# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/0968194d-5add-4f56-a5e6-82365bb5c7e8/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 KAl11O17 / R3m (160) / materials id 760755](https://mdr.nims.go.jp/datasets/bbfd4db8-ac59-46a4-b998-c3451b6f507e)

## 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: "R3m"  number: 160  Hall_symbol: "R 3 -2\""primitive_matrix:- [  0.666666666666667, -0.333333333333333, -0.333333333333333 ]- [  0.333333333333333,  0.333333333333333, -0.666666666666667 ]- [  0.333333333333333,  0.333333333333333,  0.333333333333333 ]supercell_matrix:- [   1,   0,   0 ]- [   0,   1,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     2.806557180000003,     1.620366543333332,    11.428157646666655 ] # a  - [    -2.806557179999997,     1.620366543333332,    11.428157646666655 ] # b  - [     0.000000000000003,    -3.240733086666668,    11.428157646666655 ] # c  points:  - symbol: K  # 1    coordinates: [  0.170616040000000,  0.170616050000002,  0.170616040000000 ]    mass: 39.098300  - symbol: Al # 2    coordinates: [  0.407076570000000,  0.902025000000002,  0.902025000000000 ]    mass: 26.981539  - symbol: Al # 3    coordinates: [  0.000136190000000,  0.000136200000002,  0.000136190000000 ]    mass: 26.981539  - symbol: Al # 4    coordinates: [  0.902025000000000,  0.902025000000002,  0.407076570000000 ]    mass: 26.981539  - symbol: Al # 5    coordinates: [  0.902025000000000,  0.407076570000002,  0.902025000000000 ]    mass: 26.981539  - symbol: Al # 6    coordinates: [  0.550002770000000,  0.550002760000003,  0.550002770000000 ]    mass: 26.981539  - symbol: Al # 7    coordinates: [  0.650039550000000,  0.650039540000003,  0.650039550000000 ]    mass: 26.981539  - symbol: Al # 8    coordinates: [  0.449833210000000,  0.449833200000002,  0.449833210000000 ]    mass: 26.981539  - symbol: Al # 9    coordinates: [  0.350407960000000,  0.350407950000002,  0.350407960000000 ]    mass: 26.981539  - symbol: Al # 10    coordinates: [  0.097101890000000,  0.595611000000003,  0.097101890000000 ]    mass: 26.981539  - symbol: Al # 11    coordinates: [  0.097101890000000,  0.097101900000003,  0.595610990000000 ]    mass: 26.981539  - symbol: Al # 12    coordinates: [  0.595610990000000,  0.097101900000003,  0.097101890000000 ]    mass: 26.981539  - symbol: O  # 13    coordinates: [  0.703040900000000,  0.703040900000002,  0.703040900000000 ]    mass: 15.999400  - symbol: O  # 14    coordinates: [  0.906469390000000,  0.906469390000003,  0.906469390000000 ]    mass: 15.999400  - symbol: O  # 15    coordinates: [  0.189089520000000,  0.720373010000002,  0.189089520000000 ]    mass: 15.999400  - symbol: O  # 16    coordinates: [  0.280511540000000,  0.810352660000003,  0.810352670000000 ]    mass: 15.999400  - symbol: O  # 17    coordinates: [  0.401665190000000,  0.908483170000003,  0.401665190000000 ]    mass: 15.999400  - symbol: O  # 18    coordinates: [  0.093415680000000,  0.596772920000002,  0.596772900000000 ]    mass: 15.999400  - symbol: O  # 19    coordinates: [  0.401665190000000,  0.401665190000003,  0.908483170000000 ]    mass: 15.999400  - symbol: O  # 20    coordinates: [  0.810352670000000,  0.810352660000003,  0.280511540000000 ]    mass: 15.999400  - symbol: O  # 21    coordinates: [  0.189089520000000,  0.189089510000002,  0.720373020000000 ]    mass: 15.999400  - symbol: O  # 22    coordinates: [  0.499983710000000,  0.499983700000002,  0.499983710000000 ]    mass: 15.999400  - symbol: O  # 23    coordinates: [  0.596772900000000,  0.596772920000002,  0.093415680000000 ]    mass: 15.999400  - symbol: O  # 24    coordinates: [  0.596772900000000,  0.093415700000002,  0.596772900000000 ]    mass: 15.999400  - symbol: O  # 25    coordinates: [  0.908483170000000,  0.401665190000003,  0.401665190000000 ]    mass: 15.999400  - symbol: O  # 26    coordinates: [  0.720373020000000,  0.189089510000002,  0.189089520000000 ]    mass: 15.999400  - symbol: O  # 27    coordinates: [  0.810352670000000,  0.280511530000003,  0.810352670000000 ]    mass: 15.999400  - symbol: O  # 28    coordinates: [  0.296988230000000,  0.296988240000003,  0.296988230000000 ]    mass: 15.999400  - symbol: O  # 29    coordinates: [  0.093675480000000,  0.093675490000002,  0.093675480000000 ]    mass: 15.999400  reciprocal_lattice: # without 2pi  - [     0.178154218115734,     0.102857385788655,     0.029167722710804 ] # a*  - [    -0.178154218115734,     0.102857385788655,     0.029167722710805 ] # b*  - [     0.000000000000000,    -0.205714771577311,     0.029167722710804 ] # c*unit_cell:  lattice:  - [     5.613114360000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -2.806557180000000,     4.861099630000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    34.284472940000001 ] # c  points:  - symbol: K  # 1    coordinates: [  0.333333330000000,  0.666666670000000,  0.837282710000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.170616040000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 3    coordinates: [  0.666666670000000,  0.333333330000000,  0.503949370000000 ]    mass: 39.098300    reduced_to: 1  - symbol: Al # 4    coordinates: [  0.670034380000000,  0.835017190000000,  0.737042190000000 ]    mass: 26.981539    reduced_to: 4  - symbol: Al # 5    coordinates: [  0.333333330000000,  0.666666670000000,  0.666802860000000 ]    mass: 26.981539    reduced_to: 5  - symbol: Al # 6    coordinates: [  0.164982810000000,  0.329965620000000,  0.737042190000000 ]    mass: 26.981539    reduced_to: 6  - symbol: Al # 7    coordinates: [  0.164982810000000,  0.835017190000000,  0.737042190000000 ]    mass: 26.981539    reduced_to: 7  - symbol: Al # 8    coordinates: [  0.666666670000000,  0.333333330000000,  0.883336100000000 ]    mass: 26.981539    reduced_to: 8  - symbol: Al # 9    coordinates: [  0.666666670000000,  0.333333330000000,  0.983372880000000 ]    mass: 26.981539    reduced_to: 9  - symbol: Al # 10    coordinates: [  0.666666670000000,  0.333333330000000,  0.783166540000000 ]    mass: 26.981539    reduced_to: 10  - symbol: Al # 11    coordinates: [  0.666666670000000,  0.333333330000000,  0.683741290000000 ]    mass: 26.981539    reduced_to: 11  - symbol: Al # 12    coordinates: [  0.167163630000000,  0.832836370000000,  0.929938260000000 ]    mass: 26.981539    reduced_to: 12  - symbol: Al # 13    coordinates: [  0.167163630000000,  0.334327270000000,  0.929938260000000 ]    mass: 26.981539    reduced_to: 13  - symbol: Al # 14    coordinates: [  0.665672730000000,  0.832836370000000,  0.929938260000000 ]    mass: 26.981539    reduced_to: 14  - symbol: Al # 15    coordinates: [  0.336701050000000,  0.168350520000000,  0.070375530000000 ]    mass: 26.981539    reduced_to: 4  - symbol: Al # 16    coordinates: [  0.000000000000000,  0.000000000000000,  0.000136190000000 ]    mass: 26.981539    reduced_to: 5  - symbol: Al # 17    coordinates: [  0.831649480000000,  0.663298950000000,  0.070375530000000 ]    mass: 26.981539    reduced_to: 6  - symbol: Al # 18    coordinates: [  0.831649480000000,  0.168350520000000,  0.070375530000000 ]    mass: 26.981539    reduced_to: 7  - symbol: Al # 19    coordinates: [  0.333333330000000,  0.666666670000000,  0.216669440000000 ]    mass: 26.981539    reduced_to: 8  - symbol: Al # 20    coordinates: [  0.333333330000000,  0.666666670000000,  0.316706210000000 ]    mass: 26.981539    reduced_to: 9  - symbol: Al # 21    coordinates: [  0.333333330000000,  0.666666670000000,  0.116499880000000 ]    mass: 26.981539    reduced_to: 10  - symbol: Al # 22    coordinates: [  0.333333330000000,  0.666666670000000,  0.017074620000000 ]    mass: 26.981539    reduced_to: 11  - symbol: Al # 23    coordinates: [  0.833830300000000,  0.166169700000000,  0.263271590000000 ]    mass: 26.981539    reduced_to: 12  - symbol: Al # 24    coordinates: [  0.833830300000000,  0.667660600000000,  0.263271590000000 ]    mass: 26.981539    reduced_to: 13  - symbol: Al # 25    coordinates: [  0.332339400000000,  0.166169700000000,  0.263271590000000 ]    mass: 26.981539    reduced_to: 14  - symbol: Al # 26    coordinates: [  0.003367720000000,  0.501683850000000,  0.403708860000000 ]    mass: 26.981539    reduced_to: 4  - symbol: Al # 27    coordinates: [  0.666666670000000,  0.333333330000000,  0.333469520000000 ]    mass: 26.981539    reduced_to: 5  - symbol: Al # 28    coordinates: [  0.498316150000000,  0.996632280000000,  0.403708860000000 ]    mass: 26.981539    reduced_to: 6  - symbol: Al # 29    coordinates: [  0.498316150000000,  0.501683850000000,  0.403708860000000 ]    mass: 26.981539    reduced_to: 7  - symbol: Al # 30    coordinates: [  0.000000000000000,  0.000000000000000,  0.550002770000000 ]    mass: 26.981539    reduced_to: 8  - symbol: Al # 31    coordinates: [  0.000000000000000,  0.000000000000000,  0.650039540000000 ]    mass: 26.981539    reduced_to: 9  - symbol: Al # 32    coordinates: [  0.000000000000000,  0.000000000000000,  0.449833210000000 ]    mass: 26.981539    reduced_to: 10  - symbol: Al # 33    coordinates: [  0.000000000000000,  0.000000000000000,  0.350407950000000 ]    mass: 26.981539    reduced_to: 11  - symbol: Al # 34    coordinates: [  0.500496970000000,  0.499503030000000,  0.596604920000000 ]    mass: 26.981539    reduced_to: 12  - symbol: Al # 35    coordinates: [  0.500496970000000,  0.000993930000000,  0.596604920000000 ]    mass: 26.981539    reduced_to: 13  - symbol: Al # 36    coordinates: [  0.999006070000000,  0.499503030000000,  0.596604920000000 ]    mass: 26.981539    reduced_to: 14  - symbol: O  # 37    coordinates: [  0.000000000000000,  0.000000000000000,  0.703040900000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.000000000000000,  0.000000000000000,  0.906469390000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 39    coordinates: [  0.489572170000000,  0.510427830000000,  0.699517350000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.313439250000000,  0.156719620000000,  0.967072290000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 41    coordinates: [  0.497727340000000,  0.502272660000000,  0.903937850000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.331095180000000,  0.165547600000000,  0.762320500000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 43    coordinates: [  0.497727340000000,  0.995454680000000,  0.903937850000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.843280380000000,  0.686560750000000,  0.967072290000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 45    coordinates: [  0.489572170000000,  0.979144330000000,  0.699517350000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.666666670000000,  0.333333330000000,  0.833317040000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 47    coordinates: [  0.834452400000000,  0.668904820000000,  0.762320500000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.834452400000000,  0.165547600000000,  0.762320500000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 49    coordinates: [  0.004545320000000,  0.502272660000000,  0.903937850000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 50    coordinates: [  0.020855670000000,  0.510427830000000,  0.699517350000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 51    coordinates: [  0.843280380000000,  0.156719620000000,  0.967072290000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 52    coordinates: [  0.333333330000000,  0.666666670000000,  0.963654900000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 53    coordinates: [  0.333333330000000,  0.666666670000000,  0.760342150000000 ]    mass: 15.999400    reduced_to: 53  - symbol: O  # 54    coordinates: [  0.666666670000000,  0.333333330000000,  0.036374230000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 55    coordinates: [  0.666666670000000,  0.333333330000000,  0.239802720000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 56    coordinates: [  0.156238840000000,  0.843761160000000,  0.032850680000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 57    coordinates: [  0.980105920000000,  0.490052960000000,  0.300405630000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 58    coordinates: [  0.164394000000000,  0.835606000000000,  0.237271190000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 59    coordinates: [  0.997761850000000,  0.498880930000000,  0.095653830000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 60    coordinates: [  0.164394000000000,  0.328788020000000,  0.237271190000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 61    coordinates: [  0.509947040000000,  0.019894080000000,  0.300405630000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 62    coordinates: [  0.156238840000000,  0.312477670000000,  0.032850680000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 63    coordinates: [  0.333333330000000,  0.666666670000000,  0.166650380000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 64    coordinates: [  0.501119070000000,  0.002238150000000,  0.095653830000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 65    coordinates: [  0.501119070000000,  0.498880930000000,  0.095653830000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 66    coordinates: [  0.671211980000000,  0.835606000000000,  0.237271190000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 67    coordinates: [  0.687522330000000,  0.843761160000000,  0.032850680000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 68    coordinates: [  0.509947040000000,  0.490052960000000,  0.300405630000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 69    coordinates: [  0.000000000000000,  0.000000000000000,  0.296988230000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 70    coordinates: [  0.000000000000000,  0.000000000000000,  0.093675490000000 ]    mass: 15.999400    reduced_to: 53  - symbol: O  # 71    coordinates: [  0.333333330000000,  0.666666670000000,  0.369707570000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 72    coordinates: [  0.333333330000000,  0.666666670000000,  0.573136060000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 73    coordinates: [  0.822905510000000,  0.177094490000000,  0.366184010000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 74    coordinates: [  0.646772580000000,  0.823386290000000,  0.633738960000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 75    coordinates: [  0.831060670000000,  0.168939330000000,  0.570604520000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 76    coordinates: [  0.664428520000000,  0.832214260000000,  0.428987160000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 77    coordinates: [  0.831060670000000,  0.662121350000000,  0.570604520000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 78    coordinates: [  0.176613710000000,  0.353227420000000,  0.633738960000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 79    coordinates: [  0.822905510000000,  0.645811000000000,  0.366184010000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 80    coordinates: [  0.000000000000000,  0.000000000000000,  0.499983710000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 81    coordinates: [  0.167785740000000,  0.335571480000000,  0.428987160000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 82    coordinates: [  0.167785740000000,  0.832214260000000,  0.428987160000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 83    coordinates: [  0.337878650000000,  0.168939330000000,  0.570604520000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 84    coordinates: [  0.354189000000000,  0.177094490000000,  0.366184010000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 85    coordinates: [  0.176613710000000,  0.823386290000000,  0.633738960000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 86    coordinates: [  0.666666670000000,  0.333333330000000,  0.630321560000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 87    coordinates: [  0.666666670000000,  0.333333330000000,  0.427008820000000 ]    mass: 15.999400    reduced_to: 53supercell:  lattice:  - [     5.613114360000000,     0.000000000000000,     0.000000000000000 ] # a  - [    -2.806557180000000,     4.861099630000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    34.284472940000001 ] # c  points:  - symbol: K  # 1    coordinates: [  0.333333330000000,  0.666666670000000,  0.837282710000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 2    coordinates: [  0.000000000000000,  0.000000000000000,  0.170616040000000 ]    mass: 39.098300    reduced_to: 1  - symbol: K  # 3    coordinates: [  0.666666670000000,  0.333333330000000,  0.503949370000000 ]    mass: 39.098300    reduced_to: 1  - symbol: Al # 4    coordinates: [  0.670034380000000,  0.835017190000000,  0.737042190000000 ]    mass: 26.981539    reduced_to: 4  - symbol: Al # 5    coordinates: [  0.333333330000000,  0.666666670000000,  0.666802860000000 ]    mass: 26.981539    reduced_to: 5  - symbol: Al # 6    coordinates: [  0.164982810000000,  0.329965620000000,  0.737042190000000 ]    mass: 26.981539    reduced_to: 6  - symbol: Al # 7    coordinates: [  0.164982810000000,  0.835017190000000,  0.737042190000000 ]    mass: 26.981539    reduced_to: 7  - symbol: Al # 8    coordinates: [  0.666666670000000,  0.333333330000000,  0.883336100000000 ]    mass: 26.981539    reduced_to: 8  - symbol: Al # 9    coordinates: [  0.666666670000000,  0.333333330000000,  0.983372880000000 ]    mass: 26.981539    reduced_to: 9  - symbol: Al # 10    coordinates: [  0.666666670000000,  0.333333330000000,  0.783166540000000 ]    mass: 26.981539    reduced_to: 10  - symbol: Al # 11    coordinates: [  0.666666670000000,  0.333333330000000,  0.683741290000000 ]    mass: 26.981539    reduced_to: 11  - symbol: Al # 12    coordinates: [  0.167163630000000,  0.832836370000000,  0.929938260000000 ]    mass: 26.981539    reduced_to: 12  - symbol: Al # 13    coordinates: [  0.167163630000000,  0.334327270000000,  0.929938260000000 ]    mass: 26.981539    reduced_to: 13  - symbol: Al # 14    coordinates: [  0.665672730000000,  0.832836370000000,  0.929938260000000 ]    mass: 26.981539    reduced_to: 14  - symbol: Al # 15    coordinates: [  0.336701050000000,  0.168350520000000,  0.070375530000000 ]    mass: 26.981539    reduced_to: 4  - symbol: Al # 16    coordinates: [  0.000000000000000,  0.000000000000000,  0.000136190000000 ]    mass: 26.981539    reduced_to: 5  - symbol: Al # 17    coordinates: [  0.831649480000000,  0.663298950000000,  0.070375530000000 ]    mass: 26.981539    reduced_to: 6  - symbol: Al # 18    coordinates: [  0.831649480000000,  0.168350520000000,  0.070375530000000 ]    mass: 26.981539    reduced_to: 7  - symbol: Al # 19    coordinates: [  0.333333330000000,  0.666666670000000,  0.216669440000000 ]    mass: 26.981539    reduced_to: 8  - symbol: Al # 20    coordinates: [  0.333333330000000,  0.666666670000000,  0.316706210000000 ]    mass: 26.981539    reduced_to: 9  - symbol: Al # 21    coordinates: [  0.333333330000000,  0.666666670000000,  0.116499880000000 ]    mass: 26.981539    reduced_to: 10  - symbol: Al # 22    coordinates: [  0.333333330000000,  0.666666670000000,  0.017074620000000 ]    mass: 26.981539    reduced_to: 11  - symbol: Al # 23    coordinates: [  0.833830300000000,  0.166169700000000,  0.263271590000000 ]    mass: 26.981539    reduced_to: 12  - symbol: Al # 24    coordinates: [  0.833830300000000,  0.667660600000000,  0.263271590000000 ]    mass: 26.981539    reduced_to: 13  - symbol: Al # 25    coordinates: [  0.332339400000000,  0.166169700000000,  0.263271590000000 ]    mass: 26.981539    reduced_to: 14  - symbol: Al # 26    coordinates: [  0.003367720000000,  0.501683850000000,  0.403708860000000 ]    mass: 26.981539    reduced_to: 4  - symbol: Al # 27    coordinates: [  0.666666670000000,  0.333333330000000,  0.333469520000000 ]    mass: 26.981539    reduced_to: 5  - symbol: Al # 28    coordinates: [  0.498316150000000,  0.996632280000000,  0.403708860000000 ]    mass: 26.981539    reduced_to: 6  - symbol: Al # 29    coordinates: [  0.498316150000000,  0.501683850000000,  0.403708860000000 ]    mass: 26.981539    reduced_to: 7  - symbol: Al # 30    coordinates: [  0.000000000000000,  0.000000000000000,  0.550002770000000 ]    mass: 26.981539    reduced_to: 8  - symbol: Al # 31    coordinates: [  0.000000000000000,  0.000000000000000,  0.650039540000000 ]    mass: 26.981539    reduced_to: 9  - symbol: Al # 32    coordinates: [  0.000000000000000,  0.000000000000000,  0.449833210000000 ]    mass: 26.981539    reduced_to: 10  - symbol: Al # 33    coordinates: [  0.000000000000000,  0.000000000000000,  0.350407950000000 ]    mass: 26.981539    reduced_to: 11  - symbol: Al # 34    coordinates: [  0.500496970000000,  0.499503030000000,  0.596604920000000 ]    mass: 26.981539    reduced_to: 12  - symbol: Al # 35    coordinates: [  0.500496970000000,  0.000993930000000,  0.596604920000000 ]    mass: 26.981539    reduced_to: 13  - symbol: Al # 36    coordinates: [  0.999006070000000,  0.499503030000000,  0.596604920000000 ]    mass: 26.981539    reduced_to: 14  - symbol: O  # 37    coordinates: [  0.000000000000000,  0.000000000000000,  0.703040900000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 38    coordinates: [  0.000000000000000,  0.000000000000000,  0.906469390000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 39    coordinates: [  0.489572170000000,  0.510427830000000,  0.699517350000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 40    coordinates: [  0.313439250000000,  0.156719620000000,  0.967072290000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 41    coordinates: [  0.497727340000000,  0.502272660000000,  0.903937850000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 42    coordinates: [  0.331095180000000,  0.165547600000000,  0.762320500000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 43    coordinates: [  0.497727340000000,  0.995454680000000,  0.903937850000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 44    coordinates: [  0.843280380000000,  0.686560750000000,  0.967072290000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 45    coordinates: [  0.489572170000000,  0.979144330000000,  0.699517350000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 46    coordinates: [  0.666666670000000,  0.333333330000000,  0.833317040000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 47    coordinates: [  0.834452400000000,  0.668904820000000,  0.762320500000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 48    coordinates: [  0.834452400000000,  0.165547600000000,  0.762320500000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 49    coordinates: [  0.004545320000000,  0.502272660000000,  0.903937850000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 50    coordinates: [  0.020855670000000,  0.510427830000000,  0.699517350000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 51    coordinates: [  0.843280380000000,  0.156719620000000,  0.967072290000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 52    coordinates: [  0.333333330000000,  0.666666670000000,  0.963654900000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 53    coordinates: [  0.333333330000000,  0.666666670000000,  0.760342150000000 ]    mass: 15.999400    reduced_to: 53  - symbol: O  # 54    coordinates: [  0.666666670000000,  0.333333330000000,  0.036374230000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 55    coordinates: [  0.666666670000000,  0.333333330000000,  0.239802720000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 56    coordinates: [  0.156238840000000,  0.843761160000000,  0.032850680000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 57    coordinates: [  0.980105920000000,  0.490052960000000,  0.300405630000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 58    coordinates: [  0.164394000000000,  0.835606000000000,  0.237271190000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 59    coordinates: [  0.997761850000000,  0.498880930000000,  0.095653830000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 60    coordinates: [  0.164394000000000,  0.328788020000000,  0.237271190000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 61    coordinates: [  0.509947040000000,  0.019894080000000,  0.300405630000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 62    coordinates: [  0.156238840000000,  0.312477670000000,  0.032850680000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 63    coordinates: [  0.333333330000000,  0.666666670000000,  0.166650380000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 64    coordinates: [  0.501119070000000,  0.002238150000000,  0.095653830000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 65    coordinates: [  0.501119070000000,  0.498880930000000,  0.095653830000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 66    coordinates: [  0.671211980000000,  0.835606000000000,  0.237271190000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 67    coordinates: [  0.687522330000000,  0.843761160000000,  0.032850680000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 68    coordinates: [  0.509947040000000,  0.490052960000000,  0.300405630000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 69    coordinates: [  0.000000000000000,  0.000000000000000,  0.296988230000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 70    coordinates: [  0.000000000000000,  0.000000000000000,  0.093675490000000 ]    mass: 15.999400    reduced_to: 53  - symbol: O  # 71    coordinates: [  0.333333330000000,  0.666666670000000,  0.369707570000000 ]    mass: 15.999400    reduced_to: 37  - symbol: O  # 72    coordinates: [  0.333333330000000,  0.666666670000000,  0.573136060000000 ]    mass: 15.999400    reduced_to: 38  - symbol: O  # 73    coordinates: [  0.822905510000000,  0.177094490000000,  0.366184010000000 ]    mass: 15.999400    reduced_to: 39  - symbol: O  # 74    coordinates: [  0.646772580000000,  0.823386290000000,  0.633738960000000 ]    mass: 15.999400    reduced_to: 40  - symbol: O  # 75    coordinates: [  0.831060670000000,  0.168939330000000,  0.570604520000000 ]    mass: 15.999400    reduced_to: 41  - symbol: O  # 76    coordinates: [  0.664428520000000,  0.832214260000000,  0.428987160000000 ]    mass: 15.999400    reduced_to: 42  - symbol: O  # 77    coordinates: [  0.831060670000000,  0.662121350000000,  0.570604520000000 ]    mass: 15.999400    reduced_to: 43  - symbol: O  # 78    coordinates: [  0.176613710000000,  0.353227420000000,  0.633738960000000 ]    mass: 15.999400    reduced_to: 44  - symbol: O  # 79    coordinates: [  0.822905510000000,  0.645811000000000,  0.366184010000000 ]    mass: 15.999400    reduced_to: 45  - symbol: O  # 80    coordinates: [  0.000000000000000,  0.000000000000000,  0.499983710000000 ]    mass: 15.999400    reduced_to: 46  - symbol: O  # 81    coordinates: [  0.167785740000000,  0.335571480000000,  0.428987160000000 ]    mass: 15.999400    reduced_to: 47  - symbol: O  # 82    coordinates: [  0.167785740000000,  0.832214260000000,  0.428987160000000 ]    mass: 15.999400    reduced_to: 48  - symbol: O  # 83    coordinates: [  0.337878650000000,  0.168939330000000,  0.570604520000000 ]    mass: 15.999400    reduced_to: 49  - symbol: O  # 84    coordinates: [  0.354189000000000,  0.177094490000000,  0.366184010000000 ]    mass: 15.999400    reduced_to: 50  - symbol: O  # 85    coordinates: [  0.176613710000000,  0.823386290000000,  0.633738960000000 ]    mass: 15.999400    reduced_to: 51  - symbol: O  # 86    coordinates: [  0.666666670000000,  0.333333330000000,  0.630321560000000 ]    mass: 15.999400    reduced_to: 52  - symbol: O  # 87    coordinates: [  0.666666670000000,  0.333333330000000,  0.427008820000000 ]    mass: 15.999400    reduced_to: 53displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0079563800000000,  0.0001084200000000, -0.0001310600000000 ]  - [  -0.0000011400000000,  0.0000006400000000, -0.0000000400000000 ]  - [  -0.0000011000000000,  0.0000006800000000, -0.0000014100000000 ]  - [   0.0001525100000000,  0.0000933700000000, -0.0018239300000000 ]  - [   0.0000793800000000,  0.0000003400000000, -0.0000387800000000 ]  - [   0.0000075200000000,  0.0000171500000000, -0.0000065400000000 ]  - [   0.0001962100000000, -0.0000993100000000,  0.0017899200000000 ]  - [   0.0076579000000000, -0.0000538800000000,  0.0000901500000000 ]  - [   0.0004283000000000, -0.0000006700000000, -0.0000150900000000 ]  - [   0.0043717800000000, -0.0000400700000000,  0.0000413200000000 ]  - [  -0.0001157700000000, -0.0000006800000000, -0.0000258700000000 ]  - [   0.0002760400000000, -0.0018652600000000, -0.0033674500000000 ]  - [  -0.0029657200000000,  0.0000040200000000, -0.0000087700000000 ]  - [   0.0002603300000000,  0.0018689700000000,  0.0033730800000000 ]  - [  -0.0000086100000000,  0.0000130900000000, -0.0000047500000000 ]  - [  -0.0002528400000000, -0.0000001300000000, -0.0000353400000000 ]  - [  -0.0000308400000000,  0.0000086100000000, -0.0000218700000000 ]  - [   0.0000057100000000, -0.0000208800000000, -0.0000390800000000 ]  - [  -0.0000008500000000,  0.0000003200000000,  0.0000126900000000 ]  - [   0.0000001300000000, -0.0000003200000000, -0.0000420900000000 ]  - [   0.0000062200000000, -0.0000002300000000,  0.0000197200000000 ]  - [   0.0000646400000000, -0.0000002500000000, -0.0000071300000000 ]  - [  -0.0000039400000000,  0.0000025500000000,  0.0000091500000000 ]  - [  -0.0000006300000000, -0.0000052100000000,  0.0000091100000000 ]  - [   0.0000046100000000,  0.0000036600000000,  0.0000092200000000 ]  - [  -0.0000074700000000, -0.0000030400000000, -0.0000181100000000 ]  - [   0.0000004500000000, -0.0000000800000000, -0.0000256700000000 ]  - [  -0.0000009700000000,  0.0000078100000000, -0.0000169400000000 ]  - [   0.0000061100000000, -0.0000033900000000, -0.0000164000000000 ]  - [  -0.0000016300000000,  0.0000002800000000,  0.0000493800000000 ]  - [  -0.0000008400000000, -0.0000012100000000,  0.0000072700000000 ]  - [  -0.0000011100000000, -0.0000008600000000,  0.0000362400000000 ]  - [   0.0000010900000000, -0.0000000700000000, -0.0000516600000000 ]  - [  -0.0000044200000000,  0.0000065900000000,  0.0000107600000000 ]  - [   0.0000060800000000, -0.0000029200000000,  0.0000069000000000 ]  - [   0.0000014800000000, -0.0000021200000000,  0.0000031400000000 ]  - [   0.0000043000000000, -0.0000029200000000, -0.0000113800000000 ]  - [  -0.0010246400000000, -0.0000089000000000,  0.0000202300000000 ]  - [  -0.0000263200000000,  0.0000016900000000, -0.0001904400000000 ]  - [   0.0000322300000000,  0.0002393400000000, -0.0004398600000000 ]  - [   0.0022392800000000, -0.0005032300000000,  0.0011881600000000 ]  - [  -0.0002528200000000,  0.0011795100000000, -0.0002443800000000 ]  - [   0.0013714600000000,  0.0000099000000000, -0.0000019600000000 ]  - [  -0.0003831100000000, -0.0000023600000000,  0.0000171700000000 ]  - [  -0.0000284100000000, -0.0000085300000000,  0.0000147000000000 ]  - [  -0.0046663200000000,  0.0000175600000000, -0.0000394700000000 ]  - [  -0.0022955100000000, -0.0000226700000000,  0.0000029200000000 ]  - [  -0.0002856000000000, -0.0011601000000000,  0.0002166300000000 ]  - [   0.0021645100000000,  0.0004561800000000, -0.0010974300000000 ]  - [  -0.0000172300000000,  0.0000091700000000,  0.0002255600000000 ]  - [   0.0000267900000000, -0.0002370100000000,  0.0004720400000000 ]  - [   0.0006313300000000, -0.0000005200000000,  0.0000066900000000 ]  - [   0.0003146100000000,  0.0000008500000000, -0.0000064800000000 ]  - [  -0.0000269800000000, -0.0000009400000000,  0.0000242300000000 ]  - [  -0.0000021100000000, -0.0000018900000000,  0.0000258400000000 ]  - [  -0.0000007800000000,  0.0000210400000000, -0.0000542400000000 ]  - [   0.0000008000000000, -0.0000018000000000,  0.0000085100000000 ]  - [   0.0000234400000000, -0.0000137000000000,  0.0000002100000000 ]  - [   0.0000042600000000,  0.0000038000000000, -0.0000106700000000 ]  - [  -0.0000008800000000,  0.0000248200000000,  0.0000006700000000 ]  - [   0.0000018600000000, -0.0000010900000000,  0.0000104500000000 ]  - [   0.0000335800000000, -0.0000130900000000,  0.0000165000000000 ]  - [  -0.0000004800000000, -0.0000001000000000, -0.0000810900000000 ]  - [  -0.0000041100000000, -0.0000086800000000, -0.0000020600000000 ]  - [  -0.0000084700000000,  0.0000015500000000,  0.0000050100000000 ]  - [  -0.0000190400000000, -0.0000101200000000,  0.0000027400000000 ]  - [   0.0000199700000000, -0.0000067100000000,  0.0000891500000000 ]  - [  -0.0000030200000000,  0.0000016200000000,  0.0000093600000000 ]  - [   0.0000005400000000,  0.0000010600000000,  0.0000252600000000 ]  - [   0.0000111700000000,  0.0000020100000000, -0.0000419800000000 ]  - [   0.0000000900000000, -0.0000010500000000, -0.0000036900000000 ]  - [  -0.0000017200000000, -0.0000026000000000, -0.0000090200000000 ]  - [  -0.0000003700000000, -0.0000000600000000,  0.0000181800000000 ]  - [   0.0000008400000000,  0.0000089100000000,  0.0000070900000000 ]  - [   0.0000186300000000, -0.0000106900000000, -0.0000020500000000 ]  - [   0.0000173800000000,  0.0000077200000000,  0.0000093000000000 ]  - [  -0.0000004300000000,  0.0000190900000000,  0.0000009200000000 ]  - [  -0.0000165400000000, -0.0000025900000000,  0.0000200500000000 ]  - [  -0.0000022000000000, -0.0000018100000000,  0.0000180600000000 ]  - [   0.0000004000000000, -0.0000003300000000, -0.0000681000000000 ]  - [   0.0000018100000000, -0.0000218300000000,  0.0000120800000000 ]  - [  -0.0000191700000000,  0.0000111500000000,  0.0000114300000000 ]  - [  -0.0000139500000000, -0.0000072600000000,  0.0000048300000000 ]  - [   0.0000013000000000,  0.0000030700000000,  0.0000192300000000 ]  - [  -0.0000070900000000, -0.0000065300000000,  0.0000308700000000 ]  - [   0.0000130100000000,  0.0000011200000000,  0.0000268800000000 ]  - [   0.0000015600000000,  0.0000020600000000, -0.0000267100000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0564989300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020068400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020060900000000 ]  - [  -0.0028057200000000, -0.0016198900000000,  0.0051625600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0031795600000000 ]  - [   0.0000000000000000,  0.0032397700000000,  0.0051625600000000 ]  - [   0.0028057200000000, -0.0016198900000000,  0.0051625600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0162284500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0031606000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0120255900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026318300000000 ]  - [  -0.0024311600000000,  0.0014036300000000,  0.0062351000000000 ]  - [   0.0000000000000000, -0.0028072700000000,  0.0062351000000000 ]  - [   0.0024311600000000,  0.0014036300000000,  0.0062351000000000 ]  - [   0.0001295700000000,  0.0000748100000000,  0.0026219600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0028915900000000 ]  - [   0.0000000000000000, -0.0001496200000000,  0.0026219600000000 ]  - [  -0.0001295700000000,  0.0000748100000000,  0.0026219600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0037715800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0028892500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038956200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0030199300000000 ]  - [  -0.0002276900000000,  0.0001314600000000,  0.0026578800000000 ]  - [   0.0000000000000000, -0.0002629100000000,  0.0026578800000000 ]  - [   0.0002276900000000,  0.0001314600000000,  0.0026578800000000 ]  - [   0.0001199500000000,  0.0000692500000000,  0.0026246900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029623600000000 ]  - [   0.0000000000000000, -0.0001385100000000,  0.0026246900000000 ]  - [  -0.0001199500000000,  0.0000692500000000,  0.0026246900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038085300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027136600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0039122400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0028962500000000 ]  - [  -0.0001936400000000,  0.0001118000000000,  0.0026661000000000 ]  - [   0.0000000000000000, -0.0002235900000000,  0.0026661000000000 ]  - [   0.0001936400000000,  0.0001118000000000,  0.0026661000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0014369900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001332500000000 ]  - [   0.0005236100000000, -0.0003023100000000, -0.0022526200000000 ]  - [   0.0001097800000000,  0.0000633800000000, -0.0018576800000000 ]  - [   0.0001977800000000, -0.0001141900000000,  0.0065509400000000 ]  - [   0.0008540200000000,  0.0004930700000000,  0.0007629500000000 ]  - [   0.0000000000000000,  0.0002283800000000,  0.0065509400000000 ]  - [   0.0000000000000000, -0.0001267600000000, -0.0018576800000000 ]  - [   0.0000000000000000,  0.0006046200000000, -0.0022526200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0211368500000000 ]  - [   0.0000000000000000, -0.0009861400000000,  0.0007629500000000 ]  - [  -0.0008540200000000,  0.0004930700000000,  0.0007629500000000 ]  - [  -0.0001977800000000, -0.0001141900000000,  0.0065509400000000 ]  - [  -0.0005236100000000, -0.0003023100000000, -0.0022526200000000 ]  - [  -0.0001097800000000,  0.0000633800000000, -0.0018576800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023233200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0149509400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022192000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015281200000000 ]  - [   0.0000775600000000, -0.0000447800000000, -0.0019237300000000 ]  - [  -0.0000616000000000, -0.0000355700000000, -0.0019049900000000 ]  - [   0.0003667100000000, -0.0002117200000000, -0.0019228500000000 ]  - [  -0.0004222800000000, -0.0002438000000000, -0.0018210700000000 ]  - [   0.0000000000000000,  0.0004234400000000, -0.0019228500000000 ]  - [   0.0000000000000000,  0.0000711400000000, -0.0019049900000000 ]  - [   0.0000000000000000,  0.0000895600000000, -0.0019237300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037522900000000 ]  - [   0.0000000000000000,  0.0004876000000000, -0.0018210700000000 ]  - [   0.0004222800000000, -0.0002438000000000, -0.0018210700000000 ]  - [  -0.0003667100000000, -0.0002117200000000, -0.0019228500000000 ]  - [  -0.0000775600000000, -0.0000447800000000, -0.0019237300000000 ]  - [   0.0000616000000000, -0.0000355700000000, -0.0019049900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022640900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0018814900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022721000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015484000000000 ]  - [   0.0000787500000000, -0.0000454700000000, -0.0019102900000000 ]  - [  -0.0000236100000000, -0.0000136300000000, -0.0018704100000000 ]  - [   0.0003685000000000, -0.0002127500000000, -0.0019285800000000 ]  - [  -0.0004133300000000, -0.0002386300000000, -0.0018089500000000 ]  - [   0.0000000000000000,  0.0004255100000000, -0.0019285800000000 ]  - [   0.0000000000000000,  0.0000272600000000, -0.0018704100000000 ]  - [   0.0000000000000000,  0.0000909300000000, -0.0019102900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037413900000000 ]  - [   0.0000000000000000,  0.0004772700000000, -0.0018089500000000 ]  - [   0.0004133300000000, -0.0002386300000000, -0.0018089500000000 ]  - [  -0.0003685000000000, -0.0002127500000000, -0.0019285800000000 ]  - [  -0.0000787500000000, -0.0000454700000000, -0.0019102900000000 ]  - [   0.0000236100000000, -0.0000136300000000, -0.0018704100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023611500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0018620000000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0565938000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020090900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020111700000000 ]  - [   0.0028170800000000,  0.0016264400000000, -0.0052478700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0032621300000000 ]  - [   0.0000000000000000, -0.0032528800000000, -0.0052478700000000 ]  - [  -0.0028170800000000,  0.0016264400000000, -0.0052478700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0162521400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0031943000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0122654500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0026842800000000 ]  - [   0.0023816000000000, -0.0013750200000000, -0.0061740000000000 ]  - [   0.0000000000000000,  0.0027500400000000, -0.0061740000000000 ]  - [  -0.0023816000000000, -0.0013750200000000, -0.0061740000000000 ]  - [  -0.0001441200000000, -0.0000832100000000, -0.0026691700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029691100000000 ]  - [   0.0000000000000000,  0.0001664200000000, -0.0026691700000000 ]  - [   0.0001441200000000, -0.0000832100000000, -0.0026691700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037504900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029754300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0038603800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0030343700000000 ]  - [   0.0002194500000000, -0.0001267000000000, -0.0026423300000000 ]  - [   0.0000000000000000,  0.0002534000000000, -0.0026423300000000 ]  - [  -0.0002194500000000, -0.0001267000000000, -0.0026423300000000 ]  - [  -0.0001332600000000, -0.0000769300000000, -0.0026620600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0030170800000000 ]  - [   0.0000000000000000,  0.0001538700000000, -0.0026620600000000 ]  - [   0.0001332600000000, -0.0000769300000000, -0.0026620600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037138900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027003500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0038442600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0030031200000000 ]  - [   0.0001884500000000, -0.0001088000000000, -0.0026550100000000 ]  - [   0.0000000000000000,  0.0002176100000000, -0.0026550100000000 ]  - [  -0.0001884500000000, -0.0001088000000000, -0.0026550100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014029800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001993500000000 ]  - [  -0.0005333200000000,  0.0003079100000000,  0.0022872700000000 ]  - [  -0.0000988600000000, -0.0000570800000000,  0.0019017300000000 ]  - [  -0.0000441900000000,  0.0000255100000000, -0.0062816700000000 ]  - [  -0.0008239300000000, -0.0004757000000000, -0.0008079500000000 ]  - [   0.0000000000000000, -0.0000510300000000, -0.0062816700000000 ]  - [   0.0000000000000000,  0.0001141500000000,  0.0019017300000000 ]  - [   0.0000000000000000, -0.0006158300000000,  0.0022872700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0212539400000000 ]  - [   0.0000000000000000,  0.0009514000000000, -0.0008079500000000 ]  - [   0.0008239300000000, -0.0004757000000000, -0.0008079500000000 ]  - [   0.0000441900000000,  0.0000255100000000, -0.0062816700000000 ]  - [   0.0005333200000000,  0.0003079100000000,  0.0022872700000000 ]  - [   0.0000988600000000, -0.0000570800000000,  0.0019017300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0023395800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0158979900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022647900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015749300000000 ]  - [  -0.0000941500000000,  0.0000543600000000,  0.0019564300000000 ]  - [   0.0000686400000000,  0.0000396300000000,  0.0019312000000000 ]  - [  -0.0003225200000000,  0.0001862100000000,  0.0019252000000000 ]  - [   0.0004375000000000,  0.0002525900000000,  0.0018198800000000 ]  - [   0.0000000000000000, -0.0003724200000000,  0.0019252000000000 ]  - [   0.0000000000000000, -0.0000792500000000,  0.0019312000000000 ]  - [   0.0000000000000000, -0.0001087200000000,  0.0019564300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035936500000000 ]  - [   0.0000000000000000, -0.0005051800000000,  0.0018198800000000 ]  - [  -0.0004375000000000,  0.0002525900000000,  0.0018198800000000 ]  - [   0.0003225200000000,  0.0001862100000000,  0.0019252000000000 ]  - [   0.0000941500000000,  0.0000543600000000,  0.0019564300000000 ]  - [  -0.0000686400000000,  0.0000396300000000,  0.0019312000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0023242600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018036700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022631700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015262600000000 ]  - [  -0.0000768600000000,  0.0000443700000000,  0.0019465000000000 ]  - [   0.0000331000000000,  0.0000191100000000,  0.0019161600000000 ]  - [  -0.0003347000000000,  0.0001932400000000,  0.0019318000000000 ]  - [   0.0004515800000000,  0.0002607200000000,  0.0018340100000000 ]  - [   0.0000000000000000, -0.0003864800000000,  0.0019318000000000 ]  - [   0.0000000000000000, -0.0000382200000000,  0.0019161600000000 ]  - [   0.0000000000000000, -0.0000887500000000,  0.0019465000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0036083700000000 ]  - [   0.0000000000000000, -0.0005214400000000,  0.0018340100000000 ]  - [  -0.0004515800000000,  0.0002607200000000,  0.0018340100000000 ]  - [   0.0003347000000000,  0.0001932400000000,  0.0019318000000000 ]  - [   0.0000768600000000,  0.0000443700000000,  0.0019465000000000 ]  - [  -0.0000331000000000,  0.0000191100000000,  0.0019161600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0024240300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018146700000000 ]- atom:    4  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0001751500000000,  0.0000971300000000, -0.0028109100000000 ]  - [  -0.0000014000000000,  0.0000005400000000,  0.0001265400000000 ]  - [  -0.0000010400000000,  0.0000185500000000,  0.0001347700000000 ]  - [  -0.2535449600000000, -0.0247165500000000,  0.0003166600000000 ]  - [   0.0030305700000000,  0.0152186100000000,  0.0177026300000000 ]  - [   0.0075786100000000,  0.0504612600000000,  0.0145592400000000 ]  - [   0.0956910200000000,  0.0003448300000000, -0.0008586700000000 ]  - [   0.0000078400000000,  0.0001160500000000,  0.0015730700000000 ]  - [   0.0000005100000000,  0.0000056300000000,  0.0001380100000000 ]  - [   0.0025490200000000, -0.0247173200000000,  0.0024114200000000 ]  - [   0.0003686200000000, -0.0204343800000000, -0.0021511100000000 ]  - [   0.0000423100000000, -0.0000558500000000,  0.0001274900000000 ]  - [  -0.0000027400000000,  0.0000798800000000,  0.0000831700000000 ]  - [  -0.0000417100000000, -0.0000533400000000,  0.0001277200000000 ]  - [   0.0000010300000000,  0.0000003500000000,  0.0001444100000000 ]  - [   0.0000001500000000, -0.0000047200000000,  0.0001535700000000 ]  - [  -0.0000007100000000, -0.0000006600000000,  0.0001439900000000 ]  - [  -0.0000023000000000,  0.0000004000000000,  0.0001444100000000 ]  - [  -0.0000005300000000,  0.0000001600000000,  0.0002503300000000 ]  - [  -0.0000000600000000, -0.0000002200000000,  0.0001426900000000 ]  - [   0.0000009700000000,  0.0000003300000000,  0.0002629200000000 ]  - [   0.0000002200000000,  0.0000009000000000,  0.0001825900000000 ]  - [  -0.0000183500000000,  0.0000107200000000,  0.0001768800000000 ]  - [  -0.0000009000000000, -0.0000212600000000,  0.0001764800000000 ]  - [   0.0000175100000000,  0.0000115600000000,  0.0001768600000000 ]  - [   0.0000011600000000,  0.0000008700000000,  0.0001481300000000 ]  - [   0.0000005800000000,  0.0000001600000000,  0.0001627000000000 ]  - [  -0.0000006900000000, -0.0000012600000000,  0.0001482400000000 ]  - [  -0.0000027200000000,  0.0000010900000000,  0.0001481700000000 ]  - [  -0.0000055400000000, -0.0002476100000000,  0.0002373300000000 ]  - [   0.0003655100000000, -0.0007850600000000, -0.0157100600000000 ]  - [   0.0000004300000000,  0.0000015700000000,  0.0002918500000000 ]  - [   0.0000007400000000,  0.0000003900000000,  0.0001334900000000 ]  - [   0.0022261200000000, -0.0001325800000000,  0.0001281300000000 ]  - [  -0.0000144800000000,  0.0014319900000000,  0.0014155400000000 ]  - [  -0.0022661700000000, -0.0001114200000000,  0.0001058300000000 ]  - [   0.0104215700000000, -0.0030763700000000,  0.0052162400000000 ]  - [  -0.0000016400000000, -0.0000309000000000, -0.0001768700000000 ]  - [   0.0167088900000000, -0.0026888800000000, -0.0011841400000000 ]  - [  -0.0000253800000000, -0.0000204900000000, -0.0001053600000000 ]  - [   0.0003427100000000, -0.0001843700000000, -0.0000907800000000 ]  - [  -0.0063765200000000,  0.0002309200000000, -0.0009991400000000 ]  - [  -0.0000035400000000,  0.0004637200000000, -0.0002219600000000 ]  - [   0.0000011200000000,  0.0000328900000000, -0.0000915600000000 ]  - [   0.0022800400000000,  0.0067223900000000, -0.0088258100000000 ]  - [   0.0000632800000000,  0.0031896400000000, -0.0042085700000000 ]  - [   0.0557825500000000, -0.0213401100000000,  0.0272228600000000 ]  - [   0.0150766600000000,  0.0004250900000000, -0.0027727000000000 ]  - [  -0.0003387200000000, -0.0001781500000000, -0.0000800200000000 ]  - [  -0.0079839000000000, -0.0022081100000000, -0.0014414400000000 ]  - [   0.0000217200000000, -0.0000170100000000, -0.0001033100000000 ]  - [   0.0000014500000000,  0.0000135800000000, -0.0001701300000000 ]  - [   0.0575817200000000,  0.0233330300000000, -0.0271180900000000 ]  - [  -0.0000006200000000, -0.0000013300000000, -0.0001200900000000 ]  - [  -0.0000021800000000, -0.0000018700000000, -0.0000735500000000 ]  - [  -0.0000027100000000,  0.0000020400000000, -0.0001031300000000 ]  - [  -0.0000027900000000, -0.0000038000000000, -0.0001118100000000 ]  - [   0.0000454900000000, -0.0000264500000000, -0.0001214700000000 ]  - [  -0.0000215300000000, -0.0000146100000000, -0.0001181600000000 ]  - [  -0.0000009200000000,  0.0000502500000000, -0.0001211400000000 ]  - [   0.0000018100000000,  0.0000030400000000, -0.0001099800000000 ]  - [  -0.0000021800000000, -0.0000048200000000, -0.0001059500000000 ]  - [   0.0000002500000000, -0.0000001000000000, -0.0003128200000000 ]  - [   0.0000017800000000,  0.0000225200000000, -0.0001165000000000 ]  - [   0.0000196800000000, -0.0000114300000000, -0.0001167500000000 ]  - [  -0.0000411900000000, -0.0000228600000000, -0.0001189400000000 ]  - [   0.0000038000000000,  0.0000051500000000, -0.0001022900000000 ]  - [   0.0000005100000000, -0.0000004000000000, -0.0001110300000000 ]  - [   0.0000004700000000,  0.0000010300000000, -0.0001186400000000 ]  - [   0.0000014500000000,  0.0000022500000000, -0.0001567900000000 ]  - [  -0.0000000300000000, -0.0000008800000000, -0.0001479400000000 ]  - [   0.0000060700000000, -0.0003093700000000,  0.0006988900000000 ]  - [   0.0000053700000000, -0.0000034600000000, -0.0001036600000000 ]  - [   0.0035194000000000, -0.0000655900000000, -0.0003487400000000 ]  - [   0.0004282700000000, -0.0000757900000000, -0.0002343900000000 ]  - [  -0.0000119600000000, -0.0000092300000000, -0.0001057100000000 ]  - [  -0.0000205100000000,  0.0004043700000000, -0.0008061200000000 ]  - [   0.0001746700000000, -0.0026669400000000,  0.0036887300000000 ]  - [  -0.0000022500000000,  0.0000049800000000, -0.0001037400000000 ]  - [   0.0000015600000000,  0.0000321900000000, -0.0003622000000000 ]  - [   0.0000017200000000,  0.0000127900000000, -0.0001051100000000 ]  - [   0.0000101500000000, -0.0000059000000000, -0.0001035500000000 ]  - [  -0.0003984600000000, -0.0000598300000000, -0.0002116200000000 ]  - [  -0.0000045000000000, -0.0000003100000000, -0.0001024900000000 ]  - [  -0.0038013200000000, -0.0002936100000000, -0.0005643000000000 ]  - [   0.0003834200000000,  0.0018479400000000, -0.0043012900000000 ]  - [   0.0000015200000000,  0.0000023800000000, -0.0001414600000000 ]- atom:    4  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0001732200000000, -0.0000966500000000,  0.0028122200000000 ]  - [  -0.0000009000000000,  0.0000007200000000, -0.0001274800000000 ]  - [  -0.0000010800000000, -0.0000172800000000, -0.0001389600000000 ]  - [   0.2534928400000000,  0.0284497100000000, -0.0027594500000000 ]  - [  -0.0029426500000000, -0.0152677300000000, -0.0178723200000000 ]  - [  -0.0076499400000000, -0.0503633700000000, -0.0145782400000000 ]  - [  -0.0955707600000000, -0.0004550900000000,  0.0008555900000000 ]  - [  -0.0000111900000000, -0.0001151100000000, -0.0014767400000000 ]  - [   0.0000010500000000, -0.0000065200000000, -0.0001649300000000 ]  - [  -0.0023719000000000,  0.0247540700000000, -0.0022188200000000 ]  - [  -0.0004694200000000,  0.0204399400000000,  0.0020818400000000 ]  - [  -0.0000509600000000,  0.0000611100000000, -0.0001335900000000 ]  - [   0.0000041100000000, -0.0000907200000000, -0.0000899700000000 ]  - [   0.0000515600000000,  0.0000577200000000, -0.0001346800000000 ]  - [  -0.0000162700000000, -0.0000081500000000, -0.0001907000000000 ]  - [   0.0000006700000000,  0.0000041700000000, -0.0002268700000000 ]  - [  -0.0000001900000000,  0.0000176600000000, -0.0001902000000000 ]  - [   0.0000152600000000, -0.0000080100000000, -0.0001905900000000 ]  - [  -0.0000009200000000,  0.0000004500000000, -0.0002256700000000 ]  - [   0.0000009000000000, -0.0000004400000000, -0.0002281500000000 ]  - [   0.0000004100000000, -0.0000008200000000, -0.0002277700000000 ]  - [   0.0000005300000000, -0.0000012000000000, -0.0001982100000000 ]  - [   0.0000092800000000, -0.0000053700000000, -0.0001589400000000 ]  - [  -0.0000011500000000,  0.0000108900000000, -0.0001586900000000 ]  - [  -0.0000095800000000, -0.0000045400000000, -0.0001589600000000 ]  - [  -0.0000159700000000, -0.0000075900000000, -0.0001850000000000 ]  - [  -0.0000005600000000, -0.0000002900000000, -0.0002155200000000 ]  - [  -0.0000002700000000,  0.0000169100000000, -0.0001845900000000 ]  - [   0.0000148500000000, -0.0000073900000000, -0.0001850800000000 ]  - [   0.0000030700000000,  0.0002487500000000, -0.0001396400000000 ]  - [  -0.0003362400000000,  0.0007966400000000,  0.0157118500000000 ]  - [   0.0000006500000000, -0.0000031300000000, -0.0002235300000000 ]  - [   0.0000004300000000, -0.0000006600000000, -0.0002386000000000 ]  - [  -0.0022349700000000,  0.0001356500000000, -0.0001121800000000 ]  - [   0.0000133900000000, -0.0014370800000000, -0.0014040700000000 ]  - [   0.0022722500000000,  0.0001149000000000, -0.0000923700000000 ]  - [  -0.0094066500000000,  0.0035619700000000, -0.0059765100000000 ]  - [  -0.0000020100000000,  0.0000269700000000,  0.0002384100000000 ]  - [  -0.0167366700000000,  0.0027517200000000,  0.0012957100000000 ]  - [   0.0000331700000000,  0.0000210900000000,  0.0001377200000000 ]  - [  -0.0003148100000000,  0.0001680400000000,  0.0001010500000000 ]  - [   0.0064034200000000, -0.0003107100000000,  0.0009442500000000 ]  - [   0.0000003300000000, -0.0004338600000000,  0.0002321400000000 ]  - [   0.0000023200000000, -0.0000424000000000,  0.0001277600000000 ]  - [  -0.0030557900000000, -0.0064779500000000,  0.0083564200000000 ]  - [  -0.0000929400000000, -0.0031894900000000,  0.0041133500000000 ]  - [  -0.0530490900000000,  0.0194352400000000, -0.0252977900000000 ]  - [  -0.0151140900000000, -0.0009541200000000,  0.0024457900000000 ]  - [   0.0003164300000000,  0.0001691800000000,  0.0000938600000000 ]  - [   0.0080051500000000,  0.0022767800000000,  0.0014900300000000 ]  - [  -0.0000364600000000,  0.0000257800000000,  0.0001389600000000 ]  - [   0.0000001900000000, -0.0000120000000000,  0.0001847400000000 ]  - [  -0.0606890600000000, -0.0254016400000000,  0.0290219500000000 ]  - [  -0.0000003000000000, -0.0000004600000000,  0.0001706600000000 ]  - [  -0.0000018700000000, -0.0000019100000000,  0.0001244400000000 ]  - [  -0.0000161800000000,  0.0000088500000000,  0.0001386500000000 ]  - [   0.0000053200000000,  0.0000006700000000,  0.0001301100000000 ]  - [   0.0000018000000000, -0.0000010800000000,  0.0001218200000000 ]  - [   0.0000333900000000,  0.0000171500000000,  0.0001131100000000 ]  - [  -0.0000006400000000, -0.0000004000000000,  0.0001224200000000 ]  - [   0.0000021000000000, -0.0000060400000000,  0.0001320500000000 ]  - [  -0.0000019300000000, -0.0000206800000000,  0.0001399100000000 ]  - [   0.0000005000000000, -0.0000001500000000,  0.0001527000000000 ]  - [   0.0000021100000000, -0.0000406800000000,  0.0001144300000000 ]  - [  -0.0000346500000000,  0.0000203600000000,  0.0001144400000000 ]  - [   0.0000031400000000,  0.0000025400000000,  0.0001243000000000 ]  - [   0.0000178500000000,  0.0000120300000000,  0.0001391900000000 ]  - [  -0.0000070100000000,  0.0000040600000000,  0.0001308800000000 ]  - [   0.0000007700000000,  0.0000010700000000,  0.0001708000000000 ]  - [   0.0000017300000000,  0.0000017800000000,  0.0000759700000000 ]  - [   0.0000002300000000, -0.0000012500000000,  0.0001413900000000 ]  - [  -0.0000053500000000,  0.0003044100000000, -0.0007181800000000 ]  - [  -0.0000049600000000,  0.0000028500000000,  0.0001410500000000 ]  - [  -0.0035183400000000,  0.0000811700000000,  0.0003925800000000 ]  - [  -0.0003913500000000,  0.0000533100000000,  0.0002327500000000 ]  - [   0.0000477100000000,  0.0000251500000000,  0.0001265300000000 ]  - [   0.0000174500000000, -0.0003664900000000,  0.0008085000000000 ]  - [  -0.0001931400000000,  0.0026603500000000, -0.0036534300000000 ]  - [  -0.0000019500000000, -0.0000075800000000,  0.0001408600000000 ]  - [  -0.0000008700000000, -0.0000328600000000,  0.0002281900000000 ]  - [   0.0000020600000000, -0.0000575200000000,  0.0001310900000000 ]  - [  -0.0000490500000000,  0.0000285900000000,  0.0001285500000000 ]  - [   0.0003707200000000,  0.0000460600000000,  0.0002177900000000 ]  - [   0.0000063900000000,  0.0000059800000000,  0.0001422200000000 ]  - [   0.0037922400000000,  0.0002821400000000,  0.0005961100000000 ]  - [  -0.0003663000000000, -0.0018499600000000,  0.0043577200000000 ]  - [   0.0000018000000000,  0.0000017800000000,  0.0000915900000000 ]- atom:    4  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0018270600000000, -0.0010548600000000,  0.0052293000000000 ]  - [  -0.0000005500000000, -0.0000003100000000,  0.0026463500000000 ]  - [   0.0000165900000000,  0.0000095800000000,  0.0026460500000000 ]  - [   0.0014979600000000,  0.0008648500000000, -0.1764232600000000 ]  - [   0.0191683800000000,  0.0110668700000000,  0.0130163300000000 ]  - [   0.0154105300000000, -0.0079131100000000, -0.0624834800000000 ]  - [   0.0008523100000000,  0.0173024600000000, -0.0624834800000000 ]  - [  -0.0000141300000000, -0.0000081600000000,  0.0045963300000000 ]  - [   0.0000033700000000,  0.0000019400000000,  0.0038499600000000 ]  - [  -0.0083004900000000, -0.0047922900000000, -0.0001149800000000 ]  - [  -0.0119279400000000, -0.0068866000000000, -0.0087771300000000 ]  - [  -0.0002687500000000,  0.0001447100000000,  0.0034951100000000 ]  - [  -0.0000090500000000, -0.0003051000000000,  0.0034951100000000 ]  - [   0.0002671000000000,  0.0001542100000000,  0.0035521200000000 ]  - [   0.0001593000000000,  0.0000919700000000,  0.0034669000000000 ]  - [  -0.0000021700000000, -0.0000012500000000,  0.0039117000000000 ]  - [  -0.0000006000000000, -0.0001843300000000,  0.0034661800000000 ]  - [  -0.0001599400000000,  0.0000916500000000,  0.0034661800000000 ]  - [  -0.0000005400000000, -0.0000003100000000,  0.0049699000000000 ]  - [  -0.0000001700000000, -0.0000001000000000,  0.0038208900000000 ]  - [   0.0000000500000000,  0.0000000300000000,  0.0051375300000000 ]  - [   0.0000004500000000,  0.0000002600000000,  0.0038755200000000 ]  - [  -0.0002993900000000,  0.0001719700000000,  0.0035011700000000 ]  - [  -0.0000007600000000, -0.0003452700000000,  0.0035011700000000 ]  - [   0.0002991700000000,  0.0001727200000000,  0.0035001600000000 ]  - [   0.0001605200000000,  0.0000926800000000,  0.0034711300000000 ]  - [  -0.0000000600000000, -0.0000000300000000,  0.0039148100000000 ]  - [  -0.0000004600000000, -0.0001858800000000,  0.0034706100000000 ]  - [  -0.0001612000000000,  0.0000925500000000,  0.0034706100000000 ]  - [  -0.0002296200000000, -0.0001325700000000,  0.0050289200000000 ]  - [  -0.0038898600000000, -0.0022458100000000,  0.0100752900000000 ]  - [   0.0000018900000000,  0.0000010900000000,  0.0051501900000000 ]  - [   0.0000001000000000,  0.0000000600000000,  0.0038370500000000 ]  - [  -0.0002436000000000,  0.0015884500000000,  0.0039632500000000 ]  - [   0.0012538300000000, -0.0010051900000000,  0.0039632500000000 ]  - [   0.0002311600000000,  0.0001334600000000,  0.0025243800000000 ]  - [  -0.0022002900000000, -0.0012703400000000,  0.0389318800000000 ]  - [  -0.0000411300000000, -0.0000237500000000, -0.0020652000000000 ]  - [  -0.0016908600000000, -0.0049374200000000,  0.0255762900000000 ]  - [  -0.0000909300000000, -0.0000525000000000, -0.0025292800000000 ]  - [   0.0004109900000000, -0.0001905400000000, -0.0024901000000000 ]  - [   0.0045137400000000,  0.0026060100000000,  0.0228530700000000 ]  - [   0.0000404900000000,  0.0004512000000000, -0.0024901000000000 ]  - [   0.0000011600000000,  0.0001007500000000, -0.0025162200000000 ]  - [  -0.0051213700000000,  0.0010043800000000,  0.0255762900000000 ]  - [   0.0011091100000000,  0.0006403400000000, -0.0027231900000000 ]  - [   0.0272833100000000, -0.0221493000000000,  0.0492833400000000 ]  - [  -0.0055402000000000,  0.0347026900000000,  0.0492833400000000 ]  - [  -0.0003396700000000, -0.0001961100000000, -0.0024403300000000 ]  - [  -0.0002432400000000, -0.0001404400000000,  0.0250175200000000 ]  - [   0.0000878300000000, -0.0000493700000000, -0.0025162200000000 ]  - [   0.0000054100000000,  0.0000031200000000, -0.0029918500000000 ]  - [  -0.0288281200000000, -0.0166439200000000,  0.0514259300000000 ]  - [  -0.0000013100000000, -0.0000007600000000, -0.0029687400000000 ]  - [  -0.0000023000000000, -0.0000013300000000, -0.0020178400000000 ]  - [   0.0000900800000000, -0.0000523600000000, -0.0025260300000000 ]  - [  -0.0000851700000000, -0.0000491800000000, -0.0025193400000000 ]  - [   0.0004766900000000, -0.0002758000000000, -0.0025346300000000 ]  - [  -0.0005660700000000, -0.0003268200000000, -0.0024066100000000 ]  - [  -0.0000005100000000,  0.0005507300000000, -0.0025346300000000 ]  - [   0.0000010400000000,  0.0000962700000000, -0.0025183100000000 ]  - [  -0.0000003000000000,  0.0001042000000000, -0.0025260300000000 ]  - [   0.0000001900000000,  0.0000001100000000, -0.0049246900000000 ]  - [   0.0000009800000000,  0.0006506000000000, -0.0024049900000000 ]  - [   0.0005639300000000, -0.0003244500000000, -0.0024049900000000 ]  - [  -0.0004729400000000, -0.0002730500000000, -0.0025322900000000 ]  - [  -0.0000884200000000, -0.0000510500000000, -0.0025234300000000 ]  - [   0.0000838900000000, -0.0000472400000000, -0.0025183100000000 ]  - [   0.0000008200000000,  0.0000004700000000, -0.0029983600000000 ]  - [   0.0000021900000000,  0.0000012700000000, -0.0024695400000000 ]  - [  -0.0000001900000000, -0.0000001100000000, -0.0029949400000000 ]  - [  -0.0003824300000000, -0.0002207900000000, -0.0022263600000000 ]  - [   0.0001006900000000, -0.0000595800000000, -0.0025252100000000 ]  - [  -0.0005196900000000, -0.0003000400000000, -0.0046764400000000 ]  - [   0.0004949100000000, -0.0000554300000000, -0.0026726600000000 ]  - [  -0.0005528700000000, -0.0003192000000000, -0.0023912300000000 ]  - [   0.0001994500000000,  0.0004563200000000, -0.0026726600000000 ]  - [  -0.0018288700000000,  0.0006424400000000, -0.0010974800000000 ]  - [  -0.0000012500000000,  0.0001169900000000, -0.0025252100000000 ]  - [   0.0000280500000000,  0.0000161900000000, -0.0048986700000000 ]  - [   0.0000009900000000,  0.0006363000000000, -0.0023908800000000 ]  - [   0.0005515400000000, -0.0003172900000000, -0.0023908800000000 ]  - [  -0.0004113200000000, -0.0002374800000000, -0.0020845500000000 ]  - [  -0.0000997900000000, -0.0000576100000000, -0.0025240300000000 ]  - [  -0.0003580600000000, -0.0019050700000000, -0.0010974800000000 ]  - [   0.0014310300000000,  0.0008262100000000, -0.0019663100000000 ]  - [   0.0000024400000000,  0.0000014100000000, -0.0024525200000000 ]- atom:    4  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0017871800000000,  0.0010318300000000, -0.0051825800000000 ]  - [  -0.0000006000000000, -0.0000003500000000, -0.0026442900000000 ]  - [  -0.0000178600000000, -0.0000103100000000, -0.0026463600000000 ]  - [  -0.0015706300000000, -0.0009068000000000,  0.1778007400000000 ]  - [  -0.0194114100000000, -0.0112071800000000, -0.0132818700000000 ]  - [  -0.0154415400000000,  0.0079194000000000,  0.0624844800000000 ]  - [  -0.0008623700000000, -0.0173324700000000,  0.0624844800000000 ]  - [   0.0000114700000000,  0.0000066200000000, -0.0045015100000000 ]  - [  -0.0000038600000000, -0.0000022300000000, -0.0038716300000000 ]  - [   0.0083524100000000,  0.0048222700000000,  0.0001081500000000 ]  - [   0.0118911100000000,  0.0068653400000000,  0.0087953000000000 ]  - [   0.0002603300000000, -0.0001391000000000, -0.0034972600000000 ]  - [   0.0000097000000000,  0.0002950000000000, -0.0034972600000000 ]  - [  -0.0002580500000000, -0.0001489900000000, -0.0035534900000000 ]  - [  -0.0001738500000000, -0.0001003700000000, -0.0035067500000000 ]  - [   0.0000029300000000,  0.0000016900000000, -0.0039793000000000 ]  - [  -0.0000001200000000,  0.0002001300000000, -0.0035060800000000 ]  - [   0.0001732600000000, -0.0001001700000000, -0.0035060800000000 ]  - [  -0.0000003000000000, -0.0000001700000000, -0.0049387000000000 ]  - [   0.0000002500000000,  0.0000001400000000, -0.0038998300000000 ]  - [   0.0000008700000000,  0.0000005000000000, -0.0050926900000000 ]  - [  -0.0000003000000000, -0.0000001700000000, -0.0038846700000000 ]  - [   0.0002896300000000, -0.0001675500000000, -0.0034788800000000 ]  - [  -0.0000002900000000,  0.0003346000000000, -0.0034788800000000 ]  - [  -0.0002899300000000, -0.0001673900000000, -0.0034777400000000 ]  - [  -0.0001743800000000, -0.0001006800000000, -0.0035020500000000 ]  - [   0.0000001100000000,  0.0000000700000000, -0.0039617400000000 ]  - [   0.0000003000000000,  0.0002002100000000, -0.0035012900000000 ]  - [   0.0001735400000000, -0.0000998500000000, -0.0035012900000000 ]  - [   0.0002312900000000,  0.0001335300000000, -0.0049256800000000 ]  - [   0.0040131600000000,  0.0023170000000000, -0.0101056200000000 ]  - [  -0.0000019500000000, -0.0000011300000000, -0.0050728500000000 ]  - [   0.0000006900000000,  0.0000004000000000, -0.0039368700000000 ]  - [   0.0002371000000000, -0.0016110300000000, -0.0039502000000000 ]  - [  -0.0012766500000000,  0.0010108500000000, -0.0039502000000000 ]  - [  -0.0002251900000000, -0.0001300100000000, -0.0024918100000000 ]  - [   0.0029045600000000,  0.0016769500000000, -0.0396845200000000 ]  - [   0.0000364200000000,  0.0000210300000000,  0.0021234300000000 ]  - [   0.0016580800000000,  0.0043413400000000, -0.0262007500000000 ]  - [   0.0000978400000000,  0.0000564900000000,  0.0025596200000000 ]  - [  -0.0003850000000000,  0.0001741700000000,  0.0024980000000000 ]  - [  -0.0044894300000000, -0.0025919800000000, -0.0228699000000000 ]  - [  -0.0000416600000000, -0.0004205000000000,  0.0024980000000000 ]  - [   0.0000007800000000, -0.0001137900000000,  0.0025490200000000 ]  - [   0.0045887500000000, -0.0007347300000000, -0.0262007500000000 ]  - [  -0.0011168300000000, -0.0006448000000000,  0.0026624500000000 ]  - [  -0.0263024000000000,  0.0214840500000000, -0.0489664100000000 ]  - [   0.0054545300000000, -0.0335205700000000, -0.0489664100000000 ]  - [   0.0003203900000000,  0.0001849800000000,  0.0024513500000000 ]  - [   0.0002682400000000,  0.0001548700000000, -0.0249986900000000 ]  - [  -0.0000981600000000,  0.0000575700000000,  0.0025490200000000 ]  - [  -0.0000031100000000, -0.0000017900000000,  0.0030041000000000 ]  - [   0.0280135600000000,  0.0161736400000000, -0.0513191300000000 ]  - [  -0.0000003900000000, -0.0000002200000000,  0.0030119700000000 ]  - [  -0.0000023400000000, -0.0000013500000000,  0.0020647100000000 ]  - [  -0.0001101600000000,  0.0000619400000000,  0.0025552500000000 ]  - [   0.0000870700000000,  0.0000502700000000,  0.0025357300000000 ]  - [  -0.0004307600000000,  0.0002481400000000,  0.0025321100000000 ]  - [   0.0005756000000000,  0.0003323200000000,  0.0023973500000000 ]  - [  -0.0000004800000000, -0.0004971200000000,  0.0025321100000000 ]  - [   0.0000010300000000, -0.0001027100000000,  0.0025369600000000 ]  - [  -0.0000014400000000, -0.0001263700000000,  0.0025552500000000 ]  - [   0.0000001800000000,  0.0000001000000000,  0.0047569300000000 ]  - [   0.0000010700000000, -0.0006676500000000,  0.0023986700000000 ]  - [  -0.0005776600000000,  0.0003347500000000,  0.0023986700000000 ]  - [   0.0004346500000000,  0.0002509400000000,  0.0025342000000000 ]  - [   0.0001110500000000,  0.0000641200000000,  0.0025558400000000 ]  - [  -0.0000884400000000,  0.0000522500000000,  0.0025369600000000 ]  - [   0.0000008500000000,  0.0000004900000000,  0.0030479900000000 ]  - [   0.0000020300000000,  0.0000011700000000,  0.0023847200000000 ]  - [  -0.0000005300000000, -0.0000003000000000,  0.0029826800000000 ]  - [   0.0003885200000000,  0.0002243100000000,  0.0022049300000000 ]  - [  -0.0001019100000000,  0.0000576000000000,  0.0025573200000000 ]  - [   0.0005331100000000,  0.0003077900000000,  0.0047465500000000 ]  - [  -0.0004594800000000,  0.0000279300000000,  0.0026704400000000 ]  - [   0.0005858600000000,  0.0003382500000000,  0.0024078900000000 ]  - [  -0.0002055500000000, -0.0004118800000000,  0.0026704400000000 ]  - [   0.0018223400000000, -0.0006413700000000,  0.0011070400000000 ]  - [  -0.0000010700000000, -0.0001170600000000,  0.0025573200000000 ]  - [  -0.0000281600000000, -0.0000162600000000,  0.0047563600000000 ]  - [   0.0000010200000000, -0.0006802500000000,  0.0024124300000000 ]  - [  -0.0005886000000000,  0.0003410100000000,  0.0024124300000000 ]  - [   0.0003826600000000,  0.0002209300000000,  0.0020824900000000 ]  - [   0.0001027800000000,  0.0000593400000000,  0.0025587800000000 ]  - [   0.0003557300000000,  0.0018988800000000,  0.0011070400000000 ]  - [  -0.0014230800000000, -0.0008216200000000,  0.0019938300000000 ]  - [   0.0000019000000000,  0.0000011000000000,  0.0024004900000000 ]- atom:    5  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000770500000000,  0.0000005000000000,  0.0000032500000000 ]  - [  -0.0000011200000000,  0.0000006300000000, -0.0000001100000000 ]  - [  -0.0002547900000000,  0.0000005600000000, -0.0000016200000000 ]  - [   0.0029357300000000,  0.0152577300000000,  0.0193276200000000 ]  - [  -0.1942704000000000,  0.0000884500000000, -0.0001255100000000 ]  - [  -0.0234145900000000,  0.0000424300000000, -0.0000240100000000 ]  - [   0.0030363800000000, -0.0152274400000000, -0.0192496100000000 ]  - [  -0.0000120500000000,  0.0000004300000000,  0.0000484700000000 ]  - [  -0.0000002400000000, -0.0000004400000000, -0.0000129100000000 ]  - [   0.0035051600000000,  0.0000006300000000,  0.0000584700000000 ]  - [   0.0361481300000000, -0.0001336400000000,  0.0000759900000000 ]  - [  -0.0000042900000000,  0.0000051400000000,  0.0000014600000000 ]  - [   0.0000050100000000, -0.0000054700000000, -0.0000031900000000 ]  - [   0.0000049700000000, -0.0000002600000000, -0.0000076100000000 ]  - [  -0.0000071400000000, -0.0000037500000000, -0.0000221900000000 ]  - [   0.0000013100000000, -0.0000002900000000, -0.0000359700000000 ]  - [  -0.0000001900000000,  0.0000085400000000, -0.0000220400000000 ]  - [   0.0000070900000000, -0.0000039900000000, -0.0000219500000000 ]  - [  -0.0000019600000000,  0.0000003100000000,  0.0000127200000000 ]  - [   0.0000003300000000, -0.0000003300000000, -0.0000421400000000 ]  - [  -0.0000006200000000, -0.0000002600000000,  0.0000192800000000 ]  - [   0.0000002700000000, -0.0000000800000000, -0.0000070300000000 ]  - [  -0.0000040500000000,  0.0000025200000000,  0.0000092200000000 ]  - [  -0.0000008000000000, -0.0000052500000000,  0.0000090800000000 ]  - [   0.0000045800000000,  0.0000037300000000,  0.0000090600000000 ]  - [  -0.0000078200000000, -0.0000079300000000, -0.0000198800000000 ]  - [   0.0000009400000000, -0.0000000900000000, -0.0000257300000000 ]  - [   0.0000071200000000,  0.0000079600000000, -0.0000170800000000 ]  - [   0.0000059700000000,  0.0000013400000000, -0.0000148900000000 ]  - [   0.0034729400000000,  0.0000006100000000,  0.0000588300000000 ]  - [   0.0361611600000000,  0.0001349300000000, -0.0000923600000000 ]  - [  -0.0000237700000000, -0.0000008300000000,  0.0000355200000000 ]  - [  -0.0000008000000000, -0.0000000700000000, -0.0000518400000000 ]  - [   0.0028789800000000, -0.0153632000000000, -0.0195744700000000 ]  - [  -0.0236531000000000, -0.0000393600000000,  0.0000175100000000 ]  - [   0.0029766700000000,  0.0153301400000000,  0.0194796200000000 ]  - [  -0.0041198600000000, -0.0000266000000000, -0.0000374000000000 ]  - [   0.0000035500000000, -0.0000019500000000,  0.0000310900000000 ]  - [   0.0337929900000000, -0.0109150100000000,  0.0122655200000000 ]  - [   0.0000037100000000,  0.0000000100000000,  0.0000167600000000 ]  - [   0.0000063700000000, -0.0000066500000000,  0.0000142500000000 ]  - [  -0.0003271100000000,  0.0025660300000000, -0.0042763400000000 ]  - [  -0.0000065100000000,  0.0000149900000000,  0.0000051200000000 ]  - [   0.0000019700000000, -0.0000046300000000,  0.0000177100000000 ]  - [   0.0149526200000000, -0.0001793700000000, -0.0000985800000000 ]  - [  -0.0003875000000000, -0.0000002400000000, -0.0000485100000000 ]  - [  -0.0047637100000000, -0.0000083900000000, -0.0000136300000000 ]  - [  -0.0003318600000000, -0.0025539400000000,  0.0042431000000000 ]  - [  -0.0000187300000000, -0.0000060600000000, -0.0000022300000000 ]  - [   0.0321769400000000,  0.0099147900000000, -0.0108274000000000 ]  - [  -0.0000073400000000,  0.0000044900000000,  0.0000163400000000 ]  - [  -0.0000009000000000,  0.0000008200000000,  0.0000066400000000 ]  - [   0.0067896200000000, -0.0000146300000000, -0.0000323100000000 ]  - [  -0.0000004500000000, -0.0000008900000000,  0.0000247900000000 ]  - [  -0.0000022000000000, -0.0000018800000000,  0.0000259000000000 ]  - [  -0.0000098700000000,  0.0000055300000000,  0.0000174200000000 ]  - [   0.0000008700000000, -0.0000017100000000,  0.0000083900000000 ]  - [   0.0000234800000000, -0.0000137400000000,  0.0000002800000000 ]  - [   0.0000059700000000,  0.0000014000000000, -0.0000040300000000 ]  - [  -0.0000009000000000,  0.0000248800000000,  0.0000007100000000 ]  - [   0.0000017900000000, -0.0000012300000000,  0.0000105200000000 ]  - [  -0.0000023100000000, -0.0000131100000000,  0.0000165400000000 ]  - [   0.0000002400000000, -0.0000001300000000, -0.0000809300000000 ]  - [   0.0000017900000000, -0.0000088200000000, -0.0000019800000000 ]  - [  -0.0000073200000000,  0.0000043000000000, -0.0000018400000000 ]  - [  -0.0000190800000000, -0.0000101300000000,  0.0000027200000000 ]  - [   0.0000110200000000,  0.0000088300000000,  0.0000177800000000 ]  - [  -0.0000031700000000,  0.0000016800000000,  0.0000095900000000 ]  - [   0.0000005300000000,  0.0000010600000000,  0.0000253400000000 ]  - [   0.0000014700000000,  0.0000019900000000, -0.0000417000000000 ]  - [  -0.0000023400000000, -0.0000010600000000, -0.0000036100000000 ]  - [   0.0070150400000000,  0.0000147500000000, -0.0000063600000000 ]  - [  -0.0000006700000000,  0.0000007900000000,  0.0000175500000000 ]  - [   0.0307468900000000,  0.0091034400000000, -0.0099045200000000 ]  - [  -0.0001375900000000, -0.0025214400000000,  0.0042298400000000 ]  - [   0.0000129400000000,  0.0000058000000000, -0.0000041000000000 ]  - [  -0.0044955100000000,  0.0000065800000000, -0.0000008200000000 ]  - [   0.0150222700000000,  0.0001513800000000,  0.0001264500000000 ]  - [  -0.0000010100000000, -0.0000018200000000,  0.0000181600000000 ]  - [  -0.0003543200000000, -0.0000002600000000, -0.0000668200000000 ]  - [   0.0000007300000000, -0.0000220500000000,  0.0000121900000000 ]  - [  -0.0000239000000000,  0.0000132800000000,  0.0000252700000000 ]  - [  -0.0001425100000000,  0.0025079600000000, -0.0042253100000000 ]  - [   0.0000009700000000,  0.0000022000000000,  0.0000200900000000 ]  - [   0.0291929100000000, -0.0081638900000000,  0.0086352700000000 ]  - [  -0.0041695000000000,  0.0000267400000000,  0.0000496500000000 ]  - [  -0.0000025800000000,  0.0000020400000000, -0.0000264900000000 ]- atom:    5  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0032264000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029893100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029301300000000 ]  - [   0.0179087100000000,  0.0103396000000000,  0.0132009200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2877471400000000 ]  - [   0.0000000000000000, -0.0206792000000000,  0.0132009200000000 ]  - [  -0.0179087100000000,  0.0103396000000000,  0.0132009200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054836000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043535200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0064642200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0504375700000000 ]  - [  -0.0003425600000000,  0.0001977800000000,  0.0039473400000000 ]  - [   0.0000000000000000, -0.0003955600000000,  0.0039473400000000 ]  - [   0.0003425600000000,  0.0001977800000000,  0.0039473400000000 ]  - [   0.0001816000000000,  0.0001048500000000,  0.0039190500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044155800000000 ]  - [   0.0000000000000000, -0.0002096900000000,  0.0039190500000000 ]  - [  -0.0001816000000000,  0.0001048500000000,  0.0039190500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056099900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043197600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0058001000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043837300000000 ]  - [  -0.0003370400000000,  0.0001945900000000,  0.0039511500000000 ]  - [   0.0000000000000000, -0.0003891800000000,  0.0039511500000000 ]  - [   0.0003370400000000,  0.0001945900000000,  0.0039511500000000 ]  - [   0.0001829700000000,  0.0001056400000000,  0.0039308400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044260400000000 ]  - [   0.0000000000000000, -0.0002112800000000,  0.0039308400000000 ]  - [  -0.0001829700000000,  0.0001056400000000,  0.0039308400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0064304500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0513985800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057393200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043426700000000 ]  - [  -0.0180682200000000,  0.0104316900000000,  0.0133727400000000 ]  - [   0.0000000000000000, -0.0208633800000000,  0.0133727400000000 ]  - [   0.0180682200000000,  0.0104316900000000,  0.0133727400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0237118100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022718200000000 ]  - [   0.0164362800000000, -0.0094894900000000,  0.0458603300000000 ]  - [  -0.0000878600000000, -0.0000507300000000, -0.0028376700000000 ]  - [   0.0004860100000000, -0.0002806000000000, -0.0028532000000000 ]  - [   0.0015622200000000,  0.0009019500000000, -0.0009774400000000 ]  - [   0.0000000000000000,  0.0005611900000000, -0.0028532000000000 ]  - [   0.0000000000000000,  0.0001014500000000, -0.0028376700000000 ]  - [   0.0000000000000000,  0.0189789800000000,  0.0458603300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0050210000000000 ]  - [   0.0000000000000000, -0.0018039000000000, -0.0009774400000000 ]  - [  -0.0015622200000000,  0.0009019500000000, -0.0009774400000000 ]  - [  -0.0004860100000000, -0.0002806000000000, -0.0028532000000000 ]  - [  -0.0164362800000000, -0.0094894900000000,  0.0458603300000000 ]  - [   0.0000878600000000, -0.0000507300000000, -0.0028376700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034003400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055474500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033583000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022851100000000 ]  - [   0.0001071200000000, -0.0000618400000000, -0.0028580400000000 ]  - [  -0.0000914500000000, -0.0000528000000000, -0.0028424200000000 ]  - [   0.0005358000000000, -0.0003093500000000, -0.0028634900000000 ]  - [  -0.0006372600000000, -0.0003679300000000, -0.0027151800000000 ]  - [   0.0000000000000000,  0.0006186900000000, -0.0028634900000000 ]  - [   0.0000000000000000,  0.0001056000000000, -0.0028424200000000 ]  - [   0.0000000000000000,  0.0001236900000000, -0.0028580400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055522500000000 ]  - [   0.0000000000000000,  0.0007358500000000, -0.0027151800000000 ]  - [   0.0006372600000000, -0.0003679300000000, -0.0027151800000000 ]  - [  -0.0005358000000000, -0.0003093500000000, -0.0028634900000000 ]  - [  -0.0001071200000000, -0.0000618400000000, -0.0028580400000000 ]  - [   0.0000914500000000, -0.0000528000000000, -0.0028424200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033844900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027822600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033855400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0051290100000000 ]  - [   0.0001174900000000, -0.0000678300000000, -0.0028582800000000 ]  - [  -0.0132074600000000, -0.0076253300000000,  0.0434827100000000 ]  - [  -0.0016585000000000,  0.0009575300000000, -0.0011175000000000 ]  - [  -0.0006065700000000, -0.0003502000000000, -0.0026932000000000 ]  - [   0.0000000000000000, -0.0019150700000000, -0.0011175000000000 ]  - [   0.0000000000000000,  0.0152506600000000,  0.0434827100000000 ]  - [   0.0000000000000000,  0.0001356700000000, -0.0028582800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0051349600000000 ]  - [   0.0000000000000000,  0.0007004100000000, -0.0026932000000000 ]  - [   0.0006065700000000, -0.0003502000000000, -0.0026932000000000 ]  - [   0.0016585000000000,  0.0009575300000000, -0.0011175000000000 ]  - [  -0.0001174900000000, -0.0000678300000000, -0.0028582800000000 ]  - [   0.0132074600000000, -0.0076253300000000,  0.0434827100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0238263600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027631500000000 ]- atom:    5  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0032167700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029904000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029316800000000 ]  - [  -0.0176672500000000, -0.0102001900000000, -0.0131027300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2876586000000000 ]  - [   0.0000000000000000,  0.0204003800000000, -0.0131027300000000 ]  - [   0.0176672500000000, -0.0102001900000000, -0.0131027300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0053895900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043791300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063587700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0503627500000000 ]  - [   0.0003339700000000, -0.0001928200000000, -0.0039542100000000 ]  - [   0.0000000000000000,  0.0003856400000000, -0.0039542100000000 ]  - [  -0.0003339700000000, -0.0001928200000000, -0.0039542100000000 ]  - [  -0.0001962800000000, -0.0001133200000000, -0.0039621200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044883800000000 ]  - [   0.0000000000000000,  0.0002266500000000, -0.0039621200000000 ]  - [   0.0001962800000000, -0.0001133200000000, -0.0039621200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055834300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044018100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057616500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043973000000000 ]  - [   0.0003286500000000, -0.0001897500000000, -0.0039335600000000 ]  - [   0.0000000000000000,  0.0003795000000000, -0.0039335600000000 ]  - [  -0.0003286500000000, -0.0001897500000000, -0.0039335600000000 ]  - [  -0.0001965500000000, -0.0001134800000000, -0.0039643200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044772400000000 ]  - [   0.0000000000000000,  0.0002269600000000, -0.0039643200000000 ]  - [   0.0001965500000000, -0.0001134800000000, -0.0039643200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063015700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0514406300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056669900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044455200000000 ]  - [   0.0183195400000000, -0.0105767900000000, -0.0134920200000000 ]  - [   0.0000000000000000,  0.0211535900000000, -0.0134920200000000 ]  - [  -0.0183195400000000, -0.0105767900000000, -0.0134920200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0236762600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0023235200000000 ]  - [  -0.0152989400000000,  0.0088328500000000, -0.0450209400000000 ]  - [   0.0001049800000000,  0.0000606100000000,  0.0028811500000000 ]  - [  -0.0004583000000000,  0.0002646000000000,  0.0028596800000000 ]  - [  -0.0015288100000000, -0.0008826600000000,  0.0009878700000000 ]  - [   0.0000000000000000, -0.0005292000000000,  0.0028596800000000 ]  - [   0.0000000000000000, -0.0001212200000000,  0.0028811500000000 ]  - [   0.0000000000000000, -0.0176656900000000, -0.0450209400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049316200000000 ]  - [   0.0000000000000000,  0.0017653200000000,  0.0009878700000000 ]  - [   0.0015288100000000, -0.0008826600000000,  0.0009878700000000 ]  - [   0.0004583000000000,  0.0002646000000000,  0.0028596800000000 ]  - [   0.0152989400000000,  0.0088328500000000, -0.0450209400000000 ]  - [  -0.0001049800000000,  0.0000606100000000,  0.0028811500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034261400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054538400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033947600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0023255200000000 ]  - [  -0.0001191100000000,  0.0000687700000000,  0.0028851400000000 ]  - [   0.0001025600000000,  0.0000592200000000,  0.0028713500000000 ]  - [  -0.0004890600000000,  0.0002823600000000,  0.0028609300000000 ]  - [   0.0006542600000000,  0.0003777400000000,  0.0027131400000000 ]  - [   0.0000000000000000, -0.0005647200000000,  0.0028609300000000 ]  - [   0.0000000000000000, -0.0001184300000000,  0.0028713500000000 ]  - [   0.0000000000000000, -0.0001375400000000,  0.0028851400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053885100000000 ]  - [   0.0000000000000000, -0.0007554700000000,  0.0027131400000000 ]  - [  -0.0006542600000000,  0.0003777400000000,  0.0027131400000000 ]  - [   0.0004890600000000,  0.0002823600000000,  0.0028609300000000 ]  - [   0.0001191100000000,  0.0000687700000000,  0.0028851400000000 ]  - [  -0.0001025600000000,  0.0000592200000000,  0.0028713500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034487400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027074400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033648000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0051479600000000 ]  - [  -0.0001091400000000,  0.0000630100000000,  0.0028875900000000 ]  - [   0.0143122500000000,  0.0082631800000000, -0.0442404700000000 ]  - [   0.0016902200000000, -0.0009758500000000,  0.0010770200000000 ]  - [   0.0006464800000000,  0.0003732400000000,  0.0027179800000000 ]  - [   0.0000000000000000,  0.0019516900000000,  0.0010770200000000 ]  - [   0.0000000000000000, -0.0165263600000000, -0.0442404700000000 ]  - [   0.0000000000000000, -0.0001260200000000,  0.0028875900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049910700000000 ]  - [   0.0000000000000000, -0.0007464900000000,  0.0027179800000000 ]  - [  -0.0006464800000000,  0.0003732400000000,  0.0027179800000000 ]  - [  -0.0016902200000000, -0.0009758500000000,  0.0010770200000000 ]  - [   0.0001091400000000,  0.0000630100000000,  0.0028875900000000 ]  - [  -0.0143122500000000,  0.0082631800000000, -0.0442404700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0238327500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027189600000000 ]- atom:    8  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0076568700000000,  0.0000533100000000, -0.0000300200000000 ]  - [  -0.0000024600000000,  0.0000006300000000,  0.0000008600000000 ]  - [  -0.0000015600000000,  0.0000006900000000, -0.0000004300000000 ]  - [   0.0000072700000000,  0.0001120100000000, -0.0000275900000000 ]  - [  -0.0000099400000000, -0.0000005800000000, -0.0000386100000000 ]  - [  -0.0001903000000000,  0.0000049300000000, -0.0000168500000000 ]  - [   0.0000113700000000, -0.0001185000000000, -0.0000016700000000 ]  - [  -0.2311055700000000, -0.0033065400000000, -0.0029207700000000 ]  - [  -0.0062587800000000, -0.0000071900000000, -0.0000383900000000 ]  - [   0.0013225200000000,  0.0000039300000000,  0.0000633200000000 ]  - [   0.0000190400000000,  0.0000008800000000, -0.0000225500000000 ]  - [   0.0021793200000000,  0.0245813300000000,  0.0083263600000000 ]  - [   0.0447010800000000,  0.0000941800000000,  0.0001577900000000 ]  - [   0.0019794000000000, -0.0246329700000000, -0.0082756900000000 ]  - [  -0.0000135200000000, -0.0002526900000000, -0.0002512200000000 ]  - [   0.0034745400000000,  0.0000032500000000, -0.0000235900000000 ]  - [   0.0004252300000000,  0.0000101700000000, -0.0000202700000000 ]  - [   0.0000041500000000,  0.0002437000000000,  0.0002098700000000 ]  - [  -0.0000000100000000,  0.0000003200000000,  0.0000147700000000 ]  - [   0.0000013900000000, -0.0000003100000000, -0.0000405100000000 ]  - [  -0.0000752600000000, -0.0000003300000000,  0.0000210600000000 ]  - [  -0.0009091200000000, -0.0000003800000000, -0.0000163700000000 ]  - [  -0.0000043400000000,  0.0000023700000000,  0.0000111800000000 ]  - [  -0.0000013300000000, -0.0000054500000000,  0.0000107300000000 ]  - [   0.0000047100000000,  0.0000041000000000,  0.0000105000000000 ]  - [  -0.0000070000000000, -0.0000034700000000, -0.0000164000000000 ]  - [  -0.0000008200000000, -0.0000000800000000, -0.0000241500000000 ]  - [   0.0000001700000000,  0.0000076900000000, -0.0000159600000000 ]  - [   0.0000063200000000, -0.0000029000000000, -0.0000161100000000 ]  - [   0.0000000800000000,  0.0000002800000000,  0.0000513600000000 ]  - [   0.0000108000000000, -0.0000009100000000,  0.0000099700000000 ]  - [   0.0000012500000000, -0.0000008400000000,  0.0000375400000000 ]  - [   0.0000001100000000, -0.0000001300000000, -0.0000503300000000 ]  - [  -0.0000042100000000,  0.0000008700000000,  0.0000073600000000 ]  - [  -0.0000034500000000, -0.0000033600000000,  0.0000083500000000 ]  - [   0.0000026100000000,  0.0000039200000000,  0.0000096700000000 ]  - [   0.0001073000000000, -0.0000004900000000, -0.0000161800000000 ]  - [  -0.0057923700000000,  0.0000640400000000, -0.0000369400000000 ]  - [  -0.0000081500000000, -0.0000192400000000,  0.0000217600000000 ]  - [  -0.0009245900000000, -0.0039463600000000,  0.0038241600000000 ]  - [   0.0748777600000000, -0.0343034900000000, -0.0274657400000000 ]  - [   0.0003238100000000,  0.0003748100000000,  0.0006351300000000 ]  - [   0.0150339900000000,  0.0003503600000000, -0.0001210800000000 ]  - [   0.0059291000000000,  0.0000073000000000, -0.0000162700000000 ]  - [  -0.0000434900000000, -0.0000114100000000,  0.0000173100000000 ]  - [   0.0185587500000000,  0.0000142000000000,  0.0005585000000000 ]  - [  -0.0003249900000000, -0.0000150500000000, -0.0000242700000000 ]  - [   0.0003013700000000, -0.0003612600000000, -0.0006752700000000 ]  - [   0.0787831900000000,  0.0370761300000000,  0.0298881000000000 ]  - [   0.0000099300000000,  0.0000318200000000,  0.0000140900000000 ]  - [  -0.0008961300000000,  0.0039514100000000, -0.0038197700000000 ]  - [  -0.0088936900000000, -0.0000030400000000,  0.0000717300000000 ]  - [   0.0000828800000000,  0.0000017900000000, -0.0000251000000000 ]  - [   0.0002802400000000, -0.0000005500000000,  0.0000204800000000 ]  - [  -0.0000021800000000, -0.0000019100000000,  0.0000256000000000 ]  - [  -0.0001190900000000, -0.0001731200000000,  0.0010187500000000 ]  - [   0.0000005500000000, -0.0000020100000000,  0.0000070800000000 ]  - [   0.0000238200000000, -0.0000137700000000, -0.0000008300000000 ]  - [   0.0000196200000000, -0.0000410600000000,  0.0000883700000000 ]  - [  -0.0000006100000000,  0.0000248100000000, -0.0000002100000000 ]  - [   0.0000019600000000, -0.0000006400000000,  0.0000090200000000 ]  - [  -0.0004203200000000, -0.0000167100000000,  0.0000184400000000 ]  - [   0.0000097200000000, -0.0000001100000000, -0.0000828700000000 ]  - [   0.0000891200000000, -0.0000079000000000, -0.0000034800000000 ]  - [   0.0000083200000000,  0.0000457600000000, -0.0000966500000000 ]  - [  -0.0000186500000000, -0.0000100600000000,  0.0000020600000000 ]  - [  -0.0000906300000000,  0.0001911100000000, -0.0009828100000000 ]  - [  -0.0000025100000000,  0.0000013700000000,  0.0000080100000000 ]  - [   0.0000007400000000,  