# Fileset

[phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/36700417-3ba5-48fe-9919-6d19da2e66b7/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 Tl5Se2Cl / P4/ncc (130) / materials id 28920](https://mdr.nims.go.jp/datasets/719b7bbd-a535-4e96-aa2c-998b755c996f)

## 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: "P4/ncc"  number: 130  Hall_symbol: "P 4ab 2n -1ab"supercell_matrix:- [   2,   0,   0 ]- [   0,   2,   0 ]- [   0,   0,   1 ]primitive_cell:  lattice:  - [     8.460431820000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     8.460431820000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    12.607498530000001 ] # c  points:  - symbol: Cl # 1    coordinates: [  0.500000000000000,  0.000000000000000,  0.554325360000000 ]    mass: 35.453000  - symbol: Cl # 2    coordinates: [  0.000000000000000,  0.500000000000000,  0.945674640000000 ]    mass: 35.453000  - symbol: Cl # 3    coordinates: [  0.000000000000000,  0.500000000000000,  0.445674640000000 ]    mass: 35.453000  - symbol: Cl # 4    coordinates: [  0.500000000000000,  0.000000000000000,  0.054325360000000 ]    mass: 35.453000  - symbol: Se # 5    coordinates: [  0.657681930000000,  0.342318070000000,  0.250000000000000 ]    mass: 78.960000  - symbol: Se # 6    coordinates: [  0.157681930000000,  0.157681930000000,  0.250000000000000 ]    mass: 78.960000  - symbol: Se # 7    coordinates: [  0.842318070000000,  0.842318070000000,  0.250000000000000 ]    mass: 78.960000  - symbol: Se # 8    coordinates: [  0.342318070000000,  0.657681930000000,  0.250000000000000 ]    mass: 78.960000  - symbol: Se # 9    coordinates: [  0.157681930000000,  0.842318070000000,  0.750000000000000 ]    mass: 78.960000  - symbol: Se # 10    coordinates: [  0.657681930000000,  0.657681930000000,  0.750000000000000 ]    mass: 78.960000  - symbol: Se # 11    coordinates: [  0.342318070000000,  0.342318070000000,  0.750000000000000 ]    mass: 78.960000  - symbol: Se # 12    coordinates: [  0.842318070000000,  0.157681930000000,  0.750000000000000 ]    mass: 78.960000  - symbol: Tl # 13    coordinates: [  0.369696810000000,  0.662643350000000,  0.602118930000000 ]    mass: 204.383300  - symbol: Tl # 14    coordinates: [  0.837356650000000,  0.869696810000000,  0.602118930000000 ]    mass: 204.383300  - symbol: Tl # 15    coordinates: [  0.162643350000000,  0.130303190000000,  0.602118930000000 ]    mass: 204.383300  - symbol: Tl # 16    coordinates: [  0.869696810000000,  0.837356650000000,  0.897881070000000 ]    mass: 204.383300  - symbol: Tl # 17    coordinates: [  0.130303190000000,  0.162643350000000,  0.897881070000000 ]    mass: 204.383300  - symbol: Tl # 18    coordinates: [  0.630303190000000,  0.337356650000000,  0.602118930000000 ]    mass: 204.383300  - symbol: Tl # 19    coordinates: [  0.662643350000000,  0.369696810000000,  0.897881070000000 ]    mass: 204.383300  - symbol: Tl # 20    coordinates: [  0.337356650000000,  0.630303190000000,  0.897881070000000 ]    mass: 204.383300  - symbol: Tl # 21    coordinates: [  0.162643350000000,  0.869696810000000,  0.102118930000000 ]    mass: 204.383300  - symbol: Tl # 22    coordinates: [  0.837356650000000,  0.130303190000000,  0.102118930000000 ]    mass: 204.383300  - symbol: Tl # 23    coordinates: [  0.869696810000000,  0.162643350000000,  0.397881070000000 ]    mass: 204.383300  - symbol: Tl # 24    coordinates: [  0.369696810000000,  0.337356650000000,  0.102118930000000 ]    mass: 204.383300  - symbol: Tl # 25    coordinates: [  0.630303190000000,  0.662643350000000,  0.102118930000000 ]    mass: 204.383300  - symbol: Tl # 26    coordinates: [  0.337356650000000,  0.369696810000000,  0.397881070000000 ]    mass: 204.383300  - symbol: Tl # 27    coordinates: [  0.662643350000000,  0.630303190000000,  0.397881070000000 ]    mass: 204.383300  - symbol: Tl # 28    coordinates: [  0.130303190000000,  0.837356650000000,  0.397881070000000 ]    mass: 204.383300  - symbol: Tl # 29    coordinates: [  0.500000000000000,  0.000000000000000,  0.801896650000000 ]    mass: 204.383300  - symbol: Tl # 30    coordinates: [  0.000000000000000,  0.500000000000000,  0.698103350000000 ]    mass: 204.383300  - symbol: Tl # 31    coordinates: [  0.000000000000000,  0.500000000000000,  0.198103350000000 ]    mass: 204.383300  - symbol: Tl # 32    coordinates: [  0.500000000000000,  0.000000000000000,  0.301896650000000 ]    mass: 204.383300  reciprocal_lattice: # without 2pi  - [     0.118197276601893,     0.000000000000000,     0.000000000000000 ] # a*  - [     0.000000000000000,     0.118197276601893,     0.000000000000000 ] # b*  - [     0.000000000000000,     0.000000000000000,     0.079317875597642 ] # c*unit_cell:  lattice:  - [     8.460431820000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,     8.460431820000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    12.607498530000001 ] # c  points:  - symbol: Cl # 1    coordinates: [  0.500000000000000,  