000033500000000, -0.0002406400000000 ]  - [   0.0000122200000000, -0.0000895800000000, -0.0000840300000000 ]  - [   0.0007578100000000, -0.0009234700000000,  0.0015810000000000 ]  - [  -0.0001620500000000, -0.0000218700000000, -0.0000395200000000 ]  - [  -0.0000124600000000,  0.0001268600000000,  0.0000516200000000 ]  - [  -0.0001950500000000, -0.0001556200000000, -0.0002502000000000 ]  - [   0.0000379900000000,  0.0000165500000000, -0.0000871700000000 ]  - [  -0.0000588200000000, -0.0000273900000000, -0.0000983000000000 ]  - [   0.0000877500000000, -0.0000112200000000, -0.0001840600000000 ]  - [  -0.0000212100000000,  0.0000301400000000, -0.0002113900000000 ]  - [   0.0000337700000000,  0.0000772700000000, -0.0001747900000000 ]  - [   0.0000504700000000, -0.0000427700000000, -0.0000859600000000 ]  - [   0.0000072400000000,  0.0000151000000000, -0.0001942200000000 ]  - [  -0.0000569500000000,  0.0000274200000000, -0.0001129900000000 ]  - [  -0.0000318800000000, -0.0000435400000000, -0.0001352800000000 ]  - [   0.0000189000000000,  0.0000512400000000, -0.0001380600000000 ]  - [  -0.0000131400000000,  0.0000010700000000, -0.0001978500000000 ]  - [  -0.0000040000000000,  0.0000433400000000, -0.0001543000000000 ]  - [   0.0000195600000000, -0.0000490400000000,  0.0000102000000000 ]  - [   0.0000048800000000,  0.0000247700000000, -0.0000883200000000 ]  - [  -0.0000001400000000, -0.0000396500000000, -0.0001702600000000 ]  - [  -0.0000180600000000,  0.0000293600000000,  0.0000132300000000 ]  - [   0.0000776400000000, -0.0000627900000000, -0.0002137700000000 ]  - [  -0.0000253900000000,  0.0000558600000000, -0.0001345700000000 ]  - [  -0.0000102700000000, -0.0000605300000000, -0.0000546400000000 ]  - [   0.0000392200000000, -0.0000995100000000,  0.0000000300000000 ]  - [   0.0000377000000000, -0.0000229400000000, -0.0000839000000000 ]  - [  -0.0002707600000000,  0.0003828900000000, -0.0001949000000000 ]  - [  -0.0000393200000000,  0.0000003500000000,  0.0001342400000000 ]  - [  -0.0001017300000000,  0.0000860900000000, -0.0002243900000000 ]  - [  -0.0006469900000000,  0.0017679900000000,  0.0020517200000000 ]  - [  -0.0020658200000000,  0.0018832000000000, -0.0023767800000000 ]  - [   0.0002247500000000,  0.0001136100000000, -0.0008417300000000 ]  - [   0.0002633300000000, -0.0010156400000000,  0.0000531700000000 ]  - [  -0.0000928600000000, -0.0001703900000000,  0.0006111100000000 ]- atom:   34  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0072741100000000, -0.0037590400000000, -0.0008681300000000 ]  - [   0.0027142800000000, -0.0038022700000000, -0.0002021200000000 ]  - [  -0.0004601800000000, -0.0006956800000000, -0.0007172400000000 ]  - [   0.0016709200000000,  0.0010334500000000,  0.0008915500000000 ]  - [  -0.0009733500000000, -0.0064759000000000, -0.0062150800000000 ]  - [  -0.0065000900000000, -0.0203946700000000,  0.0069209600000000 ]  - [  -0.0000819900000000,  0.0002349400000000, -0.0015065700000000 ]  - [  -0.0000382600000000,  0.0003179400000000, -0.0001902700000000 ]  - [  -0.0000345300000000, -0.0007083500000000, -0.0003760600000000 ]  - [  -0.0002119200000000,  0.0003905200000000,  0.0002905300000000 ]  - [   0.0000740400000000, -0.0000280300000000, -0.0004037600000000 ]  - [   0.0002179100000000, -0.0000775300000000,  0.0001554900000000 ]  - [  -0.0000104700000000, -0.0000434100000000, -0.0001120000000000 ]  - [   0.0000688200000000, -0.0000287900000000, -0.0001797000000000 ]  - [  -0.0000224400000000, -0.0000339200000000, -0.0002815000000000 ]  - [  -0.0000606300000000,  0.0000253500000000, -0.0001254400000000 ]  - [  -0.0000063300000000,  0.0000059100000000, -0.0002634500000000 ]  - [   0.0000614600000000,  0.0000105700000000, -0.0001746600000000 ]  - [  -0.0000521300000000, -0.0000147500000000, -0.0001816600000000 ]  - [  -0.0000084100000000, -0.0000077700000000, -0.0001059400000000 ]  - [   0.0000581300000000,  0.0000119100000000, -0.0001432300000000 ]  - [  -0.0000608000000000, -0.0000158200000000, -0.0001703400000000 ]  - [  -0.0000235500000000,  0.0000447700000000, -0.0002049300000000 ]  - [   0.0000129900000000,  0.0000501500000000,  0.0000884000000000 ]  - [   0.0000962300000000,  0.0000172100000000, -0.0003819000000000 ]  - [   0.0000021100000000, -0.0000107200000000, -0.0001217800000000 ]  - [  -0.0000244800000000, -0.0000638700000000, -0.0002651800000000 ]  - [   0.0001083100000000,  0.0004684100000000, -0.0003078000000000 ]  - [  -0.0000126000000000, -0.0004155100000000,  0.0004748500000000 ]  - [  -0.0014198400000000, -0.0033290600000000,  0.0012351900000000 ]  - [  -0.0002426300000000, -0.0005310400000000, -0.0005622000000000 ]  - [  -0.0003472600000000,  0.0013015000000000,  0.0007639700000000 ]  - [   0.0014382100000000, -0.0020761300000000, -0.0014390600000000 ]  - [  -0.0019648900000000,  0.0704963100000000,  0.0009914200000000 ]  - [  -0.0011908500000000, -0.0011660000000000, -0.0000251700000000 ]  - [  -0.0001815200000000, -0.0001872500000000, -0.0006253000000000 ]  - [   0.0037358800000000, -0.0038757700000000,  0.0037384300000000 ]  - [  -0.0042411200000000, -0.0015274400000000,  0.0006611700000000 ]  - [   0.0006988200000000,  0.0002831700000000, -0.0015334500000000 ]  - [  -0.0016771000000000, -0.0014081600000000, -0.0001992700000000 ]  - [   0.0003337000000000, -0.0007401100000000,  0.0006980500000000 ]  - [  -0.0004750200000000, -0.0005963900000000,  0.0030799400000000 ]  - [  -0.0003657800000000, -0.0204278300000000, -0.0051299800000000 ]  - [  -0.0000989200000000, -0.0001751100000000,  0.0004250600000000 ]  - [   0.0000457300000000, -0.0001182000000000, -0.0000879300000000 ]  - [   0.0000491500000000, -0.0000560600000000,  0.0002909600000000 ]  - [   0.0000081300000000,  0.0000687500000000,  0.0002818300000000 ]  - [  -0.0006599800000000,  0.0008559600000000, -0.0015587200000000 ]  - [   0.0000609100000000, -0.0000582000000000, -0.0000035900000000 ]  - [  -0.0000085100000000, -0.0001064700000000,  0.0001454400000000 ]  - [   0.0000939600000000,  0.0002413500000000,  0.0002912200000000 ]  - [  -0.0000019300000000,  0.0000227900000000,  0.0001384700000000 ]  - [   0.0000228500000000, -0.0000125300000000,  0.0001500100000000 ]  - [   0.0000142700000000,  0.0000916900000000,  0.0001435500000000 ]  - [  -0.0000190600000000,  0.0000044400000000,  0.0001576200000000 ]  - [   0.0000064300000000, -0.0001137000000000,  0.0001207300000000 ]  - [   0.0000300100000000, -0.0000591900000000,  0.0001253700000000 ]  - [  -0.0000292200000000, -0.0000360300000000, -0.0000050800000000 ]  - [  -0.0000232600000000,  0.0000743300000000,  0.0001522100000000 ]  - [  -0.0000482000000000, -0.0000581000000000,  0.0000934200000000 ]  - [   0.0000611200000000,  0.0000503900000000,  0.0000964100000000 ]  - [   0.0000349400000000,  0.0000192400000000, -0.0000017200000000 ]  - [  -0.0000317900000000, -0.0000032500000000,  0.0001004100000000 ]  - [   0.0000023000000000,  0.0000279800000000,  0.0001876800000000 ]  - [   0.0000351500000000,  0.0000117600000000,  0.0001412200000000 ]  - [   0.0000361400000000, -0.0000008800000000,  0.0001164700000000 ]  - [  -0.0000041300000000, -0.0000088300000000,  0.0001842600000000 ]  - [  -0.0000991200000000,  0.0000384300000000,  0.0000155900000000 ]  - [   0.0000450700000000, -0.0000314600000000, -0.0000644300000000 ]  - [  -0.0000298500000000,  0.0000243400000000,  0.0001062000000000 ]  - [  -0.0000187300000000,  0.0000762700000000,  0.0001982800000000 ]  - [   0.0000640900000000, -0.0000577200000000,  0.0001229200000000 ]  - [   0.0001706600000000, -0.0004656000000000,  0.0001531300000000 ]  - [   0.0000184300000000,  0.0000237200000000,  0.0000608900000000 ]  - [  -0.0000003900000000, -0.0000059900000000,  0.0002624600000000 ]  - [   0.0006829700000000, -0.0017410300000000, -0.0020300000000000 ]  - [   0.0020220100000000, -0.0019309800000000,  0.0024289700000000 ]  - [  -0.0001177000000000, -0.0000383700000000,  0.0007867800000000 ]  - [  -0.0003238000000000,  0.0010581300000000, -0.0000403300000000 ]  - [   0.0001325500000000,  0.0001372600000000, -0.0006625200000000 ]- atom:   34  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0029427300000000,  0.0003796400000000,  0.0041805100000000 ]  - [  -0.0024129300000000,  0.0014225900000000,  0.0047885900000000 ]  - [  -0.0001957700000000,  0.0000487800000000,  0.0018660900000000 ]  - [  -0.0007347100000000,  0.0004332900000000,  0.0021762600000000 ]  - [   0.0056686300000000,  0.0069736300000000,  0.0317613200000000 ]  - [  -0.0021857600000000, -0.0078057400000000,  0.0044116200000000 ]  - [   0.0000631900000000,  0.0004464700000000, -0.0002700600000000 ]  - [   0.0000447400000000, -0.0001212200000000, -0.0008149200000000 ]  - [   0.0003815500000000,  0.0000995500000000, -0.0007099700000000 ]  - [   0.0001663500000000, -0.0002897300000000, -0.0003786900000000 ]  - [  -0.0000021500000000, -0.0001223300000000, -0.0005379500000000 ]  - [  -0.0003927300000000,  0.0000756800000000, -0.0010998600000000 ]  - [   0.0000458100000000, -0.0000756400000000, -0.0006478500000000 ]  - [   0.0000534400000000, -0.0000256600000000, -0.0006736900000000 ]  - [  -0.0000103900000000,  0.0001410200000000, -0.0006716200000000 ]  - [  -0.0000799000000000,  0.0000088900000000, -0.0007531400000000 ]  - [   0.0000104000000000,  0.0000004800000000, -0.0008629300000000 ]  - [   0.0000544800000000,  0.0000771300000000, -0.0007770200000000 ]  - [  -0.0000827800000000,  0.0000122600000000, -0.0006743100000000 ]  - [  -0.0000343800000000, -0.0000054300000000, -0.0007494700000000 ]  - [   0.0000948900000000, -0.0000044000000000, -0.0006280300000000 ]  - [  -0.0000408600000000, -0.0000804600000000, -0.0007721200000000 ]  - [   0.0000513000000000,  0.0000503300000000, -0.0006644500000000 ]  - [   0.0001275900000000,  0.0000635900000000, -0.0003129700000000 ]  - [   0.0000721800000000,  0.0000091700000000, -0.0008254900000000 ]  - [  -0.0000481000000000, -0.0000886100000000, -0.0006027800000000 ]  - [  -0.0005709400000000, -0.0000309600000000, -0.0010063300000000 ]  - [   0.0001169900000000,  0.0001859300000000, -0.0007634400000000 ]  - [  -0.0000210800000000, -0.0011007200000000,  0.0004421800000000 ]  - [  -0.0009586200000000, -0.0007860600000000,  0.0027873000000000 ]  - [   0.0003975400000000,  0.0000006200000000,  0.0001875000000000 ]  - [  -0.0002384600000000,  0.0005748100000000,  0.0011660700000000 ]  - [  -0.0003489500000000,  0.0006065400000000, -0.0008898300000000 ]  - [   0.0038911600000000, -0.0014561800000000, -0.0635172300000000 ]  - [  -0.0018385500000000, -0.0008454000000000, -0.0007674800000000 ]  - [   0.0021676800000000,  0.0003175200000000, -0.0004064600000000 ]  - [   0.0031664100000000, -0.0028085800000000,  0.0006460900000000 ]  - [  -0.0010871300000000,  0.0007781200000000, -0.0030716000000000 ]  - [  -0.0018335100000000,  0.0003262700000000,  0.0006864500000000 ]  - [   0.0000129000000000, -0.0003104500000000, -0.0008811200000000 ]  - [   0.0003493800000000, -0.0000613300000000,  0.0002241700000000 ]  - [  -0.0013574900000000, -0.0017931900000000,  0.0008937600000000 ]  - [   0.0005813000000000,  0.0053151900000000, -0.0000209300000000 ]  - [  -0.0001255000000000, -0.0001393900000000,  0.0003309500000000 ]  - [   0.0000452700000000,  0.0000893000000000,  0.0002850900000000 ]  - [   0.0002805500000000,  0.0013154300000000,  0.0003469400000000 ]  - [  -0.0000367600000000, -0.0000671000000000,  0.0003973800000000 ]  - [   0.0012924700000000, -0.0011073900000000,  0.0034825300000000 ]  - [  -0.0001252900000000, -0.0000838000000000,  0.0005982100000000 ]  - [   0.0001736300000000,  0.0000590700000000,  0.0003977400000000 ]  - [   0.0000958800000000, -0.0002209200000000,  0.0001036700000000 ]  - [  -0.0000499700000000,  0.0001164800000000,  0.0006139700000000 ]  - [   0.0000589000000000, -0.0001196100000000,  0.0006196600000000 ]  - [   0.0000526300000000,  0.0000764000000000,  0.0003978500000000 ]  - [   0.0000321500000000,  0.0001199000000000,  0.0005102800000000 ]  - [  -0.0000453100000000, -0.0001098500000000,  0.0005345900000000 ]  - [  -0.0000304300000000, -0.0000714600000000,  0.0005265000000000 ]  - [  -0.0000668100000000, -0.0001052300000000,  0.0002776200000000 ]  - [  -0.0000027700000000,  0.0000579200000000,  0.0005261800000000 ]  - [  -0.0000952600000000, -0.0000320800000000,  0.0004692900000000 ]  - [   0.0001102700000000,  0.0000305100000000,  0.0004726900000000 ]  - [   0.0000699700000000,  0.0001087500000000,  0.0002877300000000 ]  - [  -0.0001048100000000, -0.0000480300000000,  0.0005840200000000 ]  - [  -0.0000521600000000,  0.0000786200000000,  0.0005078600000000 ]  - [   0.0001720800000000,  0.0000209500000000,  0.0007438700000000 ]  - [   0.0001006800000000,  0.0000304000000000,  0.0005803600000000 ]  - [   0.0000411000000000, -0.0000754800000000,  0.0004709600000000 ]  - [  -0.0005328200000000, -0.0001204400000000,  0.0003312200000000 ]  - [   0.0000239700000000,  0.0003094700000000,  0.0002849600000000 ]  - [  -0.0000800200000000,  0.0000822500000000,  0.0005280900000000 ]  - [   0.0000461700000000, -0.0000442500000000,  0.0002428300000000 ]  - [   0.0000823900000000, -0.0000094000000000,  0.0004216000000000 ]  - [   0.0000649400000000, -0.0003945100000000,  0.0002470900000000 ]  - [   0.0000895800000000,  0.0000458700000000,  0.0002430500000000 ]  - [  -0.0000171100000000, -0.0000606400000000,  0.0005250400000000 ]  - [   0.0004713200000000,  0.0002693800000000,  0.0000780200000000 ]  - [   0.0022081100000000, -0.0015867400000000,  0.0009996700000000 ]  - [  -0.0001773500000000,  0.0004463400000000,  0.0004174600000000 ]  - [  -0.0042784700000000,  0.0006119300000000,  0.0103248000000000 ]  - [   0.0002087700000000, -0.0000080600000000, -0.0001759300000000 ]- atom:   34  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0029709400000000, -0.0003748300000000, -0.0042783000000000 ]  - [   0.0025188100000000, -0.0014382900000000, -0.0047644800000000 ]  - [   0.0000820700000000, -0.0000632400000000, -0.0018145700000000 ]  - [   0.0007338500000000, -0.0004304400000000, -0.0020239600000000 ]  - [  -0.0052733200000000, -0.0066630300000000, -0.0303506300000000 ]  - [   0.0020915900000000,  0.0078514500000000, -0.0044378100000000 ]  - [  -0.0000802400000000, -0.0003241200000000,  0.0002502800000000 ]  - [  -0.0000437200000000,  0.0002249700000000,  0.0008076000000000 ]  - [  -0.0003765700000000, -0.0000975000000000,  0.0005708600000000 ]  - [  -0.0001548700000000,  0.0001695300000000,  0.0003580600000000 ]  - [   0.0000029900000000,  0.0000164800000000,  0.0005371400000000 ]  - [   0.0003884600000000, -0.0000746400000000,  0.0012272800000000 ]  - [  -0.0000583900000000, -0.0000437600000000,  0.0006707200000000 ]  - [   0.0000658400000000,  0.0000120200000000,  0.0006431200000000 ]  - [   0.0000231700000000, -0.0000208900000000,  0.0006946500000000 ]  - [  -0.0000396400000000,  0.0000042400000000,  0.0007218000000000 ]  - [  -0.0000099700000000, -0.0000003500000000,  0.0007221100000000 ]  - [   0.0000506300000000, -0.0000764600000000,  0.0007725700000000 ]  - [  -0.0000363900000000, -0.0000248200000000,  0.0006963900000000 ]  - [   0.0000345700000000,  0.0000055200000000,  0.0008793400000000 ]  - [   0.0000244900000000,  0.0000170900000000,  0.0006502200000000 ]  - [  -0.0000644400000000,  0.0000802000000000,  0.0007674100000000 ]  - [  -0.0000649500000000,  0.0000693100000000,  0.0006327700000000 ]  - [  -0.0001279600000000,  0.0000417300000000,  0.0003031100000000 ]  - [  -0.0000723100000000, -0.0000093100000000,  0.0006843700000000 ]  - [   0.0000625200000000, -0.0000308800000000,  0.0005706900000000 ]  - [   0.0005719200000000, -0.0000725600000000,  0.0009862900000000 ]  - [  -0.0001193700000000, -0.0001869600000000,  0.0008931200000000 ]  - [   0.0000106500000000,  0.0009756600000000, -0.0004355300000000 ]  - [   0.0011168000000000,  0.0009367500000000, -0.0029039300000000 ]  - [  -0.0003810500000000,  0.0001225100000000, -0.0001747100000000 ]  - [   0.0001245000000000, -0.0005626300000000, -0.0011937700000000 ]  - [   0.0004198800000000, -0.0006908100000000,  0.0009316000000000 ]  - [  -0.0043906700000000,  0.0009266200000000,  0.0621710500000000 ]  - [   0.0017507400000000,  0.0009400500000000,  0.0008059800000000 ]  - [  -0.0022377400000000, -0.0004246800000000,  0.0003468800000000 ]  - [  -0.0030596300000000,  0.0028882000000000, -0.0006972700000000 ]  - [   0.0011478900000000, -0.0007431200000000,  0.0028619400000000 ]  - [   0.0017649000000000, -0.0002809800000000, -0.0007320000000000 ]  - [   0.0000126800000000,  0.0002901100000000,  0.0010736600000000 ]  - [  -0.0003076400000000,  0.0000986700000000, -0.0001747800000000 ]  - [   0.0013806400000000,  0.0017238200000000, -0.0009273800000000 ]  - [  -0.0006109900000000, -0.0052689800000000,  0.0002004600000000 ]  - [   0.0001037400000000,  0.0001162200000000, -0.0005272700000000 ]  - [  -0.0000250400000000, -0.0000668000000000, -0.0004819800000000 ]  - [  -0.0003132300000000, -0.0013286800000000, -0.0002879700000000 ]  - [   0.0000569800000000,  0.0000443600000000, -0.0001985600000000 ]  - [  -0.0011760700000000,  0.0010159900000000, -0.0034085900000000 ]  - [   0.0000224000000000,  0.0000032200000000, -0.0006351800000000 ]  - [  -0.0001924400000000, -0.0000366400000000, -0.0001982300000000 ]  - [  -0.0001977700000000,  0.0002982800000000, -0.0000654200000000 ]  - [   0.0000856500000000, -0.0000761500000000, -0.0005577500000000 ]  - [  -0.0000943900000000,  0.0000789300000000, -0.0005635500000000 ]  - [   0.0000496200000000,  0.0000038800000000, -0.0004368000000000 ]  - [  -0.0000719700000000, -0.0000834500000000, -0.0005607000000000 ]  - [   0.0000846100000000,  0.0000731800000000, -0.0005840200000000 ]  - [   0.0001103700000000, -0.0000302900000000, -0.0004829200000000 ]  - [   0.0000446100000000,  0.0000838800000000, -0.0004740900000000 ]  - [  -0.0000773200000000,  0.0000438300000000, -0.0004830200000000 ]  - [   0.0000147400000000, -0.0000690600000000, -0.0005066800000000 ]  - [  -0.0000295800000000,  0.0000710900000000, -0.0005100600000000 ]  - [  -0.0000478000000000, -0.0000876200000000, -0.0004842000000000 ]  - [   0.0000684600000000,  0.0000874200000000, -0.0006341800000000 ]  - [   0.0000736500000000, -0.0000989500000000, -0.0003069600000000 ]  - [  -0.0001316000000000,  0.0000143800000000, -0.0006869700000000 ]  - [  -0.0000641600000000, -0.0000693800000000, -0.0006296000000000 ]  - [  -0.0000628300000000,  0.0000955100000000, -0.0002705500000000 ]  - [   0.0005138600000000,  0.0000983100000000, -0.0005270100000000 ]  - [  -0.0000024700000000, -0.0002900900000000, -0.0004820000000000 ]  - [   0.0000391600000000, -0.0001178200000000, -0.0004708200000000 ]  - [  -0.0000271900000000,  0.0000225800000000, -0.0000406600000000 ]  - [   0.0000201300000000, -0.0000702800000000, -0.0003779600000000 ]  - [  -0.0001658500000000,  0.0003151200000000, -0.0002852600000000 ]  - [  -0.0001087800000000, -0.0000238800000000, -0.0000404700000000 ]  - [  -0.0000849900000000,  0.0001407800000000, -0.0004812100000000 ]  - [  -0.0004387700000000, -0.0002401400000000, -0.0000313400000000 ]  - [  -0.0022518400000000,  0.0015614700000000, -0.0009504900000000 ]  - [   0.0002811300000000, -0.0003697300000000, -0.0004547200000000 ]  - [   0.0043295500000000, -0.0005789400000000, -0.0105390000000000 ]  - [  -0.0001752600000000, -0.0000222200000000,  0.0001338500000000 ]- atom:   39  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0009566100000000, -0.0004709100000000, -0.0012436300000000 ]  - [   0.0032017900000000, -0.0010819400000000,  0.0052172200000000 ]  - [   0.0048581000000000,  0.0019133600000000,  0.0000063400000000 ]  - [  -0.0005765400000000,  0.0012361300000000, -0.0005502600000000 ]  - [   0.0206607300000000, -0.0072016100000000, -0.0058267500000000 ]  - [   0.0007232300000000, -0.0002887000000000,  0.0011754300000000 ]  - [  -0.0020273400000000,  0.0000137300000000, -0.0013579000000000 ]  - [   0.0003244700000000, -0.0002489200000000, -0.0008836100000000 ]  - [   0.0035125000000000, -0.0015440400000000,  0.0005054500000000 ]  - [   0.0118885800000000, -0.0013056400000000, -0.0061160700000000 ]  - [   0.0006374700000000, -0.0002802900000000,  0.0004618300000000 ]  - [  -0.0006784000000000,  0.0002182700000000,  0.0002769600000000 ]  - [   0.0000216900000000, -0.0001851800000000,  0.0004380400000000 ]  - [   0.0000521200000000, -0.0000449200000000,  0.0001365800000000 ]  - [  -0.0000996300000000,  0.0001710100000000,  0.0000525700000000 ]  - [  -0.0001011300000000, -0.0000181900000000,  0.0000182300000000 ]  - [   0.0000292600000000,  0.0000044300000000,  0.0001204500000000 ]  - [   0.0000528100000000, -0.0000050200000000,  0.0001484700000000 ]  - [  -0.0000439300000000, -0.0000048500000000,  0.0001604700000000 ]  - [   0.0000087900000000, -0.0000052400000000,  0.0002399500000000 ]  - [   0.0000549500000000,  0.0000018300000000,  0.0001576100000000 ]  - [  -0.0000475500000000,  0.0000321800000000,  0.0002004100000000 ]  - [  -0.0000135200000000,  0.0000672800000000,  0.0001085200000000 ]  - [  -0.0000297000000000,  0.0000417200000000,  0.0001021200000000 ]  - [  -0.0000200600000000,  0.0000067500000000,  0.0001039200000000 ]  - [   0.0000091500000000, -0.0000592700000000,  0.0001317900000000 ]  - [   0.0001135500000000, -0.0000596500000000,  0.0003136800000000 ]  - [   0.0000731400000000,  0.0001613800000000,  0.0000949400000000 ]  - [  -0.0000496400000000,  0.0000312400000000,  0.0002295900000000 ]  - [   0.0000951200000000, -0.0001116800000000,  0.0009375000000000 ]  - [  -0.0002101000000000,  0.0000548100000000,  0.0000855400000000 ]  - [  -0.0001435100000000, -0.0000780000000000, -0.0001716100000000 ]  - [   0.0004365500000000,  0.0001964500000000, -0.0001990200000000 ]  - [   0.0021842900000000, -0.0007186100000000, -0.0019116700000000 ]  - [   0.0002430300000000,  0.0000491500000000, -0.0001753100000000 ]  - [   0.0186246300000000,  0.0002656700000000,  0.0056036700000000 ]  - [   0.0012234100000000, -0.0013128500000000,  0.0001713900000000 ]  - [   0.0000839500000000,  0.0005171200000000,  0.0012812600000000 ]  - [  -0.0764364100000000,  0.0134835000000000,  0.0051432600000000 ]  - [  -0.0002867900000000,  0.0006487900000000,  0.0005578600000000 ]  - [   0.0010630500000000, -0.0010073800000000,  0.0001467600000000 ]  - [   0.0033123600000000, -0.0090272800000000, -0.0000948900000000 ]  - [   0.0020620600000000,  0.0020647800000000, -0.0021451500000000 ]  - [  -0.0001655200000000, -0.0001035300000000, -0.0000930800000000 ]  - [  -0.0010256300000000, -0.0000933100000000, -0.0007166000000000 ]  - [   0.0022662100000000,  0.0010225400000000,  0.0019558700000000 ]  - [   0.0007644600000000,  0.0002272000000000,  0.0000186900000000 ]  - [   0.0021052700000000,  0.0000931300000000,  0.0025559300000000 ]  - [   0.0000208600000000, -0.0000204900000000,  0.0002330000000000 ]  - [   0.0000250100000000, -0.0001311400000000, -0.0012124400000000 ]  - [   0.0027013200000000,  0.0033936700000000, -0.0039066700000000 ]  - [   0.0000941000000000,  0.0001019700000000, -0.0002284400000000 ]  - [   0.0000179000000000,  0.0000150300000000, -0.0000319000000000 ]  - [  -0.0002167000000000, -0.0000440400000000,  0.0000884400000000 ]  - [  -0.0001059900000000, -0.0000639900000000, -0.0002213100000000 ]  - [   0.0000025900000000,  0.0000107000000000, -0.0001135900000000 ]  - [   0.0000396600000000, -0.0000420100000000, -0.0000969100000000 ]  - [   0.0000055100000000,  0.0000033900000000, -0.0001856100000000 ]  - [  -0.0000855700000000,  0.0000380900000000, -0.0000779900000000 ]  - [  -0.0000290400000000, -0.0000568000000000, -0.0001257600000000 ]  - [   0.0000095400000000,  0.0000544200000000, -0.0001281600000000 ]  - [  -0.0000074500000000, -0.0000075200000000, -0.0001814800000000 ]  - [   0.0000052000000000,  0.0000261400000000, -0.0001557100000000 ]  - [   0.0000254100000000, -0.0000301700000000,  0.0000321300000000 ]  - [  -0.0000128100000000,  0.0000345600000000, -0.0001174200000000 ]  - [   0.0000043000000000, -0.0000269500000000, -0.0001626800000000 ]  - [  -0.0000332900000000,  0.0000508000000000,  0.0000230900000000 ]  - [   0.0000848300000000, -0.0000043500000000, -0.0001904900000000 ]  - [   0.0000234900000000, -0.0000315300000000, -0.0002006800000000 ]  - [  -0.0000079600000000, -0.0000344600000000, -0.0000729100000000 ]  - [   0.0000164100000000,  0.0000423600000000,  0.0001034300000000 ]  - [   0.0000604900000000, -0.0000561300000000, -0.0000750800000000 ]  - [  -0.0000110500000000, -0.0000586000000000, -0.0000995500000000 ]  - [  -0.0000531900000000,  0.0000033900000000, -0.0000003700000000 ]  - [  -0.0000693300000000,  0.0000610000000000, -0.0000801800000000 ]  - [  -0.0001228700000000, -0.0000022800000000, -0.0003213600000000 ]  - [  -0.0004631500000000, -0.0004813500000000,  0.0008752900000000 ]  - [   0.0000634800000000,  0.0000446700000000, -0.0001890000000000 ]  - [   0.0001533000000000, -0.0000641900000000, -0.0005673900000000 ]  - [   0.0000902900000000,  0.0000103800000000,  0.0000149900000000 ]- atom:   39  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0009340500000000,  0.0004774800000000,  0.0011164400000000 ]  - [  -0.0030399600000000,  0.0010961400000000, -0.0052252100000000 ]  - [  -0.0050964600000000, -0.0021187700000000,  0.0000045900000000 ]  - [   0.0005550300000000, -0.0012463400000000,  0.0006913900000000 ]  - [  -0.0193390300000000,  0.0069953600000000,  0.0055428000000000 ]  - [  -0.0008159500000000,  0.0002838600000000, -0.0011700000000000 ]  - [   0.0020006000000000,  0.0001046900000000,  0.0013309400000000 ]  - [  -0.0003113000000000,  0.0003512100000000,  0.0008788500000000 ]  - [  -0.0034901500000000,  0.0015388100000000, -0.0005987500000000 ]  - [  -0.0125442100000000,  0.0013548000000000,  0.0064822200000000 ]  - [  -0.0006395300000000,  0.0001738300000000, -0.0004549400000000 ]  - [   0.0006738300000000, -0.0002137400000000, -0.0001433300000000 ]  - [  -0.0000400800000000,  0.0000665900000000, -0.0004125000000000 ]  - [   0.0000660800000000,  0.0000321000000000, -0.0001640100000000 ]  - [   0.0001118800000000, -0.0000498800000000, -0.0000279600000000 ]  - [  -0.0000179800000000,  0.0000310700000000, -0.0000471500000000 ]  - [  -0.0000291800000000, -0.0000043500000000, -0.0002585900000000 ]  - [   0.0000521100000000,  0.0000053500000000, -0.0001501200000000 ]  - [  -0.0000753200000000, -0.0000082500000000, -0.0001358300000000 ]  - [  -0.0000091400000000,  0.0000053100000000, -0.0001064700000000 ]  - [   0.0000642800000000,  0.0000112700000000, -0.0001329900000000 ]  - [  -0.0000578300000000, -0.0000329900000000, -0.0002025600000000 ]  - [  -0.0000000900000000,  