0.0000010300000000,  0.0000235000000000 ]  - [  -0.0001349300000000,  0.0000019300000000, -0.0000423400000000 ]  - [   0.0000001400000000, -0.0000010400000000, -0.0000040600000000 ]  - [   0.0000009800000000, -0.0000025900000000, -0.0000092000000000 ]  - [  -0.0000006400000000,  0.0000001600000000,  0.0000176500000000 ]  - [   0.0000039700000000,  0.0000005000000000,  0.0000240900000000 ]  - [   0.0000184700000000, -0.0000112800000000, -0.0000003200000000 ]  - [   0.0000176300000000,  0.0000077900000000,  0.0000086000000000 ]  - [  -0.0000015700000000,  0.0000190800000000,  0.0000001000000000 ]  - [   0.0000012900000000, -0.0000019800000000,  0.0000182800000000 ]  - [  -0.0000020500000000, -0.0000023200000000,  0.0000175600000000 ]  - [   0.0000003200000000, -0.0000003300000000, -0.0000697600000000 ]  - [   0.0000019900000000, -0.0000217400000000,  0.0000111900000000 ]  - [  -0.0000187200000000,  0.0000109400000000,  0.0000104400000000 ]  - [  -0.0000140400000000, -0.0000066700000000,  0.0000013600000000 ]  - [   0.0000019200000000,  0.0000033300000000,  0.0000188800000000 ]  - [  -0.0000028000000000,  0.0000013900000000,  0.0000112200000000 ]  - [   0.0000009400000000,  0.0000010400000000,  0.0000260200000000 ]  - [   0.0000017600000000,  0.0000020600000000, -0.0000275900000000 ]- atom:    8  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0161969800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0037613300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0037610500000000 ]  - [   0.0015192300000000,  0.0008771300000000,  0.0045357800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054030300000000 ]  - [   0.0000000000000000, -0.0017542600000000,  0.0045357800000000 ]  - [  -0.0015192300000000,  0.0008771300000000,  0.0045357800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.3642998900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0158578000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0196825300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056792000000000 ]  - [  -0.0014359400000000,  0.0008290400000000, -0.0003614500000000 ]  - [   0.0000000000000000, -0.0016580800000000, -0.0003614500000000 ]  - [   0.0014359400000000,  0.0008290400000000, -0.0003614500000000 ]  - [   0.0001805700000000,  0.0001042500000000,  0.0049594200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0063491400000000 ]  - [   0.0000000000000000, -0.0002085000000000,  0.0049594200000000 ]  - [  -0.0001805700000000,  0.0001042500000000,  0.0049594200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0070655100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054528200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0073003600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042642100000000 ]  - [  -0.0004229900000000,  0.0002442100000000,  0.0049769800000000 ]  - [   0.0000000000000000, -0.0004884200000000,  0.0049769800000000 ]  - [   0.0004229900000000,  0.0002442100000000,  0.0049769800000000 ]  - [   0.0002317300000000,  0.0001337900000000,  0.0049403900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0055774600000000 ]  - [   0.0000000000000000, -0.0002675800000000,  0.0049403900000000 ]  - [  -0.0002317300000000,  0.0001337900000000,  0.0049403900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0071030700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056632600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0073068200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054760400000000 ]  - [  -0.0004456300000000,  0.0002572800000000,  0.0049691900000000 ]  - [   0.0000000000000000, -0.0005145700000000,  0.0049691900000000 ]  - [   0.0004456300000000,  0.0002572800000000,  0.0049691900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048692500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0100313500000000 ]  - [  -0.0001699300000000,  0.0000981100000000, -0.0034048800000000 ]  - [   0.0024439900000000,  0.0014110400000000, -0.0017960400000000 ]  - [  -0.0381797500000000,  0.0220430900000000,  0.0458716200000000 ]  - [  -0.0021817500000000, -0.0012596300000000, -0.0052187800000000 ]  - [   0.0000000000000000, -0.0440861800000000,  0.0458716200000000 ]  - [   0.0000000000000000, -0.0028220800000000, -0.0017960400000000 ]  - [   0.0000000000000000, -0.0001962200000000, -0.0034048800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2096833800000000 ]  - [   0.0000000000000000,  0.0025192700000000, -0.0052187800000000 ]  - [   0.0021817500000000, -0.0012596300000000, -0.0052187800000000 ]  - [   0.0381797500000000,  0.0220430900000000,  0.0458716200000000 ]  - [   0.0001699300000000,  0.0000981100000000, -0.0034048800000000 ]  - [  -0.0024439900000000,  0.0014110400000000, -0.0017960400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0008474300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0003385600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042502700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0028873900000000 ]  - [  -0.0001609000000000,  0.0000929000000000, -0.0036310700000000 ]  - [  -0.0001180200000000, -0.0000681400000000, -0.0035829000000000 ]  - [   0.0006686800000000, -0.0003860600000000, -0.0036073500000000 ]  - [  -0.0008018200000000, -0.0004629300000000, -0.0034340600000000 ]  - [   0.0000000000000000,  0.0007721300000000, -0.0036073500000000 ]  - [   0.0000000000000000,  0.0001362800000000, -0.0035829000000000 ]  - [   0.0000000000000000, -0.0001858000000000, -0.0036310700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0069708800000000 ]  - [   0.0000000000000000,  0.0009258600000000, -0.0034340600000000 ]  - [   0.0008018200000000, -0.0004629300000000, -0.0034340600000000 ]  - [  -0.0006686800000000, -0.0003860600000000, -0.0036073500000000 ]  - [   0.0001609000000000,  0.0000929000000000, -0.0036310700000000 ]  - [   0.0001180200000000, -0.0000681400000000, -0.0035829000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042710800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034280300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042579800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029327700000000 ]  - [   0.0001477600000000, -0.0000853100000000, -0.0035981800000000 ]  - [  -0.0001417600000000, -0.0000818400000000, -0.0035939700000000 ]  - [   0.0006580800000000, -0.0003799400000000, -0.0036031200000000 ]  - [  -0.0007910400000000, -0.0004567000000000, -0.0034019800000000 ]  - [   0.0000000000000000,  0.0007598800000000, -0.0036031200000000 ]  - [   0.0000000000000000,  0.0001636800000000, -0.0035939700000000 ]  - [   0.0000000000000000,  0.0001706200000000, -0.0035981800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0069539400000000 ]  - [   0.0000000000000000,  0.0009134100000000, -0.0034019800000000 ]  - [   0.0007910400000000, -0.0004567000000000, -0.0034019800000000 ]  - [  -0.0006580800000000, -0.0003799400000000, -0.0036031200000000 ]  - [  -0.0001477600000000, -0.0000853100000000, -0.0035981800000000 ]  - [   0.0001417600000000, -0.0000818400000000, -0.0035939700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041981400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034694600000000 ]- atom:    8  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0162919600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037573900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037604000000000 ]  - [  -0.0015314800000000, -0.0008842000000000, -0.0045604800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054775200000000 ]  - [   0.0000000000000000,  0.0017684000000000, -0.0045604800000000 ]  - [   0.0015314800000000, -0.0008842000000000, -0.0045604800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.3777369700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0156849400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0197595800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057218800000000 ]  - [   0.0014681100000000, -0.0008476100000000,  0.0001369100000000 ]  - [   0.0000000000000000,  0.0016952300000000,  0.0001369100000000 ]  - [  -0.0014681100000000, -0.0008476100000000,  0.0001369100000000 ]  - [  -0.0001964200000000, -0.0001134000000000, -0.0049960600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063921900000000 ]  - [   0.0000000000000000,  0.0002268100000000, -0.0049960600000000 ]  - [   0.0001964200000000, -0.0001134000000000, -0.0049960600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0070332500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055299200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0072504400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042967100000000 ]  - [   0.0004145000000000, -0.0002393100000000, -0.0049549200000000 ]  - [   0.0000000000000000,  0.0004786200000000, -0.0049549200000000 ]  - [  -0.0004145000000000, -0.0002393100000000, -0.0049549200000000 ]  - [  -0.0002445900000000, -0.0001412200000000, -0.0049674600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056231800000000 ]  - [   0.0000000000000000,  0.0002824300000000, -0.0049674600000000 ]  - [   0.0002445900000000, -0.0001412200000000, -0.0049674600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0069970200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056410400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0072238100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055730800000000 ]  - [   0.0004400600000000, -0.0002540700000000, -0.0049516700000000 ]  - [   0.0000000000000000,  0.0005081400000000, -0.0049516700000000 ]  - [  -0.0004400600000000, -0.0002540700000000, -0.0049516700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0048233500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0098971100000000 ]  - [   0.0001626600000000, -0.0000939100000000,  0.0034293300000000 ]  - [  -0.0023875100000000, -0.0013784300000000,  0.0018695400000000 ]  - [   0.0374413600000000, -0.0216167800000000, -0.0459186500000000 ]  - [   0.0022133500000000,  0.0012778800000000,  0.0051870300000000 ]  - [   0.0000000000000000,  0.0432335600000000, -0.0459186500000000 ]  - [   0.0000000000000000,  0.0027568500000000,  0.0018695400000000 ]  - [   0.0000000000000000,  0.0001878300000000,  0.0034293300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2226657600000000 ]  - [   0.0000000000000000, -0.0025557500000000,  0.0051870300000000 ]  - [  -0.0022133500000000,  0.0012778800000000,  0.0051870300000000 ]  - [  -0.0374413600000000, -0.0216167800000000, -0.0459186500000000 ]  - [  -0.0001626600000000, -0.0000939100000000,  0.0034293300000000 ]  - [   0.0023875100000000, -0.0013784300000000,  0.0018695400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0007072900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0002787900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042809100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029256100000000 ]  - [   0.0001410600000000, -0.0000814400000000,  0.0036553400000000 ]  - [   0.0001279100000000,  0.0000738500000000,  0.0036072800000000 ]  - [  -0.0006223100000000,  0.0003592900000000,  0.0036032400000000 ]  - [   0.0008163900000000,  0.0004713400000000,  0.0034271000000000 ]  - [   0.0000000000000000, -0.0007185900000000,  0.0036032400000000 ]  - [   0.0000000000000000, -0.0001477000000000,  0.0036072800000000 ]  - [   0.0000000000000000,  0.0001628800000000,  0.0036553400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0067994700000000 ]  - [   0.0000000000000000, -0.0009426800000000,  0.0034271000000000 ]  - [  -0.0008163900000000,  0.0004713400000000,  0.0034271000000000 ]  - [   0.0006223100000000,  0.0003592900000000,  0.0036032400000000 ]  - [  -0.0001410600000000, -0.0000814400000000,  0.0036553400000000 ]  - [  -0.0001279100000000,  0.0000738500000000,  0.0036072800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043291200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033485500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042363500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029017700000000 ]  - [  -0.0001418600000000,  0.0000819000000000,  0.0036250400000000 ]  - [   0.0001542700000000,  0.0000890700000000,  0.0036375200000000 ]  - [  -0.0006220900000000,  0.0003591600000000,  0.0035995900000000 ]  - [   0.0008290400000000,  0.0004786500000000,  0.0034223000000000 ]  - [   0.0000000000000000, -0.0007183300000000,  0.0035995900000000 ]  - [   0.0000000000000000, -0.0001781300000000,  0.0036375200000000 ]  - [   0.0000000000000000, -0.0001638100000000,  0.0036250400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0068083500000000 ]  - [   0.0000000000000000, -0.0009573000000000,  0.0034223000000000 ]  - [  -0.0008290400000000,  0.0004786500000000,  0.0034223000000000 ]  - [   0.0006220900000000,  0.0003591600000000,  0.0035995900000000 ]  - [   0.0001418600000000,  0.0000819000000000,  0.0036250400000000 ]  - [  -0.0001542700000000,  0.0000890700000000,  0.0036375200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042594700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034189300000000 ]- atom:    9  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0004265500000000,  0.0000007600000000,  0.0000044100000000 ]  - [  -0.0000024900000000,  0.0000007900000000,  0.0000018700000000 ]  - [  -0.0000010100000000,  0.0000006500000000, -0.0000002600000000 ]  - [  -0.0000055800000000,  0.0000024100000000, -0.0000106100000000 ]  - [   0.0000000500000000, -0.0000003700000000, -0.0000380800000000 ]  - [  -0.0000101700000000,  0.0000065400000000, -0.0000142400000000 ]  - [   0.0000044500000000, -0.0000086900000000, -0.0000174400000000 ]  - [  -0.0062599600000000, -0.0000021300000000,  0.0000778800000000 ]  - [  -0.2279867800000000,  0.0033324700000000,  0.0021135400000000 ]  - [   0.0000370000000000,  0.0000010100000000,  0.0000688300000000 ]  - [   0.0000010300000000,  0.0000005800000000, -0.0000224400000000 ]  - [   0.0004037600000000,  0.0203714400000000,  0.0117656300000000 ]  - [   0.0357419600000000, -0.0000778900000000, -0.0001140000000000 ]  - [   0.0005871400000000, -0.0203268800000000, -0.0118058800000000 ]  - [   0.0004221700000000, -0.0007983200000000, -0.0039527300000000 ]  - [   0.0361611900000000, -0.0001778800000000, -0.0001271200000000 ]  - [   0.0017207500000000, -0.0000382300000000, -0.0000587200000000 ]  - [   0.0002788700000000,  0.0007839000000000,  0.0039494300000000 ]  - [   0.0000103900000000,  0.0000003100000000,  0.0000145000000000 ]  - [   0.0000015000000000, -0.0000003600000000, -0.0000403700000000 ]  - [  -0.0009118900000000,  0.0000063300000000,  0.0000249200000000 ]  - [   0.0123205000000000,  0.0001453500000000,  0.0000486000000000 ]  - [  -0.0000047100000000,  0.0000017300000000,  0.0000099900000000 ]  - [  -0.0000028100000000, -0.0000054500000000,  0.0000110200000000 ]  - [   0.0000042800000000,  0.0000047100000000,  0.0000121800000000 ]  - [  -0.0000075200000000, -0.0000031100000000, -0.0000161000000000 ]  - [   0.0000001000000000, -0.0000000400000000, -0.0000239300000000 ]  - [  -0.0000009900000000,  0.0000076800000000, -0.0000157800000000 ]  - [   0.0000057300000000, -0.0000032300000000, -0.0000159900000000 ]  - [   0.0000002500000000,  0.0000003100000000,  0.0000516900000000 ]  - [   0.0000007600000000, -0.0000009900000000,  0.0000099200000000 ]  - [   0.0000003500000000, -0.0000008300000000,  0.0000380100000000 ]  - [   0.0000003700000000, -0.0000001700000000, -0.0000500200000000 ]  - [  -0.0000038800000000,  0.0000017700000000,  0.0000090600000000 ]  - [  -0.0000015800000000, -0.0000032700000000,  0.0000086600000000 ]  - [   0.0000027800000000,  0.0000029600000000,  0.0000085500000000 ]  - [   0.0000031300000000, -0.0000009400000000, -0.0000150300000000 ]  - [  -0.0096816200000000,  0.0000092500000000, -0.0000180000000000 ]  - [  -0.0000070100000000,  0.0000033200000000,  0.0000178800000000 ]  - [   0.0673638200000000,  0.0324873600000000,  0.0185854900000000 ]  - [  -0.0002245400000000,  0.0034782400000000, -0.0050482400000000 ]  - [   0.0000239200000000,  0.0000105700000000,  0.0000040800000000 ]  - [   0.0058265000000000, -0.0000038300000000,  0.0000213800000000 ]  - [   0.0106715300000000, -0.0002943100000000,  0.0000929400000000 ]  - [  -0.0000037800000000, -0.0000110200000000,  0.0000163600000000 ]  - [   0.0006165000000000,  0.0000004900000000, -0.0000470600000000 ]  - [   0.0000033100000000, -0.0000208300000000, -0.0000164000000000 ]  - [  -0.0000085900000000,  0.0000057000000000, -0.0000383700000000 ]  - [  -0.0002047900000000, -0.0034973800000000,  0.0050943700000000 ]  - [   0.0000097000000000,  0.0000090300000000,  0.0000172100000000 ]  - [   0.0714598700000000, -0.0353627100000000, -0.0203714700000000 ]  - [  -0.0049866200000000, -0.0000611100000000,  0.0000653500000000 ]  - [   0.0000088400000000,  0.0000021500000000, -0.0000293000000000 ]  - [   0.0171106700000000, -0.0000119100000000, -0.0002049100000000 ]  - [  -0.0000020100000000, -0.0000018600000000,  0.0000246500000000 ]  - [  -0.0009205700000000, -0.0055555200000000,  0.0031752600000000 ]  - [   0.0000007100000000, -0.0000017200000000,  0.0000068000000000 ]  - [   0.0000259200000000, -0.0000150200000000, -0.0000062100000000 ]  - [   0.0007462700000000,  0.0004922500000000,  0.0015769100000000 ]  - [  -0.0000006700000000,  0.0000247800000000, -0.0000005100000000 ]  - [   0.0000016900000000, -0.0000008300000000,  0.0000090100000000 ]  - [  -0.0105569900000000,  0.0000183700000000, -0.0000567300000000 ]  - [   0.0001672900000000, -0.0000009100000000, -0.0000810800000000 ]  - [  -0.0001233900000000, -0.0000250600000000,  0.0000147100000000 ]  - [   0.0006984600000000, -0.0004843400000000, -0.0015773300000000 ]  - [  -0.0000165400000000, -0.0000088000000000,  0.0000067900000000 ]  - [  -0.0009096500000000,  0.0055771400000000, -0.0031470900000000 ]  - [  -0.0000026800000000,  0.0000013600000000,  0.0000083400000000 ]  - [   0.0000015700000000,  0.0000010300000000,  0.0000237400000000 ]  - [  -0.0000289400000000,  0.0000146400000000, -0.0000585300000000 ]  - [   0.0000002000000000, -0.0000010400000000, -0.0000045300000000 ]  - [  -0.0000002300000000, -0.0000025600000000, -0.0000098400000000 ]  - [  -0.0000004400000000,  0.0000000800000000,  0.0000173500000000 ]  - [   0.0000025700000000, -0.0000007100000000,  0.0000173600000000 ]  - [   0.0000185100000000, -0.0000109100000000, -0.0000010400000000 ]  - [   0.0000173300000000,  0.0000076300000000,  0.0000082600000000 ]  - [  -0.0000009300000000,  0.0000191200000000, -0.0000001800000000 ]  - [   0.0000019600000000, -0.0000021100000000,  0.0000181900000000 ]  - [  -0.0000020300000000, -0.0000020300000000,  0.0000172700000000 ]  - [   0.0000003500000000, -0.0000003200000000, -0.0000701500000000 ]  - [   0.0000019200000000, -0.0000215300000000,  0.0000110300000000 ]  - [  -0.0000187000000000,  0.0000109300000000,  0.0000104400000000 ]  - [  -0.0000141200000000, -0.0000070800000000,  0.0000016100000000 ]  - [   0.0000017000000000,  0.0000032000000000,  0.0000186600000000 ]  - [  -0.0000044000000000,  0.0000026900000000,  0.0000175600000000 ]  - [   0.0000006700000000,  0.0000010700000000,  0.0000256200000000 ]  - [   0.0000018000000000,  0.0000020800000000, -0.0000276200000000 ]- atom:    9  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0031739700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027016300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029236800000000 ]  - [   0.0001458000000000,  0.0000841800000000,  0.0038420800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043201500000000 ]  - [   0.0000000000000000, -0.0001683500000000,  0.0038420800000000 ]  - [  -0.0001458000000000,  0.0000841800000000,  0.0038420800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0157235500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2317870400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057072100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042665400000000 ]  - [   0.0015438800000000, -0.0008913600000000, -0.0073371400000000 ]  - [   0.0000000000000000,  0.0017827200000000, -0.0073371400000000 ]  - [  -0.0015438800000000, -0.0008913600000000, -0.0073371400000000 ]  - [  -0.0157393200000000, -0.0090871000000000,  0.0101249200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0515704900000000 ]  - [   0.0000000000000000,  0.0181742000000000,  0.0101249200000000 ]  - [   0.0157393200000000, -0.0090871000000000,  0.0101249200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056542700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042268000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045814500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0340006900000000 ]  - [  -0.0003280500000000,  0.0001894000000000,  0.0038604200000000 ]  - [   0.0000000000000000, -0.0003788000000000,  0.0038604200000000 ]  - [   0.0003280500000000,  0.0001894000000000,  0.0038604200000000 ]  - [   0.0001783100000000,  0.0001029500000000,  0.0038405700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043298100000000 ]  - [   0.0000000000000000, -0.0002058900000000,  0.0038405700000000 ]  - [  -0.0001783100000000,  0.0001029500000000,  0.0038405700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0055301000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042758700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056922600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042485500000000 ]  - [  -0.0003276100000000,  0.0001891500000000,  0.0038663600000000 ]  - [   0.0000000000000000, -0.0003782900000000,  0.0038663600000000 ]  - [   0.0003276100000000,  0.0001891500000000,  0.0038663600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033206600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0058965200000000 ]  - [   0.0001181800000000, -0.0000682300000000, -0.0028014500000000 ]  - [   0.0269954800000000,  0.0155858500000000,  0.0408723400000000 ]  - [  -0.0044488500000000,  0.0025685400000000, -0.0010223500000000 ]  - [  -0.0006182500000000, -0.0003569500000000, -0.0026515300000000 ]  - [   0.0000000000000000, -0.0051370900000000, -0.0010223500000000 ]  - [   0.0000000000000000, -0.0311716900000000,  0.0408723400000000 ]  - [   0.0000000000000000,  0.0001364600000000, -0.0028014500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054355400000000 ]  - [   0.0000000000000000,  0.0007139000000000, -0.0026515300000000 ]  - [   0.0006182500000000, -0.0003569500000000, -0.0026515300000000 ]  - [   0.0044488500000000,  0.0025685400000000, -0.0010223500000000 ]  - [  -0.0001181800000000, -0.0000682300000000, -0.0028014500000000 ]  - [  -0.0269954800000000,  0.0155858500000000,  0.0408723400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0214753200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027858100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1102001000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022382700000000 ]  - [   0.0013474700000000, -0.0007779600000000,  0.0157582400000000 ]  - [  -0.0000919900000000, -0.0000531100000000, -0.0027815800000000 ]  - [   0.0005633100000000, -0.0003252200000000, -0.0028117000000000 ]  - [  -0.0044372500000000, -0.0025618500000000, -0.0047894500000000 ]  - [   0.0000000000000000,  0.0006504500000000, -0.0028117000000000 ]  - [   0.0000000000000000,  0.0001062200000000, -0.0027815800000000 ]  - [   0.0000000000000000,  0.0015559200000000,  0.0157582400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0060298200000000 ]  - [   0.0000000000000000,  0.0051237000000000, -0.0047894500000000 ]  - [   0.0044372500000000, -0.0025618500000000, -0.0047894500000000 ]  - [  -0.0005633100000000, -0.0003252200000000, -0.0028117000000000 ]  - [  -0.0013474700000000, -0.0007779600000000,  0.0157582400000000 ]  - [   0.0000919900000000, -0.0000531100000000, -0.0027815800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033203900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017241800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033154200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022715500000000 ]  - [   0.0001165700000000, -0.0000673000000000, -0.0027966200000000 ]  - [  -0.0000869700000000, -0.0000502100000000, -0.0027711000000000 ]  - [   0.0005200500000000, -0.0003002500000000, -0.0028029800000000 ]  - [  -0.0006114000000000, -0.0003529900000000, -0.0026437700000000 ]  - [   0.0000000000000000,  0.0006005000000000, -0.0028029800000000 ]  - [   0.0000000000000000,  0.0001004300000000, -0.0027711000000000 ]  - [   0.0000000000000000,  0.0001346100000000, -0.0027966200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054233000000000 ]  - [   0.0000000000000000,  0.0007059900000000, -0.0026437700000000 ]  - [   0.0006114000000000, -0.0003529900000000, -0.0026437700000000 ]  - [  -0.0005200500000000, -0.0003002500000000, -0.0028029800000000 ]  - [  -0.0001165700000000, -0.0000673000000000, -0.0027966200000000 ]  - [   0.0000869700000000, -0.0000502100000000, -0.0027711000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033111200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027076600000000 ]- atom:    9  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0031818200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027112100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029362400000000 ]  - [  -0.0001565500000000, -0.0000903800000000, -0.0038835200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044125600000000 ]  - [   0.0000000000000000,  0.0001807700000000, -0.0038835200000000 ]  - [   0.0001565500000000, -0.0000903800000000, -0.0038835200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0158114300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2227473500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055888800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043267300000000 ]  - [  -0.0016328200000000,  0.0009427100000000,  0.0076542100000000 ]  - [   0.0000000000000000, -0.0018854200000000,  0.0076542100000000 ]  - [   0.0016328200000000,  0.0009427100000000,  0.0076542100000000 ]  - [   0.0156832000000000,  0.0090547000000000, -0.0100625200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0512676300000000 ]  - [   0.0000000000000000, -0.0181094000000000, -0.0100625200000000 ]  - [  -0.0156832000000000,  0.0090547000000000, -0.0100625200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056433700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043211900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045590900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0338257900000000 ]  - [   0.0003208700000000, -0.0001852600000000, -0.0038537100000000 ]  - [   0.0000000000000000,  0.0003705100000000, -0.0038537100000000 ]  - [  -0.0003208700000000, -0.0001852600000000, -0.0038537100000000 ]  - [  -0.0001921400000000, -0.0001109300000000, -0.0038849500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043936500000000 ]  - [   0.0000000000000000,  0.0002218600000000, -0.0038849500000000 ]  - [   0.0001921400000000, -0.0001109300000000, -0.0038849500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054459600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042709400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056377400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043639300000000 ]  - [   0.0003231400000000, -0.0001865600000000, -0.0038643300000000 ]  - [   0.0000000000000000,  0.0003731300000000, -0.0038643300000000 ]  - [  -0.0003231400000000, -0.0001865600000000, -0.0038643300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0032874100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059840500000000 ]  - [  -0.0001247100000000,  0.0000720000000000,  0.0028371400000000 ]  - [  -0.0272643000000000, -0.0157410500000000, -0.0406012700000000 ]  - [   0.0045626100000000, -0.0026342300000000,  0.0009985600000000 ]  - [   0.0006577400000000,  0.0003797500000000,  0.0026303000000000 ]  - [   0.0000000000000000,  0.0052684500000000,  0.0009985600000000 ]  - [   0.0000000000000000,  0.0314821000000000, -0.0406012700000000 ]  - [   0.0000000000000000, -0.0001440000000000,  0.0028371400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053531100000000 ]  - [   0.0000000000000000, -0.0007594900000000,  0.0026303000000000 ]  - [  -0.0006577400000000,  0.0003797500000000,  0.0026303000000000 ]  - [  -0.0045626100000000, -0.0026342300000000,  0.0009985600000000 ]  - [   0.0001247100000000,  0.0000720000000000,  0.0028371400000000 ]  - [   0.0272643000000000, -0.0157410500000000, -0.0406012700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0216041000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027493000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1024057700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022827600000000 ]  - [  -0.0013545100000000,  0.0007820200000000, -0.0156582200000000 ]  - [   0.0001034200000000,  0.0000597100000000,  0.0028189200000000 ]  - [  -0.0005182900000000,  0.0002992400000000,  0.0028175100000000 ]  - [   0.0044635700000000,  0.0025770500000000,  0.0047973400000000 ]  - [   0.0000000000000000, -0.0005984700000000,  0.0028175100000000 ]  - [   0.0000000000000000, -0.0001194200000000,  0.0028189200000000 ]  - [   0.0000000000000000, -0.0015640500000000, -0.0156582200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0058822800000000 ]  - [   0.0000000000000000, -0.0051540900000000,  0.0047973400000000 ]  - [  -0.0044635700000000,  0.0025770500000000,  0.0047973400000000 ]  - [   0.0005182900000000,  0.0002992400000000,  0.0028175100000000 ]  - [   0.0013545100000000,  0.0007820200000000, -0.0156582200000000 ]  - [  -0.0001034200000000,  0.0000597100000000,  0.0028189200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033936100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017860800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033051800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022490100000000 ]  - [  -0.0001080300000000,  0.0000623700000000,  0.0028339400000000 ]  - [   0.0001018800000000,  0.0000588200000000,  0.0028279100000000 ]  - [  -0.0004848100000000,  0.0002799000000000,  0.0028089000000000 ]  - [   0.0006535200000000,  0.0003773100000000,  0.0026765800000000 ]  - [   0.0000000000000000, -0.0005598100000000,  0.0028089000000000 ]  - [   0.0000000000000000, -0.0001176400000000,  0.0028279100000000 ]  - [   0.0000000000000000, -0.0001247400000000,  0.0028339400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053008900000000 ]  - [   0.0000000000000000, -0.0007546100000000,  0.0026765800000000 ]  - [  -0.0006535200000000,  0.0003773100000000,  0.0026765800000000 ]  - [   0.0004848100000000,  0.0002799000000000,  0.0028089000000000 ]  - [   0.0001080300000000,  0.0000623700000000,  0.0028339400000000 ]  - [  -0.0001018800000000,  0.0000588200000000,  0.0028279100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033896600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026723600000000 ]- atom:   10  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0043711300000000,  0.0000409700000000,  0.0000496700000000 ]  - [  -0.0000013300000000,  0.0000006500000000, -0.0000007300000000 ]  - [   0.0000042100000000,  0.0000006700000000, -0.0000022000000000 ]  - [   0.0025582900000000, -0.0247121400000000, -0.0083730700000000 ]  - [   0.0035075500000000, -0.0000041900000000, -0.0000518200000000 ]  - [   0.0453046600000000, -0.0000913800000000, -0.0001807800000000 ]  - [   0.0023620500000000,  0.0247594000000000,  0.0082797500000000 ]  - [   0.0013227100000000, -0.0000005100000000,  0.0000513500000000 ]  - [   0.0000391300000000, -0.0000006300000000, -0.0000136800000000 ]  - [  -0.2380631300000000,  0.0033162500000000,  0.0031344700000000 ]  - [  -0.0066064400000000,  0.0000080600000000,  0.0000012900000000 ]  - [   0.0000081100000000, -0.0001606900000000, -0.0000912300000000 ]  - [  -0.0002715100000000, -0.0000043700000000, -0.0000016000000000 ]  - [   0.0000138300000000,  0.0001654900000000,  0.0000850700000000 ]  - [  -0.0000075200000000, -0.0000015900000000, -0.0000212600000000 ]  - [  -0.0000235800000000, -0.0000001500000000, -0.0000367300000000 ]  - [  -0.0000043200000000,  0.0000084200000000, -0.0000230800000000 ]  - [   0.0000064900000000, -0.0000060200000000, -0.0000250000000000 ]  - [   0.0000001300000000,  0.0000003200000000,  0.0000116100000000 ]  - [  -0.0000000700000000, -0.0000003900000000, -0.0000429600000000 ]  - [   0.0000018400000000, -0.0000002300000000,  0.0000180000000000 ]  - [   0.0000134800000000, -0.0000001400000000, -0.0000082200000000 ]  - [  -0.0000041600000000,  0.0000027600000000,  0.0000087900000000 ]  - [  -0.0000004600000000, -0.0000050600000000,  0.0000085800000000 ]  - [   0.0000041700000000,  0.0000032900000000,  0.0000085400000000 ]  - [  -0.0000068500000000, -0.0000028000000000, -0.0000188300000000 ]  - [  -0.0000008600000000, -0.0000000400000000, -0.0000266600000000 ]  - [  -0.0000009100000000,  0.0000077100000000, -0.0000181800000000 ]  - [   0.0000063800000000, -0.0000036000000000, -0.0000180400000000 ]  - [  -0.0000768400000000,  0.0000003900000000,  0.0000482300000000 ]  - [  -0.0009126200000000, -0.0000008500000000,  0.0000181400000000 ]  - [   0.0000015900000000, -0.0000007900000000,  0.0000344000000000 ]  - [   0.0000015700000000, -0.0000001700000000, -0.0000527700000000 ]  - [  -0.0000085100000000,  0.0002561000000000,  0.0002438000000000 ]  - [   0.0004350000000000, -0.0000046800000000,  0.0000055900000000 ]  - [   0.0000012500000000, -0.0002503900000000, -0.0002315200000000 ]  - [  -0.0090741400000000,  0.0000020100000000, -0.0000823700000000 ]  - [  -0.0000598500000000, -0.0000010700000000,  0.0000289000000000 ]  - [  -0.0008883500000000,  0.0040985900000000, -0.0038692900000000 ]  - [   0.0000037000000000,  0.0000278200000000, -0.0000139100000000 ]  - [   0.0003365700000000, -0.0003288800000000, -0.0007513200000000 ]  - [   0.0789310100000000,  0.0364254200000000,  0.0294532400000000 ]  - [  -0.0002317300000000,  0.0000070900000000,  0.0000114200000000 ]  - [  -0.0000460000000000, -0.0000047400000000,  0.0000179900000000 ]  - [   0.0062287600000000, -0.0000189700000000,  0.0000508600000000 ]  - [   0.0187756600000000, -0.0000180400000000, -0.0006368600000000 ]  - [   0.0153868000000000, -0.0003765100000000,  0.0001223700000000 ]  - [   0.0829172400000000, -0.0392742400000000, -0.0320150000000000 ]  - [   0.0003238100000000,  0.0003201700000000,  0.0007687500000000 ]  - [  -0.0008364500000000, -0.0040898100000000,  0.0039315500000000 ]  - [  -0.0000073500000000, -0.0000231000000000,  0.0000486000000000 ]  - [   0.0001233100000000,  0.0000005000000000,  0.0000091700000000 ]  - [  -0.0055247100000000, -0.0000620800000000,  0.0000349400000000 ]  - [  -0.0000020600000000, -0.0000009000000000,  0.0000250200000000 ]  - [  -0.0000019300000000, -0.0000018500000000,  0.0000254900000000 ]  - [  -0.0000074800000000,  0.0000053700000000,  0.0000081100000000 ]  - [   0.0000013700000000, -0.0000015000000000,  0.0000096900000000 ]  - [   0.0000234500000000, -0.0000136500000000,  0.0000003600000000 ]  - [   0.0000057400000000,  0.0000016500000000, -0.0000033700000000 ]  - [  -0.0000007000000000,  0.0000245900000000,  0.0000011100000000 ]  - [   0.0000019800000000, -0.0000014700000000,  0.0000114200000000 ]  - [  -0.0000002100000000, -0.0000127300000000,  0.0000168800000000 ]  - [   0.0000003600000000, -0.0000001000000000, -0.0000799900000000 ]  - [   0.0000011000000000, -0.0000089400000000, -0.0000010900000000 ]  - [  -0.0000074900000000,  0.0000039800000000, -0.0000003300000000 ]  - [  -0.0000186100000000, -0.0000099400000000,  0.0000034500000000 ]  - [   0.0000127700000000,  0.0000086300000000,  0.0000277200000000 ]  - [  -0.0000032500000000,  0.0000018700000000,  0.0000103700000000 ]  - [   0.0000006400000000,  0.0000010400000000,  0.0000266100000000 ]  - [   0.0000031400000000,  0.0000020100000000, -0.0000406000000000 ]  - [   0.0000002200000000, -0.0000011100000000, -0.0000032000000000 ]  - [  -0.0001450800000000, -0.0000024800000000, -0.0000099100000000 ]  - [   0.0000002200000000, -0.0000002900000000,  0.0000186800000000 ]  - [  -0.0000947400000000,  0.0001826400000000, -0.0010103000000000 ]  - [   0.0000291300000000,  0.0000314100000000, -0.0000937400000000 ]  - [   0.0000178800000000,  0.0000079000000000,  0.0000106600000000 ]  - [   0.0000831200000000,  0.0000184500000000,  0.0000017000000000 ]  - [  -0.0004121200000000,  0.0000002000000000,  0.0000181000000000 ]  - [  -0.0000020900000000, -0.0000012500000000,  0.0000184100000000 ]  - [   0.0000089200000000, -0.0000003100000000, -0.0000668400000000 ]  - [   0.0000019700000000, -0.0000221900000000,  0.0000129300000000 ]  - [  -0.0000192200000000,  0.0000112400000000,  0.0000120500000000 ]  - [  -0.0000022800000000, -0.0000488300000000,  0.0000977100000000 ]  - [   0.0000009200000000,  0.0000028500000000,  0.0000197100000000 ]  - [  -0.0000962700000000, -0.0001829000000000,  0.0010482900000000 ]  - [   0.0002861500000000,  0.0000007000000000,  0.0000322000000000 ]  - [   0.0000017300000000,  0.0000020900000000, -0.0000252500000000 ]- atom:   10  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0121828000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038783400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038780800000000 ]  - [   0.0023261200000000,  0.0013429800000000, -0.0000240700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0063532000000000 ]  - [   0.0000000000000000, -0.0026859700000000, -0.0000240700000000 ]  - [  -0.0023261200000000,  0.0013429800000000, -0.0000240700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0198839700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056302400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.3772659800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0161924900000000 ]  - [  -0.0008561000000000,  0.0004942700000000,  0.0047443700000000 ]  - [   0.0000000000000000, -0.0009885400000000,  0.0047443700000000 ]  - [   0.0008561000000000,  0.0004942700000000,  0.0047443700000000 ]  - [   0.0002503600000000,  0.0001445400000000,  0.0050845300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056603500000000 ]  - [   0.0000000000000000, -0.0002890900000000,  0.0050845300000000 ]  - [  -0.0002503600000000,  0.0001445400000000,  0.0050845300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0072794000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056179900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0075159800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057861500000000 ]  - [  -0.0004356500000000,  0.0002515200000000,  0.0051277500000000 ]  - [   0.0000000000000000, -0.0005030400000000,  0.0051277500000000 ]  - [   0.0004356500000000,  0.0002515200000000,  0.0051277500000000 ]  - [   0.0002390700000000,  0.0001380300000000,  0.0050922200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057481700000000 ]  - [   0.0000000000000000, -0.0002760500000000,  0.0050922200000000 ]  - [  -0.0002390700000000,  0.0001380300000000,  0.0050922200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0073262300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045848400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0075325000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056465200000000 ]  - [  -0.0003972800000000,  0.0002293700000000,  0.0051493500000000 ]  - [   0.0000000000000000, -0.0004587400000000,  0.0051493500000000 ]  - [   0.0003972800000000,  0.0002293700000000,  0.0051493500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000964000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0021558200000000 ]  - [  -0.0023246400000000,  0.0013421300000000, -0.0018485700000000 ]  - [  -0.0000404300000000, -0.0000233400000000, -0.0035717900000000 ]  - [   0.0025345600000000, -0.0014633300000000, -0.0048221200000000 ]  - [   0.0404761400000000,  0.0233689100000000,  0.0452617300000000 ]  - [   0.0000000000000000,  0.0029266600000000, -0.0048221200000000 ]  - [   0.0000000000000000,  0.0000466900000000, -0.0035717900000000 ]  - [   0.0000000000000000, -0.0026842600000000, -0.0018485700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2178188300000000 ]  - [   0.0000000000000000, -0.0467378200000000,  0.0452617300000000 ]  - [  -0.0404761400000000,  0.0233689100000000,  0.0452617300000000 ]  - [  -0.0025345600000000, -0.0014633300000000, -0.0048221200000000 ]  - [   0.0023246400000000,  0.0013421300000000, -0.0018485700000000 ]  - [   0.0000404300000000, -0.0000233400000000, -0.0035717900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048417200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0123455900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043315400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029752900000000 ]  - [   0.0001629800000000, -0.0000940900000000, -0.0037212200000000 ]  - [  -0.0001202000000000, -0.0000694000000000, -0.0036893900000000 ]  - [   0.0006885600000000, -0.0003975400000000, -0.0037162800000000 ]  - [  -0.0008247500000000, -0.0004761700000000, -0.0035193800000000 ]  - [   0.0000000000000000,  0.0007950800000000, -0.0037162800000000 ]  - [   0.0000000000000000,  0.0001387900000000, -0.0036893900000000 ]  - [   0.0000000000000000,  0.0001881900000000, -0.0037212200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0071790500000000 ]  - [   0.0000000000000000,  0.0009523400000000, -0.0035193800000000 ]  - [   0.0008247500000000, -0.0004761700000000, -0.0035193800000000 ]  - [  -0.0006885600000000, -0.0003975400000000, -0.0037162800000000 ]  - [  -0.0001629800000000, -0.0000940900000000, -0.0037212200000000 ]  - [   0.0001202000000000, -0.0000694000000000, -0.0036893900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043980000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035965900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043910100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029672800000000 ]  - [   0.0001539300000000, -0.0000888700000000, -0.0037107700000000 ]  - [   0.0001426900000000,  0.0000823800000000, -0.0037174200000000 ]  - [   0.0006809200000000, -0.0003931300000000, -0.0037317700000000 ]  - [  -0.0008156900000000, -0.0004709400000000, -0.0035076800000000 ]  - [   0.0000000000000000,  0.0007862600000000, -0.0037317700000000 ]  - [   0.0000000000000000, -0.0001647700000000, -0.0037174200000000 ]  - [   0.0000000000000000,  0.0001777400000000, -0.0037107700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0071686400000000 ]  - [   0.0000000000000000,  0.0009418800000000, -0.0035076800000000 ]  - [   0.0008156900000000, -0.0004709400000000, -0.0035076800000000 ]  - [  -0.0006809200000000, -0.0003931300000000, -0.0037317700000000 ]  - [  -0.0001539300000000, -0.0000888700000000, -0.0037107700000000 ]  - [  -0.0001426900000000,  0.0000823800000000, -0.0037174200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043855100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035745100000000 ]- atom:   10  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0121120100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0038831100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0038851500000000 ]  - [  -0.0023042200000000, -0.0013303400000000,  0.0002059600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0064630700000000 ]  - [   0.0000000000000000,  0.0026606900000000,  0.0002059600000000 ]  - [   0.0023042200000000, -0.0013303400000000,  0.0002059600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0195686500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056621500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.3643650400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0164465600000000 ]  - [   0.0008483900000000, -0.0004898200000000, -0.0047569300000000 ]  - [   0.0000000000000000,  0.0009796400000000, -0.0047569300000000 ]  - [  -0.0008483900000000, -0.0004898200000000, -0.0047569300000000 ]  - [  -0.0002649900000000, -0.0001529900000000, -0.0051331400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057392400000000 ]  - [   0.0000000000000000,  0.0003059800000000, -0.0051331400000000 ]  - [   0.0002649900000000, -0.0001529900000000, -0.0051331400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0072616400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057071400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0074835100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0058060600000000 ]  - [   0.0004281000000000, -0.0002471600000000, -0.0051159200000000 ]  - [   0.0000000000000000,  0.0004943300000000, -0.0051159200000000 ]  - [  -0.0004281000000000, -0.0002471600000000, -0.0051159200000000 ]  - [  -0.0002522100000000, -0.0001456100000000, -0.0051313300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0058060700000000 ]  - [   0.0000000000000000,  0.0002912200000000, -0.0051313300000000 ]  - [   0.0002522100000000, -0.0001456100000000, -0.0051313300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0072348800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045511500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0074671100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057560200000000 ]  - [   0.0003912900000000, -0.0002259100000000, -0.0051424000000000 ]  - [   0.0000000000000000,  0.0004518200000000, -0.0051424000000000 ]  - [  -0.0003912900000000, -0.0002259100000000, -0.0051424000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002500300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022150200000000 ]  - [   0.0023535700000000, -0.0013588400000000,  0.0018461000000000 ]  - [   0.0000565800000000,  0.0000326600000000,  0.0036183900000000 ]  - [  -0.0025093300000000,  0.0014487600000000,  0.0048348300000000 ]  - [  -0.0412665400000000, -0.0238252500000000, -0.0452449700000000 ]  - [   0.0000000000000000, -0.0028975300000000,  0.0048348300000000 ]  - [   0.0000000000000000, -0.0000653300000000,  0.0036183900000000 ]  - [   0.0000000000000000,  0.0027176700000000,  0.0018461000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2053253100000000 ]  - [   0.0000000000000000,  0.0476505000000000, -0.0452449700000000 ]  - [   0.0412665400000000, -0.0238252500000000, -0.0452449700000000 ]  - [   0.0025093300000000,  0.0014487600000000,  0.0048348300000000 ]  - [  -0.0023535700000000, -0.0013588400000000,  0.0018461000000000 ]  - [  -0.0000565800000000,  0.0000326600000000,  0.0036183900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0048730400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0124738800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043742600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0030199900000000 ]  - [  -0.0001772500000000,  0.0001023400000000,  0.0037532700000000 ]  - [   0.0001301700000000,  0.0000751500000000,  0.0037218200000000 ]  - [  -0.0006439100000000,  0.0003717600000000,  0.0037202600000000 ]  - [   0.0008412800000000,  0.0004857100000000,  0.0035201000000000 ]  - [   0.0000000000000000, -0.0007435300000000,  0.0037202600000000 ]  - [   0.0000000000000000, -0.0001503000000000,  0.0037218200000000 ]  - [   0.0000000000000000, -0.0002046800000000,  0.0037532700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0070230100000000 ]  - [   0.0000000000000000, -0.0009714300000000,  0.0035201000000000 ]  - [  -0.0008412800000000,  0.0004857100000000,  0.0035201000000000 ]  - [   0.0006439100000000,  0.0003717600000000,  0.0037202600000000 ]  - [   0.0001772500000000,  0.0001023400000000,  0.0037532700000000 ]  - [  -0.0001301700000000,  0.0000751500000000,  0.0037218200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044657200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035239100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043795800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029413300000000 ]  - [  -0.0001483000000000,  0.0000856200000000,  0.0037458700000000 ]  - [  -0.0001358100000000, -0.0000784100000000,  0.0037691500000000 ]  - [  -0.0006461200000000,  0.0003730400000000,  0.0037366000000000 ]  - [   0.0008553600000000,  0.0004938400000000,  0.0035350200000000 ]  - [   0.0000000000000000, -0.0007460800000000,  0.0037366000000000 ]  - [   0.0000000000000000,  0.0001568200000000,  0.0037691500000000 ]  - [   0.0000000000000000, -0.0001712500000000,  0.0037458700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0070381900000000 ]  - [   0.0000000000000000, -0.0009876800000000,  0.0035350200000000 ]  - [  -0.0008553600000000,  0.0004938400000000,  0.0035350200000000 ]  - [   0.0006461200000000,  0.0003730400000000,  0.0037366000000000 ]  - [   0.0001483000000000,  0.0000856200000000,  0.0037458700000000 ]  - [   0.0001358100000000, -0.0000784100000000,  0.0037691500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044587200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035328000000000 ]- atom:   11  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0001161300000000,  0.0000004600000000,  0.0000011900000000 ]  - [  -0.0000010000000000,  0.0000006300000000, -0.0000011900000000 ]  - [   0.0000634200000000,  0.0000011600000000, -0.0000023500000000 ]  - [   0.0003286000000000, -0.0204600600000000, -0.0119078100000000 ]  - [   0.0361489700000000,  0.0001750400000000,  0.0000492300000000 ]  - [   0.0358174300000000,  0.0000763800000000,  0.0000956000000000 ]  - [   0.0005090500000000,  0.0204139300000000,  0.0119112800000000 ]  - [   0.0000184800000000,  0.0000004000000000,  0.0000475400000000 ]  - [   0.0000024300000000, -0.0000004700000000, -0.0000143100000000 ]  - [  -0.0066066500000000,  0.0000047900000000,  0.0000376700000000 ]  - [  -0.2311359500000000, -0.0033811300000000, -0.0020789600000000 ]  - [  -0.0000045500000000, -0.0000011800000000, -0.0000118400000000 ]  - [  -0.0000061900000000, -0.0000052000000000, -0.0000043900000000 ]  - [   0.0000042700000000,  0.0000058100000000,  0.0000033000000000 ]  - [  -0.0000073000000000, -0.0000033500000000, -0.0000239200000000 ]  - [  -0.0000006100000000, -0.0000002700000000, -0.0000375100000000 ]  - [  -0.0000010500000000,  0.0000084700000000, -0.0000235400000000 ]  - [   0.0000067900000000, -0.0000043100000000, -0.0000232200000000 ]  - [  -0.0000009300000000,  0.0000003000000000,  0.0000108600000000 ]  - [   0.0000002600000000, -0.0000004000000000, -0.0000435200000000 ]  - [   0.0000016300000000, -0.0000002700000000,  0.0000172100000000 ]  - [   0.0000010400000000, -0.0000001200000000, -0.0000085500000000 ]  - [  -0.0000046000000000,  0.0000024300000000,  0.0000080700000000 ]  - [  -0.0000015000000000, -0.0000050200000000,  0.0000079100000000 ]  - [   0.0000036300000000,  0.0000035800000000,  0.0000079100000000 ]  - [  -0.0000073200000000, -0.0000023000000000, -0.0000186000000000 ]  - [   0.0000001700000000, -0.0000000500000000, -0.0000272700000000 ]  - [  -0.0000022200000000,  0.0000078300000000, -0.0000186500000000 ]  - [   0.0000061500000000, -0.0000042100000000, -0.0000192100000000 ]  - [  -0.0009102900000000, -0.0000059100000000,  0.0000437300000000 ]  - [   0.0123200800000000, -0.0001451100000000, -0.0000490300000000 ]  - [   0.0000135800000000, -0.0000007800000000,  0.0000339300000000 ]  - [   0.0000014200000000, -0.0000001600000000, -0.0000533000000000 ]  - [   0.0004037200000000,  0.0008207400000000,  0.0039790400000000 ]  - [   0.0017417800000000,  0.0000433300000000,  0.0000422900000000 ]  - [   0.0002558500000000, -0.0008097300000000, -0.0040056600000000 ]  - [  -0.0049937500000000,  0.0000609700000000, -0.0000729700000000 ]  - [  -0.0000114800000000, -0.0000019400000000,  0.0000309600000000 ]  - [   0.0684070600000000, -0.0332309100000000, -0.0178250100000000 ]  - [   0.0000040800000000,  0.0000007700000000,  0.0000151900000000 ]  - [   0.0000270600000000, -0.0000111800000000, -0.0000119600000000 ]  - [  -0.0000314600000000, -0.0035951600000000,  0.0052739800000000 ]  - [   0.0000063100000000,  0.0000151300000000,  0.0000058000000000 ]  - [   0.0000010200000000, -0.0000050100000000,  0.0000190600000000 ]  - [   0.0104215900000000,  0.0002839400000000, -0.0000560700000000 ]  - [   0.0007082400000000, -0.0000010900000000, -0.0000490200000000 ]  - [   0.0062235700000000, -0.0000016300000000, -0.0000303300000000 ]  - [  -0.0000172500000000,  0.0036195700000000, -0.0053417900000000 ]  - [   0.0000017000000000, -0.0000016700000000,  0.0000252600000000 ]  - [   0.0725973800000000,  0.0361669600000000,  0.0196419000000000 ]  - [  -0.0000077100000000,  0.0000041400000000,  0.0000207500000000 ]  - [   0.0000038700000000,  0.0000008200000000,  0.0000083300000000 ]  - [  -0.0093495700000000, -0.0000090900000000,  0.0000205200000000 ]  - [  -0.0000005200000000, -0.0000009000000000,  0.0000255000000000 ]  - [  -0.0000019900000000, -0.0000018600000000,  0.0000256800000000 ]  - [  -0.0000090700000000,  0.0000053700000000,  0.0000175600000000 ]  - [   0.0000015500000000, -0.0000014400000000,  0.0000101700000000 ]  - [   0.0000236200000000, -0.0000137400000000,  0.0000008600000000 ]  - [   0.0000060300000000,  0.0000013100000000, -0.0000021800000000 ]  - [  -0.0000007300000000,  0.0000248100000000,  0.0000013200000000 ]  - [   0.0000020200000000, -0.0000016300000000,  0.0000118800000000 ]  - [  -0.0000018200000000, -0.0000125400000000,  0.0000171600000000 ]  - [   0.0000004700000000, -0.0000001200000000, -0.0000792000000000 ]  - [   0.0000019500000000, -0.0000091100000000, -0.0000006300000000 ]  - [  -0.0000074900000000,  0.0000044700000000, -0.0000007700000000 ]  - [  -0.0000188300000000, -0.0000101000000000,  0.0000033600000000 ]  - [   0.0000108100000000,  0.0000084400000000,  0.0000189300000000 ]  - [  -0.0000033100000000,  0.0000019200000000,  0.0000107600000000 ]  - [   0.0000006700000000,  0.0000010500000000,  0.0000271400000000 ]  - [   0.0000017200000000,  0.0000020100000000, -0.0000400000000000 ]  - [   0.0000010500000000, -0.0000010800000000, -0.0000028800000000 ]  - [  -0.0000435200000000, -0.0000154000000000,  0.0000053000000000 ]  - [   0.0000004600000000, -0.0000006600000000,  0.0000190200000000 ]  - [  -0.0008354700000000,  0.0054442100000000, -0.0031736100000000 ]  - [   0.0007251500000000, -0.0004873800000000, -0.0016006000000000 ]  - [   0.0000198800000000,  0.0000097200000000,  0.0000157800000000 ]  - [  -0.0001334800000000,  0.0000348200000000, -0.0000158000000000 ]  - [  -0.0102783800000000, -0.0000336600000000,  0.0000912900000000 ]  - [  -0.0000024600000000, -0.0000011900000000,  0.0000187400000000 ]  - [   0.0001658400000000,  0.0000004300000000, -0.0000679200000000 ]  - [   0.0000008400000000, -0.0000222400000000,  0.0000133700000000 ]  - [  -0.0000173100000000,  0.0000095000000000,  0.0000077900000000 ]  - [   0.0006585000000000,  0.0004658700000000,  0.0015975200000000 ]  - [   0.0000010400000000,  0.0000031100000000,  0.0000199600000000 ]  - [  -0.0008550600000000, -0.0054473600000000,  0.0032207000000000 ]  - [   0.0177510100000000,  0.0000114300000000,  0.0002293400000000 ]  - [   0.0000037200000000,  0.0000020900000000, -0.0000240500000000 ]- atom:   11  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0026641500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029540000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0030316100000000 ]  - [  -0.0021660100000000, -0.0012505400000000, -0.0089691900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0503240600000000 ]  - [   0.0000000000000000,  0.0025010900000000, -0.0089691900000000 ]  - [   0.0021660100000000, -0.0012505400000000, -0.0089691900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057558700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042897900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0164870300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2081862500000000 ]  - [  -0.0003101700000000,  0.0001790800000000,  0.0038886600000000 ]  - [   0.0000000000000000, -0.0003581600000000,  0.0038886600000000 ]  - [   0.0003101700000000,  0.0001790800000000,  0.0038886600000000 ]  - [   0.0001787200000000,  0.0001031800000000,  0.0038733600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043638800000000 ]  - [   0.0000000000000000, -0.0002063700000000,  0.0038733600000000 ]  - [  -0.0001787200000000,  0.0001031800000000,  0.0038733600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0055432200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042705900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0057336900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043331200000000 ]  - [  -0.0003331400000000,  0.0001923400000000,  0.0039052100000000 ]  - [   0.0000000000000000, -0.0003846700000000,  0.0039052100000000 ]  - [   0.0003331400000000,  0.0001923400000000,  0.0039052100000000 ]  - [   0.0001836500000000,  0.0001060300000000,  0.0038707700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043707500000000 ]  - [   0.0000000000000000, -0.0002120600000000,  0.0038707700000000 ]  - [  -0.0001836500000000,  0.0001060300000000,  0.0038707700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043348200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0338262700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0058443600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042884000000000 ]  - [   0.0156115800000000, -0.0090133500000000,  0.0097697700000000 ]  - [   0.0000000000000000,  0.0180267000000000,  0.0097697700000000 ]  - [  -0.0156115800000000, -0.0090133500000000,  0.0097697700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0221203300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022840500000000 ]  - [  -0.0272479800000000,  0.0157316300000000,  0.0401098600000000 ]  - [  -0.0000965400000000, -0.0000557400000000, -0.0028039700000000 ]  - [   0.0005632000000000, -0.0003251600000000, -0.0028146500000000 ]  - [   0.0047887100000000,  0.0027647600000000, -0.0007673600000000 ]  - [   0.0000000000000000,  0.0006503300000000, -0.0028146500000000 ]  - [   0.0000000000000000,  0.0001114700000000, -0.0028039700000000 ]  - [   0.0000000000000000, -0.0314632600000000,  0.0401098600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057257500000000 ]  - [   0.0000000000000000, -0.0055295200000000, -0.0007673600000000 ]  - [  -0.0047887100000000,  0.0027647600000000, -0.0007673600000000 ]  - [  -0.0005632000000000, -0.0003251600000000, -0.0028146500000000 ]  - [   0.0272479800000000,  0.0157316300000000,  0.0401098600000000 ]  - [   0.0000965400000000, -0.0000557400000000, -0.0028039700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033661400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0063088300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033173500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022578000000000 ]  - [   0.0001052300000000, -0.0000607500000000, -0.0028222000000000 ]  - [  -0.0000915600000000, -0.0000528600000000, -0.0028090100000000 ]  - [   0.0005292700000000, -0.0003055700000000, -0.0028285400000000 ]  - [  -0.0006299400000000, -0.0003637000000000, -0.0026827000000000 ]  - [   0.0000000000000000,  0.0006111400000000, -0.0028285400000000 ]  - [   0.0000000000000000,  0.0001057300000000, -0.0028090100000000 ]  - [   0.0000000000000000,  0.0001215100000000, -0.0028222000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054864400000000 ]  - [   0.0000000000000000,  0.0007273900000000, -0.0026827000000000 ]  - [   0.0006299400000000, -0.0003637000000000, -0.0026827000000000 ]  - [  -0.0005292700000000, -0.0003055700000000, -0.0028285400000000 ]  - [  -0.0001052300000000, -0.0000607500000000, -0.0028222000000000 ]  - [   0.0000915600000000, -0.0000528600000000, -0.0028090100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033444700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027497900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033514200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020227700000000 ]  - [   0.0001153300000000, -0.0000665800000000, -0.0028204600000000 ]  - [  -0.0013158000000000, -0.0007596800000000,  0.0155928000000000 ]  - [   0.0043021800000000, -0.0024838600000000, -0.0049717500000000 ]  - [  -0.0006381700000000, -0.0003684500000000, -0.0026820900000000 ]  - [   0.0000000000000000,  0.0049677300000000, -0.0049717500000000 ]  - [   0.0000000000000000,  0.0015193500000000,  0.0155928000000000 ]  - [   0.0000000000000000,  0.0001331700000000, -0.0028204600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0060007000000000 ]  - [   0.0000000000000000,  0.0007369000000000, -0.0026820900000000 ]  - [   0.0006381700000000, -0.0003684500000000, -0.0026820900000000 ]  - [  -0.0043021800000000, -0.0024838600000000, -0.0049717500000000 ]  - [  -0.0001153300000000, -0.0000665800000000, -0.0028204600000000 ]  - [   0.0013158000000000, -0.0007596800000000,  0.0155928000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0921119600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027242100000000 ]- atom:   11  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0026551300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029464600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0030261200000000 ]  - [   0.0020685600000000,  0.0011942900000000,  0.0085987900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0504763900000000 ]  - [   0.0000000000000000, -0.0023885700000000,  0.0085987900000000 ]  - [  -0.0020685600000000,  0.0011942900000000,  0.0085987900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056399900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043030600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0161598700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2166783700000000 ]  - [   0.0003010700000000, -0.0001738200000000, -0.0038839800000000 ]  - [   0.0000000000000000,  0.0003476500000000, -0.0038839800000000 ]  - [  -0.0003010700000000, -0.0001738200000000, -0.0038839800000000 ]  - [  -0.0001928800000000, -0.0001113600000000, -0.0039056100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044238800000000 ]  - [   0.0000000000000000,  0.0002227200000000, -0.0039056100000000 ]  - [   0.0001928800000000, -0.0001113600000000, -0.0039056100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055007700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043403800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056788100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043343200000000 ]  - [   0.0003237400000000, -0.0001869100000000, -0.0038758300000000 ]  - [   0.0000000000000000,  0.0003738300000000, -0.0038758300000000 ]  - [  -0.0003237400000000, -0.0001869100000000, -0.0038758300000000 ]  - [  -0.0001964400000000, -0.0001134100000000, -0.0038935200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044093300000000 ]  - [   0.0000000000000000,  0.0002268300000000, -0.0038935200000000 ]  - [   0.0001964400000000, -0.0001134100000000, -0.0038935200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042204100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0340015500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0057567400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043790200000000 ]  - [  -0.0156608000000000,  0.0090417600000000, -0.0098606700000000 ]  - [   0.0000000000000000, -0.0180835300000000, -0.0098606700000000 ]  - [   0.0156608000000000,  0.0090417600000000, -0.0098606700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0219937200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0023297100000000 ]  - [   0.0269967300000000, -0.0155865700000000, -0.0403221000000000 ]  - [   0.0001121100000000,  0.0000647300000000,  0.0028377400000000 ]  - [  -0.0005329800000000,  0.0003077200000000,  0.0028136100000000 ]  - [  -0.0046606600000000, -0.0026908300000000,  0.0007715700000000 ]  - [   0.0000000000000000, -0.0006154300000000,  0.0028136100000000 ]  - [   0.0000000000000000, -0.0001294600000000,  0.0028377400000000 ]  - [   0.0000000000000000,  0.0311731400000000, -0.0403221000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056090500000000 ]  - [   0.0000000000000000,  0.0053816600000000,  0.0007715700000000 ]  - [   0.0046606600000000, -0.0026908300000000,  0.0007715700000000 ]  - [   0.0005329800000000,  0.0003077200000000,  0.0028136100000000 ]  - [  -0.0269967300000000, -0.0155865700000000, -0.0403221000000000 ]  - [  -0.0001121100000000,  0.0000647300000000,  0.0028377400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033805900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0062108800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033462700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022923700000000 ]  - [  -0.0001182800000000,  0.0000682900000000,  0.0028425500000000 ]  - [   0.0001012000000000,  0.0000584300000000,  0.0028280500000000 ]  - [  -0.0004817800000000,  0.0002781500000000,  0.0028184000000000 ]  - [   0.0006442900000000,  0.0003719800000000,  0.0026730800000000 ]  - [   0.0000000000000000, -0.0005563100000000,  0.0028184000000000 ]  - [   0.0000000000000000, -0.0001168600000000,  0.0028280500000000 ]  - [   0.0000000000000000, -0.0001365700000000,  0.0028425500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053076600000000 ]  - [   0.0000000000000000, -0.0007439600000000,  0.0026730800000000 ]  - [  -0.0006442900000000,  0.0003719800000000,  0.0026730800000000 ]  - [   0.0004817800000000,  0.0002781500000000,  0.0028184000000000 ]  - [   0.0001182800000000,  0.0000682900000000,  0.0028425500000000 ]  - [  -0.0001012000000000,  0.0000584300000000,  0.0028280500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033965400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026663700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033241800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020619500000000 ]  - [  -0.0001085600000000,  0.0000626700000000,  0.0028433700000000 ]  - [   0.0013344000000000,  0.0007704100000000, -0.0156200300000000 ]  - [  -0.0042572500000000,  0.0024579300000000,  0.0049609800000000 ]  - [   0.0006759200000000,  0.0003902400000000,  0.0026990100000000 ]  - [   0.0000000000000000, -0.0049158500000000,  0.0049609800000000 ]  - [   0.0000000000000000, -0.0015408300000000, -0.0156200300000000 ]  - [   0.0000000000000000, -0.0001253500000000,  0.0028433700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0058466500000000 ]  - [   0.0000000000000000, -0.0007804900000000,  0.0026990100000000 ]  - [  -0.0006759200000000,  0.0003902400000000,  0.0026990100000000 ]  - [   0.0042572500000000,  0.0024579300000000,  0.0049609800000000 ]  - [   0.0001085600000000,  0.0000626700000000,  0.0028433700000000 ]  - [  -0.0013344000000000,  0.0007704100000000, -0.0156200300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0992645600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026735200000000 ]- atom:   12  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0002565900000000, -0.0018664700000000, -0.0024068100000000 ]  - [  -0.0000012100000000,  0.0000043500000000, -0.0001899900000000 ]  - [  -0.0000011700000000,  0.0000006200000000, -0.0002247400000000 ]  - [   0.0000410500000000,  0.0000527200000000, -0.0002794100000000 ]  - [   0.0000009500000000,  0.0000021800000000, -0.0003771900000000 ]  - [  -0.0000012700000000, -0.0000797000000000, -0.0002700300000000 ]  - [  -0.0000420700000000,  0.0000528300000000, -0.0002770100000000 ]  - [   0.0021647700000000,  0.0245899800000000, -0.0014324700000000 ]  - [   0.0004444000000000,  0.0203486300000000,  0.0015855200000000 ]  - [   0.0000083200000000, -0.0001621300000000, -0.0007850000000000 ]  - [  -0.0000012400000000, -0.0000031700000000, -0.0003288200000000 ]  - [  -0.2533584300000000,  0.0299294300000000,  0.0013869500000000 ]  - [   0.0076621100000000, -0.0499646300000000, -0.0145561700000000 ]  - [   0.0953894500000000, -0.0006370300000000,  0.0009006200000000 ]  - [   0.0022223300000000,  0.0001352200000000, -0.0002629900000000 ]  - [   0.0029734000000000, -0.0153233900000000, -0.0181834900000000 ]  - [  -0.0000177400000000, -0.0014240700000000, -0.0015261000000000 ]  - [  -0.0022617900000000,  0.0001099000000000, -0.0002494200000000 ]  - [  -0.0000008600000000, -0.0000011500000000, -0.0004289600000000 ]  - [   0.0000006400000000, -0.0000008400000000, -0.0003668600000000 ]  - [  -0.0000026400000000,  0.0002528400000000, -0.0003743300000000 ]  - [   0.0003455700000000,  0.0008084800000000,  0.0156375900000000 ]  - [   0.0000198900000000, -0.0000108600000000, -0.0002843600000000 ]  - [  -0.0000012300000000,  0.0000224600000000, -0.0002839700000000 ]  - [  -0.0000206700000000, -0.0000100400000000, -0.0002844200000000 ]  - [  -0.0000213200000000, -0.0000114900000000, -0.0003114700000000 ]  - [   0.0000005600000000, -0.0000002900000000, -0.0003578500000000 ]  - [  -0.0000003500000000,  0.0000240500000000, -0.0003109000000000 ]  - [   0.0000197100000000, -0.0000112800000000, -0.0003115000000000 ]  - [  -0.0000004800000000, -0.0000002300000000, -0.0003679200000000 ]  - [  -0.0000004200000000, -0.0000020500000000, -0.0003151700000000 ]  - [   0.0000007200000000, -0.0000005800000000, -0.0003952600000000 ]  - [   0.0000001500000000, -0.0000002000000000, -0.0003795700000000 ]  - [   0.0000204200000000, -0.0000113000000000, -0.0002876400000000 ]  - [  -0.0000011600000000,  0.0000244500000000, -0.0002875000000000 ]  - [  -0.0000222500000000, -0.0000111800000000, -0.0002875200000000 ]  - [  -0.0000003700000000, -0.0000141100000000,  0.0002426900000000 ]  - [   0.0609544500000000, -0.0249577900000000,  0.0297870200000000 ]  - [  -0.0000358400000000,  0.0000267800000000,  0.0002359200000000 ]  - [   0.0168961600000000,  0.0026641900000000,  0.0014135500000000 ]  - [  -0.0062576600000000,  0.0000949400000000,  0.0007142400000000 ]  - [   0.0001654600000000,  0.0001070200000000,  0.0001573300000000 ]  - [   0.0511828700000000,  0.0185713100000000, -0.0247440900000000 ]  - [   0.0034829200000000, -0.0060810200000000,  0.0080073900000000 ]  - [  -0.0000022700000000, -0.0000522800000000,  0.0002331300000000 ]  - [   0.0001185100000000, -0.0030677200000000,  0.0032852800000000 ]  - [  -0.0000010500000000, -0.0002699200000000,  0.0002891800000000 ]  - [  -0.0001629600000000,  0.0001049400000000,  0.0001523300000000 ]  - [   0.0154460200000000, -0.0007240200000000,  0.0017278200000000 ]  - [   0.0000370800000000,  0.0000299400000000,  0.0002376700000000 ]  - [  -0.0080201000000000,  0.0023083000000000,  0.0017876300000000 ]  - [   0.0100614300000000,  0.0032703200000000, -0.0054121200000000 ]  - [   0.0000034700000000, -0.0000238800000000,  0.0003663100000000 ]  - [   0.0003654400000000, -0.0018492800000000,  0.0044959700000000 ]  - [  -0.0000021800000000, -0.0000015100000000,  0.0002002500000000 ]  - [   0.0035251500000000,  0.0001025500000000,  0.0004785700000000 ]  - [   0.0000080700000000,  0.0000025200000000,  0.0002210900000000 ]  - [  -0.0000207000000000,  0.0000114700000000,  0.0002142000000000 ]  - [   0.0004490800000000,  0.0000724200000000,  0.0003066800000000 ]  - [  -0.0000009500000000, -0.0000270500000000,  0.0002163400000000 ]  - [   0.0000017900000000, -0.0000096100000000,  0.0002228700000000 ]  - [   0.0001934400000000,  0.0026725000000000, -0.0035717600000000 ]  - [   0.0000013800000000, -0.0000348400000000,  0.0004023500000000 ]  - [  -0.0000174700000000, -0.0004446900000000,  0.0008840200000000 ]  - [  -0.0004254600000000,  0.0000643800000000,  0.0002926900000000 ]  - [   0.0000250500000000,  0.0000151100000000,  0.0002167900000000 ]  - [  -0.0037859400000000,  0.0003121000000000,  0.0006901200000000 ]  - [  -0.0000104000000000,  0.0000059200000000,  0.0002219300000000 ]  - [   0.0000004900000000,  0.0000008500000000,  0.0002806700000000 ]  - [   0.0000078600000000,  0.0002963700000000, -0.0006727700000000 ]  - [  -0.0000000400000000, -0.0000010500000000,  0.0002488900000000 ]  - [  -0.0000004300000000, -0.0000027600000000,  0.0001646100000000 ]  - [  -0.0000093900000000,  0.0000051100000000,  0.0002328500000000 ]  - [   0.0000098800000000,  0.0000036500000000,  0.0002295700000000 ]  - [  -0.0000203100000000,  0.0000114200000000,  0.0002139400000000 ]  - [   0.0000653700000000,  0.0000354400000000,  0.0002119400000000 ]  - [  -0.0000012000000000, -0.0000256300000000,  0.0002145700000000 ]  - [   0.0000016500000000, -0.0000110700000000,  0.0002323900000000 ]  - [  -0.0000022600000000, -0.0000121500000000,  0.0002327500000000 ]  - [   0.0000001000000000, -0.0000003200000000,  0.0003402200000000 ]  - [   0.0000017500000000, -0.0000773200000000,  0.0002146600000000 ]  - [  -0.0000672800000000,  0.0000388400000000,  0.0002139500000000 ]  - [   0.0000244300000000,  0.0000154100000000,  0.0002163200000000 ]  - [   0.0000102100000000,  0.0000082600000000,  0.0002339800000000 ]  - [  -0.0000120200000000,  0.0000068800000000,  0.0002302800000000 ]  - [   0.0000005300000000,  0.0000009900000000,  0.0002845800000000 ]  - [   0.0000015200000000,  0.0000020600000000,  0.0001773600000000 ]- atom:   12  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0002782900000000,  0.0018684700000000,  0.0024060100000000 ]  - [  -0.0000010900000000, -0.0000031000000000,  0.0001911500000000 ]  - [  -0.0000010000000000,  0.0000006900000000,  0.0002226200000000 ]  - [  -0.0000520600000000, -0.0000598900000000,  0.0002492400000000 ]  - [   0.0000009300000000, -0.0000028900000000,  0.0002991000000000 ]  - [   0.0000019100000000,  0.0000926900000000,  0.0002399000000000 ]  - [   0.0000510300000000, -0.0000581100000000,  0.0002477000000000 ]  - [  -0.0019927600000000, -0.0246245800000000,  0.0014734800000000 ]  - [  -0.0005453200000000, -0.0203513800000000, -0.0015903000000000 ]  - [  -0.0000123900000000,  0.0001640300000000,  0.0009200800000000 ]  - [   0.0000000900000000,  0.0000042600000000,  0.0002819600000000 ]  - [   0.2536716800000000, -0.0334842900000000,  0.0010382200000000 ]  - [  -0.0077235300000000,  0.0498852200000000,  0.0145316500000000 ]  - [  -0.0953398400000000,  0.0007395700000000, -0.0009377200000000 ]  - [  -0.0022384000000000, -0.0001420000000000,  0.0002173500000000 ]  - [  -0.0028839900000000,  0.0153704000000000,  0.0182025000000000 ]  - [   0.0000180000000000,  0.0014401500000000,  0.0014846600000000 ]  - [   0.0022762500000000, -0.0001162900000000,  0.0002065700000000 ]  - [  -0.0000006300000000,  0.0000018400000000,  0.0004569700000000 ]  - [   0.0000003600000000,  0.0000001100000000,  0.0002843700000000 ]  - [   0.0000031000000000, -0.0002537800000000,  0.0004143700000000 ]  - [  -0.0003154600000000, -0.0008221100000000, -0.0156348200000000 ]  - [  -0.0000293200000000,  0.0000164000000000,  0.0003047400000000 ]  - [  -0.0000007600000000, -0.0000331900000000,  0.0003041400000000 ]  - [   0.0000289600000000,  0.0000171900000000,  0.0003047100000000 ]  - [   0.0000066500000000,  0.0000048400000000,  0.0002776500000000 ]  - [  -0.0000005700000000,  0.0000001800000000,  0.0003081500000000 ]  - [  -0.0000006200000000, -0.0000085500000000,  0.0002776000000000 ]  - [  -0.0000077300000000,  0.0000050500000000,  0.0002776400000000 ]  - [  -0.0000010800000000,  0.0000008500000000,  0.0004689100000000 ]  - [  -0.0000001100000000,  0.0000001700000000,  0.0003333100000000 ]  - [   0.0000003400000000, -0.0000009700000000,  0.0004682000000000 ]  - [   0.0000010100000000, -0.0000000800000000,  0.0002775500000000 ]  - [  -0.0000287500000000,  0.0000158700000000,  0.0003034200000000 ]  - [  -0.0000007600000000, -0.0000309500000000,  0.0003031200000000 ]  - [   0.0000271600000000,  0.0000160200000000,  0.0003035600000000 ]  - [  -0.0000011700000000,  0.0000122300000000, -0.0002719700000000 ]  - [  -0.0641575800000000,  0.0271018900000000, -0.0317745000000000 ]  - [   0.0000212800000000, -0.0000176700000000, -0.0002013000000000 ]  - [  -0.0169043900000000, -0.0027317400000000, -0.0014680200000000 ]  - [   0.0062831200000000, -0.0000246300000000, -0.0006786700000000 ]  - [  -0.0001327900000000, -0.0000934900000000, -0.0001916500000000 ]  - [  -0.0485999700000000, -0.0168465800000000,  0.0228846600000000 ]  - [  -0.0042846100000000,  0.0057788500000000, -0.0074320300000000 ]  - [  -0.0000015200000000,  0.0000310400000000, -0.0001995500000000 ]  - [  -0.0001469000000000,  0.0030671500000000, -0.0033800700000000 ]  - [   0.0000054700000000,  0.0002275600000000, -0.0003207700000000 ]  - [   0.0001293900000000, -0.0000854900000000, -0.0001845600000000 ]  - [  -0.0154838000000000,  0.0012156400000000, -0.0014356600000000 ]  - [  -0.0000195100000000, -0.0000150800000000, -0.0002004000000000 ]  - [   0.0080095700000000, -0.0023534800000000, -0.0017644800000000 ]  - [  -0.0090390700000000, -0.0037580000000000,  0.0061471400000000 ]  - [  -0.0000007000000000,  0.0000281700000000, -0.0004228200000000 ]  - [  -0.0003503400000000,  0.0018514600000000, -0.0044483900000000 ]  - [  -0.0000019000000000, -0.0000022300000000, -0.0001490000000000 ]  - [  -0.0035495100000000, -0.0001080200000000, -0.0004501700000000 ]  - [  -0.0000062400000000, -0.0000060000000000, -0.0002051900000000 ]  - [   0.0000681500000000, -0.0000391100000000, -0.0002151300000000 ]  - [  -0.0004377500000000, -0.0000696300000000, -0.0003121900000000 ]  - [  -0.0000006100000000,  0.0000770200000000, -0.0002164200000000 ]  - [   0.0000020800000000,  0.0000073800000000, -0.0002032300000000 ]  - [  -0.0002197900000000, -0.0026972300000000,  0.0036083600000000 ]  - [  -0.0000004600000000,  0.0000346600000000, -0.0005663200000000 ]  - [   0.0000204100000000,  0.0004274600000000, -0.0008891800000000 ]  - [   0.0004114800000000, -0.0000559600000000, -0.0002985000000000 ]  - [  -0.0000632200000000, -0.0000355200000000, -0.0002127600000000 ]  - [   0.0038086000000000, -0.0002774500000000, -0.0006479500000000 ]  - [   0.0000044900000000, -0.0000025800000000, -0.0002043400000000 ]  - [   0.0000007700000000,  0.0000012100000000, -0.0002310300000000 ]  - [  -0.0000035000000000, -0.0002925900000000,  0.0005883600000000 ]  - [   0.0000002700000000, -0.0000011200000000, -0.0002570400000000 ]  - [  -0.0000001700000000, -0.0000024100000000, -0.0001830800000000 ]  - [   0.0000090500000000, -0.0000052900000000, -0.0001970500000000 ]  - [  -0.0000043300000000, -0.0000046300000000, -0.0001937600000000 ]  - [   0.0000573700000000, -0.0000334000000000, -0.0002149100000000 ]  - [  -0.0000303000000000, -0.0000199200000000, -0.0001938700000000 ]  - [  -0.0000009000000000,  0.0000638200000000, -0.0002141100000000 ]  - [   0.0000020000000000,  0.0000062500000000, -0.0001943300000000 ]  - [  -0.0000019800000000,  0.0000087700000000, -0.0001973300000000 ]  - [   0.0000004200000000, -0.0000002900000000, -0.0004780800000000 ]  - [   0.0000020100000000,  0.0000333700000000, -0.0001914200000000 ]  - [   0.0000290400000000, -0.0000165400000000, -0.0001916700000000 ]  - [  -0.0000526900000000, -0.0000294400000000, -0.0002124700000000 ]  - [  -0.0000076000000000, -0.0000021200000000, -0.0001958800000000 ]  - [   0.0000027200000000, -0.0000013400000000, -0.0001930000000000 ]  - [   0.0000007700000000,  0.0000011100000000, -0.0002313900000000 ]  - [   0.0000018000000000,  0.0000021000000000, -0.0002306400000000 ]- atom:   12  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0033437600000000,  0.0019305200000000,  0.0061735300000000 ]  - [   0.0000033200000000, -0.0000019200000000,  0.0026573900000000 ]  - [  -0.0000010600000000,  0.0000006100000000,  0.0026461600000000 ]  - [   0.0001248300000000,  0.0000210800000000,  0.0034809300000000 ]  - [   0.0000050300000000, -0.0000029000000000,  0.0039108500000000 ]  - [   0.0000441600000000, -0.0001186400000000,  0.0034809300000000 ]  - [  -0.0001265100000000,  0.0000730400000000,  0.0035377200000000 ]  - [   0.0083299300000000, -0.0048092900000000, -0.0001352000000000 ]  - [   0.0117671100000000, -0.0067937400000000, -0.0075370500000000 ]  - [  -0.0000895400000000,  0.0000517000000000,  0.0048195200000000 ]  - [  -0.0000077100000000,  0.0000044500000000,  0.0038620400000000 ]  - [   0.0001550900000000, -0.0000895400000000, -0.1813704700000000 ]  - [  -0.0154750600000000, -0.0078728200000000, -0.0625584400000000 ]  - [  -0.0009194700000000,  0.0173382000000000, -0.0625584400000000 ]  - [   0.0001120700000000,  0.0015677100000000,  0.0039379000000000 ]  - [  -0.0196528100000000,  0.0113465600000000,  0.0134933400000000 ]  - [  -0.0013016400000000, -0.0008809100000000,  0.0039379000000000 ]  - [  -0.0000914100000000,  0.0000527700000000,  0.0024790100000000 ]  - [  -0.0000017600000000,  0.0000010200000000,  0.0049662100000000 ]  - [   0.0000012000000000, -0.0000006900000000,  0.0038236200000000 ]  - [   0.0002400100000000, -0.0001385700000000,  0.0051622100000000 ]  - [   0.0040542800000000, -0.0023407400000000,  0.0098323900000000 ]  - [  -0.0002998300000000,  0.0001731100000000,  0.0035028200000000 ]  - [  -0.0000007600000000, -0.0003459100000000,  0.0035017400000000 ]  - [   0.0002991900000000,  0.0001736200000000,  0.0035017400000000 ]  - [   0.0001600500000000,  0.0000928500000000,  0.0034732700000000 ]  - [  -0.0000000600000000,  0.0000000400000000,  0.0039167100000000 ]  - [  -0.0000003900000000, -0.0001850300000000,  0.0034732700000000 ]  - [  -0.0001613900000000,  0.0000931800000000,  0.0034720400000000 ]  - [  -0.0000003300000000,  0.0000001900000000,  0.0050090200000000 ]  - [  -0.0000003800000000,  0.0000002200000000,  0.0038651900000000 ]  - [   0.0000009300000000, -0.0000005300000000,  0.0051551900000000 ]  - [   0.0000010100000000, -0.0000005800000000,  0.0038386300000000 ]  - [  -0.0002979200000000,  0.0001720000000000,  0.0035006200000000 ]  - [  -0.0000003200000000, -0.0003421700000000,  0.0034995800000000 ]  - [   0.0002961700000000,  0.0001713600000000,  0.0034995800000000 ]  - [  -0.0000113000000000,  0.0000065200000000, -0.0029815600000000 ]  - [   0.0310326400000000, -0.0179167000000000,  0.0529283700000000 ]  - [   0.0001020400000000, -0.0000589100000000, -0.0025453900000000 ]  - [   0.0021431100000000, -0.0027668800000000,  0.0275548000000000 ]  - [  -0.0038867500000000,  0.0022440200000000,  0.0228293800000000 ]  - [  -0.0005009500000000, -0.0002609000000000, -0.0023929700000000 ]  - [  -0.0235391000000000, -0.0190284600000000,  0.0477512900000000 ]  - [   0.0034677400000000, -0.0004725500000000,  0.0275548000000000 ]  - [   0.0000047300000000,  0.0001250800000000, -0.0025326700000000 ]  - [  -0.0009645800000000,  0.0005569000000000, -0.0029452100000000 ]  - [  -0.0000245300000000,  0.0005642900000000, -0.0023929700000000 ]  - [   0.0004721600000000, -0.0002726000000000, -0.0022614100000000 ]  - [   0.0047095800000000,  0.0298996900000000,  0.0477512900000000 ]  - [  -0.0001059600000000, -0.0000666400000000, -0.0025326700000000 ]  - [  -0.0004514300000000,  0.0002606400000000,  0.0250762000000000 ]  - [   0.0023757100000000, -0.0013716200000000,  0.0393599000000000 ]  - [  -0.0000109300000000,  0.0000063100000000, -0.0025683200000000 ]  - [  -0.0014059100000000,  0.0008117000000000, -0.0018468400000000 ]  - [  -0.0000004700000000,  0.0000002700000000, -0.0020186400000000 ]  - [   0.0005357500000000, -0.0003093200000000, -0.0048341200000000 ]  - [  -0.0000831400000000, -0.0000502500000000, -0.0025195200000000 ]  - [   0.0004763200000000, -0.0002750000000000, -0.0025363800000000 ]  - [  -0.0005971400000000, -0.0000819000000000, -0.0025460700000000 ]  - [  -0.0000009100000000,  0.0005471300000000, -0.0025361400000000 ]  - [   0.0000019500000000,  0.0000971300000000, -0.0025195200000000 ]  - [   0.0018028900000000,  0.0005728200000000, -0.0010657500000000 ]  - [  -0.0000301400000000,  0.0000174000000000, -0.0049100100000000 ]  - [  -0.0002276500000000,  0.0005580900000000, -0.0025460700000000 ]  - [   0.0004907600000000, -0.0002833400000000, -0.0019501200000000 ]  - [  -0.0004742800000000, -0.0002727700000000, -0.0025361400000000 ]  - [   0.0004053700000000, -0.0018477600000000, -0.0010657500000000 ]  - [   0.0000812900000000, -0.0000469300000000, -0.0025193900000000 ]  - [  -0.0000001000000000,  0.0000000600000000, -0.0029982200000000 ]  - [   0.0003883700000000, -0.0002242300000000, -0.0026526400000000 ]  - [   0.0000006600000000, -0.0000003800000000, -0.0029967700000000 ]  - [   0.0000004600000000, -0.0000002600000000, -0.0020546000000000 ]  - [   0.0001029600000000, -0.0000594500000000, -0.0025262600000000 ]  - [  -0.0000802000000000, -0.0000476300000000, -0.0025091600000000 ]  - [   0.0004736000000000, -0.0002734400000000, -0.0025376900000000 ]  - [  -0.0005520900000000, -0.0003211100000000, -0.0023916300000000 ]  - [  -0.0000008200000000,  0.0005428800000000, -0.0025356600000000 ]  - [   0.0000011500000000,  0.0000932800000000, -0.0025091600000000 ]  - [  -0.0000021500000000,  0.0001171300000000, -0.0025262200000000 ]  - [   0.0000003600000000, -0.0000002100000000, -0.0049138500000000 ]  - [   0.0000020500000000,  0.0006386800000000, -0.0023916300000000 ]  - [   0.0005516700000000, -0.0003185100000000, -0.0023912300000000 ]  - [  -0.0004705600000000, -0.0002707200000000, -0.0025356600000000 ]  - [  -0.0001025100000000, -0.0000567000000000, -0.0025262200000000 ]  - [   0.0000774800000000, -0.0000447400000000, -0.0025055800000000 ]  - [   0.0000003300000000, -0.0000001900000000, -0.0029987000000000 ]  - [   0.0000002200000000, -0.0000001200000000, -0.0024529200000000 ]- atom:   12  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0033978200000000, -0.0019617300000000, -0.0062343000000000 ]  - [  -0.0000054600000000,  0.0000031500000000, -0.0026608900000000 ]  - [  -0.0000010600000000,  0.0000006100000000, -0.0026528800000000 ]  - [  -0.0001355800000000, -0.0000277300000000, -0.0035158400000000 ]  - [  -0.0000039100000000,  0.0000022600000000, -0.0039954400000000 ]  - [  -0.0000437700000000,  0.0001312800000000, -0.0035158400000000 ]  - [   0.0001352900000000, -0.0000781100000000, -0.0035722900000000 ]  - [  -0.0082722800000000,  0.0047760000000000,  0.0003694400000000 ]  - [  -0.0118050200000000,  0.0068156300000000,  0.0074484800000000 ]  - [   0.0000868800000000, -0.0000501600000000, -0.0046828800000000 ]  - [   0.0000077500000000, -0.0000044800000000, -0.0039145000000000 ]  - [  -0.0002062800000000,  0.0001190900000000,  0.1800861600000000 ]  - [   0.0154514800000000,  0.0078590900000000,  0.0625238000000000 ]  - [   0.0009195700000000, -0.0173109100000000,  0.0625238000000000 ]  - [  -0.0001268300000000, -0.0015486900000000, -0.0039803700000000 ]  - [   0.0194036000000000, -0.0112026700000000, -0.0133758900000000 ]  - [   0.0012777900000000,  0.0008841900000000, -0.0039803700000000 ]  - [   0.0001054600000000, -0.0000608900000000, -0.0025419400000000 ]  - [   0.0000005200000000, -0.0000003000000000, -0.0049465800000000 ]  - [   0.0000004900000000, -0.0000002900000000, -0.0039109000000000 ]  - [  -0.0002354200000000,  0.0001359200000000, -0.0051282600000000 ]  - [  -0.0039316400000000,  0.0022699300000000, -0.0098017800000000 ]  - [   0.0002913000000000, -0.0001681800000000, -0.0034887600000000 ]  - [  -0.0000012100000000,  0.0003362800000000, -0.0034879300000000 ]  - [  -0.0002918300000000, -0.0001670900000000, -0.0034879300000000 ]  - [  -0.0001751500000000, -0.0001001300000000, -0.0035111700000000 ]  - [  -0.0000001500000000,  0.0000000900000000, -0.0039728900000000 ]  - [  -0.0000008600000000,  0.0002017500000000, -0.0035111700000000 ]  - [   0.0001738900000000, -0.0001004000000000, -0.0035102600000000 ]  - [  -0.0000008700000000,  0.0000005000000000, -0.0049161400000000 ]  - [   0.0000019100000000, -0.0000011000000000, -0.0038527500000000 ]  - [   0.0000007600000000, -0.0000004400000000, -0.0050888100000000 ]  - [   0.0000006700000000, -0.0000003900000000, -0.0039461600000000 ]  - [   0.0002907100000000, -0.0001678400000000, -0.0034910200000000 ]  - [  -0.0000014200000000,  0.0003367800000000, -0.0034900700000000 ]  - [  -0.0002923700000000, -0.0001671600000000, -0.0034900700000000 ]  - [   0.0000113800000000, -0.0000065700000000,  0.0029506700000000 ]  - [  -0.0319234400000000,  0.0184310100000000, -0.0530331400000000 ]  - [  -0.0001133800000000,  0.0000654600000000,  0.0025820400000000 ]  - [  -0.0021428100000000,  0.0034194000000000, -0.0268407900000000 ]  - [   0.0039100700000000, -0.0022574800000000, -0.0228431600000000 ]  - [   0.0005376300000000,  0.0002759700000000,  0.0023642500000000 ]  - [   0.0245073200000000,  0.0196592600000000, -0.0481434500000000 ]  - [  -0.0040326900000000,  0.0001460300000000, -0.0268407900000000 ]  - [  -0.0000089900000000, -0.0001423200000000,  0.0025681900000000 ]  - [   0.0009543400000000, -0.0005509900000000,  0.0028139200000000 ]  - [   0.0000298200000000, -0.0006035800000000,  0.0023642500000000 ]  - [  -0.0005061400000000,  0.0002922200000000,  0.0022317100000000 ]  - [  -0.0047717600000000, -0.0310535900000000, -0.0481434500000000 ]  - [   0.0001187600000000,  0.0000789500000000,  0.0025681900000000 ]  - [   0.0004385600000000, -0.0002532000000000, -0.0250215000000000 ]  - [  -0.0016983600000000,  0.0009805500000000, -0.0386485100000000 ]  - [   0.0000108300000000, -0.0000062500000000,  0.0025197600000000 ]  - [   0.0014119900000000, -0.0008152200000000,  0.0019210000000000 ]  - [  -0.0000011500000000,  0.0000006700000000,  0.0020679600000000 ]  - [  -0.0005406200000000,  0.0003121300000000,  0.0048300000000000 ]  - [   0.0000901400000000,  0.0000498300000000,  0.0025454000000000 ]  - [  -0.0004278200000000,  0.0002470000000000,  0.0025369400000000 ]  - [   0.0006134100000000,  0.0000932100000000,  0.0025450800000000 ]  - [  -0.0000003800000000, -0.0004991800000000,  0.0025401500000000 ]  - [   0.0000019100000000, -0.0001029800000000,  0.0025454000000000 ]  - [  -0.0018152000000000, -0.0006061800000000,  0.0011284700000000 ]  - [   0.0000306400000000, -0.0000176900000000,  0.0047534500000000 ]  - [   0.0002259800000000, -0.0005778400000000,  0.0025450800000000 ]  - [  -0.0005085900000000,  0.0002936300000000,  0.0019541200000000 ]  - [   0.0004321100000000,  0.0002499200000000,  0.0025401500000000 ]  - [  -0.0003826300000000,  0.0018751000000000,  0.0011284700000000 ]  - [  -0.0000919300000000,  0.0000530700000000,  0.0025458300000000 ]  - [   0.0000002300000000, -0.0000001300000000,  0.0030596600000000 ]  - [  -0.0003785500000000,  0.0002185600000000,  0.0025719700000000 ]  - [   0.0000006200000000, -0.0000003600000000,  0.0029889400000000 ]  - [   0.0000009000000000, -0.0000005200000000,  0.0020345400000000 ]  - [  -0.0000998200000000,  0.0000576300000000,  0.0025636400000000 ]  - [   0.0000889600000000,  0.0000486800000000,  0.0025533600000000 ]  - [  -0.0004356500000000,  0.0002515300000000,  0.0025390400000000 ]  - [   0.0005911000000000,  0.0003388700000000,  0.0024173900000000 ]  - [  -0.0000010100000000, -0.0005071200000000,  0.0025407700000000 ]  - [   0.0000023200000000, -0.0001013800000000,  0.0025533600000000 ]  - [  -0.0000020800000000, -0.0001171000000000,  0.0025637700000000 ]  - [   0.0000004000000000, -0.0000002300000000,  0.0047828000000000 ]  - [   0.0000020800000000, -0.0006813400000000,  0.0024173900000000 ]  - [  -0.0005914800000000,  0.0003414900000000,  0.0024177900000000 ]  - [   0.0004386700000000,  0.0002544300000000,  0.0025407700000000 ]  - [   0.0001003700000000,  0.0000603500000000,  0.0025637700000000 ]  - [  -0.0000908100000000,  0.0000524300000000,  0.0025512200000000 ]  - [  -0.0000003100000000,  0.0000001800000000,  0.0030617000000000 ]  - [   0.0000002500000000, -0.0000001400000000,  0.0024067900000000 ]- atom:   37  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000035300000000,  0.0000002300000000,  0.0000021100000000 ]  - [  -0.0000011000000000,  0.0000006300000000, -0.0000000500000000 ]  - [  -0.0000277300000000,  0.0000008100000000, -0.0000013400000000 ]  - [   0.0094027000000000, -0.0036212600000000, -0.0021242100000000 ]  - [  -0.0041173100000000,  0.0000543700000000, -0.0000097900000000 ]  - [   0.0156660000000000, -0.0000097100000000, -0.0000060600000000 ]  - [   0.0104232100000000,  0.0030165400000000,  0.0029876300000000 ]  - [   0.0001072000000000,  0.0000006200000000,  0.0000495700000000 ]  - [   0.0000050400000000, -0.0000004900000000, -0.0000129200000000 ]  - [  -0.0090745100000000, -0.0000156900000000,  0.0000661000000000 ]  - [  -0.0049923900000000, -0.0000686000000000, -0.0000161100000000 ]  - [  -0.0000047200000000, -0.0000101000000000, -0.0000141000000000 ]  - [  -0.0000216700000000, -0.0000055600000000, -0.0000031000000000 ]  - [   0.0000048600000000,  0.0000149900000000,  0.0000083100000000 ]  - [  -0.0000072300000000, -0.0000030800000000, -0.0000217000000000 ]  - [  -0.0000028700000000, -0.0000003000000000, -0.0000359100000000 ]  - [  -0.0000014700000000,  0.0000085300000000, -0.0000220300000000 ]  - [   0.0000069900000000, -0.0000046900000000, -0.0000224400000000 ]  - [  -0.0000008800000000,  0.0000003000000000,  0.0000128100000000 ]  - [  -0.0000012100000000, -0.0000003900000000, -0.0000420300000000 ]  - [   0.0000006500000000, -0.0000002900000000,  0.0000194300000000 ]  - [   0.0000010800000000, -0.0000001300000000, -0.0000069300000000 ]  - [  -0.0000052000000000,  0.0000025500000000,  0.0000088900000000 ]  - [  -0.0000018700000000, -0.0000053700000000,  0.0000092600000000 ]  - [   