0.000000000000000,  0.554325360000000 ]    mass: 35.453000    reduced_to: 1  - symbol: Cl # 2    coordinates: [  0.000000000000000,  0.500000000000000,  0.945674640000000 ]    mass: 35.453000    reduced_to: 2  - symbol: Cl # 3    coordinates: [  0.000000000000000,  0.500000000000000,  0.445674640000000 ]    mass: 35.453000    reduced_to: 3  - symbol: Cl # 4    coordinates: [  0.500000000000000,  0.000000000000000,  0.054325360000000 ]    mass: 35.453000    reduced_to: 4  - symbol: Se # 5    coordinates: [  0.657681930000000,  0.342318070000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 5  - symbol: Se # 6    coordinates: [  0.157681930000000,  0.157681930000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 6  - symbol: Se # 7    coordinates: [  0.842318070000000,  0.842318070000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 7  - symbol: Se # 8    coordinates: [  0.342318070000000,  0.657681930000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 8  - symbol: Se # 9    coordinates: [  0.157681930000000,  0.842318070000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 9  - symbol: Se # 10    coordinates: [  0.657681930000000,  0.657681930000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 10  - symbol: Se # 11    coordinates: [  0.342318070000000,  0.342318070000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 11  - symbol: Se # 12    coordinates: [  0.842318070000000,  0.157681930000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 12  - symbol: Tl # 13    coordinates: [  0.369696810000000,  0.662643350000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 13  - symbol: Tl # 14    coordinates: [  0.837356650000000,  0.869696810000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 14  - symbol: Tl # 15    coordinates: [  0.162643350000000,  0.130303190000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 15  - symbol: Tl # 16    coordinates: [  0.869696810000000,  0.837356650000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 16  - symbol: Tl # 17    coordinates: [  0.130303190000000,  0.162643350000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 17  - symbol: Tl # 18    coordinates: [  0.630303190000000,  0.337356650000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 18  - symbol: Tl # 19    coordinates: [  0.662643350000000,  0.369696810000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 19  - symbol: Tl # 20    coordinates: [  0.337356650000000,  0.630303190000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 20  - symbol: Tl # 21    coordinates: [  0.162643350000000,  0.869696810000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 21  - symbol: Tl # 22    coordinates: [  0.837356650000000,  0.130303190000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 22  - symbol: Tl # 23    coordinates: [  0.869696810000000,  0.162643350000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 23  - symbol: Tl # 24    coordinates: [  0.369696810000000,  0.337356650000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 24  - symbol: Tl # 25    coordinates: [  0.630303190000000,  0.662643350000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 25  - symbol: Tl # 26    coordinates: [  0.337356650000000,  0.369696810000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 26  - symbol: Tl # 27    coordinates: [  0.662643350000000,  0.630303190000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 27  - symbol: Tl # 28    coordinates: [  0.130303190000000,  0.837356650000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 28  - symbol: Tl # 29    coordinates: [  0.500000000000000,  0.000000000000000,  0.801896650000000 ]    mass: 204.383300    reduced_to: 29  - symbol: Tl # 30    coordinates: [  0.000000000000000,  0.500000000000000,  0.698103350000000 ]    mass: 204.383300    reduced_to: 30  - symbol: Tl # 31    coordinates: [  0.000000000000000,  0.500000000000000,  0.198103350000000 ]    mass: 204.383300    reduced_to: 31  - symbol: Tl # 32    coordinates: [  0.500000000000000,  0.000000000000000,  0.301896650000000 ]    mass: 204.383300    reduced_to: 32supercell:  lattice:  - [    16.920863640000000,     0.000000000000000,     0.000000000000000 ] # a  - [     0.000000000000000,    16.920863640000000,     0.000000000000000 ] # b  - [     0.000000000000000,     0.000000000000000,    12.607498530000001 ] # c  points:  - symbol: Cl # 1    coordinates: [  0.250000000000000,  0.000000000000000,  0.554325360000000 ]    mass: 35.453000    reduced_to: 1  - symbol: Cl # 2    coordinates: [  0.750000000000000,  0.000000000000000,  0.554325360000000 ]    mass: 35.453000    reduced_to: 1  - symbol: Cl # 3    coordinates: [  0.250000000000000,  0.500000000000000,  0.554325360000000 ]    mass: 35.453000    reduced_to: 1  - symbol: Cl # 4    coordinates: [  0.750000000000000,  0.500000000000000,  0.554325360000000 ]    mass: 35.453000    reduced_to: 1  - symbol: Cl # 5    coordinates: [  0.000000000000000,  0.250000000000000,  