0.0000519100000000, -0.0001373300000000 ]  - [   0.0000299900000000,  0.0000628800000000, -0.0001046300000000 ]  - [   0.0000192700000000, -0.0000066700000000, -0.0002419500000000 ]  - [   0.0000038200000000, -0.0000599200000000, -0.0001600500000000 ]  - [  -0.0001132200000000, -0.0000460800000000, -0.0003147900000000 ]  - [  -0.0000731500000000, -0.0001589500000000,  0.0000366900000000 ]  - [   0.0000360600000000, -0.0001500200000000, -0.0002017100000000 ]  - [   0.0000272100000000,  0.0000984300000000, -0.0009574600000000 ]  - [   0.0002220600000000,  0.0000644200000000, -0.0000605900000000 ]  - [   0.0000209300000000,  0.0000828900000000,  0.0001368300000000 ]  - [  -0.0003536200000000, -0.0002980800000000,  0.0002351200000000 ]  - [  -0.0022137400000000,  0.0006960200000000,  0.0016866900000000 ]  - [  -0.0003188200000000,  0.0000534700000000,  0.0002178300000000 ]  - [  -0.0188771000000000, -0.0003357900000000, -0.0057788100000000 ]  - [  -0.0011273400000000,  0.0013952100000000, -0.0002151100000000 ]  - [  -0.0000492900000000, -0.0004716200000000, -0.0014568000000000 ]  - [   0.0760814400000000, -0.0131702500000000, -0.0051722400000000 ]  - [   0.0003144700000000, -0.0006813400000000, -0.0003520600000000 ]  - [  -0.0010127200000000,  0.0010517600000000, -0.0001022200000000 ]  - [  -0.0033047400000000,  0.0089353600000000,  0.0000380100000000 ]  - [  -0.0020889500000000, -0.0020233600000000,  0.0023148500000000 ]  - [   0.0001421700000000,  0.0000840400000000, -0.0001071200000000 ]  - [   0.0010482100000000,  0.0001011900000000,  0.0004744300000000 ]  - [  -0.0022862100000000, -0.0010370300000000, -0.0018938200000000 ]  - [  -0.0007409900000000, -0.0002477100000000,  0.0001788100000000 ]  - [  -0.0019906500000000, -0.0001840500000000, -0.0024839900000000 ]  - [  -0.0001254800000000, -0.0000600300000000, -0.0002695500000000 ]  - [  -0.0000340400000000,  0.0001540800000000,  0.0014314700000000 ]  - [  -0.0027911100000000, -0.0033314000000000,  0.0039464400000000 ]  - [  -0.0000584600000000, -0.0000625000000000,  0.0002848700000000 ]  - [  -0.0000537500000000, -0.0000555300000000,  0.0000861800000000 ]  - [   0.0003195900000000,  0.0001238200000000, -0.0001313400000000 ]  - [   0.0000662400000000,  0.0000997600000000,  0.0001692400000000 ]  - [   0.0000364100000000, -0.0000468500000000,  0.0000619400000000 ]  - [   0.0000393600000000, -0.0000597500000000,  0.0001382600000000 ]  - [  -0.0000279400000000, -0.0000243100000000, -0.0000121700000000 ]  - [   0.0000050100000000,  0.0000636000000000,  0.0001194500000000 ]  - [  -0.0000517100000000, -0.0000448200000000,  0.0000864500000000 ]  - [   0.0000705100000000,  0.0000472800000000,  0.0000891100000000 ]  - [   0.0000292100000000,  0.0000287600000000, -0.0000166600000000 ]  - [  -0.0000416100000000,  0.0000135800000000,  0.0001044900000000 ]  - [  -0.0000041600000000,  0.0000095300000000,  0.0001680100000000 ]  - [   0.0000522900000000,  0.0000012100000000,  0.0001718700000000 ]  - [   0.0000313000000000, -0.0000127600000000,  0.0001115100000000 ]  - [   0.0000112800000000, -0.0000309600000000,  0.0001763500000000 ]  - [  -0.0001061800000000, -0.0000179700000000, -0.0000073200000000 ]  - [  -0.0000022100000000,  0.0000533700000000,  0.0000026600000000 ]  - [  -0.0000327200000000, -0.0000012100000000,  0.0001274500000000 ]  - [   0.0000033100000000, -0.0000634400000000,  0.0000971200000000 ]  - [   0.0000412900000000, -0.0000240000000000,  0.0001168300000000 ]  - [  -0.0000895200000000, -0.0000219900000000,  0.0000610100000000 ]  - [   0.0000316200000000,  0.0000183500000000,  0.0001997400000000 ]  - [  -0.0000330400000000,  0.0000193500000000,  0.0001221300000000 ]  - [   0.0001541100000000,  0.0000425400000000,  0.0003735500000000 ]  - [   0.0004171200000000,  0.0004338700000000, -0.0008031500000000 ]  - [   0.0000374300000000,  0.0000357500000000,  0.0001492300000000 ]  - [  -0.0001932200000000,  0.0000995000000000,  0.0005139600000000 ]  - [  -0.0000477000000000, -0.0000471100000000, -0.0000645200000000 ]- atom:   39  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0004447500000000,  0.0002850800000000, -0.0002046700000000 ]  - [  -0.0011462100000000,  0.0017090700000000, -0.0028660200000000 ]  - [   0.0029875100000000,  0.0073156400000000,  0.0013311700000000 ]  - [  -0.0005257500000000, -0.0004036700000000, -0.0002483200000000 ]  - [  -0.0074269800000000,  0.0031908900000000,  0.0006591800000000 ]  - [   0.0000768900000000, -0.0006088100000000, -0.0021520400000000 ]  - [   0.0013791500000000, -0.0005988400000000,  0.0007516300000000 ]  - [  -0.0002492300000000,  0.0000605300000000, -0.0001152200000000 ]  - [  -0.0010332500000000,  0.0048247200000000, -0.0028915900000000 ]  - [  -0.0015770300000000,  0.0012890700000000,  0.0007356800000000 ]  - [   0.0001981500000000, -0.0008270300000000, -0.0001059400000000 ]  - [  -0.0000795700000000,  0.0004605400000000,  0.0006741900000000 ]  - [  -0.0000535200000000,  0.0001779500000000,  0.0001868100000000 ]  - [   0.0000748700000000, -0.0000307500000000,  0.0002605300000000 ]  - [  -0.0000597300000000,  0.0000004000000000,  0.0003081700000000 ]  - [  -0.0000611600000000,  0.0000284000000000,  0.0002454800000000 ]  - [  -0.0000002400000000, -0.0000115900000000,  0.0000579600000000 ]  - [   0.0000597800000000, -0.0000486300000000,  0.0001816100000000 ]  - [  -0.0000666500000000, -0.0000134100000000,  0.0001468900000000 ]  - [   0.0000034900000000,  0.0000197300000000,  0.0002236800000000 ]  - [   0.0000645000000000,  0.0000087100000000,  0.0001516800000000 ]  - [  -0.0000673200000000,  0.0000361400000000,  0.0001544500000000 ]  - [   0.0000063200000000,  0.0000613600000000,  0.0001464600000000 ]  - [   0.0000346500000000,  0.0000696200000000,  0.0000649300000000 ]  - [  -0.0000081700000000,  0.0000069600000000,  0.0000998400000000 ]  - [  -0.0000022800000000, -0.0000578300000000,  0.0001165000000000 ]  - [  -0.0000280200000000, -0.0000423400000000,  0.0001350000000000 ]  - [  -0.0000764600000000, -0.0002542900000000,  0.0003731000000000 ]  - [  -0.0000050100000000, -0.0001077000000000,  0.0001076600000000 ]  - [  -0.0001963100000000,  0.0001997200000000,  0.0002741800000000 ]  - [   0.0001754700000000,  0.0002117600000000,  0.0002343700000000 ]  - [  -0.0000297600000000, -0.0004001900000000,  0.0000416100000000 ]  - [   0.0001795000000000,  0.0003396100000000, -0.0000463400000000 ]  - [   0.0002066900000000, -0.0002713700000000,  0.0002086200000000 ]  - [  -0.0002165000000000,  0.0000248300000000, -0.0001080400000000 ]  - [  -0.0021034700000000, -0.0015672300000000,  0.0002858200000000 ]  - [   0.0010800700000000, -0.0000939800000000,  