0.0000036400000000,  0.0000037900000000,  0.0000097700000000 ]  - [  -0.0000076800000000, -0.0000039500000000, -0.0000178700000000 ]  - [  -0.0000011500000000, -0.0000000500000000, -0.0000256500000000 ]  - [   0.0000002600000000,  0.0000079000000000, -0.0000171400000000 ]  - [   0.0000059500000000, -0.0000026600000000, -0.0000169400000000 ]  - [   0.0002792700000000, -0.0000015500000000,  0.0000495700000000 ]  - [   0.0171117300000000, -0.0000346800000000,  0.0003099500000000 ]  - [   0.0000007300000000, -0.0000008200000000,  0.0000359900000000 ]  - [   0.0000009500000000, -0.0000001800000000, -0.0000518000000000 ]  - [   0.0003669500000000, -0.0018448200000000, -0.0014022300000000 ]  - [  -0.0028501200000000,  0.0000010800000000,  0.0000152900000000 ]  - [   0.0003443800000000,  0.0018569100000000,  0.0014158000000000 ]  - [  -0.1100996300000000,  0.0006822000000000, -0.0013103200000000 ]  - [  -0.0000125700000000, -0.0000020600000000,  0.0000320500000000 ]  - [   0.0069614500000000,  0.0182112600000000,  0.0003580700000000 ]  - [   0.0000030100000000,  0.0000019300000000,  0.0000113000000000 ]  - [   0.0000374300000000, -0.0000221800000000, -0.0000474700000000 ]  - [   0.0100133600000000,  0.0075707400000000,  0.0161045600000000 ]  - [  -0.0000023500000000,  0.0000149000000000,  0.0000049700000000 ]  - [  -0.0000020700000000, -0.0000038000000000,  0.0000167300000000 ]  - [   0.0385504000000000, -0.0000280800000000,  0.0000051400000000 ]  - [   0.0017152700000000,  0.0000039500000000, -0.0000499500000000 ]  - [  -0.0030481400000000,  0.0000300900000000, -0.0000674800000000 ]  - [   0.0099856200000000, -0.0074955000000000, -0.0159708700000000 ]  - [   0.0000126500000000,  0.0000096600000000,  0.0000596700000000 ]  - [   0.0070091900000000, -0.0182328700000000, -0.0003235100000000 ]  - [  -0.0000066800000000,  0.0000017700000000,  0.0000199700000000 ]  - [   0.0000097000000000,  0.0000008000000000,  0.0000054100000000 ]  - [   0.0007994600000000, -0.0000109500000000, -0.0000175300000000 ]  - [  -0.0000008200000000, -0.0000009300000000,  0.0000255100000000 ]  - [  -0.0000021300000000, -0.0000018900000000,  0.0000268200000000 ]  - [  -0.0000105400000000,  0.0000061600000000,  0.0000168800000000 ]  - [   0.0000001500000000, -0.0000021200000000,  0.0000075900000000 ]  - [   0.0000231100000000, -0.0000135800000000,  0.0000003000000000 ]  - [   0.0000051600000000,  0.0000009600000000, -0.0000038800000000 ]  - [  -0.0000009500000000,  0.0000245300000000,  0.0000007800000000 ]  - [   0.0000017800000000, -0.0000003600000000,  0.0000094800000000 ]  - [  -0.0000019200000000, -0.0000140100000000,  0.0000168700000000 ]  - [   0.0000002400000000, -0.0000001300000000, -0.0000811400000000 ]  - [   0.0000017400000000, -0.0000084400000000, -0.0000023700000000 ]  - [  -0.0000071400000000,  0.0000041600000000, -0.0000024800000000 ]  - [  -0.0000188100000000, -0.0000099800000000,  0.0000028200000000 ]  - [   0.0000118900000000,  0.0000091100000000,  0.0000190900000000 ]  - [  -0.0000024500000000,  0.0000012500000000,  0.0000084700000000 ]  - [   0.0000004800000000,  0.0000010400000000,  0.0000240900000000 ]  - [   0.0000013500000000,  0.0000019900000000, -0.0000428800000000 ]  - [  -0.0000002400000000, -0.0000010900000000, -0.0000028300000000 ]  - [   0.0016306200000000, -0.0000084100000000, -0.0000054600000000 ]  - [  -0.0000012700000000,  0.0000005100000000,  0.0000185900000000 ]  - [   0.0033685400000000,  0.0032906000000000,  0.0063262800000000 ]  - [  -0.0000257800000000, -0.0003077900000000,  0.0002559200000000 ]  - [   0.0000167800000000,  0.0000076300000000,  0.0000078800000000 ]  - [  -0.0005627900000000,  0.0000196500000000, -0.0000029600000000 ]  - [  -0.0023655500000000, -0.0000269000000000,  0.0000518900000000 ]  - [  -0.0000021000000000, -0.0000026900000000,  0.0000184900000000 ]  - [  -0.0000188500000000, -0.0000000800000000, -0.0000683800000000 ]  - [   0.0000013300000000, -0.0000216300000000,  0.0000116900000000 ]  - [  -0.0000193600000000,  0.0000109700000000,  0.0000122500000000 ]  - [  -0.0000619400000000,  0.0002916400000000, -0.0002538600000000 ]  - [   0.0000019700000000,  0.0000034000000000,  0.0000199000000000 ]  - [   0.0033642300000000, -0.0033281900000000, -0.0063634200000000 ]  - [   0.0001299200000000,  0.0000058300000000,  0.0000147600000000 ]  - [   0.0000012400000000,  0.0000020800000000, -0.0000275700000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0014127900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022643000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022395200000000 ]  - [   0.0051838300000000,  0.0029928800000000,  0.0396230300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0234949800000000 ]  - [   0.0000000000000000, -0.0059857700000000,  0.0396230300000000 ]  - [  -0.0051838300000000,  0.0029928800000000,  0.0396230300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0047869400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033068800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0002568300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0219249700000000 ]  - [   0.0002523100000000, -0.0001456700000000, -0.0029603200000000 ]  - [   0.0000000000000000,  0.0002913400000000, -0.0029603200000000 ]  - [  -0.0002523100000000, -0.0001456700000000, -0.0029603200000000 ]  - [  -0.0001506600000000, -0.0000869900000000, -0.0030061300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034060900000000 ]  - [   0.0000000000000000,  0.0001739700000000, -0.0030061300000000 ]  - [   0.0001506600000000, -0.0000869900000000, -0.0030061300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042252300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033453900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043593400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033385700000000 ]  - [   0.0002474000000000, -0.0001428400000000, -0.0029766000000000 ]  - [   0.0000000000000000,  0.0002856800000000, -0.0029766000000000 ]  - [  -0.0002474000000000, -0.0001428400000000, -0.0029766000000000 ]  - [  -0.0001511900000000, -0.0000872900000000, -0.0030025600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033960000000000 ]  - [   0.0000000000000000,  0.0001745800000000, -0.0030025600000000 ]  - [   0.0001511900000000, -0.0000872900000000, -0.0030025600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042061800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1025423900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0043068900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033792000000000 ]  - [   0.0044526500000000, -0.0025707400000000, -0.0018710700000000 ]  - [   0.0000000000000000,  0.0051414800000000, -0.0018710700000000 ]  - [  -0.0044526500000000, -0.0025707400000000, -0.0018710700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2466068200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017574300000000 ]  - [   0.0009272900000000, -0.0005353700000000, -0.0196980100000000 ]  - [   0.0000849300000000,  0.0000490300000000,  0.0021781300000000 ]  - [  -0.0005126000000000,  0.0002959500000000,  0.0022104600000000 ]  - [   0.0184411500000000,  0.0106470000000000,  0.0130723100000000 ]  - [   0.0000000000000000, -0.0005919000000000,  0.0022104600000000 ]  - [   0.0000000000000000, -0.0000980700000000,  0.0021781300000000 ]  - [   0.0000000000000000,  0.0010707400000000, -0.0196980100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0063317100000000 ]  - [   0.0000000000000000, -0.0212940000000000,  0.0130723100000000 ]  - [  -0.0184411500000000,  0.0106470000000000,  0.0130723100000000 ]  - [   0.0005126000000000,  0.0002959500000000,  0.0022104600000000 ]  - [  -0.0009272900000000, -0.0005353700000000, -0.0196980100000000 ]  - [  -0.0000849300000000,  0.0000490300000000,  0.0021781300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026251100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0100002600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0025744600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017661500000000 ]  - [  -0.0000941000000000,  0.0000543300000000,  0.0021883000000000 ]  - [   0.0000782900000000,  0.0000452000000000,  0.0021758400000000 ]  - [  -0.0003651200000000,  0.0002108000000000,  0.0021658300000000 ]  - [   0.0004966600000000,  0.0002867500000000,  0.0020537300000000 ]  - [   0.0000000000000000, -0.0004216100000000,  0.0021658300000000 ]  - [   0.0000000000000000, -0.0000904000000000,  0.0021758400000000 ]  - [   0.0000000000000000, -0.0001086600000000,  0.0021883000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040600800000000 ]  - [   0.0000000000000000, -0.0005734900000000,  0.0020537300000000 ]  - [  -0.0004966600000000,  0.0002867500000000,  0.0020537300000000 ]  - [   0.0003651200000000,  0.0002108000000000,  0.0021658300000000 ]  - [   0.0000941000000000,  0.0000543300000000,  0.0021883000000000 ]  - [  -0.0000782900000000,  0.0000452000000000,  0.0021758400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026181200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020417000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0025480900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040297500000000 ]  - [  -0.0000828900000000,  0.0000478600000000,  0.0021901200000000 ]  - [   0.0072501900000000,  0.0041859000000000,  0.0042659900000000 ]  - [   0.0002942700000000, -0.0001698900000000,  0.0013213500000000 ]  - [   0.0005005000000000,  0.0002889700000000,  0.0020641800000000 ]  - [   0.0000000000000000,  0.0003397900000000,  0.0013213500000000 ]  - [   0.0000000000000000, -0.0083718000000000,  0.0042659900000000 ]  - [   0.0000000000000000, -0.0000957200000000,  0.0021901200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0039075800000000 ]  - [   0.0000000000000000, -0.0005779300000000,  0.0020641800000000 ]  - [  -0.0005005000000000,  0.0002889700000000,  0.0020641800000000 ]  - [  -0.0002942700000000, -0.0001698900000000,  0.0013213500000000 ]  - [   0.0000828900000000,  0.0000478600000000,  0.0021901200000000 ]  - [  -0.0072501900000000,  0.0041859000000000,  0.0042659900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059335200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020508300000000 ]- atom:   37  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0014287400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022721900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022451000000000 ]  - [  -0.0060130000000000, -0.0034716100000000, -0.0389842600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0238924800000000 ]  - [   0.0000000000000000,  0.0069432100000000, -0.0389842600000000 ]  - [   0.0060130000000000, -0.0034716100000000, -0.0389842600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049008900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0032942500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000872300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0221849100000000 ]  - [  -0.0002620600000000,  0.0001513000000000,  0.0029659700000000 ]  - [   0.0000000000000000, -0.0003026000000000,  0.0029659700000000 ]  - [   0.0002620600000000,  0.0001513000000000,  0.0029659700000000 ]  - [   0.0001364600000000,  0.0000787800000000,  0.0029738800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033468300000000 ]  - [   0.0000000000000000, -0.0001575700000000,  0.0029738800000000 ]  - [  -0.0001364600000000,  0.0000787800000000,  0.0029738800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042682400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0032759200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044148900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033378900000000 ]  - [  -0.0002569700000000,  0.0001483600000000,  0.0030067100000000 ]  - [   0.0000000000000000, -0.0002967300000000,  0.0030067100000000 ]  - [   0.0002569700000000,  0.0001483600000000,  0.0030067100000000 ]  - [   0.0001382600000000,  0.0000798200000000,  0.0029799100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033581100000000 ]  - [   0.0000000000000000, -0.0001596500000000,  0.0029799100000000 ]  - [  -0.0001382600000000,  0.0000798200000000,  0.0029799100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043245300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1100383200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043954300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0032890000000000 ]  - [  -0.0044914600000000,  0.0025931500000000,  0.0018949700000000 ]  - [   0.0000000000000000, -0.0051862900000000,  0.0018949700000000 ]  - [   0.0044914600000000,  0.0025931500000000,  0.0018949700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2518178300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017086600000000 ]  - [  -0.0009513300000000,  0.0005492500000000,  0.0198500700000000 ]  - [  -0.0000708100000000, -0.0000408800000000, -0.0021471800000000 ]  - [   0.0005415000000000, -0.0003126300000000, -0.0022114900000000 ]  - [  -0.0181455400000000, -0.0104763300000000, -0.0128896700000000 ]  - [   0.0000000000000000,  0.0006252700000000, -0.0022114900000000 ]  - [   0.0000000000000000,  0.0000817600000000, -0.0021471800000000 ]  - [   0.0000000000000000, -0.0010985000000000,  0.0198500700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0064345500000000 ]  - [   0.0000000000000000,  0.0209526700000000, -0.0128896700000000 ]  - [   0.0181455400000000, -0.0104763300000000, -0.0128896700000000 ]  - [  -0.0005415000000000, -0.0003126300000000, -0.0022114900000000 ]  - [   0.0009513300000000,  0.0005492500000000,  0.0198500700000000 ]  - [   0.0000708100000000, -0.0000408800000000, -0.0021471800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0026141600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0099324600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025446900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017302300000000 ]  - [   0.0000792100000000, -0.0000457300000000, -0.0021678600000000 ]  - [  -0.0000702800000000, -0.0000405700000000, -0.0021595700000000 ]  - [   0.0004122300000000, -0.0002380000000000, -0.0021759900000000 ]  - [  -0.0004829100000000, -0.0002788100000000, -0.0020654200000000 ]  - [   0.0000000000000000,  0.0004760100000000, -0.0021759900000000 ]  - [   0.0000000000000000,  0.0000811500000000, -0.0021595700000000 ]  - [   0.0000000000000000,  0.0000914600000000, -0.0021678600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042400400000000 ]  - [   0.0000000000000000,  0.0005576200000000, -0.0020654200000000 ]  - [   0.0004829100000000, -0.0002788100000000, -0.0020654200000000 ]  - [  -0.0004122300000000, -0.0002380000000000, -0.0021759900000000 ]  - [  -0.0000792100000000, -0.0000457300000000, -0.0021678600000000 ]  - [   0.0000702800000000, -0.0000405700000000, -0.0021595700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025683900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0021264300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025737900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0040864400000000 ]  - [   0.0000875900000000, -0.0000505700000000, -0.0021669500000000 ]  - [  -0.0073681700000000, -0.0042540200000000, -0.0043183600000000 ]  - [  -0.0002634600000000,  0.0001521100000000, -0.0013262600000000 ]  - [  -0.0004633800000000, -0.0002675300000000, -0.0020490300000000 ]  - [   0.0000000000000000, -0.0003042200000000, -0.0013262600000000 ]  - [   0.0000000000000000,  0.0085080300000000, -0.0043183600000000 ]  - [   0.0000000000000000,  0.0001011400000000, -0.0021669500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0040604200000000 ]  - [   0.0000000000000000,  0.0005350600000000, -0.0020490300000000 ]  - [   0.0004633800000000, -0.0002675300000000, -0.0020490300000000 ]  - [   0.0002634600000000,  0.0001521100000000, -0.0013262600000000 ]  - [  -0.0000875900000000, -0.0000505700000000, -0.0021669500000000 ]  - [   0.0073681700000000, -0.0042540200000000, -0.0043183600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0060659800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0021060100000000 ]- atom:   38  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0010239500000000,  0.0000104200000000,  0.0000078300000000 ]  - [  -0.0000024100000000,  0.0000005900000000,  0.0000017600000000 ]  - [  -0.0000013900000000,  0.0000006800000000,  0.0000005200000000 ]  - [  -0.0000055100000000, -0.0000332400000000, -0.0000519000000000 ]  - [   0.0000069500000000, -0.0000004000000000, -0.0000369100000000 ]  - [   0.0000513200000000,  0.0000067100000000, -0.0000132000000000 ]  - [   0.0000045800000000,  0.0000265400000000,  0.0000262900000000 ]  - [  -0.0057899700000000, -0.0000733300000000,  0.0000523200000000 ]  - [  -0.0096789900000000, -0.0000190200000000, -0.0000250900000000 ]  - [  -0.0000604000000000,  0.0000014200000000,  0.0000722700000000 ]  - [  -0.0000098200000000,  0.0000005600000000, -0.0000212700000000 ]  - [   0.0641691700000000, -0.0271752400000000,  0.0325834200000000 ]  - [   0.0174862000000000, -0.0002456800000000, -0.0001474000000000 ]  - [   0.0609426100000000,  0.0248851700000000, -0.0304047500000000 ]  - [  -0.0000050600000000, -0.0003110400000000, -0.0004055000000000 ]  - [   0.0070164700000000,  0.0000148400000000, -0.0000136700000000 ]  - [   0.0005374700000000,  0.0000099300000000, -0.0000176900000000 ]  - [   0.0000149300000000,  0.0003038500000000,  0.0003653400000000 ]  - [   0.0000002500000000,  0.0000002600000000,  0.0000163500000000 ]  - [   0.0000002800000000, -0.0000003600000000, -0.0000392800000000 ]  - [  -0.0001438800000000, -0.0000006900000000,  0.0000230400000000 ]  - [  -0.0000434600000000, -0.0000031600000000, -0.0000140500000000 ]  - [  -0.0000043500000000,  0.0000021100000000,  0.0000117300000000 ]  - [  -0.0000017700000000, -0.0000055800000000,  0.0000117400000000 ]  - [   0.0000047700000000,  0.0000043800000000,  0.0000118500000000 ]  - [  -0.0000090300000000, -0.0000038500000000, -0.0000147800000000 ]  - [   0.0000005300000000, -0.0000000900000000, -0.0000227800000000 ]  - [  -0.0000013100000000,  0.0000077400000000, -0.0000145400000000 ]  - [   0.0000043400000000, -0.0000026700000000, -0.0000148300000000 ]  - [  -0.0000005000000000,  0.0000003000000000,  0.0000529900000000 ]  - [   0.0000017000000000, -0.0000010400000000,  0.0000114400000000 ]  - [  -0.0000013900000000, -0.0000008200000000,  0.0000396200000000 ]  - [  -0.0000013600000000, -0.0000001700000000, -0.0000488500000000 ]  - [  -0.0000042200000000,  0.0000026600000000,  0.0000098600000000 ]  - [  -0.0000003000000000, -0.0000034500000000,  0.0000094100000000 ]  - [   0.0000027300000000,  0.0000021400000000,  0.0000092800000000 ]  - [  -0.0000112600000000, -0.0000010100000000, -0.0000160300000000 ]  - [  -0.2087773100000000,  0.0024987000000000, -0.0021816000000000 ]  - [  -0.0000097600000000,  0.0000099400000000,  0.0000066800000000 ]  - [   0.0097932600000000,  0.0081651200000000,  0.0203361000000000 ]  - [   0.0077853400000000,  0.0203005300000000, -0.0001339200000000 ]  - [   0.0000189900000000,  0.0000312800000000, -0.0000679400000000 ]  - [   0.0429592000000000,  0.0000064600000000,  0.0000235500000000 ]  - [  -0.0042740200000000,  0.0000656500000000, -0.0000515700000000 ]  - [   0.0000050200000000, -0.0000111600000000,  0.0000156300000000 ]  - [   0.0008581600000000,  0.0000080500000000, -0.0000533000000000 ]  - [  -0.0000374800000000, -0.0000201900000000, -0.0000176000000000 ]  - [  -0.0000125000000000, -0.0000155800000000,  0.0000321300000000 ]  - [   0.0077843800000000, -0.0203097900000000,  0.0001677800000000 ]  - [   0.0000072300000000,  0.0000024800000000,  0.0000269400000000 ]  - [   0.0098545900000000, -0.0081143000000000, -0.0201315100000000 ]  - [   0.0008618600000000, -0.0000133200000000,  0.0000296100000000 ]  - [   0.0000137400000000,  0.0000021500000000, -0.0000306700000000 ]  - [   0.0016305300000000,  0.0000025600000000,  0.0000201200000000 ]  - [  -0.0000022500000000, -0.0000019200000000,  0.0000250000000000 ]  - [  -0.0002313800000000, -0.0007758200000000,  0.0007884100000000 ]  - [   0.0000003900000000, -0.0000020800000000,  0.0000061000000000 ]  - [   0.0000239900000000, -0.0000139900000000, -0.0000022500000000 ]  - [   0.0000567400000000,  0.0000033100000000,  0.0002012000000000 ]  - [  -0.0000007600000000,  0.0000249800000000, -0.0000010500000000 ]  - [   0.0000018800000000, -0.0000005600000000,  0.0000080400000000 ]  - [  -0.0015712900000000, -0.0000148300000000,  0.0000219800000000 ]  - [   0.0000230200000000, -0.0000001000000000, -0.0000845300000000 ]  - [   0.0000497600000000, -0.0000074100000000, -0.0000047400000000 ]  - [   0.0000463200000000,  0.0000013300000000, -0.0002103300000000 ]  - [  -0.0000187700000000, -0.0000100600000000,  0.0000017100000000 ]  - [  -0.0002033800000000,  0.0007874600000000, -0.0007559600000000 ]  - [  -0.0000024900000000,  0.0000013000000000,  0.0000069700000000 ]  - [   0.0000007400000000,  0.0000010100000000,  0.0000221500000000 ]  - [  -0.0000808200000000,  0.0000015100000000, -0.0000440100000000 ]  - [   0.0000000600000000, -0.0000010900000000, -0.0000052700000000 ]  - [  -0.0000005700000000, -0.0000025900000000, -0.0000098000000000 ]  - [  -0.0000007900000000,  0.0000001700000000,  0.0000167000000000 ]  - [   0.0000021200000000, -0.0000003600000000,  0.0000147200000000 ]  - [   0.0000185300000000, -0.0000110000000000, -0.0000018000000000 ]  - [   0.0000169200000000,  0.0000074100000000,  0.0000075000000000 ]  - [  -0.0000009700000000,  0.0000191200000000, -0.0000008200000000 ]  - [   0.0000008900000000, -0.0000018800000000,  0.0000172300000000 ]  - [  -0.0000021600000000, -0.0000023700000000,  0.0000165900000000 ]  - [  -0.0000001600000000, -0.0000003800000000, -0.0000715800000000 ]  - [   0.0000018200000000, -0.0000212700000000,  0.0000102300000000 ]  - [  -0.0000185200000000,  0.0000107500000000,  0.0000098100000000 ]  - [  -0.0000142000000000, -0.0000071500000000,  0.0000010700000000 ]  - [   0.0000018100000000,  0.0000033100000000,  0.0000179000000000 ]  - [  -0.0000044600000000,  0.0000020900000000,  0.0000183800000000 ]  - [   0.0000011700000000,  0.0000010300000000,  0.0000244200000000 ]  - [   0.0000016400000000,  0.0000020400000000, -0.0000289400000000 ]- atom:   38  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0001729900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015359100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0015522800000000 ]  - [  -0.0002126600000000, -0.0001227800000000, -0.0021145600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023426000000000 ]  - [   0.0000000000000000,  0.0002455500000000, -0.0021145600000000 ]  - [   0.0002126600000000, -0.0001227800000000, -0.0021145600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0099719300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0059528000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0021214600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023362300000000 ]  - [   0.0312616200000000, -0.0180489000000000,  0.0530503400000000 ]  - [   0.0000000000000000,  0.0360978100000000,  0.0530503400000000 ]  - [  -0.0312616200000000, -0.0180489000000000,  0.0530503400000000 ]  - [   0.0007049500000000,  0.0004070100000000, -0.0022432300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0051790000000000 ]  - [   0.0000000000000000, -0.0008140100000000, -0.0022432300000000 ]  - [  -0.0007049500000000,  0.0004070100000000, -0.0022432300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029026000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023050800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029330700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020435300000000 ]  - [   0.0001684700000000, -0.0000972600000000, -0.0020361200000000 ]  - [   0.0000000000000000,  0.0001945300000000, -0.0020361200000000 ]  - [  -0.0001684700000000, -0.0000972600000000, -0.0020361200000000 ]  - [  -0.0001047600000000, -0.0000604800000000, -0.0020621400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023346900000000 ]  - [   0.0000000000000000,  0.0001209700000000, -0.0020621400000000 ]  - [   0.0001047600000000, -0.0000604800000000, -0.0020621400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0028563700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0022537200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029633500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023329400000000 ]  - [   0.0001708100000000, -0.0000986200000000, -0.0020385100000000 ]  - [   0.0000000000000000,  0.0001972400000000, -0.0020385100000000 ]  - [  -0.0001708100000000, -0.0000986200000000, -0.0020385100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017214200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1578185600000000 ]  - [  -0.0000332600000000,  0.0000192000000000,  0.0015037000000000 ]  - [   0.0171211100000000,  0.0098848800000000,  0.0121541400000000 ]  - [   0.0016474100000000, -0.0009511300000000, -0.0139427000000000 ]  - [   0.0001547000000000,  0.0000893100000000,  0.0013658100000000 ]  - [   0.0000000000000000,  0.0019022600000000, -0.0139427000000000 ]  - [   0.0000000000000000, -0.0197697500000000,  0.0121541400000000 ]  - [   0.0000000000000000, -0.0000384000000000,  0.0015037000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011143100000000 ]  - [   0.0000000000000000, -0.0001786300000000,  0.0013658100000000 ]  - [  -0.0001547000000000,  0.0000893100000000,  0.0013658100000000 ]  - [  -0.0016474100000000, -0.0009511300000000, -0.0139427000000000 ]  - [   0.0000332600000000,  0.0000192000000000,  0.0015037000000000 ]  - [  -0.0171211100000000,  0.0098848800000000,  0.0121541400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0099564600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011416700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040976000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0012189200000000 ]  - [   0.0004293100000000, -0.0002478600000000,  0.0007071000000000 ]  - [   0.0000539000000000,  0.0000311200000000,  0.0014938400000000 ]  - [  -0.0002461000000000,  0.0001420900000000,  0.0014863200000000 ]  - [   0.0005375500000000,  0.0003103600000000,  0.0015274600000000 ]  - [   0.0000000000000000, -0.0002841800000000,  0.0014863200000000 ]  - [   0.0000000000000000, -0.0000622400000000,  0.0014938400000000 ]  - [   0.0000000000000000,  0.0004957200000000,  0.0007071000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027923600000000 ]  - [   0.0000000000000000, -0.0006207100000000,  0.0015274600000000 ]  - [  -0.0005375500000000,  0.0003103600000000,  0.0015274600000000 ]  - [   0.0002461000000000,  0.0001420900000000,  0.0014863200000000 ]  - [  -0.0004293100000000, -0.0002478600000000,  0.0007071000000000 ]  - [  -0.0000539000000000,  0.0000311200000000,  0.0014938400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018020400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010678800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017470200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011862300000000 ]  - [  -0.0000590000000000,  0.0000340600000000,  0.0015073500000000 ]  - [   0.0000533600000000,  0.0000308100000000,  0.0015038000000000 ]  - [  -0.0002487400000000,  0.0001436100000000,  0.0014864200000000 ]  - [   0.0003534800000000,  0.0002040800000000,  0.0014188600000000 ]  - [   0.0000000000000000, -0.0002872200000000,  0.0014864200000000 ]  - [   0.0000000000000000, -0.0000616200000000,  0.0015038000000000 ]  - [   0.0000000000000000, -0.0000681300000000,  0.0015073500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027679600000000 ]  - [   0.0000000000000000, -0.0004081600000000,  0.0014188600000000 ]  - [  -0.0003534800000000,  0.0002040800000000,  0.0014188600000000 ]  - [   0.0002487400000000,  0.0001436100000000,  0.0014864200000000 ]  - [   0.0000590000000000,  0.0000340600000000,  0.0015073500000000 ]  - [  -0.0000533600000000,  0.0000308100000000,  0.0015038000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017981700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0013984900000000 ]- atom:   38  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0001589900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015344300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0015476300000000 ]  - [   0.0002024100000000,  0.0001168600000000,  0.0020817200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022601500000000 ]  - [   0.0000000000000000, -0.0002337300000000,  0.0020817200000000 ]  - [  -0.0002024100000000,  0.0001168600000000,  0.0020817200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0099614200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059222400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022463000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022861800000000 ]  - [  -0.0302677700000000,  0.0174751000000000, -0.0529114200000000 ]  - [   0.0000000000000000, -0.0349502100000000, -0.0529114200000000 ]  - [   0.0302677700000000,  0.0174751000000000, -0.0529114200000000 ]  - [  -0.0007129100000000, -0.0004116000000000,  0.0021955600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0051029300000000 ]  - [   0.0000000000000000,  0.0008232000000000,  0.0021955600000000 ]  - [   0.0007129100000000, -0.0004116000000000,  0.0021955600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029249500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022197600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029696500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020323300000000 ]  - [  -0.0001769500000000,  0.0001021600000000,  0.0020526300000000 ]  - [   0.0000000000000000, -0.0002043300000000,  0.0020526300000000 ]  - [   0.0001769500000000,  0.0001021600000000,  0.0020526300000000 ]  - [   0.0000912300000000,  0.0000526700000000,  0.0020258200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022811100000000 ]  - [   0.0000000000000000, -0.0001053500000000,  0.0020258200000000 ]  - [  -0.0000912300000000,  0.0000526700000000,  0.0020258200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0029520400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022678500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0030322000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022275500000000 ]  - [  -0.0001764300000000,  0.0001018600000000,  0.0020506200000000 ]  - [   0.0000000000000000, -0.0002037200000000,  0.0020506200000000 ]  - [   0.0001764300000000,  0.0001018600000000,  0.0020506200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017553800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1567065900000000 ]  - [   0.0000198500000000, -0.0000114600000000, -0.0014693800000000 ]  - [  -0.0168112900000000, -0.0097060000000000, -0.0118578000000000 ]  - [  -0.0016178200000000,  0.0009340500000000,  0.0139552800000000 ]  - [  -0.0001175600000000, -0.0000678700000000, -0.0013940300000000 ]  - [   0.0000000000000000, -0.0018680900000000,  0.0139552800000000 ]  - [   0.0000000000000000,  0.0194120000000000, -0.0118578000000000 ]  - [   0.0000000000000000,  0.0000229200000000, -0.0014693800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010474200000000 ]  - [   0.0000000000000000,  0.0001357400000000, -0.0013940300000000 ]  - [   0.0001175600000000, -0.0000678700000000, -0.0013940300000000 ]  - [   0.0016178200000000,  0.0009340500000000,  0.0139552800000000 ]  - [  -0.0000198500000000, -0.0000114600000000, -0.0014693800000000 ]  - [   0.0168112900000000, -0.0097060000000000, -0.0118578000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0099139800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011904100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0040252900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011713400000000 ]  - [  -0.0004460000000000,  0.0002575000000000, -0.0006813400000000 ]  - [  -0.0000474200000000, -0.0000273800000000, -0.0014690200000000 ]  - [   0.0002904100000000, -0.0001676700000000, -0.0014842000000000 ]  - [  -0.0005207100000000, -0.0003006300000000, -0.0015280800000000 ]  - [   0.0000000000000000,  0.0003353300000000, -0.0014842000000000 ]  - [   0.0000000000000000,  0.0000547600000000, -0.0014690200000000 ]  - [   0.0000000000000000, -0.0005150000000000, -0.0006813400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029508600000000 ]  - [   0.0000000000000000,  0.0006012700000000, -0.0015280800000000 ]  - [   0.0005207100000000, -0.0003006300000000, -0.0015280800000000 ]  - [  -0.0002904100000000, -0.0001676700000000, -0.0014842000000000 ]  - [   0.0004460000000000,  0.0002575000000000, -0.0006813400000000 ]  - [   0.0000474200000000, -0.0000273800000000, -0.0014690200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017441900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011507400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017561300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0012069600000000 ]  - [   0.0000605400000000, -0.0000349500000000, -0.0014712400000000 ]  - [  -0.0000443800000000, -0.0000256200000000, -0.0014599200000000 ]  - [   0.0002825900000000, -0.0001631600000000, -0.0014835200000000 ]  - [  -0.0003152300000000, -0.0001820000000000, -0.0013941200000000 ]  - [   0.0000000000000000,  0.0003263100000000, -0.0014835200000000 ]  - [   0.0000000000000000,  0.0000512400000000, -0.0014599200000000 ]  - [   0.0000000000000000,  0.0000699100000000, -0.0014712400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0029031500000000 ]  - [   0.0000000000000000,  0.0003640000000000, -0.0013941200000000 ]  - [   0.0003152300000000, -0.0001820000000000, -0.0013941200000000 ]  - [  -0.0002825900000000, -0.0001631600000000, -0.0014835200000000 ]  - [  -0.0000605400000000, -0.0000349500000000, -0.0014712400000000 ]  - [   0.0000443800000000, -0.0000256200000000, -0.0014599200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017355200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0014463600000000 ]- atom:   39  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000225400000000, -0.0000020600000000,  0.0005335900000000 ]  - [  -0.0000013200000000,  0.0000007200000000,  0.0000780600000000 ]  - [   0.0000078100000000,  0.0000161400000000,  0.0000848500000000 ]  - [   0.0167081400000000, -0.0014724500000000, -0.0016766300000000 ]  - [   0.0321559400000000, -0.0098767400000000,  0.0150435600000000 ]  - [   0.0059542400000000, -0.0089093300000000,  0.0034499900000000 ]  - [  -0.0079984200000000,  0.0021892200000000,  0.0001789500000000 ]  - [  -0.0000011300000000, -0.0000231800000000, -0.0001162800000000 ]  - [   0.0000014400000000, -0.0000016500000000,  0.0001103300000000 ]  - [  -0.0008426700000000,  0.0041045500000000, -0.0022889000000000 ]  - [   0.0725105700000000, -0.0360694500000000, -0.0280584200000000 ]  - [  -0.0000322600000000,  0.0000248600000000,  0.0001061800000000 ]  - [  -0.0000025400000000, -0.0000464800000000,  0.0001173300000000 ]  - [   0.0000338900000000,  0.0000274200000000,  0.0001106700000000 ]  - [  -0.0000031100000000, -0.0000007900000000,  0.0000809100000000 ]  - [   0.0000002900000000,  0.0000006900000000,  0.0000800900000000 ]  - [   0.0000002700000000,  0.0000033000000000,  0.0000815100000000 ]  - [   0.0000006700000000, -0.0000007900000000,  0.0000809800000000 ]  - [  -0.0000000700000000,  0.0000006700000000,  0.0001593000000000 ]  - [   0.0000009900000000, -0.0000008900000000,  0.0000733500000000 ]  - [   0.0000007800000000, -0.0000006700000000,  0.0001711100000000 ]  - [   0.0000007300000000, -0.0000007500000000,  0.0001074700000000 ]  - [  -0.0000125300000000,  0.0000078000000000,  0.0001126000000000 ]  - [  -0.0000013000000000, -0.0000152500000000,  0.0001130200000000 ]  - [   0.0000123200000000,  0.0000086500000000,  0.0001125600000000 ]  - [  -0.0000003200000000,  0.0000004700000000,  0.0000848500000000 ]  - [   0.0000007500000000, -0.0000007200000000,  0.0000905300000000 ]  - [  -0.0000008600000000,  0.0000001400000000,  0.0000845400000000 ]  - [  -0.0000011200000000,  0.0000002400000000,  0.0000845900000000 ]  - [  -0.0001028500000000, -0.0001801100000000, -0.0001008400000000 ]  - [  -0.0008948000000000, -0.0055845500000000,  0.0013725200000000 ]  - [   0.0000015100000000, -0.0000004700000000,  0.0002063600000000 ]  - [   0.0000017800000000, -0.0000003600000000,  0.0000632100000000 ]  - [   0.0035432100000000,  0.0000905100000000,  0.0005439800000000 ]  - [   0.0007641100000000,  0.0023603100000000,  0.0014252400000000 ]  - [  -0.0038045100000000, -0.0003675100000000, -0.0003740200000000 ]  - [   0.0069809400000000,  0.0182414300000000,  0.0009453300000000 ]  - [  -0.0000036200000000,  0.0000032100000000,  0.0000056000000000 ]  - [  -0.2025096300000000,  0.0646732200000000,  0.0068140500000000 ]  - [   0.0000079100000000,  0.0000037800000000, -0.0000600500000000 ]  - [  -0.0000470200000000,  0.0000258900000000, -0.0000868800000000 ]  - [  -0.0023718300000000, -0.0015914800000000,  0.0021597100000000 ]  - [   0.0000015300000000, -0.0000651800000000, -0.0000513500000000 ]  - [   0.0000015600000000, -0.0000102500000000, -0.0000601000000000 ]  - [   0.0089569700000000, -0.0247493200000000,  0.0017422800000000 ]  - [   0.0000529400000000, -0.0005992200000000,  0.0005312000000000 ]  - [   0.0072466100000000,  0.0039217400000000,  0.0115487200000000 ]  - [   0.0002534600000000,  0.0003357800000000, -0.0004286400000000 ]  - [   0.0000499300000000,  0.0000260300000000, -0.0000746000000000 ]  - [   0.0494300700000000,  0.0012773100000000,  0.0024286700000000 ]  - [  -0.0000107400000000,  0.0000073400000000, -0.0000571800000000 ]  - [   0.0000016500000000, -0.0000019300000000, -0.0000780700000000 ]  - [   0.0094261200000000, -0.0077820600000000, -0.0171396900000000 ]  - [  -0.0000003000000000, -0.0000007900000000, -0.0000621200000000 ]  - [  -0.0000017800000000, -0.0000019100000000, -0.0000338200000000 ]  - [  -0.0000075800000000,  0.0000043900000000, -0.0000579500000000 ]  - [  -0.0000020300000000, -0.0000035600000000, -0.0000671000000000 ]  - [   0.0000370200000000, -0.0000213900000000, -0.0000746300000000 ]  - [  -0.0000111100000000, -0.0000086800000000, -0.0000746600000000 ]  - [  -0.0000006100000000,  0.0000400600000000, -0.0000742400000000 ]  - [   0.0000021700000000,  0.0000025300000000, -0.0000652900000000 ]  - [  -0.0000017700000000, -0.0000107700000000, -0.0000581700000000 ]  - [   0.0000005900000000, -0.0000001500000000, -0.0002240300000000 ]  - [   0.0000021700000000,  0.0000109200000000, -0.0000729500000000 ]  - [   0.0000099700000000, -0.0000054800000000, -0.0000734200000000 ]  - [  -0.0000319100000000, -0.0000177200000000, -0.0000721800000000 ]  - [   0.0000093400000000,  0.0000074300000000, -0.0000571500000000 ]  - [   0.0000004500000000, -0.0000001700000000, -0.0000663600000000 ]  - [   0.0000008500000000,  0.0000010100000000, -0.0000652400000000 ]  - [   0.0000018100000000,  0.0000019700000000, -0.0001144200000000 ]  - [   0.0000004500000000, -0.0000010200000000, -0.0000924100000000 ]  - [  -0.0002136900000000, -0.0007810000000000,  0.0004296500000000 ]  - [   0.0000019300000000, -0.0000013000000000, -0.0000560100000000 ]  - [  -0.0037150500000000,  0.0011160200000000, -0.0015240900000000 ]  - [   0.0014139300000000, -0.0000448000000000, -0.0004045800000000 ]  - [  -0.0000028600000000, -0.0000037700000000, -0.0000636600000000 ]  - [   0.0000338900000000,  0.0006201300000000, -0.0004734100000000 ]  - [   0.0037143900000000,  0.0032076200000000,  0.0100031000000000 ]  - [  -0.0000019600000000,  0.0000006300000000, -0.0000561800000000 ]  - [   0.0000189600000000,  0.0000025200000000, -0.0003031400000000 ]  - [   0.0000020600000000,  0.0000020300000000, -0.0000623800000000 ]  - [   0.0000023400000000, -0.0000007900000000, -0.0000631500000000 ]  - [  -0.0009121800000000, -0.0001292300000000, -0.0001048600000000 ]  - [  -0.0000003500000000,  0.0000019500000000, -0.0000549700000000 ]  - [   0.0007547400000000, -0.0006185500000000,  0.0011081300000000 ]  - [   0.0034502500000000, -0.0033682100000000, -0.0073388800000000 ]  - [   0.0000019200000000,  0.0000023200000000, -0.0000955400000000 ]- atom:   39  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000218500000000,  0.0000029200000000, -0.0005219300000000 ]  - [  -0.0000008400000000,  0.0000006500000000, -0.0000765500000000 ]  - [  -0.0000104200000000, -0.0000147300000000, -0.0000855200000000 ]  - [  -0.0167358700000000,  0.0015559800000000,  0.0016696400000000 ]  - [  -0.0338101700000000,  0.0109498400000000, -0.0167066500000000 ]  - [  -0.0067109800000000,  0.0085237900000000, -0.0029128800000000 ]  - [   0.0079878100000000, -0.0022948500000000, -0.0003352200000000 ]  - [  -0.0000008200000000,  0.0000241800000000,  0.0002171100000000 ]  - [   0.0000003900000000,  0.0000008500000000, -0.0001332600000000 ]  - [   0.0008832800000000, -0.0040872900000000,  0.0023919500000000 ]  - [  -0.0684909400000000,  0.0333231600000000,  0.0262150000000000 ]  - [   0.0000233300000000, -0.0000193800000000, -0.0001091400000000 ]  - [   0.0000038400000000,  0.0000352200000000, -0.0001208100000000 ]  - [  -0.0000234300000000, -0.0000225400000000, -0.0001142000000000 ]  - [  -0.0000119300000000, -0.0000068600000000, -0.0001227300000000 ]  - [   0.0000006500000000, -0.0000011400000000, -0.0001490800000000 ]  - [  -0.0000010200000000,  0.0000136900000000, -0.0001232300000000 ]  - [   0.0000124000000000, -0.0000066700000000, -0.0001227000000000 ]  - [  -0.0000011800000000,  0.0000000900000000, -0.0001303000000000 ]  - [   0.0000001300000000,  0.0000003100000000, -0.0001546400000000 ]  - [   0.0000007500000000,  0.0000002300000000, -0.0001292200000000 ]  - [   0.0000002200000000,  0.0000005300000000, -0.0001187200000000 ]  - [   0.0000031000000000, -0.0000021100000000, -0.0000914200000000 ]  - [  -0.0000005900000000,  0.0000044100000000, -0.0000919900000000 ]  - [  -0.0000037100000000, -0.0000012600000000, -0.0000914100000000 ]  - [  -0.0000142600000000, -0.0000070600000000, -0.0001172600000000 ]  - [  -0.0000005900000000,  0.0000007100000000, -0.0001389900000000 ]  - [   0.0000000700000000,  0.0000155200000000, -0.0001164300000000 ]  - [   0.0000133400000000, -0.0000063900000000, -0.0001170200000000 ]  - [   0.0001094500000000,  0.0001810100000000,  0.0002014400000000 ]  - [   0.0009367700000000,  0.0055441700000000, -0.0013324800000000 ]  - [  -0.0000003900000000, -0.0000010000000000, -0.0001312500000000 ]  - [  -0.0000004500000000,  0.0000001300000000, -0.0001640600000000 ]  - [  -0.0035340900000000, -0.0001195000000000, -0.0005340700000000 ]  - [  -0.0008042900000000, -0.0023432600000000, -0.0014062800000000 ]  - [   0.0037943500000000,  0.0003799300000000,  0.0004123400000000 ]  - [  -0.0069882400000000, -0.0182054600000000, -0.0009277400000000 ]  - [  -0.0000000600000000, -0.0000070000000000,  0.0000568400000000 ]  - [   0.2011945000000000, -0.0626647500000000, -0.0041335500000000 ]  - [  -0.0000014000000000, -0.0000039400000000,  0.0000881700000000 ]  - [   0.0000751800000000, -0.0000422500000000,  0.0000947000000000 ]  - [   0.0023590900000000,  0.0016977400000000, -0.0022883800000000 ]  - [  -0.0000046000000000,  0.0000950000000000,  0.0000598200000000 ]  - [   0.0000020100000000,  0.0000024600000000,  0.0000921200000000 ]  - [  -0.0089135700000000,  0.0247278600000000, -0.0016950500000000 ]  - [  -0.0000575700000000,  0.0005951800000000, -0.0006306300000000 ]  - [  -0.0072700800000000, -0.0039042600000000, -0.0114483700000000 ]  - [  -0.0002890200000000, -0.0003359700000000,  0.0004244400000000 ]  - [  -0.0000718100000000, -0.0000348200000000,  0.0000872700000000 ]  - [  -0.0497963100000000, -0.0012343300000000, -0.0023636900000000 ]  - [  -0.0000024800000000,  0.0000007200000000,  0.0000887900000000 ]  - [   0.0000002300000000,  0.0000036000000000,  0.0000872300000000 ]  - [  -0.0093520800000000,  0.0078273800000000,  0.0172577500000000 ]  - [  -0.0000004400000000, -0.0000009100000000,  0.0001109700000000 ]  - [  -0.0000021300000000, -0.0000017700000000,  0.0000858000000000 ]  - [  -0.0000127800000000,  0.0000075500000000,  0.0000914700000000 ]  - [   0.0000029000000000, -0.0000004900000000,  0.0000808700000000 ]  - [   0.0000102000000000, -0.0000059100000000,  0.0000733600000000 ]  - [   0.0000219100000000,  0.0000106600000000,  0.0000657400000000 ]  - [  -0.0000008100000000,  0.0000095900000000,  0.0000738500000000 ]  - [   0.0000018900000000, -0.0000034000000000,  0.0000828500000000 ]  - [  -0.0000021800000000, -0.0000164800000000,  0.0000901100000000 ]  - [   0.0000003700000000, -0.0000000100000000,  0.0000588300000000 ]  - [   0.0000018600000000, -0.0000275500000000,  0.0000671000000000 ]  - [  -0.0000235900000000,  0.0000138300000000,  0.0000671900000000 ]  - [  -0.0000057600000000, -0.0000024000000000,  0.0000759900000000 ]  - [   0.0000140900000000,  0.0000107700000000,  0.0000920100000000 ]  - [  -0.0000050900000000,  0.0000029500000000,  0.0000817900000000 ]  - [   0.0000005500000000,  0.0000011500000000,  0.0001116200000000 ]  - [   0.0000015400000000,  0.0000021600000000,  0.0000279200000000 ]  - [  -0.0000000800000000, -0.0000010000000000,  0.0000846600000000 ]  - [   0.0002220900000000,  0.0007793500000000, -0.0004455300000000 ]  - [  -0.0000033400000000,  0.0000018700000000,  0.0000916200000000 ]  - [   0.0037023700000000, -0.0012016800000000,  0.0016922400000000 ]  - [  -0.0013731800000000,  0.0000126400000000,  0.0004094200000000 ]  - [   0.0000373700000000,  0.0000190000000000,  0.0000804200000000 ]  - [  -0.0000414300000000, -0.0005758400000000,  0.0004713500000000 ]  - [  -0.0036869700000000, -0.0032246300000000, -0.0100325500000000 ]  - [  -0.0000021000000000, -0.0000053100000000,  0.0000914600000000 ]  - [  -0.0000192300000000, -0.0000029700000000,  0.0001631400000000 ]  - [   0.0000018500000000, -0.0000449900000000,  0.0000845100000000 ]  - [  -0.0000397000000000,  0.0000227700000000,  0.0000842500000000 ]  - [   0.0008786800000000,  0.0001139100000000,  0.0000972900000000 ]  - [   0.0000043700000000,  0.0000049500000000,  0.0000928900000000 ]  - [  -0.0007539700000000,  0.0006382600000000, -0.0010929500000000 ]  - [  -0.0034503700000000,  0.0033215500000000,  0.0072927800000000 ]  - [   0.0000015700000000,  0.0000019400000000,  0.0000397500000000 ]- atom:   39  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0002092000000000,  0.0001207800000000, -0.0022668100000000 ]  - [  -0.0000011700000000,  0.0000006700000000, -0.0019272400000000 ]  - [  -0.0000722600000000,  0.0000417200000000, -0.0019400800000000 ]  - [  -0.0012452200000000, -0.0088433600000000,  0.0261938500000000 ]  - [   0.0109124400000000, -0.0063003000000000,  0.0449862800000000 ]  - [   0.0070359700000000,  0.0055000700000000,  0.0261938500000000 ]  - [   0.0014794900000000, -0.0008541800000000,  0.0250616800000000 ]  - [   0.0000038900000000, -0.0000022500000000, -0.0033640300000000 ]  - [   0.0000011100000000, -0.0000006400000000, -0.0028286400000000 ]  - [  -0.0039020600000000,  0.0022528500000000, -0.0017667200000000 ]  - [  -0.0186441100000000,  0.0107641800000000,  0.0402638900000000 ]  - [   0.0002144800000000, -0.0001238300000000, -0.0025613600000000 ]  - [  -0.0000027200000000,  0.0002458000000000, -0.0025494400000000 ]  - [  -0.0002142300000000, -0.0001205400000000, -0.0025494400000000 ]  - [  -0.0001295900000000, -0.0000742800000000, -0.0025619000000000 ]  - [   0.0000001200000000, -0.0000000700000000, -0.0029049900000000 ]  - [  -0.0000004600000000,  0.0001493700000000, -0.0025619000000000 ]  - [   0.0001283600000000, -0.0000741100000000, -0.0025624600000000 ]  - [  -0.0000004400000000,  0.0000002500000000, -0.0035936500000000 ]  - [   0.0000016000000000, -0.0000009200000000, -0.0028522600000000 ]  - [   0.0000014100000000, -0.0000008100000000, -0.0037069100000000 ]  - [  -0.0000002000000000,  0.0000001200000000, -0.0028363000000000 ]  - [   0.0002102100000000, -0.0001213700000000, -0.0025303900000000 ]  - [  -0.0000005000000000,  0.0002431000000000, -0.0025322300000000 ]  - [  -0.0002107800000000, -0.0001211200000000, -0.0025322300000000 ]  - [  -0.0001277500000000, -0.0000752100000000, -0.0025558800000000 ]  - [  -0.0000001800000000,  0.0000001000000000, -0.0028945600000000 ]  - [   0.0000012600000000,  0.0001482400000000, -0.0025558800000000 ]  - [   0.0001262700000000, -0.0000729000000000, -0.0025589100000000 ]  - [   0.0009976300000000, -0.0005759800000000, -0.0035886800000000 ]  - [   0.0031545000000000, -0.0018212500000000,  0.0156449200000000 ]  - [  -0.0000085100000000,  0.0000049100000000, -0.0036994900000000 ]  - [   0.0000004700000000, -0.0000002700000000, -0.0028822200000000 ]  - [   0.0004617600000000, -0.0002666000000000, -0.0048168200000000 ]  - [  -0.0042465100000000, -0.0016809700000000, -0.0010923300000000 ]  - [  -0.0006674900000000,  0.0045180700000000, -0.0010923300000000 ]  - [   0.0003437800000000, -0.0001984800000000, -0.0197874800000000 ]  - [  -0.0000100700000000,  0.0000058200000000,  0.0015100200000000 ]  - [   0.0064022500000000, -0.0036963400000000, -0.1552730200000000 ]  - [   0.0000685100000000,  0.0000374400000000,  0.0018626200000000 ]  - [  -0.0002542500000000,  0.0001467900000000,  0.0018258600000000 ]  - [   0.0006161600000000, -0.0125056900000000,  0.0065135200000000 ]  - [   0.0000078600000000, -0.0003182200000000,  0.0018458900000000 ]  - [   0.0000018300000000, -0.0000780500000000,  0.0018626200000000 ]  - [  -0.0006656600000000,  0.0023454300000000, -0.0177516500000000 ]  - [   0.0004364100000000, -0.0002519600000000,  0.0027943000000000 ]  - [   0.0111383200000000,  0.0057192300000000,  0.0065135200000000 ]  - [   0.0009520200000000, -0.0005496500000000, -0.0061139300000000 ]  - [   0.0002795200000000,  0.0001523000000000,  0.0018458900000000 ]  - [  -0.0023640300000000, -0.0005962300000000, -0.0177516500000000 ]  - [  -0.0000715200000000,  0.0000412900000000,  0.0018656600000000 ]  - [   0.0000017200000000, -0.0000010000000000,  0.0022069000000000 ]  - [  -0.0194942400000000,  0.0112550000000000,  0.0127107100000000 ]  - [  -0.0000002400000000,  0.0000001400000000,  0.0021966000000000 ]  - [  -0.0000008600000000,  0.0000005000000000,  0.0015081800000000 ]  - [  -0.0000789200000000,  0.0000455600000000,  0.0018646000000000 ]  - [   0.0000669000000000,  0.0000364200000000,  0.0018535900000000 ]  - [  -0.0003054100000000,  0.0001763300000000,  0.0018431800000000 ]  - [   0.0004242800000000,  0.0002428000000000,  0.0017480700000000 ]  - [  -0.0000006300000000, -0.0003565500000000,  0.0018449300000000 ]  - [   0.0000019100000000, -0.0000761500000000,  0.0018535900000000 ]  - [  -0.0000018600000000, -0.0000937200000000,  0.0018656700000000 ]  - [   0.0000003300000000, -0.0000001900000000,  0.0034440400000000 ]  - [   0.0000018700000000, -0.0004888400000000,  0.0017480700000000 ]  - [  -0.0004246900000000,  0.0002452000000000,  0.0017479300000000 ]  - [   0.0003084700000000,  0.0001788200000000,  0.0018449300000000 ]  - [   0.0000802400000000,  0.0000484700000000,  0.0018656700000000 ]  - [  -0.0000687900000000,  0.0000397100000000,  0.0018539700000000 ]  - [   0.0000000400000000, -0.0000000200000000,  0.0022318100000000 ]  - [   0.0000003900000000, -0.0000002300000000,  0.0017301800000000 ]  - [  -0.0000002200000000,  0.0000001300000000,  0.0021703200000000 ]  - [   0.0007708800000000, -0.0004450700000000,  0.0006803500000000 ]  - [  -0.0000713000000000,  0.0000411600000000,  0.0018672800000000 ]  - [   0.0015207700000000, -0.0123699600000000,  0.0095795100000000 ]  - [  -0.0004618600000000,  0.0002666500000000,  0.0038840600000000 ]  - [   0.0004365300000000,  0.0002492300000000,  0.0017586000000000 ]  - [  -0.0004495800000000, -0.0004581800000000,  0.0012005800000000 ]  - [   0.0114730800000000,  0.0048679600000000,  0.0095795100000000 ]  - [  -0.0000017400000000, -0.0000836400000000,  0.0018676000000000 ]  - [  -0.0001366700000000,  0.0000789000000000,  0.0035010200000000 ]  - [   0.0000024200000000, -0.0005026700000000,  0.0017586000000000 ]  - [  -0.0004403700000000,  0.0002542500000000,  0.0017677500000000 ]  - [   0.0001720100000000,  0.0006184400000000,  0.0012005800000000 ]  - [   0.0000715700000000,  0.0000433200000000,  0.0018676000000000 ]  - [   0.0010473700000000, -0.0006047000000000, -0.0062001900000000 ]  - [  -0.0063711100000000,  0.0036783600000000,  0.0043665200000000 ]  - [  -0.0000010000000000,  0.0000005800000000,  0.0017471500000000 ]- atom:   39  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0002054000000000, -0.0001185900000000,  0.0022733300000000 ]  - [  -0.0000012100000000,  0.0000007000000000,  0.0019300300000000 ]  - [   0.0000704900000000, -0.0000407000000000,  0.0019407400000000 ]  - [   0.0012335500000000,  0.0095650000000000, -0.0255772700000000 ]  - [  -0.0121731400000000,  0.0070281700000000, -0.0458918500000000 ]  - [  -0.0076667600000000, -0.0058507800000000, -0.0255772700000000 ]  - [  -0.0014513500000000,  0.0008379400000000, -0.0249511800000000 ]  - [  -0.0000049100000000,  0.0000028400000000,  0.0034679200000000 ]  - [  -0.0000005600000000,  0.0000003200000000,  0.0028073000000000 ]  - [   0.0038961200000000, -0.0022494300000000,  0.0019302600000000 ]  - [   0.0187837000000000, -0.0108447700000000, -0.0401646500000000 ]  - [  -0.0002231600000000,  0.0001288400000000,  0.0025595800000000 ]  - [   0.0000028700000000, -0.0002569500000000,  0.0025479400000000 ]  - [   0.0002239600000000,  0.0001259900000000,  0.0025479400000000 ]  - [   0.0001138900000000,  0.0000673000000000,  0.0025226800000000 ]  - [   0.0000012400000000, -0.0000007200000000,  0.0028379000000000 ]  - [  -0.0000013300000000, -0.0001322800000000,  0.0025226800000000 ]  - [  -0.0001150200000000,  0.0000664100000000,  0.0025227500000000 ]  - [  -0.0000007400000000,  0.0000004300000000,  0.0036262200000000 ]  - [  -0.0000000300000000,  0.0000000200000000,  0.0027748500000000 ]  - [   0.0000005600000000, -0.0000003300000000,  0.0037520300000000 ]  - [  -0.0000005600000000,  0.0000003200000000,  0.0028276700000000 ]  - [  -0.0002195900000000,  0.0001267800000000,  0.0025535300000000 ]  - [  -0.0000016800000000, -0.0002536200000000,  0.0025551600000000 ]  - [   0.0002188000000000,  0.0001282700000000,  0.0025551600000000 ]  - [   0.0001129400000000,  0.0000682800000000,  0.0025260700000000 ]  - [  -0.0000001300000000,  0.0000000800000000,  0.0028481700000000 ]  - [  -0.0000026600000000, -0.0001319500000000,  0.0025260700000000 ]  - [  -0.0001142000000000,  0.0000659400000000,  0.0025288700000000 ]  - [  -0.0010051600000000,  0.0005803300000000,  0.0036952600000000 ]  - [  -0.0031691800000000,  0.0018297300000000, -0.0157738800000000 ]  - [   0.0000102200000000, -0.0000059000000000,  0.0037776400000000 ]  - [   0.0000011000000000, -0.0000006400000000,  0.0027842500000000 ]  - [  -0.0004667700000000,  0.0002694900000000,  0.0048457300000000 ]  - [   0.0042721100000000,  0.0016929000000000,  0.0011005000000000 ]  - [   0.0006699600000000, -0.0045462100000000,  0.0011005000000000 ]  - [  -0.0003392200000000,  0.0001958500000000,  0.0197608200000000 ]  - [   0.0000088300000000, -0.0000051000000000, -0.0014543100000000 ]  - [  -0.0045167300000000,  0.0026077400000000,  0.1545382500000000 ]  - [  -0.0000562200000000, -0.0000348000000000, -0.0018273800000000 ]  - [   0.0002843900000000, -0.0001641900000000, -0.0018224300000000 ]  - [  -0.0005708500000000,  0.0123153000000000, -0.0063964900000000 ]  - [  -0.0000111700000000,  0.0003482400000000, -0.0018387400000000 ]  - [   0.0000020300000000,  0.0000660900000000, -0.0018273800000000 ]  - [   0.0006882000000000, -0.0024110900000000,  0.0178059300000000 ]  - [  -0.0004349200000000,  0.0002511000000000, -0.0028997700000000 ]  - [  -0.0109507900000000, -0.0056632800000000, -0.0063964900000000 ]  - [  -0.0009821000000000,  0.0005670100000000,  0.0060523200000000 ]  - [  -0.0003071600000000, -0.0001644500000000, -0.0018387400000000 ]  - [   0.0024321600000000,  0.0006095500000000,  0.0178059300000000 ]  - [   0.0000539500000000, -0.0000311500000000, -0.0018303500000000 ]  - [  -0.0000017000000000,  0.0000009800000000, -0.0021913000000000 ]  - [   0.0191726900000000, -0.0110693600000000, -0.0124752800000000 ]  - [  -0.0000002100000000,  0.0000001200000000, -0.0021579700000000 ]  - [  -0.0000008800000000,  0.0000005100000000, -0.0014639500000000 ]  - [   0.0000652600000000, -0.0000376800000000, -0.0018386800000000 ]  - [  -0.0000598900000000, -0.0000367600000000, -0.0018329700000000 ]  - [   0.0003552400000000, -0.0002051000000000, -0.0018490700000000 ]  - [  -0.0004089900000000, -0.0002381000000000, -0.0017544100000000 ]  - [  -0.0000007700000000,  0.0004063800000000, -0.0018472300000000 ]  - [   0.0000018900000000,  0.0000702500000000, -0.0018329700000000 ]  - [  -0.0000020900000000,  0.0000725600000000, -0.0018376700000000 ]  - [   0.0000003200000000, -0.0000001900000000, -0.0036130900000000 ]  - [   0.0000017100000000,  0.0004732500000000, -0.0017544100000000 ]  - [   0.0004084900000000, -0.0002358400000000, -0.0017543400000000 ]  - [  -0.0003523200000000, -0.0002025300000000, -0.0018472300000000 ]  - [  -0.0000638800000000, -0.0000344700000000, -0.0018376700000000 ]  - [   0.0000579200000000, -0.0000334400000000, -0.0018328000000000 ]  - [  -0.0000000500000000,  0.0000000300000000, -0.0021774200000000 ]  - [   0.0000004100000000, -0.0000002300000000, -0.0018123400000000 ]  - [   0.0000013600000000, -0.0000007800000000, -0.0021866000000000 ]  - [  -0.0007745000000000,  0.0004471600000000, -0.0007015000000000 ]  - [   0.0000754100000000, -0.0000435400000000, -0.0018365400000000 ]  - [  -0.0015321800000000,  0.0125872300000000, -0.0097426800000000 ]  - [   0.0005034700000000, -0.0002906800000000, -0.0039095800000000 ]  - [  -0.0003983100000000, -0.0002317800000000, -0.0017385100000000 ]  - [   0.0004501000000000,  0.0004969600000000, -0.0011980000000000 ]  - [  -0.0116669500000000, -0.0049667100000000, -0.0097426800000000 ]  - [  -0.0000026000000000,  0.0000849800000000, -0.0018367100000000 ]  - [   0.0001383300000000, -0.0000798600000000, -0.0036447000000000 ]  - [   0.0000015800000000,  0.0004608300000000, -0.0017385100000000 ]  - [   0.0004011600000000, -0.0002316100000000, -0.0017470200000000 ]  - [  -0.0002053300000000, -0.0006382800000000, -0.0011980000000000 ]  - [  -0.0000748900000000, -0.0000402400000000, -0.0018367100000000 ]  - [  -0.0010653400000000,  0.0006150700000000,  0.0062923500000000 ]  - [   0.0064750100000000, -0.0037383500000000, -0.0044099200000000 ]  - [   0.0000014000000000, -0.0000008100000000, -0.0017977000000000 ]- atom:   40  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0000290100000000,  0.0002410800000000,  0.0001058100000000 ]  - [  -0.0000031200000000,  0.0000098300000000, -0.0000296400000000 ]  - [  -0.0000010700000000,  0.0000004700000000, -0.0000678400000000 ]  - [  -0.0000342700000000, -0.0000246100000000, -0.0001103800000000 ]  - [   0.0000011800000000, -0.0000006500000000, -0.0001364400000000 ]  - [  -0.0000000800000000,  0.0000452900000000, -0.0001086300000000 ]  - [   0.0000341200000000, -0.0000233300000000, -0.0001085200000000 ]  - [  -0.0008885500000000, -0.0039538600000000,  0.0024816400000000 ]  - [   0.0713886300000000,  0.0352767200000000,  0.0280450200000000 ]  - [  -0.0000018600000000,  0.0000279800000000,  0.0000161000000000 ]  - [  -0.0000007000000000,  0.0000005700000000, -0.0001282800000000 ]  - [   0.0168870400000000,  0.0015476200000000,  0.0021352700000000 ]  - [   0.0071870800000000,  0.0082801900000000, -0.0019180300000000 ]  - [  -0.0080205100000000, -0.0022789700000000,  0.0005063600000000 ]  - [   0.0035202500000000, -0.0000608900000000, -0.0005468100000000 ]  - [   0.0291858000000000,  0.0081364700000000, -0.0130562500000000 ]  - [   0.0007289300000000, -0.0023401600000000, -0.0014934300000000 ]  - [  -0.0037992400000000,  0.0003575100000000,  0.0003227500000000 ]  - [  -0.0000002400000000,  0.0000010400000000, -0.0001369500000000 ]  - [   0.0000015900000000, -0.0000002000000000, -0.0001384100000000 ]  - [  -0.0000901600000000,  0.0001842400000000,  0.0001554700000000 ]  - [  -0.0008227100000000,  0.0054648800000000, -0.0013421700000000 ]  - [   0.0000033800000000, -0.0000020900000000, -0.0000769600000000 ]  - [  -0.0000011400000000,  0.0000038600000000, -0.0000765400000000 ]  - [  -0.0000042000000000, -0.0000009200000000, -0.0000766300000000 ]  - [  -0.0000107800000000, -0.0000058400000000, -0.0001048800000000 ]  - [   0.0000006600000000,  0.0000005500000000, -0.0001240700000000 ]  - [  -0.0000008400000000,  0.0000123900000000, -0.0001051000000000 ]  - [   0.0000096000000000, -0.0000056200000000, -0.0001048700000000 ]  - [  -0.0000007400000000,  0.0000005800000000, -0.0000752100000000 ]  - [  -0.0000001600000000, -0.0000005300000000, -0.0000898500000000 ]  - [   0.0000010900000000, -0.0000012400000000, -0.0000925900000000 ]  - [   0.0000010300000000,  0.0000003000000000, -0.0001501200000000 ]  - [   0.0000031400000000, -0.0000024400000000, -0.0000801500000000 ]  - [  -0.0000003600000000,  0.0000050900000000, -0.0000806700000000 ]  - [  -0.0000063200000000, -0.0000021900000000, -0.0000800200000000 ]  - [  -0.0000005300000000,  0.0000011600000000,  0.0000634900000000 ]  - [   0.0098615200000000,  0.0081194700000000,  0.0169007900000000 ]  - [  -0.0000026700000000,  0.0000009700000000,  0.0000793600000000 ]  - [  -0.1995177800000000, -0.0615830600000000, -0.0120075700000000 ]  - [  -0.0022526900000000,  0.0015894700000000, -0.0022109900000000 ]  - [   0.0000120200000000,  0.0000009600000000,  0.0000565900000000 ]  - [   0.0068338500000000, -0.0041241700000000, -0.0113561500000000 ]  - [   0.0089057000000000,  0.0245967700000000, -0.0016793200000000 ]  - [  -0.0000018000000000, -0.0000041500000000,  0.0000788500000000 ]  - [   0.0000511200000000,  0.0005569000000000, -0.0003828500000000 ]  - [   0.0000019300000000,  0.0000000700000000,  0.0000362600000000 ]  - [  -0.0000104400000000,  0.0000025200000000,  0.0000565800000000 ]  - [   0.0002192700000000, -0.0003473100000000,  0.0002965800000000 ]  - [   0.0000046500000000,  0.0000040000000000,  0.0000811900000000 ]  - [   0.0489844500000000, -0.0013494000000000, -0.0022730000000000 ]  - [   0.0070249900000000, -0.0183729800000000, -0.0010504900000000 ]  - [   0.0000040500000000,  0.0000081200000000, -0.0000311200000000 ]  - [   0.0033657900000000,  0.0033337500000000,  0.0073808800000000 ]  - [  -0.0000020400000000, -0.0000015100000000,  0.0000754500000000 ]  - [  -0.0037259400000000, -0.0010140500000000,  0.0014768000000000 ]  - [   0.0000033600000000, -0.0000004600000000,  0.0000715500000000 ]  - [   0.0000065000000000, -0.0000043900000000,  0.0000645300000000 ]  - [   0.0014312900000000,  0.0000058100000000,  0.0003625100000000 ]  - [  -0.0000006100000000,  0.0000044000000000,  0.0000654400000000 ]  - [   0.0000020300000000, -0.0000037400000000,  0.0000733300000000 ]  - [   0.0037945100000000, -0.0031735700000000, -0.0099926200000000 ]  - [   0.0000174200000000, -0.0000062800000000,  0.0001384000000000 ]  - [   0.0000366900000000, -0.0006251600000000,  0.0004662100000000 ]  - [  -0.0009159900000000,  0.0001091600000000,  0.0000998400000000 ]  - [  -0.0000009600000000, -0.0000004600000000,  0.0000683900000000 ]  - [   0.0007700300000000,  0.0006298100000000, -0.0010280400000000 ]  - [  -0.0000051400000000,  0.0000029000000000,  0.0000724700000000 ]  - [   0.0000008600000000,  0.0000009800000000,  0.0001022600000000 ]  - [  -0.0001979500000000,  0.0007525500000000, -0.0004883300000000 ]  - [   0.0000002400000000, -0.0000010900000000,  0.0000711000000000 ]  - [  -0.0000001800000000, -0.0000026000000000,  0.0000420500000000 ]  - [  -0.0000026300000000,  0.0000013200000000,  0.0000818300000000 ]  - [   0.0000050100000000,  0.0000006900000000,  0.0000821300000000 ]  - [   0.0000070900000000, -0.0000043800000000,  0.0000632600000000 ]  - [   0.0000318700000000,  0.0000159300000000,  0.0000697200000000 ]  - [  -0.0000009100000000,  0.0000057600000000,  0.0000640300000000 ]  - [   0.0000019500000000, -0.0000047300000000,  0.0000827900000000 ]  - [  -0.0000020000000000, -0.0000046800000000,  0.0000816000000000 ]  - [   0.0000003900000000, -0.0000003700000000,  0.0000531700000000 ]  - [   0.0000019700000000, -0.0000383800000000,  0.0000725400000000 ]  - [  -0.0000332100000000,  0.0000192900000000,  0.0000719700000000 ]  - [  -0.0000025200000000, -0.0000004700000000,  0.0000656900000000 ]  - [   0.0000040600000000,  0.0000045100000000,  0.0000830100000000 ]  - [  -0.0000066100000000,  0.0000039200000000,  0.0000827400000000 ]  - [   0.0000007700000000,  0.0000010200000000,  0.0001015500000000 ]  - [   0.0000017800000000,  0.0000020600000000,  0.0000345300000000 ]- atom:   40  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000347100000000, -0.0002397500000000, -0.0001027200000000 ]  - [   0.0000009600000000, -0.0000087300000000,  0.0000277500000000 ]  - [  -0.0000010900000000,  0.0000007000000000,  0.0000625400000000 ]  - [   0.0000229800000000,  0.0000170900000000,  0.0000760200000000 ]  - [   0.0000007300000000, -0.0000002000000000,  0.0000536700000000 ]  - [   0.0000007100000000, -0.0000319800000000,  0.0000742900000000 ]  - [  -0.0000248100000000,  0.0000176400000000,  0.0000751200000000 ]  - [   0.0009286400000000,  0.0039402800000000, -0.0023516000000000 ]  - [  -0.0674364500000000, -0.0325748000000000, -0.0262506100000000 ]  - [  -0.0000009700000000, -0.0000260200000000,  0.0001134800000000 ]  - [  -0.0000003900000000,  0.0000003900000000,  0.0000769100000000 ]  - [  -0.0169130300000000, -0.0016215400000000, -0.0021525900000000 ]  - [  -0.0079940500000000, -0.0078617900000000,  0.0012935900000000 ]  - [   0.0080073500000000,  0.0023829900000000, -0.0003852700000000 ]  - [  -0.0035190900000000,  0.0000859500000000,  0.0005052700000000 ]  - [  -0.0307541800000000, -0.0091339400000000,  0.0144699800000000 ]  - [  -0.0007679600000000,  0.0023344400000000,  0.0014434000000000 ]  - [   0.0037979400000000, -0.0003730600000000, -0.0003915400000000 ]  - [  -0.0000012100000000, -0.0000005000000000,  0.0001588600000000 ]  - [  -0.0000005600000000, -0.0000006400000000,  0.0000513700000000 ]  - [   0.0000999000000000, -0.0001848200000000, -0.0001195700000000 ]  - [   0.0008657200000000, -0.0054291300000000,  0.0013057200000000 ]  - [  -0.0000122900000000,  0.0000071900000000,  0.0000932300000000 ]  - [  -0.0000006400000000, -0.0000142300000000,  0.0000924700000000 ]  - [   0.0000120100000000,  0.0000076800000000,  0.0000928300000000 ]  - [  -0.0000040000000000, -0.0000010300000000,  0.0000669900000000 ]  - [  -0.0000006400000000, -0.0000007800000000,  0.0000696400000000 ]  - [  -0.0000000200000000,  0.0000031300000000,  0.0000677400000000 ]  - [   0.0000025500000000, -0.0000007700000000,  0.0000669700000000 ]  - [  -0.0000008300000000, -0.0000000400000000,  0.0001703600000000 ]  - [  -0.0000003200000000, -0.0000014900000000,  0.0001032700000000 ]  - [  -0.0000000900000000, -0.0000004900000000,  0.0001599100000000 ]  - [   0.0000001900000000, -0.0000007500000000,  0.0000435800000000 ]  - [  -0.0000109500000000,  0.0000065800000000,  0.0000918000000000 ]  - [  -0.0000015800000000, -0.0000111300000000,  0.0000921700000000 ]  - [   0.0000107600000000,  0.0000066300000000,  0.0000919500000000 ]  - [  -0.0000009200000000, -0.0000031300000000, -0.0000897700000000 ]  - [  -0.0097900800000000, -0.0081638100000000, -0.0170271500000000 ]  - [  -0.0000118700000000,  0.0000079600000000, -0.0000422200000000 ]  - [   0.1982506300000000,  0.0595059300000000,  0.0095261700000000 ]  - [   0.0022417600000000, -0.0016947700000000,  0.0023151900000000 ]  - [   0.0000211900000000,  0.0000129900000000, -0.0000873500000000 ]  - [  -0.0068621700000000,  0.0040958500000000,  0.0112422400000000 ]  - [  -0.0088585900000000, -0.0246058400000000,  0.0017017800000000 ]  - [  -0.0000019900000000, -0.0000172200000000, -0.0000427600000000 ]  - [  -0.0000554400000000, -0.0005542100000000,  0.0002919900000000 ]  - [   0.0000022100000000, -0.0000428700000000, -0.0000647500000000 ]  - [  -0.0000231800000000,  0.0000167700000000, -0.0000857100000000 ]  - [  -0.0002417300000000,  0.0003576500000000, -0.0003104900000000 ]  - [   0.0000129600000000,  0.0000107200000000, -0.0000414300000000 ]  - [  -0.0493667100000000,  0.0013328400000000,  0.0022793500000000 ]  - [  -0.0070292700000000,  0.0183387800000000,  0.0010196900000000 ]  - [  -0.0000011200000000, -0.0000038500000000, -0.0000232800000000 ]  - [  -0.0033692600000000, -0.0032883500000000, -0.0072356400000000 ]  - [  -0.0000020100000000, -0.0000023800000000, -0.0000231700000000 ]  - [   0.0036918600000000,  0.0011084000000000, -0.0015734000000000 ]  - [  -0.0000014400000000, -0.0000031100000000, -0.0000528900000000 ]  - [   0.0000402000000000, -0.0000229300000000, -0.0000629100000000 ]  - [  -0.0014166700000000,  0.0000070400000000, -0.0003736200000000 ]  - [  -0.0000009100000000,  0.0000446200000000, -0.0000629400000000 ]  - [   0.0000018700000000,  0.0000013500000000, -0.0000509700000000 ]  - [  -0.0037758500000000,  0.0031616100000000,  0.0100956500000000 ]  - [  -0.0000176700000000,  0.0000057800000000, -0.0002966000000000 ]  - [  -0.0000387400000000,  0.0006008900000000, -0.0004656800000000 ]  - [   0.0008954400000000, -0.0000988600000000, -0.0000905100000000 ]  - [  -0.0000365100000000, -0.0000197100000000, -0.0000617500000000 ]  - [  -0.0007390500000000, -0.0006270900000000,  0.0010861900000000 ]  - [  -0.0000008200000000,  0.0000003400000000, -0.0000521500000000 ]  - [   0.0000004100000000,  0.0000009400000000, -0.0000497200000000 ]  - [   0.0002095700000000, -0.0007521300000000,  0.0004047200000000 ]  - [   0.0000000200000000, -0.0000011700000000, -0.0000761200000000 ]  - [  -0.0000004100000000, -0.0000027200000000, -0.0000595400000000 ]  - [   0.0000022500000000, -0.0000016200000000, -0.0000435600000000 ]  - [   0.0000006800000000, -0.0000017400000000, -0.0000434200000000 ]  - [   0.0000292700000000, -0.0000173200000000, -0.0000617600000000 ]  - [   0.0000035400000000, -0.0000003100000000, -0.0000487700000000 ]  - [  -0.0000011500000000,  0.0000315200000000, -0.0000610500000000 ]  - [   0.0000017100000000, -0.0000003100000000, -0.0000419700000000 ]  - [  -0.0000022100000000,  0.0000011000000000, -0.0000437500000000 ]  - [   0.0000001800000000, -0.0000003900000000, -0.0001857800000000 ]  - [   0.0000017900000000, -0.0000060200000000, -0.0000461900000000 ]  - [  -0.0000052600000000,  0.0000030300000000, -0.0000464900000000 ]  - [  -0.0000250400000000, -0.0000133200000000, -0.0000592800000000 ]  - [  -0.0000013400000000,  0.0000015300000000, -0.0000425000000000 ]  - [  -0.0000028100000000,  0.0000015300000000, -0.0000426500000000 ]  - [   0.0000005500000000,  0.0000009600000000, -0.0000450300000000 ]  - [   0.0000015600000000,  0.0000019900000000, -0.0000852600000000 ]- atom:   40  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0004539700000000, -0.0002621000000000, -0.0018781300000000 ]  - [  -0.0000120600000000, -0.0000069600000000, -0.0018953200000000 ]  - [  -0.0000004300000000, -0.0000002500000000, -0.0019212900000000 ]  - [  -0.0001273300000000, -0.0000735100000000, -0.0025614500000000 ]  - [   0.0000015600000000,  0.0000009000000000, -0.0028987100000000 ]  - [   0.0000118600000000,  0.0001390900000000, -0.0025508000000000 ]  - [   0.0001263900000000, -0.0000592700000000, -0.0025508000000000 ]  - [   0.0038187400000000,  0.0022047500000000, -0.0017934900000000 ]  - [   0.0195530700000000,  0.0112889700000000,  0.0406571500000000 ]  - [  -0.0000311600000000, -0.0000179900000000, -0.0035338100000000 ]  - [  -0.0000021500000000, -0.0000012400000000, -0.0028459700000000 ]  - [   0.0014355600000000, -0.0084656200000000,  0.0268637100000000 ]  - [  -0.0066136600000000,  0.0054760400000000,  0.0268637100000000 ]  - [  -0.0017647900000000, -0.0010189000000000,  0.0249784600000000 ]  - [  -0.0003760500000000, -0.0002171100000000, -0.0047417700000000 ]  - [  -0.0098664500000000, -0.0056964000000000,  0.0442355100000000 ]  - [   0.0042642200000000, -0.0017859200000000, -0.0011232500000000 ]  - [   0.0005854600000000,  0.0045858800000000, -0.0011232500000000 ]  - [   0.0000062900000000,  0.0000036300000000, -0.0036034400000000 ]  - [   0.0000005600000000,  0.0000003200000000, -0.0028436900000000 ]  - [  -0.0010315400000000, -0.0005955600000000, -0.0037312200000000 ]  - [  -0.0032041100000000, -0.0018498900000000,  0.0156717300000000 ]  - [   0.0002075900000000, -0.0001222400000000, -0.0025217000000000 ]  - [  -0.0000020700000000,  0.0002409000000000, -0.0025217000000000 ]  - [  -0.0002077600000000, -0.0001199500000000, -0.0025226800000000 ]  - [  -0.0001282400000000, -0.0000740400000000, -0.0025471000000000 ]  - [   0.0000000400000000,  0.0000000200000000, -0.0028845600000000 ]  - [  -0.0000005700000000,  0.0001475600000000, -0.0025487200000000 ]  - [   0.0001275100000000, -0.0000742700000000, -0.0025487200000000 ]  - [  -0.0000008200000000, -0.0000004800000000, -0.0035454900000000 ]  - [  -0.0000004400000000, -0.0000002500000000, -0.0027922400000000 ]  - [  -0.0000001300000000, -0.0000000800000000, -0.0036754900000000 ]  - [  -0.0000002800000000, -0.0000001600000000, -0.0028724400000000 ]  - [   0.0002100100000000, -0.0001221200000000, -0.0025246800000000 ]  - [  -0.0000007500000000,  0.0002429300000000, -0.0025246800000000 ]  - [  -0.0002107000000000, -0.0001216500000000, -0.0025249500000000 ]  - [  -0.0000041600000000, -0.0000024000000000,  0.0021488800000000 ]  - [   0.0200706300000000,  0.0115877800000000,  0.0118924300000000 ]  - [  -0.0000819700000000,  0.0000484100000000,  0.0018626200000000 ]  - [  -0.0098279500000000, -0.0056741700000000, -0.1556312500000000 ]  - [  -0.0000283800000000, -0.0116765600000000,  0.0062419600000000 ]  - [   0.0003995000000000,  0.0002306500000000,  0.0016836300000000 ]  - [  -0.0101263900000000,  0.0058137000000000,  0.0062419600000000 ]  - [   0.0005996300000000,  0.0023079700000000, -0.0177485700000000 ]  - [   0.0000009500000000, -0.0000951900000000,  0.0018626200000000 ]  - [  -0.0003758900000000, -0.0002170200000000,  0.0028708500000000 ]  - [  -0.0000041200000000, -0.0004734500000000,  0.0017255900000000 ]  - [  -0.0004120800000000,  0.0002331500000000,  0.0017255900000000 ]  - [  -0.0008340600000000, -0.0004815500000000, -0.0059699300000000 ]  - [   0.0000821100000000,  0.0000474100000000,  0.0018671100000000 ]  - [   0.0022985800000000, -0.0006346900000000, -0.0177485700000000 ]  - [  -0.0003115600000000, -0.0001798800000000, -0.0196665700000000 ]  - [  -0.0000030500000000, -0.0000017600000000,  0.0017404100000000 ]  - [   0.0063969300000000,  0.0036932700000000,  0.0043677800000000 ]  - [  -0.0000037200000000, -0.0000021500000000,  0.0015066600000000 ]  - [  -0.0016294900000000, -0.0125994300000000,  0.0097782500000000 ]  - [   0.0000640200000000,  0.0000369600000000,  0.0018436400000000 ]  - [  -0.0003094700000000,  0.0001790900000000,  0.0018362900000000 ]  - [   0.0006269200000000,  0.0003619500000000,  0.0038017000000000 ]  - [   0.0000003600000000, -0.0003575500000000,  0.0018362900000000 ]  - [   0.0000007700000000, -0.0000758800000000,  0.0018456000000000 ]  - [  -0.0117261800000000,  0.0048885400000000,  0.0097782500000000 ]  - [   0.0001477700000000,  0.0000853200000000,  0.0034892700000000 ]  - [   0.0004871100000000, -0.0005605700000000,  0.0010868100000000 ]  - [  -0.0002419100000000,  0.0007021300000000,  0.0010868100000000 ]  - [   0.0003181200000000,  0.0001836700000000,  0.0018467400000000 ]  - [  -0.0010915900000000, -0.0006302300000000, -0.0062536300000000 ]  - [  -0.0000653300000000,  0.0000386100000000,  0.0018456000000000 ]  - [   0.0000016300000000,  0.0000009400000000,  0.0022221600000000 ]  - [  -0.0007345800000000, -0.0004241100000000,  0.0008955900000000 ]  - [  -0.0000003600000000, -0.0000002100000000,  0.0021647000000000 ]  - [  -0.0000014100000000, -0.0000008100000000,  0.0014716800000000 ]  - [  -0.0000743000000000,  0.0000416300000000,  0.0018621100000000 ]  - [   0.0000636900000000,  0.0000367700000000,  0.0018524000000000 ]  - [  -0.0003118900000000,  0.0001794100000000,  0.0018388100000000 ]  - [   0.0004313600000000,  0.0002490500000000,  0.0017519400000000 ]  - [  -0.0000005700000000, -0.0003598100000000,  0.0018388100000000 ]  - [   0.0000009400000000, -0.0000755100000000,  0.0018542000000000 ]  - [  -0.0000011000000000, -0.0000851600000000,  0.0018621100000000 ]  - [   0.0000000800000000,  0.0000000500000000,  0.0034446700000000 ]  - [   0.0000010400000000, -0.0005008800000000,  0.0017544200000000 ]  - [  -0.0004332600000000,  0.0002513400000000,  0.0017544200000000 ]  - [   0.0003156900000000,  0.0001822600000000,  0.0018411600000000 ]  - [   0.0000753100000000,  0.0000434800000000,  0.0018636100000000 ]  - [  -0.0000649300000000,  0.0000385700000000,  0.0018542000000000 ]  - [   0.0000009500000000,  0.0000005500000000,  0.0022224000000000 ]  - [   0.0000022000000000,  0.0000012700000000,  0.0017371400000000 ]- atom:   40  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0004560300000000,  0.0002632900000000,  0.0018818900000000 ]  - [   0.0000108400000000,  0.0000062600000000,  0.0018919800000000 ]  - [  -0.0000006300000000, -0.0000003700000000,  0.0019148500000000 ]  - [   0.0001153900000000,  0.0000666200000000,  0.0025255700000000 ]  - [  -0.0000004600000000, -0.0000002600000000,  0.0028141300000000 ]  - [  -0.0000114500000000, -0.0001267300000000,  0.0025153500000000 ]  - [  -0.0001154800000000,  0.0000534500000000,  0.0025153500000000 ]  - [  -0.0038256600000000, -0.0022087500000000,  0.0018657300000000 ]  - [  -0.0193668700000000, -0.0111814700000000, -0.0408191000000000 ]  - [   0.0000293900000000,  0.0000169700000000,  0.0036612500000000 ]  - [   0.0000011900000000,  0.0000006900000000,  0.0027928600000000 ]  - [  -0.0014467800000000,  0.0076988500000000, -0.0275337300000000 ]  - [   0.0059440100000000, -0.0051023700000000, -0.0275337300000000 ]  - [   0.0017880100000000,  0.0010323100000000, -0.0251233300000000 ]  - [   0.0003648400000000,  0.0002106400000000,  0.0046830900000000 ]  - [   0.0086648000000000,  0.0050026300000000, -0.0434891200000000 ]  - [  -0.0042384800000000,  0.0017837900000000,  0.0010835300000000 ]  - [  -0.0005744300000000, -0.0045625200000000,  0.0010835300000000 ]  - [  -0.0000071400000000, -0.0000041200000000,  0.0036232000000000 ]  - [  -0.0000004100000000, -0.0000002400000000,  0.0027550300000000 ]  - [   0.0010263900000000,  0.0005925900000000,  0.0037623300000000 ]  - [   0.0031890700000000,  0.0018412100000000, -0.0155436800000000 ]  - [  -0.0002169800000000,  0.0001264600000000,  0.0025364700000000 ]  - [   0.0000010300000000, -0.0002511400000000,  0.0025364700000000 ]  - [   0.0002166200000000,  0.0001250700000000,  0.0025375200000000 ]  - [   0.0001139700000000,  0.0000658000000000,  0.0025073600000000 ]  - [  -0.0000000300000000, -0.0000000200000000,  0.0028281800000000 ]  - [   0.0000004500000000, -0.0001327700000000,  0.0025092700000000 ]  - [  -0.0001147600000000,  0.0000667800000000,  0.0025092700000000 ]  - [   0.0000000300000000,  0.0000000200000000,  0.0036385500000000 ]  - [  -0.0000001800000000, -0.0000001000000000,  0.0028037300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0037398700000000 ]  - [   0.0000011000000000,  0.0000006400000000,  0.0027634400000000 ]  - [  -0.0002171700000000,  0.0001249500000000,  0.0025352700000000 ]  - [  -0.0000003800000000, -0.0002505500000000,  0.0025352700000000 ]  - [   0.0002161200000000,  0.0001247800000000,  0.0025358500000000 ]  - [   0.0000026300000000,  0.0000015200000000, -0.0021747700000000 ]  - [  -0.0204011400000000, -0.0117786100000000, -0.0121145500000000 ]  - [   0.0000650800000000, -0.0000410500000000, -0.0018244000000000 ]  - [   0.0116754300000000,  0.0067408100000000,  0.1564379000000000 ]  - [   0.0000582900000000,  0.0118594200000000, -0.0063781300000000 ]  - [  -0.0003664800000000, -0.0002115900000000, -0.0017139000000000 ]  - [   0.0102997100000000, -0.0058792300000000, -0.0063781300000000 ]  - [  -0.0005707700000000, -0.0022699300000000,  0.0177611700000000 ]  - [  -0.0000030100000000,  0.0000768800000000, -0.0018244000000000 ]  - [   0.0003765400000000,  0.0002173900000000, -0.0029579000000000 ]  - [   0.0000060400000000,  0.0004314300000000, -0.0017528700000000 ]  - [   0.0003766500000000, -0.0002104800000000, -0.0017528700000000 ]  - [   0.0008177600000000,  0.0004721400000000,  0.0060154100000000 ]  - [  -0.0000625800000000, -0.0000361300000000, -0.0018256200000000 ]  - [  -0.0022512000000000,  0.0006406600000000,  0.0177611700000000 ]  - [   0.0003180700000000,  0.0001836400000000,  0.0196743800000000 ]  - [   0.0000073600000000,  0.0000042500000000, -0.0017932900000000 ]  - [  -0.0062940700000000, -0.0036338800000000, -0.0042112800000000 ]  - [  -0.0000008800000000, -0.0000005100000000, -0.0014530000000000 ]  - [   0.0015848400000000,  0.0123956000000000, -0.0095399800000000 ]  - [  -0.0000639400000000, -0.0000369200000000, -0.0018233100000000 ]  - [   0.0003536400000000, -0.0002058000000000, -0.0018324000000000 ]  - [  -0.0006130700000000, -0.0003539600000000, -0.0037852500000000 ]  - [  -0.0000014100000000,  0.0004091600000000, -0.0018324000000000 ]  - [   0.0000013000000000,  0.0000715000000000, -0.0018229300000000 ]  - [   0.0115273200000000, -0.0048252900000000, -0.0095399800000000 ]  - [  -0.0001464200000000, -0.0000845400000000, -0.0036446400000000 ]  - [  -0.0004825700000000,  0.0005409800000000, -0.0010908400000000 ]  - [   0.0002272200000000, -0.0006884100000000, -0.0010908400000000 ]  - [  -0.0003545600000000, -0.0002047100000000, -0.0018384000000000 ]  - [   0.0011126100000000,  0.0006423700000000,  0.0062431500000000 ]  - [   0.0000625700000000, -0.0000346200000000, -0.0018229300000000 ]  - [   0.0000000300000000,  0.0000000200000000, -0.0021682100000000 ]  - [   0.0007345500000000,  0.0004240900000000, -0.0009812400000000 ]  - [  -0.0000003300000000, -0.0000001900000000, -0.0021679900000000 ]  - [  -0.0000014300000000, -0.0000008300000000, -0.0014877500000000 ]  - [   0.0000713300000000, -0.0000426200000000, -0.0018223000000000 ]  - [  -0.0000600300000000, -0.0000346600000000, -0.0018120700000000 ]  - [   0.0003458300000000, -0.0002004700000000, -0.0018355200000000 ]  - [  -0.0003968800000000, -0.0002291400000000, -0.0017300000000000 ]  - [  -0.0000006900000000,  0.0003997300000000, -0.0018355200000000 ]  - [   0.0000011200000000,  0.0000672800000000, -0.0018117900000000 ]  - [  -0.0000012400000000,  0.0000830800000000, -0.0018223000000000 ]  - [  -0.0000000200000000, -0.0000000100000000, -0.0035747500000000 ]  - [   0.0000009800000000,  0.0004553600000000, -0.0017273200000000 ]  - [   0.0003948400000000, -0.0002268300000000, -0.0017273200000000 ]  - [  -0.0003422400000000, -0.0001975900000000, -0.0018330800000000 ]  - [  -0.0000705500000000, -0.0000407300000000, -0.0018212000000000 ]  - [   0.0000588300000000, -0.0000326700000000, -0.0018117900000000 ]  - [   0.0000007600000000,  0.0000004400000000, -0.0021630800000000 ]  - [   0.0000021400000000,  0.0000012400000000, -0.0017844200000000 ]- atom:   41  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0021791600000000, -0.0004670300000000,  0.0000867800000000 ]  - [  -0.0000007500000000,  0.0000009600000000,  0.0003527600000000 ]  - [  -0.0000007800000000,  0.0000004700000000,  0.0003447800000000 ]  - [   0.0003240100000000,  0.0002540300000000,  0.0003840900000000 ]  - [  -0.0000072800000000,  0.0000019500000000,  0.0004356800000000 ]  - [  -0.0000720100000000, -0.0004018200000000,  0.0003430100000000 ]  - [  -0.0003225100000000,  0.0001711000000000,  0.0003168200000000 ]  - [   0.0787261500000000, -0.0370500300000000, -0.0389754200000000 ]  - [  -0.0001930100000000,  0.0034878200000000, -0.0045330100000000 ]  - [   0.0003265100000000, -0.0003225900000000,  0.0025889200000000 ]  - [   0.0000116600000000, -0.0000018900000000,  0.0005270500000000 ]  - [  -0.0062668900000000, -0.0000052800000000, -0.0039501000000000 ]  - [   0.0458544200000000,  0.0183612100000000, -0.0277712400000000 ]  - [   0.0154396400000000,  0.0019941500000000, -0.0048377500000000 ]  - [   0.0004025600000000,  0.0001347300000000,  0.0004582800000000 ]  - [  -0.0001599500000000, -0.0025111900000000, -0.0017018900000000 ]  - [  -0.0000848600000000, -0.0003402300000000,  0.0002547400000000 ]  - [  -0.0003770600000000,  0.0000479200000000,  0.0003760500000000 ]  - [  -0.0000006100000000, -0.0000003800000000,  0.0006553200000000 ]  - [   0.0000003100000000, -0.0000006400000000,  0.0004631600000000 ]  - [   0.0000118700000000,  0.0000422100000000,  0.0006843000000000 ]  - [   0.0006938900000000, -0.0004737700000000,  0.0042781900000000 ]  - [  -0.0000436100000000,  0.0000250800000000,  0.0004660800000000 ]  - [  -0.0000002800000000, -0.0000495100000000,  0.0004660200000000 ]  - [   0.0000424800000000,  0.0000259500000000,  0.0004660400000000 ]  - [   0.0000138900000000,  0.0000092700000000,  0.0004378700000000 ]  - [  -0.0000002700000000, -0.0000002600000000,  0.0004886900000000 ]  - [  -0.0000019400000000, -0.0000180500000000,  0.0004381500000000 ]  - [  -0.0000152300000000,  0.0000095000000000,  0.0004378900000000 ]  - [   0.0000006800000000,  0.0000000400000000,  0.0006978900000000 ]  - [   0.0000009800000000, -0.0000018500000000,  0.0005517200000000 ]  - [   0.0000012100000000, -0.0000010800000000,  0.0007031500000000 ]  - [   0.0000009800000000, -0.0000002300000000,  0.0004562800000000 ]  - [  -0.0000480600000000,  0.0000273800000000,  0.0004617200000000 ]  - [  -0.0000016600000000, -0.0000543300000000,  0.0004625400000000 ]  - [   0.0000466300000000,  0.0000286600000000,  0.0004630000000000 ]  - [   0.0000229200000000, -0.0000150000000000, -0.0005441000000000 ]  - [   0.0077776900000000,  0.0203035500000000,  0.0016662700000000 ]  - [  -0.0000679500000000,  0.0000384200000000, -0.0002542200000000 ]  - [  -0.0022389600000000,  0.0011778700000000, -0.0000706900000000 ]  - [  -0.2123190900000000,  0.0217076000000000,  0.0813170400000000 ]  - [  -0.0003202300000000, -0.0001306000000000, -0.0005737600000000 ]  - [   0.0079577700000000, -0.0214442700000000,  0.0035940800000000 ]  - [   0.0044171200000000,  0.0055154200000000,  0.0102156400000000 ]  - [  -0.0000127900000000, -0.0000820800000000, -0.0002688500000000 ]  - [   0.0027199200000000, -0.0036032500000000, -0.0074412900000000 ]  - [   0.0000041000000000,  0.0002952700000000, -0.0005803100000000 ]  - [   0.0004129100000000, -0.0001769900000000, -0.0008337600000000 ]  - [   0.0450502700000000,  0.0000094000000000,  0.0042373700000000 ]  - [   0.0000691900000000,  0.0000537500000000, -0.0002765300000000 ]  - [   0.0002251100000000,  0.0003460400000000,  0.0008534900000000 ]  - [   0.0093815300000000, -0.0071548600000000, -0.0178262900000000 ]  - [  -0.0000436400000000,  0.0000243700000000,  0.0003919400000000 ]  - [  -0.0000477100000000, -0.0002986700000000,  0.0003008500000000 ]  - [  -0.0000018500000000, -0.0000018700000000, -0.0002411900000000 ]  - [   0.0013820600000000, -0.0000200000000000, -0.0004702100000000 ]  - [  -0.0000099600000000, -0.0000081400000000, -0.0003218900000000 ]  - [   0.0000818100000000, -0.0000473400000000, -0.0003313300000000 ]  - [  -0.0000249300000000, -0.0000154400000000, -0.0002991100000000 ]  - [  -0.0000006800000000,  0.0000918000000000, -0.0003305900000000 ]  - [   0.0000020800000000,  0.0000116300000000, -0.0003200800000000 ]  - [  -0.0000160100000000,  0.0006144300000000, -0.0006232800000000 ]  - [  -0.0000009500000000, -0.0000065200000000, -0.0006982100000000 ]  - [   0.0000007600000000,  0.0000218400000000, -0.0001816900000000 ]  - [   0.0000155200000000, -0.0000279300000000, -0.0002709100000000 ]  - [  -0.0000769700000000, -0.0000437200000000, -0.0003289100000000 ]  - [  -0.0008827800000000, -0.0000510200000000, -0.0001682800000000 ]  - [   0.0000082700000000, -0.0000047800000000, -0.0003210800000000 ]  - [   0.0000007500000000,  0.0000009800000000, -0.0003697000000000 ]  - [   0.0000462800000000,  0.0000002200000000, -0.0005562200000000 ]  - [   0.0000002300000000, -0.0000010900000000, -0.0003941000000000 ]  - [   0.0000001900000000, -0.0000028100000000, -0.0002796900000000 ]  - [   0.0000134300000000, -0.0000079000000000, -0.0003138800000000 ]  - [  -0.0000136400000000, -0.0000106100000000, -0.0003148700000000 ]  - [   0.0000766600000000, -0.0000445200000000, -0.0003302300000000 ]  - [  -0.0000567600000000, -0.0000352200000000, -0.0003040200000000 ]  - [  -0.0000011100000000,  0.0000860600000000, -0.0003298700000000 ]  - [   0.0000029000000000,  0.0000166800000000, -0.0003145700000000 ]  - [  -0.0000019800000000,  0.0000138500000000, -0.0003140100000000 ]  - [   0.0000003800000000, -0.0000003100000000, -0.0007005400000000 ]  - [   0.0000020000000000,  0.0000639300000000, -0.0003013200000000 ]  - [   0.0000554600000000, -0.0000318600000000, -0.0003017300000000 ]  - [  -0.0000720700000000, -0.0000403600000000, -0.0003282400000000 ]  - [  -0.0000120300000000, -0.0000047600000000, -0.0003126900000000 ]  - [   0.0000127800000000, -0.0000066800000000, -0.0003188300000000 ]  - [  -0.0000000500000000,  0.0000011600000000, -0.0003505200000000 ]  - [   0.0000017900000000,  0.0000020600000000, -0.0003426400000000 ]- atom:   41  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0022218700000000,  0.0004886400000000, -0.0001524300000000 ]  - [  -0.0000014100000000,  0.0000001900000000, -0.0003499900000000 ]  - [  -0.0000012700000000,  0.0000007100000000, -0.0003447400000000 ]  - [  -0.0003350400000000, -0.0002617600000000, -0.0004127000000000 ]  - [   0.0000094000000000, -0.0000028500000000, -0.0005112200000000 ]  - [   0.0000734300000000,  0.0004148200000000, -0.0003715200000000 ]  - [   0.0003317400000000, -0.0001761800000000, -0.0003440100000000 ]  - [  -0.0749314100000000,  0.0343245200000000,  0.0366822300000000 ]  - [   0.0002400700000000, -0.0034926900000000,  0.0044755100000000 ]  - [  -0.0003333100000000,  0.0003232400000000, -0.0024541000000000 ]  - [  -0.0000128800000000,  0.0000029500000000, -0.0005714400000000 ]  - [   0.0062699900000000, -0.0001243900000000,  0.0038461100000000 ]  - [  -0.0484809000000000, -0.0202023600000000,  0.0297787900000000 ]  - [  -0.0154893000000000, -0.0023537700000000,  0.0046420700000000 ]  - [  -0.0004184200000000, -0.0001407200000000, -0.0004973200000000 ]  - [   0.0001267700000000,  0.0025145400000000,  0.0016446200000000 ]  - [   0.0000801900000000,  0.0003578600000000, -0.0002959300000000 ]  - [   0.0003908300000000, -0.0000580900000000, -0.0004191600000000 ]  - [  -0.0000007300000000,  0.0000008500000000, -0.0006240100000000 ]  - [   0.0000006700000000, -0.0000001900000000, -0.0005430000000000 ]  - [  -0.0000096100000000, -0.0000429000000000, -0.0006414500000000 ]  - [  -0.0006876500000000,  0.0004760900000000, -0.0042835700000000 ]  - [   0.0000343600000000, -0.0000197000000000, -0.0004431200000000 ]  - [  -0.0000016300000000,  0.0000386600000000, -0.0004432300000000 ]  - [  -0.0000341100000000, -0.0000188900000000, -0.0004431300000000 ]  - [  -0.0000283000000000, -0.0000159400000000, -0.0004697100000000 ]  - [   0.0000004500000000, -0.0000000100000000, -0.0005358400000000 ]  - [   0.0000010900000000,  0.0000332400000000, -0.0004694600000000 ]  - [   0.0000272000000000, -0.0000157700000000, -0.0004698000000000 ]  - [  -0.0000021400000000,  0.0000004800000000, -0.0005934100000000 ]  - [  -0.0000013700000000, -0.0000001900000000, -0.0005311400000000 ]  - [   0.0000003100000000, -0.0000008000000000, -0.0006276000000000 ]  - [   0.0000002800000000, -0.0000001200000000, -0.0005558600000000 ]  - [   0.0000398300000000, -0.0000229300000000, -0.0004433200000000 ]  - [  -0.0000001600000000,  0.0000476800000000, -0.0004443100000000 ]  - [  -0.0000415800000000, -0.0000239300000000, -0.0004443700000000 ]  - [  -0.0000245200000000,  0.0000129800000000,  0.0005124100000000 ]  - [  -0.0077890700000000, -0.0203099400000000, -0.0015985700000000 ]  - [   0.0000542700000000, -0.0000298700000000,  0.0002868500000000 ]  - [   0.0022556100000000, -0.0011048100000000,  0.0000173500000000 ]  - [   0.2113080600000000, -0.0167892400000000, -0.0807501800000000 ]  - [   0.0003515900000000,  0.0001439600000000,  0.0005377200000000 ]  - [  -0.0079378300000000,  0.0214486600000000, -0.0035875700000000 ]  - [  -0.0044575600000000, -0.0054883700000000, -0.0101208100000000 ]  - [   0.0000092200000000,  0.0000615000000000,  0.0003007000000000 ]  - [  -0.0027450000000000,  0.0035759200000000,  0.0072981900000000 ]  - [   0.0000001800000000, -0.0003369600000000,  0.0005480500000000 ]  - [  -0.0004453700000000,  0.0001963000000000,  0.0008016500000000 ]  - [  -0.0451089900000000, -0.0000121400000000, -0.0041915800000000 ]  - [  -0.0000522600000000, -0.0000395600000000,  0.0003120100000000 ]  - [  -0.0002359900000000, -0.0003589800000000, -0.0007970800000000 ]  - [  -0.0093614400000000,  0.0072236700000000,  0.0180469900000000 ]  - [   0.0000466000000000, -0.0000206400000000, -0.0004501700000000 ]  - [   0.0000441700000000,  0.0002966200000000, -0.0002559200000000 ]  - [  -0.0000020600000000, -0.0000020200000000,  0.0002890800000000 ]  - [  -0.0014046900000000,  0.0000371200000000,  0.0004965100000000 ]  - [   0.0000123000000000,  0.0000047000000000,  0.0003365600000000 ]  - [  -0.0000339500000000,  0.0000194000000000,  0.0003283500000000 ]  - [   0.0000356000000000,  0.0000176700000000,  0.0002895500000000 ]  - [  -0.0000007700000000, -0.0000415200000000,  0.0003285400000000 ]  - [   0.0000019500000000, -0.0000142800000000,  0.0003384500000000 ]  - [   0.0000163600000000, -0.0006439400000000,  0.0006550600000000 ]  - [   0.0000017700000000,  0.0000061300000000,  0.0005312800000000 ]  - [   0.0000024900000000, -0.0000387900000000,  0.0001761800000000 ]  - [  -0.0000292800000000,  0.0000357600000000,  0.0002659900000000 ]  - [   0.0000386100000000,  0.0000230000000000,  0.0003309100000000 ]  - [   0.0009082300000000,  0.0000677800000000,  0.0002105200000000 ]  - [  -0.0000143300000000,  0.0000081200000000,  0.0003373100000000 ]  - [   0.0000006200000000,  0.0000009700000000,  0.0004176900000000 ]  - [  -0.0000420000000000,  0.0000036800000000,  0.0004721800000000 ]  - [   0.0000000900000000, -0.0000011900000000,  0.0003842100000000 ]  - [  -0.0000006900000000, -0.0000025200000000,  0.0002579700000000 ]  - [  -0.0000131100000000,  0.0000072800000000,  0.0003478400000000 ]  - [   0.0000196100000000,  0.0000096200000000,  0.0003495200000000 ]  - [  -0.0000391800000000,  0.0000222600000000,  0.0003272100000000 ]  - [   0.0000914800000000,  0.0000503900000000,  0.0003213500000000 ]  - [  -0.0000008500000000, -0.0000475700000000,  0.0003283000000000 ]  - [   0.0000008900000000, -0.0000219700000000,  0.0003514500000000 ]  - [  -0.0000021000000000, -0.0000168100000000,  0.0003477000000000 ]  - [   0.0000003000000000, -0.0000004200000000,  0.0005596600000000 ]  - [   0.0000018700000000, -0.0001075000000000,  0.0003238800000000 ]  - [  -0.0000930800000000,  0.0000537600000000,  0.0003234000000000 ]  - [   0.0000436200000000,  0.0000260100000000,  0.0003301200000000 ]  - [   0.0000142600000000,  0.0000104400000000,  0.0003490300000000 ]  - [  -0.0000223200000000,  0.0000122600000000,  0.0003549400000000 ]  - [   0.0000014600000000,  0.0000008300000000,  0.0004020600000000 ]  - [   0.0000016600000000,  0.0000019500000000,  0.0002886900000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0010660200000000, -0.0006154600000000,  0.0062866600000000 ]  - [  -0.0000033900000000,  0.0000019500000000, -0.0019278900000000 ]  - [  -0.0000010200000000,  0.0000005900000000, -0.0019238800000000 ]  - [  -0.0001021900000000, -0.0002105900000000, -0.0025088900000000 ]  - [   0.0000103500000000, -0.0000059800000000, -0.0028967100000000 ]  - [   0.0001312800000000,  0.0001937900000000, -0.0025088900000000 ]  - [   0.0000923000000000, -0.0000532900000000, -0.0024590100000000 ]  - [  -0.0282066900000000,  0.0162851400000000,  0.0458861500000000 ]  - [  -0.0050824500000000,  0.0029343500000000, -0.0010101700000000 ]  - [  -0.0007579500000000,  0.0004376000000000, -0.0047586200000000 ]  - [  -0.0000174200000000,  0.0000100600000000, -0.0028386300000000 ]  - [   0.0007043400000000, -0.0004066500000000,  0.0229103700000000 ]  - [  -0.0259642200000000, -0.0131467500000000,  0.0481425600000000 ]  - [  -0.0015966900000000,  0.0290590500000000,  0.0481425600000000 ]  - [  -0.0002419400000000, -0.0008032800000000, -0.0026934100000000 ]  - [   0.0042440200000000, -0.0024502900000000, -0.0011260500000000 ]  - [   0.0005746900000000,  0.0006111600000000, -0.0026934100000000 ]  - [   0.0002216600000000, -0.0001279800000000, -0.0021030800000000 ]  - [  -0.0000004900000000,  0.0000002900000000, -0.0035838400000000 ]  - [   0.0000011100000000, -0.0000006400000000, -0.0028460000000000 ]  - [  -0.0000937700000000,  0.0000541400000000, -0.0037095000000000 ]  - [  -0.0016043700000000,  0.0009262800000000, -0.0049769800000000 ]  - [   0.0002097600000000, -0.0001211000000000, -0.0025269100000000 ]  - [  -0.0000011800000000,  0.0002423700000000, -0.0025279100000000 ]  - [  -0.0002104900000000, -0.0001201700000000, -0.0025279100000000 ]  - [  -0.0001293500000000, -0.0000738000000000, -0.0025499100000000 ]  - [  -0.0000008500000000,  0.0000004900000000, -0.0028881400000000 ]  - [  -0.0000007600000000,  0.0001489200000000, -0.0025499100000000 ]  - [   0.0001278200000000, -0.0000738000000000, -0.0025466700000000 ]  - [  -0.0000008900000000,  0.0000005100000000, -0.0035517400000000 ]  - [  -0.0000044900000000,  0.0000025900000000, -0.0028057100000000 ]  - [   0.0000008100000000, -0.0000004600000000, -0.0036767000000000 ]  - [   0.0000007800000000, -0.0000004500000000, -0.0028741300000000 ]  - [   0.0002103600000000, -0.0001214500000000, -0.0025290600000000 ]  - [   0.0000006500000000,  0.0002455500000000, -0.0025298400000000 ]  - [  -0.0002123300000000, -0.0001233400000000, -0.0025298400000000 ]  - [  -0.0000521700000000,  0.0000301200000000,  0.0021950100000000 ]  - [  -0.0001462900000000,  0.0000844600000000, -0.0139472700000000 ]  - [  -0.0000963400000000,  0.0000556200000000,  0.0018407700000000 ]  - [  -0.0022690800000000, -0.0118420300000000,  0.0063962700000000 ]  - [   0.0812373600000000, -0.0469024100000000, -0.1488947400000000 ]  - [   0.0005477900000000,  0.0002647900000000,  0.0016311100000000 ]  - [  -0.0006212300000000,  0.0045114800000000, -0.0160778500000000 ]  - [   0.0091209600000000,  0.0078861000000000,  0.0063962700000000 ]  - [   0.0000231100000000, -0.0000872200000000,  0.0018585300000000 ]  - [  -0.0093502600000000,  0.0053983700000000,  0.0079216100000000 ]  - [   0.0000445800000000, -0.0006068000000000,  0.0016311100000000 ]  - [  -0.0007711400000000,  0.0004452200000000,  0.0022157600000000 ]  - [  -0.0042176700000000, -0.0017177400000000, -0.0160778500000000 ]  - [   0.0000870900000000,  0.0000236000000000,  0.0018585300000000 ]  - [  -0.0003118000000000,  0.0001800200000000, -0.0059980700000000 ]  - [  -0.0160630000000000,  0.0092739800000000,  0.0133040200000000 ]  - [  -0.0000756700000000,  0.0000436900000000,  0.0017120300000000 ]  - [   0.0002563800000000, -0.0001480200000000,  0.0013420100000000 ]  - [  -0.0000010700000000,  0.0000006200000000,  0.0015073400000000 ]  - [  -0.0004163300000000,  0.0002403700000000,  0.0039210600000000 ]  - [   0.0000659500000000,  0.0000359500000000,  0.0018481500000000 ]  - [  -0.0003039800000000,  0.0001755000000000,  0.0018399600000000 ]  - [   0.0004074000000000,  0.0000902600000000,  0.0017680100000000 ]  - [  -0.0000005900000000, -0.0003553100000000,  0.0018422500000000 ]  - [   0.0000018400000000, -0.0000750900000000,  0.0018481500000000 ]  - [  -0.0003740600000000, -0.0003431500000000,  0.0012126500000000 ]  - [   0.0000111700000000, -0.0000064500000000,  0.0034217900000000 ]  - [   0.0001255400000000, -0.0003979500000000,  0.0017680100000000 ]  - [  -0.0003716700000000,  0.0002145900000000,  0.0015501400000000 ]  - [   0.0003074100000000,  0.0001781700000000,  0.0018422500000000 ]  - [   0.0001101400000000,  0.0004955200000000,  0.0012126500000000 ]  - [  -0.0000680000000000,  0.0000392600000000,  0.0018484300000000 ]  - [   0.0000000400000000, -0.0000000200000000,  0.0022253400000000 ]  - [  -0.0001998300000000,  0.0001153700000000,  0.0018473200000000 ]  - [   0.0000005400000000, -0.0000003100000000,  0.0021653900000000 ]  - [  -0.0000000900000000,  0.0000000500000000,  0.0014742100000000 ]  - [  -0.0000725900000000,  0.0000419100000000,  0.0018631400000000 ]  - [   0.0000672300000000,  0.0000374700000000,  0.0018539800000000 ]  - [  -0.0003106700000000,  0.0001793700000000,  0.0018404800000000 ]  - [   0.0004332700000000,  0.0002478400000000,  0.0017552800000000 ]  - [  -0.0000006100000000, -0.0003624300000000,  0.0018428900000000 ]  - [   0.0000011600000000, -0.0000769600000000,  0.0018539800000000 ]  - [  -0.0000021800000000, -0.0000854500000000,  0.0018631700000000 ]  - [   0.0000003300000000, -0.0000001900000000,  0.0034484800000000 ]  - [   0.0000020000000000, -0.0004991500000000,  0.0017552800000000 ]  - [  -0.0004337800000000,  0.0002504400000000,  0.0017556000000000 ]  - [   0.0003135700000000,  0.0001817500000000,  0.0018428900000000 ]  - [   0.0000729100000000,  0.0000446100000000,  0.0018631700000000 ]  - [  -0.0000709500000000,  0.0000409700000000,  0.0018630600000000 ]  - [   0.0000001100000000, -0.0000000600000000,  0.0022229800000000 ]  - [   0.0000001600000000, -0.0000000900000000,  0.0017362900000000 ]- atom:   41  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [  -0.0012241300000000,  0.0007067500000000, -0.0065483400000000 ]  - [   0.0000010900000000, -0.0000006300000000,  0.0019303600000000 ]  - [  -0.0000011400000000,  0.0000006600000000,  0.0019232000000000 ]  - [   0.0000898900000000,  0.0002030000000000,  0.0024815900000000 ]  - [  -0.0000092200000000,  0.0000053200000000,  0.0028215200000000 ]  - [  -0.0001308600000000, -0.0001793500000000,  0.0024815900000000 ]  - [  -0.0000819800000000,  0.0000473300000000,  0.0024333800000000 ]  - [   0.0291056100000000, -0.0168041300000000, -0.0459066000000000 ]  - [   0.0050571400000000, -0.0029197400000000,  0.0010146500000000 ]  - [   0.0007592500000000, -0.0004383500000000,  0.0048930100000000 ]  - [   0.0000172500000000, -0.0000099600000000,  0.0027948300000000 ]  - [  -0.0006877300000000,  0.0003970600000000, -0.0227603000000000 ]  - [   0.0248044400000000,  0.0125128700000000, -0.0477488700000000 ]  - [   0.0015657600000000, -0.0277377100000000, -0.0477488700000000 ]  - [   0.0002250900000000,  0.0007911300000000,  0.0026526700000000 ]  - [  -0.0042138400000000,  0.0024328600000000,  0.0010748300000000 ]  - [  -0.0005725900000000, -0.0005905000000000,  0.0026526700000000 ]  - [  -0.0002072600000000,  0.0001196600000000,  0.0020656100000000 ]  - [  -0.0000007800000000,  0.0000004500000000,  0.0036148600000000 ]  - [   0.0000004800000000, -0.0000002800000000,  0.0027684000000000 ]  - [   0.0000951500000000, -0.0000549400000000,  0.0037539900000000 ]  - [   0.0015907600000000, -0.0009184300000000,  0.0049593400000000 ]  - [  -0.0002189200000000,  0.0001263900000000,  0.0025493000000000 ]  - [  -0.0000008700000000, -0.0002526500000000,  0.0025500300000000 ]  - [   0.0002183600000000,  0.0001270800000000,  0.0025500300000000 ]  - [   0.0001145300000000,  0.0000667600000000,  0.0025197200000000 ]  - [   0.0000005800000000, -0.0000003400000000,  0.0028411400000000 ]  - [  -0.0000005600000000, -0.0001325700000000,  0.0025197200000000 ]  - [  -0.0001157000000000,  0.0000668000000000,  0.0025161400000000 ]  - [  -0.0000004700000000,  0.0000002700000000,  0.0036560700000000 ]  - [   0.0000060200000000, -0.0000034800000000,  0.0028269500000000 ]  - [   0.0000011600000000, -0.0000006700000000,  0.0037539400000000 ]  - [   0.0000008000000000, -0.0000004600000000,  0.0027755800000000 ]  - [  -0.0002181700000000,  0.0001259600000000,  0.0025470500000000 ]  - [  -0.0000024300000000, -0.0002515200000000,  0.0025475700000000 ]  - [   0.0002166100000000,  0.0001278700000000,  0.0025475700000000 ]  - [   0.0000524300000000, -0.0000302700000000, -0.0022322800000000 ]  - [   0.0001530700000000, -0.0000883700000000,  0.0139477900000000 ]  - [   0.0000862500000000, -0.0000497900000000, -0.0018109900000000 ]  - [   0.0022577100000000,  0.0116406600000000, -0.0062253600000000 ]  - [  -0.0807721300000000,  0.0466338100000000,  0.1479460300000000 ]  - [  -0.0005115300000000, -0.0002481500000000, -0.0016627500000000 ]  - [   0.0006253700000000, -0.0045002000000000,  0.0160929400000000 ]  - [  -0.0089522500000000, -0.0077755700000000, -0.0062253600000000 ]  - [  -0.0000274500000000,  0.0000714400000000, -0.0018295800000000 ]  - [   0.0094831900000000, -0.0054751200000000, -0.0081093500000000 ]  - [  -0.0000408700000000,  0.0005670800000000, -0.0016627500000000 ]  - [   0.0007391000000000, -0.0004267200000000, -0.0022512900000000 ]  - [   0.0042099800000000,  0.0017085100000000,  0.0160929400000000 ]  - [  -0.0000756000000000, -0.0000119500000000, -0.0018295800000000 ]  - [   0.0002959500000000, -0.0001708700000000,  0.0059855700000000 ]  - [   0.0157591400000000, -0.0090985400000000, -0.0130117400000000 ]  - [   0.0000765800000000, -0.0000442100000000, -0.0017698800000000 ]  - [  -0.0002557600000000,  0.0001476600000000, -0.0013093600000000 ]  - [  -0.0000006400000000,  0.0000003700000000, -0.0014629200000000 ]  - [   0.0003982900000000, -0.0002299500000000, -0.0038756400000000 ]  - [  -0.0000589100000000, -0.0000362800000000, -0.0018276000000000 ]  - [   0.0003536600000000, -0.0002041800000000, -0.0018450600000000 ]  - [  -0.0003923900000000, -0.0000868200000000, -0.0017738300000000 ]  - [  -0.0000007600000000,  0.0004047900000000, -0.0018439300000000 ]  - [   0.0000019600000000,  0.0000691600000000, -0.0018276000000000 ]  - [   0.0003686700000000,  0.0003193200000000, -0.0011888900000000 ]  - [  -0.0000104300000000,  0.0000060200000000, -0.0035900700000000 ]  - [  -0.0001210100000000,  0.0003832300000000, -0.0017738300000000 ]  - [   0.0003562600000000, -0.0002056900000000, -0.0015566700000000 ]  - [  -0.0003509400000000, -0.0002017400000000, -0.0018439300000000 ]  - [  -0.0000922000000000, -0.0004789400000000, -0.0011888900000000 ]  - [   0.0000571300000000, -0.0000329800000000, -0.0018273100000000 ]  - [   0.0000000200000000, -0.0000000100000000, -0.0021708100000000 ]  - [   0.0001991200000000, -0.0001149600000000, -0.0019295700000000 ]  - [   0.0000006800000000, -0.0000003900000000, -0.0021806600000000 ]  - [   0.0000014000000000, -0.0000008100000000, -0.0014996900000000 ]  - [   0.0000763900000000, -0.0000441100000000, -0.0018322400000000 ]  - [  -0.0000585000000000, -0.0000363900000000, -0.0018152000000000 ]  - [   0.0003496500000000, -0.0002018700000000, -0.0018449100000000 ]  - [  -0.0003954500000000, -0.0002306900000000, -0.0017350300000000 ]  - [  -0.0000012700000000,  0.0003995500000000, -0.0018436200000000 ]  - [   0.0000022600000000,  0.0000688500000000, -0.0018152000000000 ]  - [  -0.0000021100000000,  0.0000863500000000, -0.0018321100000000 ]  - [   0.0000003700000000, -0.0000002100000000, -0.0035907500000000 ]  - [   0.0000020600000000,  0.0004578100000000, -0.0017350300000000 ]  - [   0.0003950700000000, -0.0002281000000000, -0.0017345000000000 ]  - [  -0.0003466600000000, -0.0001986700000000, -0.0018436200000000 ]  - [  -0.0000758300000000, -0.0000413500000000, -0.0018321100000000 ]  - [   0.0000575300000000, -0.0000332100000000, -0.0018227900000000 ]  - [  -0.0000001500000000,  0.0000000900000000, -0.0021669500000000 ]  - [   0.0000002700000000, -0.0000001500000000, -0.0017883400000000 ]- atom:   42  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0002665200000000,  0.0011713800000000,  0.0008413000000000 ]  - [  -0.0000010900000000,  0.0000007800000000, -0.0004342000000000 ]  - [  -0.0000026400000000,  0.0000033200000000, -0.0004334300000000 ]  - [  -0.0063866200000000,  0.0003355800000000,  0.0045366300000000 ]  - [  -0.0003472400000000,  0.0025581000000000,  0.0014994400000000 ]  - [   0.0503539500000000, -0.0208927700000000,  0.0312029200000000 ]  - [   0.0150759900000000, -0.0021184500000000,  0.0055891100000000 ]  - [   0.0003109900000000,  0.0003706700000000, -0.0021513300000000 ]  - [   0.0000076400000000,  0.0000029100000000, -0.0006522000000000 ]  - [   0.0828620000000000,  0.0392544200000000,  0.0422108100000000 ]  - [  -0.0000004500000000, -0.0036022300000000,  0.0047155100000000 ]  - [   0.0001458300000000, -0.0001582600000000, -0.0005226800000000 ]  - [  -0.0000550400000000,  0.0002141000000000, -0.0004959400000000 ]  - [  -0.0001414700000000, -0.0000933800000000, -0.0004931600000000 ]  - [  -0.0000376600000000, -0.0000211500000000, -0.0005930600000000 ]  - [  -0.0000050200000000, -0.0000030100000000, -0.0006637400000000 ]  - [  -0.0000011200000000,  0.0000435700000000, -0.0005938000000000 ]  - [   0.0000364000000000, -0.0000219100000000, -0.0005937700000000 ]  - [  -0.0000005200000000,  0.0000004900000000, -0.0007996800000000 ]  - [   0.0000006900000000, -0.0000002500000000, -0.0006752800000000 ]  - [   0.0000019100000000,  0.0000000800000000, -0.0008202200000000 ]  - [   0.0000010800000000,  0.0000012300000000, -0.0006649100000000 ]  - [   0.0000428900000000, -0.0000251400000000, -0.0005629200000000 ]  - [  -0.0000027100000000,  0.0000511800000000, -0.0005630300000000 ]  - [  -0.0000439300000000, -0.0000243500000000, -0.0005629800000000 ]  - [  -0.0000355200000000, -0.0000193200000000, -0.0005896700000000 ]  - [  -0.0000004700000000,  0.0000001800000000, -0.0006709900000000 ]  - [   0.0000000300000000,  0.0000392500000000, -0.0005893100000000 ]  - [   0.0000331300000000, -0.0000190800000000, -0.0005896500000000 ]  - [   0.0000136900000000, -0.0000418600000000, -0.0007624800000000 ]  - [   0.0007264200000000,  0.0004878700000000, -0.0044445000000000 ]  - [   0.0000003400000000,  0.0000000300000000, -0.0008010600000000 ]  - [   0.0000003100000000,  0.0000002500000000, -0.0006895700000000 ]  - [   0.0004400000000000, -0.0001679500000000, -0.0006002100000000 ]  - [  -0.0001071200000000,  0.0003844200000000, -0.0003723900000000 ]  - [  -0.0004157900000000, -0.0000566900000000, -0.0004923700000000 ]  - [   0.0100040400000000,  0.0074964600000000,  0.0181662700000000 ]  - [   0.0000015300000000,  0.0000228400000000,  0.0001670300000000 ]  - [  -0.0023653400000000, -0.0016772400000000,  0.0006541200000000 ]  - [  -0.0000006600000000, -0.0000055500000000,  0.0003995900000000 ]  - [  -0.0003229600000000,  0.0001131500000000,  0.0005363800000000 ]  - [  -0.2186965400000000, -0.0219567200000000, -0.0892023800000000 ]  - [  -0.0000140500000000, -0.0003097600000000,  0.0004932200000000 ]  - [  -0.0000077100000000,  0.0000111900000000,  0.0004076300000000 ]  - [   0.0043833200000000, -0.0055838200000000, -0.0104605700000000 ]  - [   0.0024738300000000,  0.0033708900000000,  0.0065980300000000 ]  - [   0.0078777000000000,  0.0213712100000000, -0.0040041800000000 ]  - [   0.0453293800000000,  0.0002635700000000, -0.0047531600000000 ]  - [   0.0004182800000000,  0.0001823500000000,  0.0007630700000000 ]  - [   0.0002809800000000, -0.0003175800000000, -0.0009602000000000 ]  - [  -0.0000013800000000, -0.0000130800000000,  0.0004125100000000 ]  - [   0.0000209200000000,  0.0000181400000000,  0.0005847700000000 ]  - [   0.0079105400000000, -0.0204111000000000, -0.0021121900000000 ]  - [  -0.0000008700000000, -0.0000008000000000,  0.0005069200000000 ]  - [  -0.0000021600000000, -0.0000018300000000,  0.0003602800000000 ]  - [  -0.0000298700000000,  0.0000173900000000,  0.0004350400000000 ]  - [   0.0000150800000000,  0.0000065300000000,  0.0004229500000000 ]  - [  -0.0000508700000000,  0.0000292600000000,  0.0004155600000000 ]  - [   0.0000986700000000,  0.0000548800000000,  0.0003901300000000 ]  - [  -0.0000008600000000, -0.0000609300000000,  0.0004160000000000 ]  - [   0.0000018500000000, -0.0000175100000000,  0.0004248100000000 ]  - [  -0.0000017100000000, -0.0000359900000000,  0.0004338500000000 ]  - [   0.0000003100000000, -0.0000000700000000,  0.0007131600000000 ]  - [   0.0000017000000000, -0.0001161300000000,  0.0003918600000000 ]  - [  -0.0001005000000000,  0.0000579400000000,  0.0003917100000000 ]  - [   0.0000553000000000,  0.0000328400000000,  0.0004181000000000 ]  - [   0.0000317200000000,  0.0000204200000000,  0.0004392400000000 ]  - [  -0.0000173400000000,  0.0000099600000000,  0.0004238200000000 ]  - [   0.0000005100000000,  0.0000011000000000,  0.0005211700000000 ]  - [   0.0000017700000000,  0.0000023100000000,  0.0003579900000000 ]  - [   0.0000000000000000, -0.0000009900000000,  0.0004867500000000 ]  - [   0.0000524800000000,  0.0000001000000000,  0.0005202400000000 ]  - [  -0.0000168200000000,  0.0000095100000000,  0.0004350800000000 ]  - [   0.0014239700000000, -0.0000044100000000,  0.0006413200000000 ]  - [  -0.0000123800000000,  0.0000024400000000,  0.0004016700000000 ]  - [   0.0001105500000000,  0.0000615500000000,  0.0004034700000000 ]  - [  -0.0000052200000000, -0.0000131600000000,  0.0002787200000000 ]  - [   0.0000106500000000, -0.0006310700000000,  0.0007383300000000 ]  - [  -0.0000022100000000, -0.0000207200000000,  0.0004348700000000 ]  - [  -0.0000015900000000,  0.0000059500000000,  0.0007137900000000 ]  - [   0.0000017900000000, -0.0001292600000000,  0.0004057700000000 ]  - [  -0.0001123500000000,  0.0000649300000000,  0.0004056900000000 ]  - [   0.0000084100000000,  0.0000253300000000,  0.0003673000000000 ]  - [   0.0000177800000000,  0.0000126900000000,  0.0004362900000000 ]  - [  -0.0009085900000000,  0.0000713600000000,  0.0002494500000000 ]  - [  -0.0000650200000000,  0.0003152600000000, -0.0001601500000000 ]  - [   0.0000015500000000,  0.0000022100000000,  0.0003717000000000 ]- atom:   42  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0002710400000000, -0.0011711400000000, -0.0008369100000000 ]  - [  -0.0000014600000000,  0.0000005600000000,  0.0004312300000000 ]  - [   0.0000001600000000, -0.0000019500000000,  0.0004281500000000 ]  - [   0.0063900500000000, -0.0002059700000000, -0.0044676600000000 ]  - [   0.0003138100000000, -0.0025649000000000, -0.0015946900000000 ]  - [  -0.0532634100000000,  0.0228949300000000, -0.0334056000000000 ]  - [  -0.0151146800000000,  0.0025253400000000, -0.0054057400000000 ]  - [  -0.0003167900000000, -0.0003688200000000,  0.0022449900000000 ]  - [  -0.0000064100000000, -0.0000037500000000,  0.0006229700000000 ]  - [  -0.0789852500000000, -0.0364463900000000, -0.0395683200000000 ]  - [   0.0000487300000000,  0.0036105700000000, -0.0047354600000000 ]  - [  -0.0001543900000000,  0.0001635500000000,  0.0005149600000000 ]  - [   0.0000565700000000, -0.0002244000000000,  0.0004872600000000 ]  - [   0.0001507200000000,  0.0000973100000000,  0.0004841800000000 ]  - [   0.0000219900000000,  0.0000133100000000,  0.0005448500000000 ]  - [   0.0000056500000000,  0.0000025300000000,  0.0005882800000000 ]  - [   0.0000000000000000, -0.0000263300000000,  0.0005457400000000 ]  - [  -0.0000235200000000,  0.0000143200000000,  0.0005457300000000 ]  - [  -0.0000015200000000,  0.0000000500000000,  0.0008207500000000 ]  - [   0.0000000500000000, -0.0000004100000000,  0.0005877900000000 ]  - [  -0.0000007700000000, -0.0000005500000000,  0.0008526400000000 ]  - [  -0.0000005200000000, -0.0000014200000000,  0.0006471400000000 ]  - [  -0.0000520500000000,  0.0000304500000000,  0.0005788600000000 ]  - [   0.0000004500000000, -0.0000612600000000,  0.0005787800000000 ]  - [   0.0000514600000000,  0.0000312900000000,  0.0005788600000000 ]  - [   0.0000202900000000,  0.0000125800000000,  0.0005508700000000 ]  - [  -0.0000001100000000, -0.0000004400000000,  0.0006164800000000 ]  - [  -0.0000011900000000, -0.0000233600000000,  0.0005510800000000 ]  - [  -0.0000210900000000,  0.0000128000000000,  0.0005508500000000 ]  - [  -0.0000148600000000,  0.0000426100000000,  0.0008571000000000 ]  - [  -0.0007220400000000, -0.0004925200000000,  0.0044541500000000 ]  - [   0.0000004000000000, -0.0000015500000000,  0.0008667400000000 ]  - [   0.0000006000000000, -0.0000004100000000,  0.0005822200000000 ]  - [  -0.0004492700000000,  0.0001705900000000,  0.0006092400000000 ]  - [   0.0001010200000000, -0.0003915500000000,  0.0003835100000000 ]  - [   0.0004210400000000,  0.0000639900000000,  0.0005059500000000 ]  - [  -0.0099946300000000, -0.0075721800000000, -0.0184169700000000 ]  - [  -0.0000053000000000, -0.0000267300000000, -0.0001036100000000 ]  - [   0.0023657100000000,  0.0016094800000000, -0.0005309500000000 ]  - [   0.0000077200000000,  0.0000058800000000, -0.0003662900000000 ]  - [   0.0003488000000000, -0.0001288300000000, -0.0005230300000000 ]  - [   0.2178257400000000,  0.0167285000000000,  0.0887159500000000 ]  - [   0.0000104100000000,  0.0003384000000000, -0.0004807600000000 ]  - [   0.0000109800000000, -0.0000200900000000, -0.0003705600000000 ]  - [  -0.0044379400000000,  0.0055305200000000,  0.0104416900000000 ]  - [  -0.0025012400000000, -0.0033454000000000, -0.0066447600000000 ]  - [  -0.0078537100000000, -0.0213849600000000,  0.0039782900000000 ]  - [  -0.0453532200000000, -0.0002472600000000,  0.0046867800000000 ]  - [  -0.0004396800000000, -0.0001909300000000, -0.0007472100000000 ]  - [  -0.0002613200000000,  0.0003542800000000,  0.0009758000000000 ]  - [  -0.0000131200000000,  0.0000216600000000, -0.0003760000000000 ]  - [  -0.0000196600000000, -0.0000164800000000, -0.0005694400000000 ]  - [  -0.0079182300000000,  0.0204229400000000,  0.0020432900000000 ]  - [  -0.0000002500000000, -0.0000009400000000, -0.0004541700000000 ]  - [  -0.0000021700000000, -0.0000018600000000, -0.0003073800000000 ]  - [   0.0000100300000000, -0.0000060300000000, -0.0003977900000000 ]  - [  -0.0000132500000000, -0.0000098200000000, -0.0004037800000000 ]  - [   0.0000975300000000, -0.0000565100000000, -0.0004133000000000 ]  - [  -0.0000868700000000, -0.0000521500000000, -0.0003943200000000 ]  - [  -0.0000009400000000,  0.0001103900000000, -0.0004128800000000 ]  - [   0.0000017800000000,  0.0000151200000000, -0.0004019100000000 ]  - [  -0.0000026100000000,  0.0000097400000000, -0.0003981300000000 ]  - [   0.0000002300000000, -0.0000001100000000, -0.0008702200000000 ]  - [   0.0000019400000000,  0.0000978600000000, -0.0003929700000000 ]  - [   0.0000850800000000, -0.0000488300000000, -0.0003930300000000 ]  - [  -0.0000931600000000, -0.0000528700000000, -0.0004108600000000 ]  - [  -0.0000096100000000, -0.0000028000000000, -0.0004006500000000 ]  - [   0.0000109300000000, -0.0000064400000000, -0.0004030000000000 ]  - [   0.0000005000000000,  0.0000010600000000, -0.0004676100000000 ]  - [   0.0000011500000000,  0.0000017900000000, -0.0004384600000000 ]  - [   0.0000000000000000, -0.0000010900000000, -0.0004903500000000 ]  - [  -0.0000523300000000, -0.0000052100000000, -0.0005380500000000 ]  - [   0.0000161100000000, -0.0000095800000000, -0.0003957900000000 ]  - [  -0.0014233200000000, -0.0000029300000000, -0.0005963400000000 ]  - [   0.0000483800000000, -0.0000244100000000, -0.0003982600000000 ]  - [  -0.0000750300000000, -0.0000455200000000, -0.0003819200000000 ]  - [   0.0000021800000000,  0.0000506400000000, -0.0002748300000000 ]  - [  -0.0000027700000000,  0.0006301200000000, -0.0006982500000000 ]  - [  -0.0000022700000000,  0.0000172600000000, -0.0003959300000000 ]  - [   0.0000018200000000, -0.0000064900000000, -0.0008449400000000 ]  - [   0.0000017200000000,  0.0000846100000000, -0.0003789100000000 ]  - [   0.0000732300000000, -0.0000421800000000, -0.0003796700000000 ]  - [  -0.0000362200000000, -0.0000385800000000, -0.0003608800000000 ]  - [  -0.0000153000000000, -0.0000064500000000, -0.0003947000000000 ]  - [   0.0009027100000000, -0.0000651200000000, -0.0002176900000000 ]  - [   0.0000632300000000, -0.0003131600000000,  0.0002190000000000 ]  - [   0.0000015300000000,  0.0000020000000000, -0.0004212400000000 ]- atom:   42  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0002305700000000, -0.0001331200000000,  0.0008007100000000 ]  - [  -0.0000004500000000, -0.0000002600000000, -0.0018235400000000 ]  - [  -0.0000073600000000, -0.0000042500000000, -0.0018237300000000 ]  - [  -0.0009681000000000, -0.0005589300000000,  0.0227674000000000 ]  - [  -0.0042439700000000, -0.0024502600000000, -0.0010313900000000 ]  - [   0.0282711900000000, -0.0133312300000000,  0.0489348200000000 ]  - [   0.0025904100000000,  0.0311491800000000,  0.0489348200000000 ]  - [   0.0006562700000000,  0.0003789000000000, -0.0051564000000000 ]  - [   0.0000215900000000,  0.0000124700000000, -0.0026551500000000 ]  - [   0.0312026200000000,  0.0180148400000000,  0.0453754400000000 ]  - [   0.0052930900000000,  0.0030559700000000, -0.0008087400000000 ]  - [   0.0001695100000000, -0.0002483900000000, -0.0023833100000000 ]  - [  -0.0001303600000000,  0.0002710000000000, -0.0023833100000000 ]  - [  -0.0001628900000000, -0.0000940400000000, -0.0022500700000000 ]  - [  -0.0001234600000000, -0.0000712800000000, -0.0024230000000000 ]  - [  -0.0000133000000000, -0.0000076800000000, -0.0027425900000000 ]  - [  -0.0000020100000000,  0.0001432900000000, -0.0024245000000000 ]  - [   0.0001230800000000, -0.0000733900000000, -0.0024245000000000 ]  - [  -0.0000002700000000, -0.0000001600000000, -0.0034006100000000 ]  - [   0.0000003000000000,  0.0000001700000000, -0.0027016900000000 ]  - [   0.0000008400000000,  0.0000004900000000, -0.0035054800000000 ]  - [   0.0000053300000000,  0.0000030800000000, -0.0026986500000000 ]  - [   0.0001980600000000, -0.0001148000000000, -0.0023970300000000 ]  - [  -0.0000003800000000,  0.0002289300000000, -0.0023970300000000 ]  - [  -0.0001978700000000, -0.0001142400000000, -0.0023936100000000 ]  - [  -0.0001223600000000, -0.0000706400000000, -0.0024190200000000 ]  - [   0.0000004000000000,  0.0000002300000000, -0.0027400600000000 ]  - [   0.0000002500000000,  0.0001407700000000, -0.0024199200000000 ]  - [   0.0001220400000000, -0.0000701700000000, -0.0024199200000000 ]  - [   0.0000926700000000,  0.0000535100000000, -0.0033829800000000 ]  - [   0.0015708500000000,  0.0009069300000000, -0.0047807300000000 ]  - [  -0.0000003900000000, -0.0000002200000000, -0.0034864500000000 ]  - [   0.0000000800000000,  0.0000000500000000, -0.0027306800000000 ]  - [   0.0003051600000000, -0.0008409100000000, -0.0025393600000000 ]  - [  -0.0005756700000000,  0.0006847300000000, -0.0025393600000000 ]  - [  -0.0002920500000000, -0.0001686200000000, -0.0019469000000000 ]  - [   0.0158833900000000,  0.0091702800000000,  0.0128299900000000 ]  - [  -0.0000518100000000, -0.0000299200000000,  0.0014144500000000 ]  - [   0.0022027800000000, -0.0118842000000000,  0.0064027100000000 ]  - [   0.0000741700000000,  0.0000428200000000,  0.0017139000000000 ]  - [  -0.0005438100000000,  0.0003226700000000,  0.0016531200000000 ]  - [  -0.0888071700000000, -0.0512728400000000, -0.1449520000000000 ]  - [   0.0000075300000000, -0.0006322800000000,  0.0016531200000000 ]  - [  -0.0000196500000000, -0.0000749900000000,  0.0017558100000000 ]  - [  -0.0091906300000000,  0.0078497600000000,  0.0064027100000000 ]  - [   0.0096869500000000,  0.0055927700000000,  0.0088301000000000 ]  - [   0.0007327900000000,  0.0050175000000000, -0.0156082800000000 ]  - [   0.0047116800000000, -0.0018741400000000, -0.0156082800000000 ]  - [   0.0008101500000000,  0.0004677400000000,  0.0022437900000000 ]  - [   0.0004378500000000,  0.0002527900000000, -0.0060388600000000 ]  - [  -0.0000747700000000,  0.0000204700000000,  0.0017558100000000 ]  - [   0.0000515500000000,  0.0000297600000000,  0.0021496900000000 ]  - [   0.0000879500000000,  0.0000507800000000, -0.0146343900000000 ]  - [  -0.0000019000000000, -0.0000011000000000,  0.0020830200000000 ]  - [  -0.0000021300000000, -0.0000012300000000,  0.0014358200000000 ]  - [  -0.0000847500000000,  0.0000498500000000,  0.0017665600000000 ]  - [   0.0000580300000000,  0.0000335000000000,  0.0017483500000000 ]  - [  -0.0002909500000000,  0.0001675100000000,  0.0017473500000000 ]  - [   0.0003973300000000,  0.0002294000000000,  0.0016496800000000 ]  - [  -0.0000004100000000, -0.0003357300000000,  0.0017473500000000 ]  - [   0.0000011600000000, -0.0000689400000000,  0.0017495700000000 ]  - [   0.0000008000000000, -0.0000983300000000,  0.0017665600000000 ]  - [   0.0000002600000000,  0.0000001500000000,  0.0032552400000000 ]  - [   0.0000007800000000, -0.0004614000000000,  0.0016520600000000 ]  - [  -0.0003992000000000,  0.0002313800000000,  0.0016520600000000 ]  - [   0.0002950600000000,  0.0001703500000000,  0.0017496700000000 ]  - [   0.0000879600000000,  0.0000507900000000,  0.0017770700000000 ]  - [  -0.0000591200000000,  0.0000354800000000,  0.0017495700000000 ]  - [   0.0000009500000000,  0.0000005500000000,  0.0021055500000000 ]  - [   0.0000029600000000,  0.0000017100000000,  0.0016283700000000 ]  - [  -0.0000003000000000, -0.0000001700000000,  0.0020581300000000 ]  - [   0.0002042300000000,  0.0001179100000000,  0.0015206300000000 ]  - [  -0.0000734700000000,  0.0000412600000000,  0.0017705800000000 ]  - [   0.0003660100000000,  0.0002113100000000,  0.0038007300000000 ]  - [  -0.0002776800000000,  0.0000269000000000,  0.0017725900000000 ]  - [   0.0004085400000000,  0.0002358700000000,  0.0016625400000000 ]  - [  -0.0001155500000000, -0.0002539300000000,  0.0017725900000000 ]  - [   0.0003714300000000, -0.0003245800000000,  0.0011095600000000 ]  - [  -0.0000010000000000, -0.0000842600000000,  0.0017705800000000 ]  - [  -0.0000097300000000, -0.0000056200000000,  0.0032567100000000 ]  - [   0.0000011500000000, -0.0004746400000000,  0.0016657300000000 ]  - [  -0.0004104800000000,  0.0002383100000000,  0.0016657300000000 ]  - [   0.0002557500000000,  0.0001476600000000,  0.0015585300000000 ]  - [   0.0000746700000000,  0.0000431100000000,  0.0017718400000000 ]  - [  -0.0000953800000000,  0.0004839500000000,  0.0011095600000000 ]  - [  -0.0002584600000000, -0.0001492200000000,  0.0012798300000000 ]  - [   0.0000021900000000,  0.0000012600000000,  0.0016433900000000 ]- atom:   42  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0002299000000000,  0.0001327300000000, -0.0007708100000000 ]  - [  -0.0000005500000000, -0.0000003200000000,  0.0018208500000000 ]  - [   0.0000064800000000,  0.0000037400000000,  0.0018186600000000 ]  - [   0.0009742600000000,  0.0005624900000000, -0.0229568900000000 ]  - [   0.0042752400000000,  0.0024683100000000,  0.0009326400000000 ]  - [  -0.0294440600000000,  0.0139659100000000, -0.0493154000000000 ]  - [  -0.0026272000000000, -0.0324822600000000, -0.0493154000000000 ]  - [  -0.0006541800000000, -0.0003776900000000,  0.0052485500000000 ]  - [  -0.0000216800000000, -0.0000125200000000,  0.0026261300000000 ]  - [  -0.0302240800000000, -0.0174498800000000, -0.0451290600000000 ]  - [  -0.0053225600000000, -0.0030729800000000,  0.0007282100000000 ]  - [  -0.0001788200000000,  0.0002537800000000,  0.0023749800000000 ]  - [   0.0001303700000000, -0.0002817500000000,  0.0023749800000000 ]  - [   0.0001731800000000,  0.0000999900000000,  0.0022426100000000 ]  - [   0.0001086800000000,  0.0000627400000000,  0.0023759400000000 ]  - [   0.0000141100000000,  0.0000081500000000,  0.0026676200000000 ]  - [   0.0000014600000000, -0.0001269800000000,  0.0023775500000000 ]  - [  -0.0001092400000000,  0.0000647500000000,  0.0023775500000000 ]  - [  -0.0000007000000000, -0.0000004000000000,  0.0034221500000000 ]  - [   0.0000000300000000,  0.0000000200000000,  0.0026151900000000 ]  - [   0.0000001600000000,  0.0000000900000000,  0.0035395900000000 ]  - [  -0.0000049900000000, -0.0000028800000000,  0.0026821400000000 ]  - [  -0.0002075700000000,  0.0001192300000000,  0.0024132600000000 ]  - [  -0.0000005300000000, -0.0002393800000000,  0.0024132600000000 ]  - [   0.0002071500000000,  0.0001196000000000,  0.0024100500000000 ]  - [   0.0001082700000000,  0.0000625100000000,  0.0023810800000000 ]  - [  -0.0000006000000000, -0.0000003500000000,  0.0026862900000000 ]  - [  -0.0000003300000000, -0.0001258600000000,  0.0023822000000000 ]  - [  -0.0001091600000000,  0.0000626500000000,  0.0023822000000000 ]  - [  -0.0000939000000000, -0.0000542100000000,  0.0034778900000000 ]  - [  -0.0015844500000000, -0.0009147800000000,  0.0048023300000000 ]  - [   0.0000005900000000,  0.0000003400000000,  0.0035533400000000 ]  - [   0.0000008800000000,  0.0000005100000000,  0.0026233400000000 ]  - [  -0.0003132000000000,  0.0008491300000000,  0.0025524000000000 ]  - [   0.0005787700000000, -0.0006958000000000,  0.0025524000000000 ]  - [   0.0002984800000000,  0.0001723300000000,  0.0019562800000000 ]  - [  -0.0161946600000000, -0.0093499900000000, -0.0131301300000000 ]  - [   0.0000474900000000,  0.0000274200000000, -0.0013476000000000 ]  - [  -0.0022454700000000,  0.0121038300000000, -0.0065054400000000 ]  - [  -0.0000697500000000, -0.0000402700000000, -0.0016824700000000 ]  - [   0.0005678200000000, -0.0003387900000000, -0.0016415900000000 ]  - [   0.0890577100000000,  0.0514174900000000,  0.1460546500000000 ]  - [  -0.0000094900000000,  0.0006611400000000, -0.0016415900000000 ]  - [   0.0000215400000000,  0.0000650100000000, -0.0017217600000000 ]  - [   0.0093594900000000, -0.0079965500000000, -0.0065054400000000 ]  - [  -0.0095549600000000, -0.0055165600000000, -0.0088249900000000 ]  - [  -0.0007242100000000, -0.0050400400000000,  0.0155795900000000 ]  - [  -0.0047269000000000,  0.0018928300000000,  0.0155795900000000 ]  - [  -0.0008258000000000, -0.0004767800000000, -0.0022240200000000 ]  - [  -0.0004164900000000, -0.0002404600000000,  0.0061286300000000 ]  - [   0.0000670700000000, -0.0000138600000000, -0.0017217600000000 ]  - [  -0.0000487200000000, -0.0000281300000000, -0.0021371500000000 ]  - [  -0.0000778100000000, -0.0000449300000000,  0.0146173200000000 ]  - [   0.0000003800000000,  0.0000002200000000, -0.0020296000000000 ]  - [  -0.0000022900000000, -0.0000013200000000, -0.0013807600000000 ]  - [   0.0000608500000000, -0.0000378900000000, -0.0017300600000000 ]  - [  -0.0000590600000000, -0.0000341000000000, -0.0017312100000000 ]  - [   0.0003348000000000, -0.0001938900000000, -0.0017439900000000 ]  - [  -0.0003875200000000, -0.0002237400000000, -0.0016557900000000 ]  - [  -0.0000005100000000,  0.0003868900000000, -0.0017439900000000 ]  - [   0.0000010700000000,  0.0000660200000000, -0.0017300200000000 ]  - [  -0.0000023900000000,  0.0000716400000000, -0.0017300600000000 ]  - [   0.0000002300000000,  0.0000001300000000, -0.0034134100000000 ]  - [   0.0000014300000000,  0.0004444600000000, -0.0016549600000000 ]  - [   0.0003856300000000, -0.0002209900000000, -0.0016549600000000 ]  - [  -0.0003309700000000, -0.0001910800000000, -0.0017417900000000 ]  - [  -0.0000612000000000, -0.0000353400000000, -0.0017372900000000 ]  - [   0.0000577100000000, -0.0000320800000000, -0.0017300200000000 ]  - [   0.0000008400000000,  0.0000004800000000, -0.0020557900000000 ]  - [   0.0000014100000000,  0.0000008100000000, -0.0017125000000000 ]  - [  -0.0000002900000000, -0.0000001700000000, -0.0020606800000000 ]  - [  -0.0002085700000000, -0.0001204200000000, -0.0015376000000000 ]  - [   0.0000685700000000, -0.0000409500000000, -0.0017313000000000 ]  - [  -0.0003682900000000, -0.0002126300000000, -0.0037840200000000 ]  - [   0.0003108500000000, -0.0000463100000000, -0.0017697300000000 ]  - [  -0.0003753400000000, -0.0002167000000000, -0.0016424200000000 ]  - [   0.0001153200000000,  0.0002923600000000, -0.0017697300000000 ]  - [  -0.0003707100000000,  0.0003209600000000, -0.0010660200000000 ]  - [  -0.0000011800000000,  0.0000798600000000, -0.0017313000000000 ]  - [   0.0000100100000000,  0.0000057800000000, -0.0033890100000000 ]  - [   0.0000010500000000,  0.0004307200000000, -0.0016408000000000 ]  - [   0.0003735400000000, -0.0002144500000000, -0.0016408000000000 ]  - [  -0.0002810300000000, -0.0001622500000000, -0.0015497600000000 ]  - [  -0.0000677100000000, -0.0000390900000000, -0.0017298600000000 ]  - [   0.0000926100000000, -0.0004815200000000, -0.0010660200000000 ]  - [   0.0002614200000000,  0.0001509300000000, -0.0012197100000000 ]  - [   0.0000022700000000,  0.0000013100000000, -0.0016949800000000 ]- atom:   46  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0046675000000000, -0.0000080600000000,  0.0000023300000000 ]  - [  -0.0000009800000000,  0.0000006400000000, -0.0000003900000000 ]  - [  -0.0000017100000000,  0.0000006700000000, -0.0000017900000000 ]  - [   0.0000593500000000,  0.0031857400000000,  0.0010986700000000 ]  - [  -0.0003864900000000,  0.0000005000000000, -0.0000393900000000 ]  - [  -0.0054472000000000,  0.0000138800000000, -0.0000060200000000 ]  - [   0.0000941000000000, -0.0031927500000000, -0.0011265400000000 ]  - [   0.0185571700000000,  0.0000071400000000, -0.0004146700000000 ]  - [   0.0006165500000000,  0.0000011200000000, -0.0000132400000000 ]  - [   0.0187738800000000,  0.0000028000000000,  0.0005179000000000 ]  - [   0.0007066400000000, -0.0000009800000000, -0.0000248200000000 ]  - [   0.0001155900000000, -0.0030657400000000, -0.0009640600000000 ]  - [  -0.0051808100000000, -0.0000114700000000, -0.0000130700000000 ]  - [   0.0001487000000000,  0.0030691100000000,  0.0009545100000000 ]  - [  -0.0000069500000000,  0.0000278400000000,  0.0000050000000000 ]  - [  -0.0003536300000000, -0.0000012100000000, -0.0000373300000000 ]  - [  -0.0000549400000000,  0.0000083800000000, -0.0000225600000000 ]  - [   0.0000067700000000, -0.0000355400000000, -0.0000499400000000 ]  - [  -0.0000023600000000,  0.0000003100000000,  0.0000120600000000 ]  - [   0.0000004100000000, -0.0000003000000000, -0.0000425100000000 ]  - [   0.0000099900000000, -0.0000002600000000,  0.0000189300000000 ]  - [   0.0001663600000000,  0.0000001100000000, -0.0000061200000000 ]  - [  -0.0000048500000000,  0.0000025000000000,  0.0000079700000000 ]  - [  -0.0000016400000000, -0.0000051800000000,  0.0000087700000000 ]  - [   0.0000036300000000,  0.0000036700000000,  0.0000096700000000 ]  - [  -0.0000076600000000, -0.0000031400000000, -0.0000169000000000 ]  - [   0.0000010000000000, -0.0000000900000000, -0.0000261600000000 ]  - [  -0.0000010500000000,  0.0000078100000000, -0.0000174500000000 ]  - [   0.0000058700000000, -0.0000033300000000, -0.0000185900000000 ]  - [   0.0000092000000000,  0.0000003000000000,  0.0000487500000000 ]  - [   0.0001671100000000, -0.0000012100000000,  0.0000064100000000 ]  - [  -0.0000012700000000, -0.0000008700000000,  0.0000353000000000 ]  - [   0.0000005600000000, -0.0000001300000000, -0.0000521900000000 ]  - [  -0.0000034800000000, -0.0000318600000000, -0.0000233700000000 ]  - [  -0.0000595800000000, -0.0000029000000000,  0.0000065300000000 ]  - [   0.0000023100000000,  0.0000362800000000,  0.0000365000000000 ]  - [   0.0017143100000000, -0.0000033100000000, -0.0000102800000000 ]  - [   0.0008558200000000, -0.0000048100000000,  0.0000401600000000 ]  - [   0.0000500900000000, -0.0005927100000000,  0.0004529600000000 ]  - [   0.0000588400000000,  0.0005555800000000, -0.0003599500000000 ]  - [   0.0027523700000000, -0.0035881300000000, -0.0093862900000000 ]  - [   0.0025107700000000,  0.0033552000000000,  0.0095814100000000 ]  - [  -0.0034865300000000,  0.0000305300000000, -0.0000138000000000 ]  - [  -0.0009073800000000, -0.0000051200000000,  0.0000209800000000 ]  - [  -0.0009810500000000, -0.0000098900000000,  0.0000142200000000 ]  - [  -0.0302490400000000, -0.0000011000000000, -0.0000350900000000 ]  - [  -0.0033267800000000, -0.0000339900000000,  0.0000028700000000 ]  - [   0.0024644400000000, -0.0033586100000000, -0.0096589000000000 ]  - [   0.0027159400000000,  0.0035952300000000,  0.0094487700000000 ]  - [   0.0000619000000000,  0.0006045800000000, -0.0004169200000000 ]  - [   0.0000440800000000, -0.0005514700000000,  0.0003944000000000 ]  - [   0.0016706100000000,  0.0000035200000000,  0.0000033500000000 ]  - [   0.0006859400000000,  0.0000047000000000, -0.0000390100000000 ]  - [  -0.0000193700000000, -0.0000009900000000,  0.0000254200000000 ]  - [  -0.0000023800000000, -0.0000019300000000,  0.0000262700000000 ]  - [   0.0000093900000000,  0.0000084500000000, -0.0001199300000000 ]  - [   0.0000009400000000, -0.0000017900000000,  0.0000088200000000 ]  - [   0.0000235200000000, -0.0000136800000000,  0.0000004900000000 ]  - [   0.0000039600000000,  0.0000073100000000, -0.0000130100000000 ]  - [  -0.0000007600000000,  0.0000247200000000,  0.0000008600000000 ]  - [   0.0000019900000000, -0.0000011400000000,  0.0000107400000000 ]  - [   0.0000218000000000, -0.0000129800000000,  0.0000163300000000 ]  - [  -0.0000005000000000, -0.0000001200000000, -0.0000804600000000 ]  - [  -0.0000105100000000, -0.0000087500000000, -0.0000015500000000 ]  - [  -0.0000089300000000, -0.0000019100000000,  0.0000081700000000 ]  - [  -0.0000187800000000, -0.0000100500000000,  0.0000028700000000 ]  - [   0.0000299800000000,  0.0000059900000000,  0.0001557600000000 ]  - [  -0.0000028900000000,  0.0000016200000000,  0.0000096200000000 ]  - [   0.0000006800000000,  0.0000010400000000,  0.0000256100000000 ]  - [   0.0000224600000000,  0.0000020300000000, -0.0000418600000000 ]  - [   0.0000001600000000, -0.0000010600000000, -0.0000032500000000 ]  - [   0.0000224000000000, -0.0000026100000000, -0.0000085600000000 ]  - [  -0.0000001800000000, -0.0000001100000000,  0.0000184300000000 ]  - [   0.0000205100000000, -0.0000066000000000,  0.0001658500000000 ]  - [   0.0000169100000000, -0.0000172200000000,  0.0000112300000000 ]  - [   0.0000176200000000,  0.0000077900000000,  0.0000094800000000 ]  - [  -0.0000134900000000,  0.0000189100000000,  0.0000011200000000 ]  - [   0.0000298800000000, -0.0000026000000000,  0.0000202900000000 ]  - [  -0.0000020700000000, -0.0000017700000000,  0.0000183500000000 ]  - [  -0.0000006100000000, -0.0000003200000000, -0.0000674600000000 ]  - [   0.0000019100000000, -0.0000219500000000,  0.0000123900000000 ]  - [  -0.0000191000000000,  0.0000111400000000,  0.0000119500000000 ]  - [  -0.0000154300000000, -0.0000005800000000, -0.0000079800000000 ]  - [   0.0000014600000000,  0.0000030800000000,  0.0000196400000000 ]  - [   0.0000125900000000,  0.0000088500000000, -0.0001275900000000 ]  - [  -0.0000223800000000,  0.0000011500000000,  0.0000273300000000 ]  - [   0.0000017900000000,  0.0000020700000000, -0.0000264400000000 ]- atom:   46  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0212069400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0036744400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0036747600000000 ]  - [  -0.0041556700000000, -0.0023992800000000, -0.0027115500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0050183200000000 ]  - [   0.0000000000000000,  0.0047985500000000, -0.0027115500000000 ]  - [   0.0041556700000000, -0.0023992800000000, -0.0027115500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2225853700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054094700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2054097500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0056917100000000 ]  - [   0.0033385900000000, -0.0019275400000000, -0.0028812400000000 ]  - [   0.0000000000000000,  0.0038550700000000, -0.0028812400000000 ]  - [  -0.0033385900000000, -0.0019275400000000, -0.0028812400000000 ]  - [  -0.0003031600000000, -0.0001750300000000, -0.0048477400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0050988400000000 ]  - [   0.0000000000000000,  0.0003500600000000, -0.0048477400000000 ]  - [   0.0003031600000000, -0.0001750300000000, -0.0048477400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0068714500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054046100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0070771000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059313900000000 ]  - [   0.0004044100000000, -0.0002334800000000, -0.0048421400000000 ]  - [   0.0000000000000000,  0.0004669700000000, -0.0048421400000000 ]  - [  -0.0004044100000000, -0.0002334800000000, -0.0048421400000000 ]  - [  -0.0002390700000000, -0.0001380300000000, -0.0048551000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054938000000000 ]  - [   0.0000000000000000,  0.0002760500000000, -0.0048551000000000 ]  - [   0.0002390700000000, -0.0001380300000000, -0.0048551000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0068368800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0059469500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0070605900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0054490600000000 ]  - [   0.0004816500000000, -0.0002780800000000, -0.0048290000000000 ]  - [   0.0000000000000000,  0.0005561600000000, -0.0048290000000000 ]  - [  -0.0004816500000000, -0.0002780800000000, -0.0048290000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0063558100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0010653200000000 ]  - [   0.0005733500000000, -0.0003310300000000,  0.0028644300000000 ]  - [  -0.0003311200000000, -0.0001911700000000,  0.0029334800000000 ]  - [  -0.0074000200000000,  0.0042724000000000,  0.0080589600000000 ]  - [   0.0065974600000000,  0.0038090500000000,  0.0087707000000000 ]  - [   0.0000000000000000, -0.0085448100000000,  0.0080589600000000 ]  - [   0.0000000000000000,  0.0003823500000000,  0.0029334800000000 ]  - [   0.0000000000000000,  0.0006620500000000,  0.0028644300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.4914125300000000 ]  - [   0.0000000000000000, -0.0076180900000000,  0.0087707000000000 ]  - [  -0.0065974600000000,  0.0038090500000000,  0.0087707000000000 ]  - [   0.0074000200000000,  0.0042724000000000,  0.0080589600000000 ]  - [  -0.0005733500000000, -0.0003310300000000,  0.0028644300000000 ]  - [   0.0003311200000000, -0.0001911700000000,  0.0029334800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0062814200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0036335800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040024900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0028609400000000 ]  - [  -0.0002420400000000,  0.0001397400000000,  0.0035879400000000 ]  - [   0.0001236100000000,  0.0000713700000000,  0.0035230100000000 ]  - [  -0.0006078100000000,  0.0003509200000000,  0.0035211100000000 ]  - [   0.0007857300000000,  0.0004536400000000,  0.0033209900000000 ]  - [   0.0000000000000000, -0.0007018400000000,  0.0035211100000000 ]  - [   0.0000000000000000, -0.0001427400000000,  0.0035230100000000 ]  - [   0.0000000000000000, -0.0002794900000000,  0.0035879400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0066377800000000 ]  - [   0.0000000000000000, -0.0009072900000000,  0.0033209900000000 ]  - [  -0.0007857300000000,  0.0004536400000000,  0.0033209900000000 ]  - [   0.0006078100000000,  0.0003509200000000,  0.0035211100000000 ]  - [   0.0002420400000000,  0.0001397400000000,  0.0035879400000000 ]  - [  -0.0001236100000000,  0.0000713700000000,  0.0035230100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042281700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033569700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0041427100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0028632600000000 ]  - [  -0.0001404200000000,  0.0000810700000000,  0.0035449100000000 ]  - [   0.0002218600000000,  0.0001280900000000,  0.0035895800000000 ]  - [  -0.0005979300000000,  0.0003452100000000,  0.0035085100000000 ]  - [   0.0008099300000000,  0.0004676100000000,  0.0033449900000000 ]  - [   0.0000000000000000, -0.0006904300000000,  0.0035085100000000 ]  - [   0.0000000000000000, -0.0002561800000000,  0.0035895800000000 ]  - [   0.0000000000000000, -0.0001621400000000,  0.0035449100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0066507600000000 ]  - [   0.0000000000000000, -0.0009352300000000,  0.0033449900000000 ]  - [  -0.0008099300000000,  0.0004676100000000,  0.0033449900000000 ]  - [   0.0005979300000000,  0.0003452100000000,  0.0035085100000000 ]  - [   0.0001404200000000,  0.0000810700000000,  0.0035449100000000 ]  - [  -0.0002218600000000,  0.0001280900000000,  0.0035895800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040226100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033403900000000 ]- atom:   46  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0211900600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0036748500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0036721000000000 ]  - [   0.0041670800000000,  0.0024058600000000,  0.0026711100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049358200000000 ]  - [   0.0000000000000000, -0.0048117300000000,  0.0026711100000000 ]  - [  -0.0041670800000000,  0.0024058600000000,  0.0026711100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2097512700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053827300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2177357800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0056456300000000 ]  - [  -0.0033253100000000,  0.0019198700000000,  0.0028837700000000 ]  - [   0.0000000000000000, -0.0038397300000000,  0.0028837700000000 ]  - [   0.0033253100000000,  0.0019198700000000,  0.0028837700000000 ]  - [   0.0002881400000000,  0.0001663600000000,  0.0048057400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0050290300000000 ]  - [   0.0000000000000000, -0.0003327200000000,  0.0048057400000000 ]  - [  -0.0002881400000000,  0.0001663600000000,  0.0048057400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0068977400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053221800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0071188200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0059155300000000 ]  - [  -0.0004125900000000,  0.0002382100000000,  0.0048595800000000 ]  - [   0.0000000000000000, -0.0004764200000000,  0.0048595800000000 ]  - [   0.0004125900000000,  0.0002382100000000,  0.0048595800000000 ]  - [   0.0002259200000000,  0.0001304300000000,  0.0048228700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054427900000000 ]  - [   0.0000000000000000, -0.0002608700000000,  0.0048228700000000 ]  - [  -0.0002259200000000,  0.0001304300000000,  0.0048228700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0069369200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0059668800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0071353400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0053464000000000 ]  - [  -0.0004873200000000,  0.0002813500000000,  0.0048418900000000 ]  - [   0.0000000000000000, -0.0005627100000000,  0.0048418900000000 ]  - [   0.0004873200000000,  0.0002813500000000,  0.0048418900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0064139400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010885800000000 ]  - [  -0.0005846200000000,  0.0003375300000000, -0.0028320600000000 ]  - [   0.0003439800000000,  0.0001986000000000, -0.0028948800000000 ]  - [   0.0073413500000000, -0.0042385300000000, -0.0079741700000000 ]  - [  -0.0066434900000000, -0.0038356200000000, -0.0088810200000000 ]  - [   0.0000000000000000,  0.0084770600000000, -0.0079741700000000 ]  - [   0.0000000000000000, -0.0003972000000000, -0.0028948800000000 ]  - [   0.0000000000000000, -0.0006750600000000, -0.0028320600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.4910191700000000 ]  - [   0.0000000000000000,  0.0076712400000000, -0.0088810200000000 ]  - [   0.0066434900000000, -0.0038356200000000, -0.0088810200000000 ]  - [  -0.0073413500000000, -0.0042385300000000, -0.0079741700000000 ]  - [   0.0005846200000000,  0.0003375300000000, -0.0028320600000000 ]  - [  -0.0003439800000000,  0.0001986000000000, -0.0028948800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0062388700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0036219700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0039669400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0028176500000000 ]  - [   0.0002273700000000, -0.0001312700000000, -0.0035596800000000 ]  - [  -0.0001138200000000, -0.0000657100000000, -0.0034953100000000 ]  - [   0.0006536800000000, -0.0003774000000000, -0.0035220900000000 ]  - [  -0.0007702200000000, -0.0004446900000000, -0.0033239600000000 ]  - [   0.0000000000000000,  0.0007548100000000, -0.0035220900000000 ]  - [   0.0000000000000000,  0.0001314200000000, -0.0034953100000000 ]  - [   0.0000000000000000,  0.0002625500000000, -0.0035596800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0068021000000000 ]  - [   0.0000000000000000,  0.0008893700000000, -0.0033239600000000 ]  - [   0.0007702200000000, -0.0004446900000000, -0.0033239600000000 ]  - [  -0.0006536800000000, -0.0003774000000000, -0.0035220900000000 ]  - [  -0.0002273700000000, -0.0001312700000000, -0.0035596800000000 ]  - [   0.0001138200000000, -0.0000657100000000, -0.0034953100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041659300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034335700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041595300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0028910000000000 ]  - [   0.0001461400000000, -0.0000843800000000, -0.0035139700000000 ]  - [  -0.0002100200000000, -0.0001212500000000, -0.0035425400000000 ]  - [   0.0006334000000000, -0.0003656900000000, -0.0035086600000000 ]  - [  -0.0007711700000000, -0.0004452300000000, -0.0033214100000000 ]  - [   0.0000000000000000,  0.0007313900000000, -0.0035086600000000 ]  - [   0.0000000000000000,  0.0002425100000000, -0.0035425400000000 ]  - [   0.0000000000000000,  0.0001687500000000, -0.0035139700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0067894000000000 ]  - [   0.0000000000000000,  0.0008904700000000, -0.0033214100000000 ]  - [   0.0007711700000000, -0.0004452300000000, -0.0033214100000000 ]  - [  -0.0006334000000000, -0.0003656900000000, -0.0035086600000000 ]  - [  -0.0001461400000000, -0.0000843800000000, -0.0035139700000000 ]  - [   0.0002100200000000, -0.0001212500000000, -0.0035425400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0039558400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033862800000000 ]- atom:   52  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0006294300000000, -0.0000008900000000,  0.0000031800000000 ]  - [   0.0000112500000000,  0.0000006900000000,  0.0000001000000000 ]  - [  -0.0000009200000000,  0.0000006800000000, -0.0000014900000000 ]  - [  -0.0000056700000000,  0.0000086900000000, -0.0000115400000000 ]  - [  -0.0000014800000000, -0.0000003600000000, -0.0000399700000000 ]  - [  -0.0000210800000000,  0.0000068000000000, -0.0000157800000000 ]  - [   0.0000048500000000, -0.0000152000000000, -0.0000196000000000 ]  - [  -0.0088952700000000,  0.0000172300000000,  0.0000504600000000 ]  - [  -0.0049852400000000,  0.0000690200000000, -0.0000234300000000 ]  - [   0.0001214000000000,  0.0000008200000000,  0.0000660000000000 ]  - [   0.0000028500000000,  0.0000005700000000, -0.0000243200000000 ]  - [   0.0090372400000000,  0.0038143400000000,  0.0015979800000000 ]  - [   0.0156401300000000,  0.0000097200000000, -0.0000154100000000 ]  - [   0.0100627100000000, -0.0032127600000000, -0.0024826400000000 ]  - [   0.0003804100000000,  0.0018417300000000,  0.0014052600000000 ]  - [  -0.0041688300000000, -0.0000549800000000, -0.0000677000000000 ]  - [  -0.0028299400000000,  0.0000042700000000, -0.0000302800000000 ]  - [   0.0003656400000000, -0.0018567800000000, -0.0014488100000000 ]  - [   0.0000013400000000,  0.0000002800000000,  0.0000124900000000 ]  - [   0.0000010100000000, -0.0000002300000000, -0.0000421900000000 ]  - [   0.0002856000000000,  0.0000016500000000,  0.0000189600000000 ]  - [   0.0177517900000000,  0.0000335700000000, -0.0002753100000000 ]  - [  -0.0000046900000000,  0.0000028600000000,  0.0000096200000000 ]  - [  -0.0000009400000000, -0.0000053000000000,  0.0000092200000000 ]  - [   0.0000039600000000,  0.0000035100000000,  0.0000088900000000 ]  - [  -0.0000078400000000, -0.0000031600000000, -0.0000171600000000 ]  - [  -0.0000011200000000, -0.0000000800000000, -0.0000258200000000 ]  - [  -0.0000011800000000,  0.0000078400000000, -0.0000173100000000 ]  - [   0.0000057000000000, -0.0000033100000000, -0.0000180400000000 ]  - [  -0.0000008600000000,  0.0000003200000000,  0.0000493400000000 ]  - [   0.0000004600000000, -0.0000009400000000,  0.0000079900000000 ]  - [   0.0000003300000000, -0.0000008300000000,  0.0000355300000000 ]  - [  -0.0000010300000000, -0.0000001200000000, -0.0000519300000000 ]  - [  -0.0000035200000000,  0.0000014400000000,  0.0000066000000000 ]  - [  -0.0000018200000000, -0.0000031100000000,  0.0000068700000000 ]  - [   0.0000028600000000,  0.0000031700000000,  0.0000074300000000 ]  - [   0.0000081400000000, -0.0000009800000000, -0.0000132400000000 ]  - [   0.0008589600000000,  0.0000119600000000,  0.0000202000000000 ]  - [  -0.0000074300000000,  0.0000022400000000,  0.0000198500000000 ]  - [   0.0070156800000000, -0.0183401400000000, -0.0002975300000000 ]  - [   0.0093816700000000, -0.0072248900000000, -0.0159857600000000 ]  - [   0.0000364700000000,  0.0000242000000000,  0.0000338200000000 ]  - [  -0.0030819900000000, -0.0000338200000000,  0.0000561300000000 ]  - [   0.0388266300000000,  0.0000130500000000,  0.0000304500000000 ]  - [  -0.0000061000000000, -0.0000114500000000,  0.0000177600000000 ]  - [   0.0016700600000000, -0.0000041300000000, -0.0000452600000000 ]  - [  -0.0000077300000000, -0.0000211100000000, -0.0000151300000000 ]  - [   0.0000037800000000, -0.0000078000000000, -0.0000657800000000 ]  - [   0.0093649100000000,  0.0071577300000000,  0.0158368400000000 ]  - [   0.0000100000000000,  0.0000105600000000,  0.0000180500000000 ]  - [   0.0070350600000000,  0.0183765500000000,  0.0003340400000000 ]  - [  -0.1100028700000000, -0.0006847000000000,  0.0012612300000000 ]  - [   0.0000096300000000,  0.0000021600000000, -0.0000289800000000 ]  - [   0.0001288700000000, -0.0000056900000000,  0.0000372500000000 ]  - [  -0.0000015300000000, -0.0000019000000000,  0.0000265100000000 ]  - [   0.0034390400000000, -0.0033190800000000, -0.0063685900000000 ]  - [   0.0000003100000000, -0.0000020700000000,  0.0000080900000000 ]  - [   0.0000223300000000, -0.0000133600000000,  0.0000006400000000 ]  - [  -0.0000566100000000,  0.0003143600000000, -0.0002631000000000 ]  - [  -0.0000014200000000,  0.0000244500000000,  0.0000009500000000 ]  - [   0.0000018300000000, -0.0000005100000000,  0.0000100100000000 ]  - [  -0.0023450800000000,  0.0000119000000000, -0.0000163400000000 ]  - [  -0.0000227700000000, -0.0000003300000000, -0.0000803500000000 ]  - [  -0.0006064600000000, -0.0000096000000000,  0.0000019900000000 ]  - [  -0.0000733500000000, -0.0003108400000000,  0.0002584600000000 ]  - [  -0.0000194500000000, -0.0000100300000000,  0.0000028000000000 ]  - [   0.0034627400000000,  0.0033736300000000,  0.0064779000000000 ]  - [  -0.0000024200000000,  0.0000012600000000,  0.0000087400000000 ]  - [   0.0000005300000000,  0.0000010600000000,  0.0000244900000000 ]  - [   0.0015764700000000,  0.0000076400000000, -0.0000455400000000 ]  - [   0.0000000800000000, -0.0000010100000000, -0.0000026400000000 ]  - [  -0.0000001400000000, -0.0000025800000000, -0.0000082300000000 ]  - [  -0.0000009500000000,  0.0000002400000000,  0.0000188400000000 ]  - [   0.0000023400000000, -0.0000007600000000,  0.0000188300000000 ]  - [   0.0000180600000000, -0.0000107800000000,  0.0000005200000000 ]  - [   0.0000173000000000,  0.0000077000000000,  0.0000091900000000 ]  - [  -0.0000011600000000,  0.0000186700000000,  0.0000012600000000 ]  - [   0.0000018500000000, -0.0000017800000000,  0.0000191600000000 ]  - [  -0.0000022300000000, -0.0000025100000000,  0.0000187800000000 ]  - [   0.0000001900000000, -0.0000003200000000, -0.0000677400000000 ]  - [   0.0000017900000000, -0.0000216400000000,  0.0000121100000000 ]  - [  -0.0000189000000000,  0.0000109900000000,  0.0000116900000000 ]  - [  -0.0000137900000000, -0.0000067400000000,  0.0000028800000000 ]  - [   0.0000020500000000,  0.0000034900000000,  0.0000200900000000 ]  - [  -0.0000040800000000,  0.0000024400000000,  0.0000180100000000 ]  - [   0.0000005300000000,  0.0000010600000000,  0.0000265400000000 ]  - [   0.0000016500000000,  0.0000020800000000, -0.0000270700000000 ]- atom:   52  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0023336100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023980400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0023006800000000 ]  - [  -0.0001829700000000, -0.0001056400000000, -0.0030194200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034602500000000 ]  - [   0.0000000000000000,  0.0002112800000000, -0.0030194200000000 ]  - [   0.0001829700000000, -0.0001056400000000, -0.0030194200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0008100200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0216336100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0048002900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034010500000000 ]  - [  -0.0061839400000000,  0.0035703000000000,  0.0386768400000000 ]  - [   0.0000000000000000, -0.0071406000000000,  0.0386768400000000 ]  - [   0.0061839400000000,  0.0035703000000000,  0.0386768400000000 ]  - [  -0.0043533500000000, -0.0025134100000000, -0.0020084700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0239527500000000 ]  - [   0.0000000000000000,  0.0050268200000000, -0.0020084700000000 ]  - [   0.0043533500000000, -0.0025134100000000, -0.0020084700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042184200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033991300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044166000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0991758300000000 ]  - [   0.0002546800000000, -0.0001470400000000, -0.0030252500000000 ]  - [   0.0000000000000000,  0.0002940800000000, -0.0030252500000000 ]  - [  -0.0002546800000000, -0.0001470400000000, -0.0030252500000000 ]  - [  -0.0001515300000000, -0.0000874800000000, -0.0030477900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034492500000000 ]  - [   0.0000000000000000,  0.0001749700000000, -0.0030477900000000 ]  - [   0.0001515300000000, -0.0000874800000000, -0.0030477900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042557600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033534700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044083700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034301700000000 ]  - [   0.0002536900000000, -0.0001464700000000, -0.0030254300000000 ]  - [   0.0000000000000000,  0.0002929300000000, -0.0030254300000000 ]  - [  -0.0002536900000000, -0.0001464700000000, -0.0030254300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026048600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0099011800000000 ]  - [  -0.0000877300000000,  0.0000506500000000,  0.0022162000000000 ]  - [  -0.0010330400000000, -0.0005964200000000, -0.0197117200000000 ]  - [  -0.0177950000000000,  0.0102739500000000,  0.0130533000000000 ]  - [   0.0005955900000000,  0.0003438600000000,  0.0021329900000000 ]  - [   0.0000000000000000, -0.0205478900000000,  0.0130533000000000 ]  - [   0.0000000000000000,  0.0011928500000000, -0.0197117200000000 ]  - [   0.0000000000000000, -0.0001013000000000,  0.0022162000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0062140800000000 ]  - [   0.0000000000000000, -0.0006877300000000,  0.0021329900000000 ]  - [  -0.0005955900000000,  0.0003438600000000,  0.0021329900000000 ]  - [   0.0177950000000000,  0.0102739500000000,  0.0130533000000000 ]  - [   0.0000877300000000,  0.0000506500000000,  0.0022162000000000 ]  - [   0.0010330400000000, -0.0005964200000000, -0.0197117200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.2402029400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020150200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0060160300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017901500000000 ]  - [  -0.0073871800000000,  0.0042649900000000,  0.0044488600000000 ]  - [   0.0000780800000000,  0.0000450800000000,  0.0022096300000000 ]  - [  -0.0003543500000000,  0.0002045800000000,  0.0021985500000000 ]  - [  -0.0001831300000000, -0.0001057300000000,  0.0012518400000000 ]  - [   0.0000000000000000, -0.0004091700000000,  0.0021985500000000 ]  - [   0.0000000000000000, -0.0000901500000000,  0.0022096300000000 ]  - [   0.0000000000000000, -0.0085299800000000,  0.0044488600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0039165400000000 ]  - [   0.0000000000000000,  0.0002114600000000,  0.0012518400000000 ]  - [   0.0001831300000000, -0.0001057300000000,  0.0012518400000000 ]  - [   0.0003543500000000,  0.0002045800000000,  0.0021985500000000 ]  - [   0.0073871800000000,  0.0042649900000000,  0.0044488600000000 ]  - [  -0.0000780800000000,  0.0000450800000000,  0.0022096300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026554600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044730100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0025899300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017626100000000 ]  - [  -0.0000859800000000,  0.0000496400000000,  0.0022241900000000 ]  - [   0.0000806800000000,  0.0000465800000000,  0.0022182300000000 ]  - [  -0.0003766600000000,  0.0002174700000000,  0.0022009600000000 ]  - [   0.0005151300000000,  0.0002974100000000,  0.0020978500000000 ]  - [   0.0000000000000000, -0.0004349300000000,  0.0022009600000000 ]  - [   0.0000000000000000, -0.0000931600000000,  0.0022182300000000 ]  - [   0.0000000000000000, -0.0000992800000000,  0.0022241900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0041372000000000 ]  - [   0.0000000000000000, -0.0005948200000000,  0.0020978500000000 ]  - [  -0.0005151300000000,  0.0002974100000000,  0.0020978500000000 ]  - [   0.0003766600000000,  0.0002174700000000,  0.0022009600000000 ]  - [   0.0000859800000000,  0.0000496400000000,  0.0022241900000000 ]  - [  -0.0000806800000000,  0.0000465800000000,  0.0022182300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026555500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020844500000000 ]- atom:   52  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0023309200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0023877500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0022879400000000 ]  - [   0.0001716300000000,  0.0000990900000000,  0.0029764500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033663800000000 ]  - [   0.0000000000000000, -0.0001981800000000,  0.0029764500000000 ]  - [  -0.0001716300000000,  0.0000990900000000,  0.0029764500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0007515800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0214477900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0049182800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033394600000000 ]  - [   0.0053784900000000, -0.0031052700000000, -0.0393322500000000 ]  - [   0.0000000000000000,  0.0062105400000000, -0.0393322500000000 ]  - [  -0.0053784900000000, -0.0031052700000000, -0.0393322500000000 ]  - [   0.0043060500000000,  0.0024861000000000,  0.0019549600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0237117400000000 ]  - [   0.0000000000000000, -0.0049721900000000,  0.0019549600000000 ]  - [  -0.0043060500000000,  0.0024861000000000,  0.0019549600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0042267700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033029100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044366600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0922128900000000 ]  - [  -0.0002621200000000,  0.0001513300000000,  0.0030309800000000 ]  - [   0.0000000000000000, -0.0003026600000000,  0.0030309800000000 ]  - [   0.0002621200000000,  0.0001513300000000,  0.0030309800000000 ]  - [   0.0001376000000000,  0.0000794500000000,  0.0030019700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033840700000000 ]  - [   0.0000000000000000, -0.0001588900000000,  0.0030019700000000 ]  - [  -0.0001376000000000,  0.0000794500000000,  0.0030019700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0043375200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033561500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044630400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033135500000000 ]  - [  -0.0002583700000000,  0.0001491700000000,  0.0030266300000000 ]  - [   0.0000000000000000, -0.0002983400000000,  0.0030266300000000 ]  - [   0.0002583700000000,  0.0001491700000000,  0.0030266300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0026327300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0099753800000000 ]  - [   0.0000764700000000, -0.0000441500000000, -0.0021772900000000 ]  - [   0.0010356100000000,  0.0005979100000000,  0.0196316900000000 ]  - [   0.0180791700000000, -0.0104380100000000, -0.0132599900000000 ]  - [  -0.0005580900000000, -0.0003222200000000, -0.0021549100000000 ]  - [   0.0000000000000000,  0.0208760300000000, -0.0132599900000000 ]  - [   0.0000000000000000, -0.0011958200000000,  0.0196316900000000 ]  - [   0.0000000000000000,  0.0000883000000000, -0.0021772900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063068400000000 ]  - [   0.0000000000000000,  0.0006444300000000, -0.0021549100000000 ]  - [   0.0005580900000000, -0.0003222200000000, -0.0021549100000000 ]  - [  -0.0180791700000000, -0.0104380100000000, -0.0132599900000000 ]  - [  -0.0000764700000000, -0.0000441500000000, -0.0021772900000000 ]  - [  -0.0010356100000000,  0.0005979100000000,  0.0196316900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.2355192100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020580500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0059873100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017401000000000 ]  - [   0.0072431000000000, -0.0041818100000000, -0.0043239100000000 ]  - [  -0.0000700700000000, -0.0000404500000000, -0.0021768600000000 ]  - [   0.0003978700000000, -0.0002297100000000, -0.0021911500000000 ]  - [   0.0001941500000000,  0.0001120900000000, -0.0012510300000000 ]  - [   0.0000000000000000,  0.0004594200000000, -0.0021911500000000 ]  - [   0.0000000000000000,  0.0000809100000000, -0.0021768600000000 ]  - [   0.0000000000000000,  0.0083636100000000, -0.0043239100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0040644200000000 ]  - [   0.0000000000000000, -0.0002241900000000, -0.0012510300000000 ]  - [  -0.0001941500000000,  0.0001120900000000, -0.0012510300000000 ]  - [  -0.0003978700000000, -0.0002297100000000, -0.0021911500000000 ]  - [  -0.0072431000000000, -0.0041818100000000, -0.0043239100000000 ]  - [   0.0000700700000000, -0.0000404500000000, -0.0021768600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025863600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0045215900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025953500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017787500000000 ]  - [   0.0000894200000000, -0.0000516300000000, -0.0021832800000000 ]  - [  -0.0000696000000000, -0.0000401900000000, -0.0021661000000000 ]  - [   0.0004099100000000, -0.0002366600000000, -0.0021928300000000 ]  - [  -0.0004748800000000, -0.0002741700000000, -0.0020662400000000 ]  - [   0.0000000000000000,  0.0004733300000000, -0.0021928300000000 ]  - [   0.0000000000000000,  0.0000803700000000, -0.0021661000000000 ]  - [   0.0000000000000000,  0.0001032500000000, -0.0021832800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0042581300000000 ]  - [   0.0000000000000000,  0.0005483400000000, -0.0020662400000000 ]  - [   0.0004748800000000, -0.0002741700000000, -0.0020662400000000 ]  - [  -0.0004099100000000, -0.0002366600000000, -0.0021928300000000 ]  - [  -0.0000894200000000, -0.0000516300000000, -0.0021832800000000 ]  - [   0.0000696000000000, -0.0000401900000000, -0.0021661000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025825200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0021249800000000 ]- atom:   53  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0003124000000000,  0.0000030500000000, -0.0000344700000000 ]  - [  -0.0000013300000000,  0.0000006800000000, -0.0000013300000000 ]  - [   0.0000085900000000,  0.0000006400000000, -0.0000028300000000 ]  - [   0.0606970800000000,  0.0254668500000000, -0.0294919600000000 ]  - [   0.0067896800000000, -0.0000154100000000, -0.0000586800000000 ]  - [   0.0169438800000000,  0.0002326300000000,  0.0001083700000000 ]  - [   0.0575719600000000, -0.0232682600000000,  0.0273796800000000 ]  - [   0.0000791700000000,  0.0000004400000000,  0.0000407700000000 ]  - [   0.0000086200000000, -0.0000004400000000, -0.0000146500000000 ]  - [  -0.0055257800000000,  0.0000750700000000,  0.0000609500000000 ]  - [  -0.0093512300000000,  0.0000194300000000, -0.0000108900000000 ]  - [  -0.0000026200000000, -0.0000228100000000, -0.0000150500000000 ]  - [  -0.0000417000000000, -0.0000056100000000, -0.0000043800000000 ]  - [   0.0000070100000000,  0.0000278700000000,  0.0000062700000000 ]  - [  -0.0000075400000000, -0.0000035800000000, -0.0000237300000000 ]  - [  -0.0000034400000000, -0.0000002500000000, -0.0000379100000000 ]  - [  -0.0000008800000000,  0.0000086300000000, -0.0000239700000000 ]  - [   0.0000067500000000, -0.0000041900000000, -0.0000242500000000 ]  - [  -0.0000025900000000,  0.0000003100000000,  0.0000103400000000 ]  - [  -0.0000013900000000, -0.0000003200000000, -0.0000438900000000 ]  - [   0.0000012600000000, -0.0000002300000000,  0.0000165500000000 ]  - [   0.0000042300000000, -0.0000001200000000, -0.0000095700000000 ]  - [  -0.0000061300000000,  0.0000031100000000,  0.0000076900000000 ]  - [  -0.0000017400000000, -0.0000050600000000,  0.0000074400000000 ]  - [   0.0000021900000000,  0.0000030300000000,  0.0000077400000000 ]  - [  -0.0000070000000000, -0.0000027200000000, -0.0000193300000000 ]  - [   0.0000005300000000, -0.0000000500000000, -0.0000276200000000 ]  - [  -0.0000011100000000,  0.0000079700000000, -0.0000189700000000 ]  - [   0.0000067200000000, -0.0000038600000000, -0.0000191800000000 ]  - [  -0.0001373600000000,  0.0000007300000000,  0.0000472200000000 ]  - [  -0.0000314300000000,  0.0000020400000000,  0.0000157600000000 ]  - [   0.0000017300000000, -0.0000007800000000,  0.0000328900000000 ]  - [   0.0000004300000000, -0.0000000700000000, -0.0000536600000000 ]  - [  -0.0000011600000000,  0.0002968900000000,  0.0003894600000000 ]  - [   0.0005156500000000, -0.0000042500000000,  0.0000036100000000 ]  - [   0.0000105100000000, -0.0002931300000000, -0.0003772200000000 ]  - [   0.0007973100000000,  0.0000129400000000, -0.0000364300000000 ]  - [   0.0000102600000000, -0.0000018000000000,  0.0000324500000000 ]  - [   0.0093492300000000, -0.0078241900000000, -0.0193992200000000 ]  - [   0.0000063700000000,  0.0000062900000000,  0.0000119900000000 ]  - [  -0.0000324700000000,  0.0000148600000000, -0.0000700400000000 ]  - [   0.0079204600000000, -0.0204134700000000,  0.0000591800000000 ]  - [  -0.0000078700000000,  0.0000131300000000,  0.0000063700000000 ]  - [  -0.0000062200000000, -0.0000048500000000,  0.0000192200000000 ]  - [  -0.0041306700000000, -0.0000753400000000,  0.0000829300000000 ]  - [   0.0006848400000000, -0.0000089900000000, -0.0000379100000000 ]  - [   0.0432840500000000, -0.0000160600000000, -0.0000351700000000 ]  - [   0.0079076800000000,  0.0204224900000000, -0.0001059900000000 ]  - [  -0.0000548800000000, -0.0000262700000000,  0.0000846700000000 ]  - [   0.0094300900000000,  0.0077881600000000,  0.0192663800000000 ]  - [  -0.0000052300000000, -0.0000014400000000,  0.0000243600000000 ]  - [   0.0000090200000000,  0.0000008300000000,  0.0000087200000000 ]  - [  -0.2027418100000000, -0.0024021500000000,  0.0021195500000000 ]  - [  -0.0000007100000000, -0.0000008800000000,  0.0000261900000000 ]  - [  -0.0000020600000000, -0.0000018700000000,  0.0000268800000000 ]  - [  -0.0000095600000000,  0.0000057500000000,  0.0000174300000000 ]  - [   0.0000010400000000, -0.0000016500000000,  0.0000101000000000 ]  - [   0.0000232800000000, -0.0000135600000000,  0.0000013800000000 ]  - [   0.0000060100000000,  0.0000014600000000, -0.0000019300000000 ]  - [  -0.0000008200000000,  0.0000246800000000,  0.0000018900000000 ]  - [   0.0000018900000000, -0.0000012400000000,  0.0000120000000000 ]  - [  -0.0000016900000000, -0.0000128600000000,  0.0000178200000000 ]  - [   0.0000003900000000, -0.0000001100000000, -0.0000783300000000 ]  - [   0.0000017500000000, -0.0000092300000000, -0.0000003000000000 ]  - [  -0.0000076800000000,  0.0000045000000000, -0.0000002200000000 ]  - [  -0.0000188300000000, -0.0000100200000000,  0.0000039600000000 ]  - [   0.0000109500000000,  0.0000084600000000,  0.0000204800000000 ]  - [  -0.0000031100000000,  0.0000017300000000,  0.0000109200000000 ]  - [   0.0000005700000000,  0.0000010700000000,  0.0000272200000000 ]  - [   0.0000017200000000,  0.0000020400000000, -0.0000399800000000 ]  - [   0.0000000200000000, -0.0000010700000000, -0.0000019900000000 ]  - [  -0.0000826600000000, -0.0000020600000000, -0.0000085300000000 ]  - [  -0.0000001400000000, -0.0000001700000000,  0.0000197400000000 ]  - [  -0.0002039800000000,  0.0007535300000000, -0.0007146500000000 ]  - [   0.0000617200000000, -0.0000125300000000, -0.0001980400000000 ]  - [   0.0000181300000000,  0.0000082500000000,  0.0000116300000000 ]  - [   0.0000399800000000,  0.0000181700000000,  0.0000031700000000 ]  - [  -0.0015052300000000, -0.0000015900000000,  0.0000142600000000 ]  - [  -0.0000022100000000, -0.0000016500000000,  0.0000195800000000 ]  - [   0.0000210600000000, -0.0000003500000000, -0.0000651800000000 ]  - [   0.0000017200000000, -0.0000223600000000,  0.0000136300000000 ]  - [  -0.0000192600000000,  0.0000111800000000,  0.0000125200000000 ]  - [   0.0000308900000000, -0.0000050000000000,  0.0002033300000000 ]  - [   0.0000012600000000,  0.0000030900000000,  0.0000208400000000 ]  - [  -0.0002058800000000, -0.0007478600000000,  0.0007551500000000 ]  - [   0.0015755100000000, -0.0000023100000000,  0.0000316400000000 ]  - [   0.0000018000000000,  0.0000020900000000, -0.0000248000000000 ]- atom:   53  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0158609900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0018418700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0018477900000000 ]  - [  -0.0275822900000000, -0.0159246400000000,  0.0512925100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0055368400000000 ]  - [   0.0000000000000000,  0.0318492900000000,  0.0512925100000000 ]  - [   0.0275822900000000, -0.0159246400000000,  0.0512925100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002449100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027793600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0125447200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0062091900000000 ]  - [   0.0003929000000000, -0.0002268400000000, -0.0025489600000000 ]  - [   0.0000000000000000,  0.0004536800000000, -0.0025489600000000 ]  - [  -0.0003929000000000, -0.0002268400000000, -0.0025489600000000 ]  - [  -0.0001244700000000, -0.0000718600000000, -0.0024488900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027746500000000 ]  - [   0.0000000000000000,  0.0001437300000000, -0.0024488900000000 ]  - [   0.0001244700000000, -0.0000718600000000, -0.0024488900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034375800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027307500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035428500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027017600000000 ]  - [   0.0002008800000000, -0.0001159800000000, -0.0024208600000000 ]  - [   0.0000000000000000,  0.0002319600000000, -0.0024208600000000 ]  - [  -0.0002008800000000, -0.0001159800000000, -0.0024208600000000 ]  - [  -0.0001235600000000, -0.0000713300000000, -0.0024440200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027670200000000 ]  - [   0.0000000000000000,  0.0001426700000000, -0.0024440200000000 ]  - [   0.0001235600000000, -0.0000713300000000, -0.0024440200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0033436800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0017539400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0035317800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0027575100000000 ]  - [  -0.0006285500000000,  0.0003629000000000, -0.0026040700000000 ]  - [   0.0000000000000000, -0.0007257900000000, -0.0026040700000000 ]  - [   0.0006285500000000,  0.0003629000000000, -0.0026040700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0099582300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0011917100000000 ]  - [  -0.0170594000000000,  0.0098492500000000,  0.0124767900000000 ]  - [   0.0000033000000000,  0.0000019100000000,  0.0017870300000000 ]  - [   0.0004392200000000, -0.0002535800000000,  0.0017477400000000 ]  - [  -0.0020607000000000, -0.0011897500000000, -0.0146466500000000 ]  - [   0.0000000000000000,  0.0005071600000000,  0.0017477400000000 ]  - [   0.0000000000000000, -0.0000038100000000,  0.0017870300000000 ]  - [   0.0000000000000000, -0.0196985000000000,  0.0124767900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0037060000000000 ]  - [   0.0000000000000000,  0.0023795000000000, -0.0146466500000000 ]  - [   0.0020607000000000, -0.0011897500000000, -0.0146466500000000 ]  - [  -0.0004392200000000, -0.0002535800000000,  0.0017477400000000 ]  - [   0.0170594000000000,  0.0098492500000000,  0.0124767900000000 ]  - [  -0.0000033000000000,  0.0000019100000000,  0.0017870300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020476800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.1699273600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020980200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0014432200000000 ]  - [  -0.0000753100000000,  0.0000434800000000,  0.0017864900000000 ]  - [   0.0000635100000000,  0.0000366700000000,  0.0017718200000000 ]  - [  -0.0002936600000000,  0.0001695400000000,  0.0017640400000000 ]  - [   0.0004042600000000,  0.0002334000000000,  0.0016708200000000 ]  - [   0.0000000000000000, -0.0003390800000000,  0.0017640400000000 ]  - [   0.0000000000000000, -0.0000733400000000,  0.0017718200000000 ]  - [   0.0000000000000000, -0.0000869600000000,  0.0017864900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0032896000000000 ]  - [   0.0000000000000000, -0.0004668000000000,  0.0016708200000000 ]  - [  -0.0004042600000000,  0.0002334000000000,  0.0016708200000000 ]  - [   0.0002936600000000,  0.0001695400000000,  0.0017640400000000 ]  - [   0.0000753100000000,  0.0000434800000000,  0.0017864900000000 ]  - [  -0.0000635100000000,  0.0000366700000000,  0.0017718200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0021330800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016504200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0020746400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0010979000000000 ]  - [  -0.0000694500000000,  0.0000401000000000,  0.0017862700000000 ]  - [  -0.0004409400000000, -0.0002545800000000,  0.0009627500000000 ]  - [  -0.0004955500000000,  0.0002861100000000,  0.0018898700000000 ]  - [   0.0004174200000000,  0.0002409900000000,  0.0016846800000000 ]  - [   0.0000000000000000, -0.0005722100000000,  0.0018898700000000 ]  - [   0.0000000000000000,  0.0005091500000000,  0.0009627500000000 ]  - [   0.0000000000000000, -0.0000802000000000,  0.0017862700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0033336000000000 ]  - [   0.0000000000000000, -0.0004819900000000,  0.0016846800000000 ]  - [  -0.0004174200000000,  0.0002409900000000,  0.0016846800000000 ]  - [   0.0004955500000000,  0.0002861100000000,  0.0018898700000000 ]  - [   0.0000694500000000,  0.0000401000000000,  0.0017862700000000 ]  - [   0.0004409400000000, -0.0002545800000000,  0.0009627500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0045141500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0016650000000000 ]- atom:   53  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0149847600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018378400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0018416000000000 ]  - [   0.0285296000000000,  0.0164715700000000, -0.0514579000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0054492700000000 ]  - [   0.0000000000000000, -0.0329431400000000, -0.0514579000000000 ]  - [  -0.0285296000000000,  0.0164715700000000, -0.0514579000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0003785300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027481400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0122677900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063214500000000 ]  - [  -0.0003986000000000,  0.0002301300000000,  0.0025371800000000 ]  - [   0.0000000000000000, -0.0004602600000000,  0.0025371800000000 ]  - [   0.0003986000000000,  0.0002301300000000,  0.0025371800000000 ]  - [   0.0001096700000000,  0.0000633200000000,  0.0024002800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026975900000000 ]  - [   0.0000000000000000, -0.0001266300000000,  0.0024002800000000 ]  - [  -0.0001096700000000,  0.0000633200000000,  0.0024002800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034573000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026440200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035742500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026818000000000 ]  - [  -0.0002089600000000,  0.0001206400000000,  0.0024351600000000 ]  - [   0.0000000000000000, -0.0002412900000000,  0.0024351600000000 ]  - [   0.0002089600000000,  0.0001206400000000,  0.0024351600000000 ]  - [   0.0001100400000000,  0.0000635300000000,  0.0024050700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0027112400000000 ]  - [   0.0000000000000000, -0.0001270700000000,  0.0024050700000000 ]  - [  -0.0001100400000000,  0.0000635300000000,  0.0024050700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0034364800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017673600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035964600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0026494500000000 ]  - [   0.0006301900000000, -0.0003638400000000,  0.0026157900000000 ]  - [   0.0000000000000000,  0.0007276800000000,  0.0026157900000000 ]  - [  -0.0006301900000000, -0.0003638400000000,  0.0026157900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0099850600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011365200000000 ]  - [   0.0173392100000000, -0.0100108000000000, -0.0127003400000000 ]  - [   0.0000098800000000,  0.0000057000000000, -0.0017443600000000 ]  - [  -0.0004028300000000,  0.0002325700000000, -0.0017360500000000 ]  - [   0.0020943900000000,  0.0012092000000000,  0.0146035600000000 ]  - [   0.0000000000000000, -0.0004651500000000, -0.0017360500000000 ]  - [   0.0000000000000000, -0.0000114100000000, -0.0017443600000000 ]  - [   0.0000000000000000,  0.0200216000000000, -0.0127003400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0035392700000000 ]  - [   0.0000000000000000, -0.0024183900000000,  0.0146035600000000 ]  - [  -0.0020943900000000,  0.0012092000000000,  0.0146035600000000 ]  - [   0.0004028300000000,  0.0002325700000000, -0.0017360500000000 ]  - [  -0.0173392100000000, -0.0100108000000000, -0.0127003400000000 ]  - [  -0.0000098800000000,  0.0000057000000000, -0.0017443600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020237300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.1701357500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020518800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0013971700000000 ]  - [   0.0000590200000000, -0.0000340700000000, -0.0017529400000000 ]  - [  -0.0000559500000000, -0.0000323000000000, -0.0017442300000000 ]  - [   0.0003378600000000, -0.0001950600000000, -0.0017611200000000 ]  - [  -0.0003884900000000, -0.0002242900000000, -0.0016703100000000 ]  - [   0.0000000000000000,  0.0003901200000000, -0.0017611200000000 ]  - [   0.0000000000000000,  0.0000646000000000, -0.0017442300000000 ]  - [   0.0000000000000000,  0.0000681500000000, -0.0017529400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034463000000000 ]  - [   0.0000000000000000,  0.0004485900000000, -0.0016703100000000 ]  - [   0.0003884900000000, -0.0002242900000000, -0.0016703100000000 ]  - [  -0.0003378600000000, -0.0001950600000000, -0.0017611200000000 ]  - [  -0.0000590200000000, -0.0000340700000000, -0.0017529400000000 ]  - [   0.0000559500000000, -0.0000323000000000, -0.0017442300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020715700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017255400000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0020846100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0011164800000000 ]  - [   0.0000722200000000, -0.0000417000000000, -0.0017494700000000 ]  - [   0.0004519900000000,  0.0002609600000000, -0.0009086500000000 ]  - [   0.0005313200000000, -0.0003067600000000, -0.0018872100000000 ]  - [  -0.0003786300000000, -0.0002186000000000, -0.0016575200000000 ]  - [   0.0000000000000000,  0.0006135200000000, -0.0018872100000000 ]  - [   0.0000000000000000, -0.0005219100000000, -0.0009086500000000 ]  - [   0.0000000000000000,  0.0000833900000000, -0.0017494700000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0034645400000000 ]  - [   0.0000000000000000,  0.0004372000000000, -0.0016575200000000 ]  - [   0.0003786300000000, -0.0002186000000000, -0.0016575200000000 ]  - [  -0.0005313200000000, -0.0003067600000000, -0.0018872100000000 ]  - [  -0.0000722200000000, -0.0000417000000000, -0.0017494700000000 ]  - [  -0.0004519900000000,  0.0002609600000000, -0.0009086500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044755500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0017095900000000 ]