0.0003566600000000 ]  - [   0.0003442900000000,  0.0005977900000000,  0.0016589600000000 ]  - [   0.0133943100000000, -0.0388190100000000,  0.0019116800000000 ]  - [  -0.0006321500000000,  0.0017462100000000, -0.0001623100000000 ]  - [  -0.0006078000000000,  0.0023015900000000, -0.0001652900000000 ]  - [  -0.0088967700000000,  0.0128972300000000,  0.0008725200000000 ]  - [   0.0020309500000000,  0.0019164400000000, -0.0014812000000000 ]  - [  -0.0001234600000000,  0.0003791200000000,  0.0000910600000000 ]  - [   0.0003045200000000,  0.0006953700000000,  0.0042094400000000 ]  - [   0.0006076000000000,  0.0010197600000000,  0.0006928000000000 ]  - [   0.0003243900000000,  0.0004087400000000, -0.0002293700000000 ]  - [  -0.0010970400000000, -0.0005895000000000, -0.0001620200000000 ]  - [  -0.0002917100000000, -0.0002124200000000, -0.0005360500000000 ]  - [   0.0000602200000000, -0.0000316800000000,  0.0003983500000000 ]  - [   0.0026003000000000,  0.0015614200000000, -0.0029050300000000 ]  - [  -0.0000642300000000, -0.0000973000000000, -0.0000812000000000 ]  - [  -0.0000532100000000,  0.0000118700000000, -0.0001426600000000 ]  - [   0.0002561800000000,  0.0000457300000000, -0.0003740200000000 ]  - [  -0.0000110300000000,  0.0001909500000000, -0.0000232400000000 ]  - [   0.0001420300000000,  0.0000514500000000, -0.0000544200000000 ]  - [   0.0000778400000000, -0.0001049700000000, -0.0000309400000000 ]  - [  -0.0000190100000000,  0.0000127300000000, -0.0001668000000000 ]  - [  -0.0000285700000000,  0.0000571900000000, -0.0001025500000000 ]  - [  -0.0000256100000000, -0.0000512100000000, -0.0001248400000000 ]  - [   0.0000309200000000,  0.0000582300000000, -0.0001167400000000 ]  - [   0.0000193700000000, -0.0000090300000000, -0.0001489800000000 ]  - [  -0.0000118200000000,  0.0000443700000000, -0.0001351300000000 ]  - [   0.0000149600000000, -0.0000136700000000,  0.0000034500000000 ]  - [   0.0000169700000000,  0.0000302300000000, -0.0000975900000000 ]  - [   0.0000109300000000, -0.0000439700000000, -0.0001419200000000 ]  - [  -0.0000241200000000,  0.0000025600000000,  0.0000001800000000 ]  - [   0.0000030700000000, -0.0000149700000000, -0.0001639100000000 ]  - [   0.0000092100000000,  0.0000220100000000, -0.0001510700000000 ]  - [  -0.0000172100000000, -0.0000506000000000, -0.0000805900000000 ]  - [   0.0000251400000000, -0.0000900700000000, -0.0000518300000000 ]  - [   0.0000329200000000, -0.0000436800000000, -0.0000824800000000 ]  - [  -0.0001060000000000,  0.0000002600000000, -0.0001374900000000 ]  - [  -0.0000199800000000,  0.0000459100000000,  0.0000400200000000 ]  - [  -0.0000312200000000,  0.0000469100000000, -0.0000833400000000 ]  - [   0.0000396100000000,  0.0003290400000000,  0.0003192300000000 ]  - [   0.0004399800000000,  0.0007233900000000, -0.0017199200000000 ]  - [   0.0000744400000000,  0.0000961000000000, -0.0001300100000000 ]  - [  -0.0000113100000000, -0.0000681700000000, -0.0000837000000000 ]  - [   0.0001424200000000, -0.0000354400000000,  0.0000932600000000 ]- atom:   39  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0004408600000000, -0.0002849500000000,  0.0000701800000000 ]  - [   0.0012384900000000, -0.0017163200000000,  0.0028506800000000 ]  - [  -0.0033945600000000, -0.0078338200000000, -0.0013972100000000 ]  - [   0.0005196000000000,  0.0004116300000000,  0.0003851200000000 ]  - [   0.0074996600000000, -0.0031057500000000, -0.0006142900000000 ]  - [  -0.0001740500000000,  0.0005961500000000,  0.0021571100000000 ]  - [  -0.0013941100000000,  0.0007107900000000, -0.0007867500000000 ]  - [   0.0002503200000000,  0.0000450400000000,  0.0001161500000000 ]  - [   0.0010570400000000, -0.0049004400000000,  0.0029201100000000 ]  - [   0.0016051300000000, -0.0014334300000000, -0.0007772100000000 ]  - [  -0.0001990000000000,  0.0007158900000000,  0.0001070000000000 ]  - [   0.0000791600000000, -0.0004599900000000, -0.0005322200000000 ]  - [   0.0000389100000000, -0.0002970300000000, -0.0001596800000000 ]  - [   0.0000440900000000,  0.0000172900000000, -0.0002872300000000 ]  - [   0.0000728000000000,  0.0001189200000000, -0.0002817200000000 ]  - [  -0.0000582600000000, -0.0000147600000000, -0.0002733100000000 ]  - [   0.0000004900000000,  0.0000112300000000, -0.0001948900000000 ]  - [   0.0000455100000000,  0.0000487600000000, -0.0001820400000000 ]  - [  -0.0000525400000000,  0.0000002700000000, -0.0001214000000000 ]  - [  -0.0000036100000000, -0.0000197100000000, -0.0000892100000000 ]  - [   0.0000550100000000,  0.0000041500000000, -0.0001259400000000 ]  - [  -0.0000379800000000, -0.0000369000000000, -0.0001553600000000 ]  - [  -0.0000194200000000,  0.0000577300000000, -0.0001741300000000 ]  - [  -0.0000343400000000,  0.0000349300000000, -0.0000664800000000 ]  - [   0.0000080400000000, -0.0000066900000000, -0.0002364000000000 ]  - [   0.0000153600000000, -0.0000616300000000, -0.0001438500000000 ]  - [   0.0000277200000000, -0.0000633000000000, -0.0001368100000000 ]  - [   0.0000761200000000,  0.0002538900000000, -0.0002380200000000 ]  - [  -0.0000081500000000, -0.0000129500000000, -0.0000812700000000 ]  - [   0.0003155700000000, -0.0002100200000000, -0.0003012000000000 ]  - [  -0.0001617500000000, -0.0000905900000000, -0.0002079800000000 ]  - [  -0.0000886600000000,  0.0004087800000000, -0.0000671700000000 ]  - [  -0.0000984400000000, -0.0004401000000000,  0.0000863200000000 ]  - [  -0.0002383200000000,  0.0002496100000000, -0.0003986300000000 ]  - [   0.0001369200000000,  0.0000750700000000,  0.0001482800000000 ]  - [   0.0020509100000000,  0.0014482000000000, -0.0003118600000000 ]  - [  -0.0010118400000000,  0.0002061400000000, -0.0004000300000000 ]  - [  -0.0003147900000000, -0.0005651100000000, -0.0018578900000000 ]  - [  -0.0132536100000000,  0.0396239900000000, -0.0020337400000000 ]  - [   0.0006511500000000, -0.0017626200000000,  0.0003473400000000 ]  - [   0.0006331100000000, -0.0022505600000000,  0.0002241700000000 ]  - [   0.0090668800000000, -0.0131594400000000, -0.0009411500000000 ]  - [  -0.0020434400000000, -0.0018973500000000,  0.0016672900000000 ]  - [   0.0001019200000000, -0.0003990300000000, -0.0002929500000000 ]  - [  -0.0002824100000000, -0.0006840100000000, -0.0043981100000000 ]  - [  -0.0006331800000000, -0.0010557100000000, -0.0006405200000000 ]  - [  -0.0003024900000000, -0.0004302900000000,  0.0004277400000000 ]  - [   0.0011871100000000,  0.0005151800000000,  0.0001875200000000 ]  - [   0.0001919000000000,  0.0001326600000000,  0.0004984800000000 ]  - [  -0.0000818000000000,  0.0000506100000000, -0.0001951800000000 ]  - [  -0.0027087000000000, -0.0014758400000000,  0.0029559600000000 ]  - [   0.0001000200000000,  0.0001365700000000,  0.0001356600000000 ]  - [   0.0000173400000000, -0.0000522200000000,  0.0001955700000000 ]  - [  -0.0001548200000000,  0.0000339200000000,  0.0003323000000000 ]  - [  -0.0000291200000000, -0.0001554200000000, -0.0000298600000000 ]  - [  -0.0001018900000000, -0.0000864300000000,  0.0000029900000000 ]  - [   0.0000026100000000,  0.0000028300000000,  0.0000726900000000 ]  - [  -0.0000031200000000, -0.0000337600000000, -0.0000314200000000 ]  - [  -0.0000516400000000,  0.0000447900000000,  0.0001430700000000 ]  - [  -0.0000547100000000, -0.0000505700000000,  0.0000847700000000 ]  - [   0.0000493400000000,  0.0000434300000000,  0.0000771100000000 ]  - [   0.0000028100000000,  0.0000300000000000, -0.0000493600000000 ]  - [  -0.0000243000000000, -0.0000045200000000,  0.0000831900000000 ]  - [   0.0000068800000000, -0.0000073200000000,  0.0001961900000000 ]  - [   0.0000228700000000,  0.0000055800000000,  0.0001516700000000 ]  - [   0.0000250100000000,  0.0000039100000000,  0.0000900000000000 ]  - [   0.0000019800000000,  0.0000176100000000,  0.0001989600000000 ]  - [  -0.0000242500000000, -0.0000079700000000, -0.0000339700000000 ]  - [   0.0000114900000000,  0.0000002100000000, -0.0000471500000000 ]  - [  -0.0000231400000000,  0.0000146700000000,  0.0001345300000000 ]  - [  -0.0000051200000000,  0.0000681100000000,  0.0002519700000000 ]  - [   0.0000690300000000, -0.0000365100000000,  0.0001233400000000 ]  - [   0.0000035800000000, -0.0000805900000000,  0.0000965600000000 ]  - [  -0.0000005800000000, -0.0000236100000000,  0.0001593700000000 ]  - [  -0.0000705500000000,  0.0000331500000000,  0.0001247100000000 ]  - [  -0.0000053300000000, -0.0002895600000000, -0.0002648100000000 ]  - [  -0.0004753700000000, -0.0007617700000000,  0.0017732600000000 ]  - [   0.0000275200000000, -0.0000158000000000,  0.0000899900000000 ]  - [  -0.0000294800000000,  0.0001041400000000,  0.0000339800000000 ]  - [  -0.0001013900000000, -0.0000014500000000, -0.0001429600000000 ]- atom:   39  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0001287900000000, -0.0004414000000000,  0.0000724000000000 ]  - [   0.0035139600000000, -0.0030221200000000,  0.0163686800000000 ]  - [   0.0012797000000000,  0.0017301100000000,  0.0084173700000000 ]  - [   0.0003070400000000,  0.0013799100000000,  0.0027407000000000 ]  - [  -0.0073491600000000,  0.0020123800000000,  0.0068958700000000 ]  - [   0.0003813400000000,  0.0003148200000000,  0.0022330100000000 ]  - [   0.0007598900000000,  0.0009742100000000,  0.0025523500000000 ]  - [  -0.0013865500000000,  0.0000505600000000,  0.0009391500000000 ]  - [   0.0003554000000000, -0.0019997200000000,  0.0045503800000000 ]  - [  -0.0045676700000000,  0.0001242200000000,  0.0079522900000000 ]  - [   0.0005024500000000, -0.0004981300000000,  0.0005640900000000 ]  - [   0.0001870800000000, -0.0003686200000000, -0.0010599400000000 ]  - [   0.0003124600000000,  0.0002191200000000, -0.0012230100000000 ]  - [   0.0000750900000000, -0.0000849800000000, -0.0011018100000000 ]  - [  -0.0000328800000000, -0.0000880700000000, -0.0007203400000000 ]  - [  -0.0000839200000000,  0.0001850400000000, -0.0010975000000000 ]  - [  -0.0000187400000000, -0.0000211600000000, -0.0013122300000000 ]  - [   0.0000604600000000,  0.0000896400000000, -0.0011014100000000 ]  - [  -0.0000670400000000,  0.0000282300000000, -0.0010259900000000 ]  - [   0.0000022000000000,  0.0000256200000000, -0.0011659000000000 ]  - [   0.0000631100000000, -0.0000365800000000, -0.0010257000000000 ]  - [  -0.0000662500000000, -0.0001270400000000, -0.0011806200000000 ]  - [  -0.0000554500000000,  0.0000911600000000, -0.0011078900000000 ]  - [   0.0000870200000000, -0.0000165100000000, -0.0011243600000000 ]  - [  -0.0000049500000000, -0.0000095500000000, -0.0012863000000000 ]  - [   0.0000357500000000, -0.0000626700000000, -0.0010090800000000 ]  - [  -0.0000198600000000, -0.0000605400000000, -0.0011152500000000 ]  - [   0.0002049300000000,  0.0005118400000000, -0.0015399500000000 ]  - [  -0.0000369900000000, -0.0001203300000000, -0.0007075500000000 ]  - [   0.0008454100000000, -0.0001091400000000, -0.0007227600000000 ]  - [  -0.0004006300000000,  0.0000269200000000, -0.0009784800000000 ]  - [  -0.0002991000000000, -0.0002401400000000, -0.0009533400000000 ]  - [   0.0000034100000000, -0.0003289400000000,  0.0000616000000000 ]  - [  -0.0022830400000000,  0.0014762300000000,  0.0006037800000000 ]  - [   0.0009148800000000, -0.0000227100000000,  0.0002335300000000 ]  - [   0.0068964900000000, -0.0011087700000000,  0.0003074800000000 ]  - [  -0.0002596200000000,  0.0003364000000000, -0.0018695000000000 ]  - [   0.0011694800000000,  0.0030723300000000,  0.0008067900000000 ]  - [   0.0052967600000000,  0.0019194100000000, -0.0617569200000000 ]  - [   0.0009208200000000, -0.0020381500000000,  0.0001587100000000 ]  - [  -0.0006411200000000,  0.0019359800000000, -0.0022825400000000 ]  - [   0.0000565100000000, -0.0008727100000000, -0.0044188500000000 ]  - [  -0.0028577900000000, -0.0023851700000000,  0.0010811600000000 ]  - [   0.0006296300000000, -0.0012644700000000, -0.0002544900000000 ]  - [  -0.0000333400000000,  0.0054468600000000,  0.0104195100000000 ]  - [  -0.0002218300000000, -0.0001427400000000, -0.0022817200000000 ]  - [  -0.0006554600000000, -0.0004996300000000,  0.0002974500000000 ]  - [   0.0015646200000000, -0.0005118200000000, -0.0002696900000000 ]  - [   0.0004908600000000,  0.0001445000000000,  0.0008622600000000 ]  - [   0.0002535700000000,  0.0001572300000000,  0.0004136800000000 ]  - [  -0.0040497000000000, -0.0041630600000000,  0.0022390600000000 ]  - [  -0.0002388100000000,  0.0001281300000000,  0.0009378500000000 ]  - [   0.0000405800000000, -0.0001887100000000,  0.0007226100000000 ]  - [  -0.0004920700000000, -0.0001798200000000,  0.0007964900000000 ]  - [   0.0000383300000000,  0.0005596600000000,  0.0007991100000000 ]  - [   0.0001392000000000,  0.0000221500000000,  0.0008181500000000 ]  - [   0.0000044000000000, -0.0000913400000000,  0.0008601100000000 ]  - [  -0.0001157500000000, -0.0001374500000000,  0.0005089300000000 ]  - [   0.0000696000000000,  0.0000790000000000,  0.0007397800000000 ]  - [  -0.0001312600000000, -0.0000163000000000,  0.0007238800000000 ]  - [   0.0001286000000000,  0.0000266900000000,  0.0007787900000000 ]  - [   0.0001018100000000,  0.0001535600000000,  0.0005044200000000 ]  - [  -0.0001477900000000, -0.0000887900000000,  0.0008411100000000 ]  - [  -0.0000633900000000,  0.0001022600000000,  0.0006843700000000 ]  - [   0.0001273600000000, -0.0000820200000000,  0.0009032500000000 ]  - [   0.0001548400000000,  0.0000956300000000,  0.0008640200000000 ]  - [   0.0000619400000000, -0.0001135300000000,  0.0006898500000000 ]  - [  -0.0001578300000000, -0.0001071600000000,  0.0004592300000000 ]  - [   0.0001942700000000,  0.0000810900000000,  0.0004353700000000 ]  - [  -0.0001445100000000,  0.0001263200000000,  0.0009032100000000 ]  - [  -0.0001043600000000,  0.0001855100000000,  0.0008131800000000 ]  - [   0.0001062400000000,  0.0000304700000000,  0.0007849400000000 ]  - [   0.0001278500000000, -0.0002237400000000,  0.0007459100000000 ]  - [   0.0000701600000000, -0.0001002900000000,  0.0005983800000000 ]  - [  -0.0001246000000000, -0.0000367900000000,  0.0007789100000000 ]  - [  -0.0003279400000000, -0.0002702100000000,  0.0001965100000000 ]  - [  -0.0008524600000000, -0.0017552900000000,  0.0047559600000000 ]  - [  -0.0000824700000000,  0.0000859200000000,  0.0006582000000000 ]  - [  -0.0000232900000000,  0.0002129500000000,  0.0008002400000000 ]  - [  -0.0000090600000000, -0.0001057800000000,  0.0008190500000000 ]- atom:   39  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0001331500000000,  0.0004432300000000, -0.0002227500000000 ]  - [  -0.0035557900000000,  0.0032724200000000, -0.0174254300000000 ]  - [  -0.0014082800000000, -0.0017712100000000, -0.0084319800000000 ]  - [  -0.0003063200000000, -0.0013811600000000, -0.0026253500000000 ]  - [   0.0074986600000000, -0.0019947700000000, -0.0068499300000000 ]  - [  -0.0004896700000000, -0.0003120700000000, -0.0022759000000000 ]  - [  -0.0007596200000000, -0.0008547500000000, -0.0025659700000000 ]  - [   0.0013871400000000,  0.0000613400000000, -0.0009176700000000 ]  - [  -0.0002638700000000,  0.0017079000000000, -0.0042112800000000 ]  - [   0.0043539800000000, -0.0001917800000000, -0.0078514100000000 ]  - [  -0.0004980500000000,  0.0003927100000000, -0.0005463900000000 ]  - [  -0.0001882100000000,  0.0003654500000000,  0.0012087100000000 ]  - [  -0.0003241100000000, -0.0003390200000000,  0.0012691100000000 ]  - [   0.0000448800000000,  0.0000711800000000,  0.0010802000000000 ]  - [   0.0000456100000000,  0.0002057000000000,  0.0007525800000000 ]  - [  -0.0000352800000000, -0.0001703000000000,  0.0010752900000000 ]  - [   0.0000191800000000,  0.0000213500000000,  0.0011808700000000 ]  - [   0.0000446500000000, -0.0000902200000000,  0.0011070900000000 ]  - [  -0.0000525400000000, -0.0000408500000000,  0.0010564900000000 ]  - [  -0.0000020900000000, -0.0000257100000000,  0.0013063900000000 ]  - [   0.0000574400000000,  0.0000491700000000,  0.0010561700000000 ]  - [  -0.0000389400000000,  0.0001275000000000,  0.0011863700000000 ]  - [   0.0000430700000000,  0.0000282100000000,  0.0010862400000000 ]  - [  -0.0000865300000000,  0.0001219800000000,  0.0011285100000000 ]  - [   0.0000049600000000,  0.0000102300000000,  0.0011558100000000 ]  - [  -0.0000229400000000, -0.0000569300000000,  0.0009866600000000 ]  - [   0.0000187100000000, -0.0000444100000000,  0.0011183000000000 ]  - [  -0.0002084400000000, -0.0005177900000000,  0.0016839500000000 ]  - [   0.0000251600000000,  0.0000011600000000,  0.0007347700000000 ]  - [  -0.0007319800000000,  0.0000936400000000,  0.0006896300000000 ]  - [   0.0004183600000000,  0.0000946300000000,  0.0010100900000000 ]  - [   0.0001805400000000,  0.0002518800000000,  0.0009262700000000 ]  - [   0.0000743900000000,  0.0002282900000000, -0.0000167100000000 ]  - [   0.0022977000000000, -0.0015164000000000, -0.0008146100000000 ]  - [  -0.0010132900000000,  0.0001272200000000, -0.0001953400000000 ]  - [  -0.0070111500000000,  0.0010037700000000, -0.0003186100000000 ]  - [   0.0003453300000000, -0.0002340000000000,  0.0018432500000000 ]  - [  -0.0011625000000000, -0.0030966300000000, -0.0010137500000000 ]  - [  -0.0050081400000000, -0.0020297400000000,  0.0620042600000000 ]  - [  -0.0009067000000000,  0.0020435200000000,  0.0000487100000000 ]  - [   0.0006918500000000, -0.0019129400000000,  0.0023318600000000 ]  - [  -0.0000756700000000,  0.0009415400000000,  0.0043919900000000 ]  - [   0.0028553400000000,  0.0024207900000000, -0.0008698600000000 ]  - [  -0.0006439600000000,  0.0012243900000000,  0.0000555300000000 ]  - [   0.0000601900000000, -0.0053322900000000, -0.0104443500000000 ]  - [   0.0001679800000000,  0.0001055400000000,  0.0023328700000000 ]  - [   0.0006771100000000,  0.0004776000000000, -0.0001023900000000 ]  - [  -0.0014586000000000,  0.0004357200000000,  0.0002977700000000 ]  - [  -0.0005913600000000, -0.0002198200000000, -0.0009021700000000 ]  - [  -0.0002780600000000, -0.0001363000000000, -0.0002219700000000 ]  - [   0.0039149100000000,  0.0042227400000000, -0.0021943900000000 ]  - [   0.0002751500000000, -0.0000890200000000, -0.0008887000000000 ]  - [  -0.0000778700000000,  0.0001499200000000, -0.0006748200000000 ]  - [   0.0005910100000000,  0.0002587800000000, -0.0008413900000000 ]  - [  -0.0000790000000000, -0.0005211300000000, -0.0008551900000000 ]  - [  -0.0000972200000000, -0.0000579600000000, -0.0008733200000000 ]  - [   0.0000753000000000, -0.0000089600000000, -0.0008246800000000 ]  - [   0.0000945100000000,  0.0001173100000000, -0.0007091700000000 ]  - [  -0.0001500800000000,  0.0000225500000000, -0.0007018300000000 ]  - [   0.0000514800000000, -0.0000851900000000, -0.0007679600000000 ]  - [  -0.0000483200000000,  0.0000751700000000, -0.0008227900000000 ]  - [  -0.0000802800000000, -0.0001331700000000, -0.0007050200000000 ]  - [   0.0001118400000000,  0.0001291300000000, -0.0008972000000000 ]  - [   0.0000848500000000, -0.0001233700000000, -0.0004881900000000 ]  - [  -0.0000880100000000,  0.0001188600000000, -0.0008540200000000 ]  - [  -0.0001186000000000, -0.0001358500000000, -0.0009202900000000 ]  - [  -0.0000836100000000,  0.0001347900000000, -0.0004942100000000 ]  - [   0.0001376900000000,  0.0000860400000000, -0.0006591700000000 ]  - [  -0.0001747600000000, -0.0000599300000000, -0.0006355200000000 ]  - [   0.0001052100000000, -0.0001635800000000, -0.0008541200000000 ]  - [   0.0001253600000000, -0.0002087100000000, -0.0006184100000000 ]  - [  -0.0000049600000000, -0.0001108400000000, -0.0007472900000000 ]  - [  -0.0002309500000000,  0.0001452700000000, -0.0007901500000000 ]  - [  -0.0000905800000000,  0.0001228000000000, -0.0004014200000000 ]  - [   0.0000239700000000,  0.0001174700000000, -0.0007407400000000 ]  - [   0.0003675700000000,  0.0003133600000000, -0.0001377400000000 ]  - [   0.0008257000000000,  0.0017383700000000, -0.0047577300000000 ]  - [   0.0001845700000000, -0.0000058700000000, -0.0006999400000000 ]  - [  -0.0000162100000000, -0.0001769800000000, -0.0008540700000000 ]  - [   0.0000480400000000,  0.0000690400000000, -0.0008724700000000 ]