0.945674640000000 ]    mass: 35.453000    reduced_to: 5  - symbol: Cl # 6    coordinates: [  0.500000000000000,  0.250000000000000,  0.945674640000000 ]    mass: 35.453000    reduced_to: 5  - symbol: Cl # 7    coordinates: [  0.000000000000000,  0.750000000000000,  0.945674640000000 ]    mass: 35.453000    reduced_to: 5  - symbol: Cl # 8    coordinates: [  0.500000000000000,  0.750000000000000,  0.945674640000000 ]    mass: 35.453000    reduced_to: 5  - symbol: Cl # 9    coordinates: [  0.000000000000000,  0.250000000000000,  0.445674640000000 ]    mass: 35.453000    reduced_to: 9  - symbol: Cl # 10    coordinates: [  0.500000000000000,  0.250000000000000,  0.445674640000000 ]    mass: 35.453000    reduced_to: 9  - symbol: Cl # 11    coordinates: [  0.000000000000000,  0.750000000000000,  0.445674640000000 ]    mass: 35.453000    reduced_to: 9  - symbol: Cl # 12    coordinates: [  0.500000000000000,  0.750000000000000,  0.445674640000000 ]    mass: 35.453000    reduced_to: 9  - symbol: Cl # 13    coordinates: [  0.250000000000000,  0.000000000000000,  0.054325360000000 ]    mass: 35.453000    reduced_to: 13  - symbol: Cl # 14    coordinates: [  0.750000000000000,  0.000000000000000,  0.054325360000000 ]    mass: 35.453000    reduced_to: 13  - symbol: Cl # 15    coordinates: [  0.250000000000000,  0.500000000000000,  0.054325360000000 ]    mass: 35.453000    reduced_to: 13  - symbol: Cl # 16    coordinates: [  0.750000000000000,  0.500000000000000,  0.054325360000000 ]    mass: 35.453000    reduced_to: 13  - symbol: Se # 17    coordinates: [  0.328840965000000,  0.171159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 17  - symbol: Se # 18    coordinates: [  0.828840965000000,  0.171159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 17  - symbol: Se # 19    coordinates: [  0.328840965000000,  0.671159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 17  - symbol: Se # 20    coordinates: [  0.828840965000000,  0.671159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 17  - symbol: Se # 21    coordinates: [  0.078840965000000,  0.078840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 21  - symbol: Se # 22    coordinates: [  0.578840965000000,  0.078840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 21  - symbol: Se # 23    coordinates: [  0.078840965000000,  0.578840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 21  - symbol: Se # 24    coordinates: [  0.578840965000000,  0.578840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 21  - symbol: Se # 25    coordinates: [  0.421159035000000,  0.421159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 25  - symbol: Se # 26    coordinates: [  0.921159035000000,  0.421159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 25  - symbol: Se # 27    coordinates: [  0.421159035000000,  0.921159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 25  - symbol: Se # 28    coordinates: [  0.921159035000000,  0.921159035000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 25  - symbol: Se # 29    coordinates: [  0.171159035000000,  0.328840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 29  - symbol: Se # 30    coordinates: [  0.671159035000000,  0.328840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 29  - symbol: Se # 31    coordinates: [  0.171159035000000,  0.828840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 29  - symbol: Se # 32    coordinates: [  0.671159035000000,  0.828840965000000,  0.250000000000000 ]    mass: 78.960000    reduced_to: 29  - symbol: Se # 33    coordinates: [  0.078840965000000,  0.421159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 34    coordinates: [  0.578840965000000,  0.421159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 35    coordinates: [  0.078840965000000,  0.921159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 36    coordinates: [  0.578840965000000,  0.921159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 33  - symbol: Se # 37    coordinates: [  0.328840965000000,  0.328840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 38    coordinates: [  0.828840965000000,  0.328840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 39    coordinates: [  0.328840965000000,  0.828840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 40    coordinates: [  0.828840965000000,  0.828840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 37  - symbol: Se # 41    coordinates: [  0.171159035000000,  0.171159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 42    coordinates: [  0.671159035000000,  0.171159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 43    coordinates: [  0.171159035000000,  0.671159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 44    coordinates: [  0.671159035000000,  0.671159035000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 41  - symbol: Se # 45    coordinates: [  0.421159035000000,  0.078840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Se # 46    coordinates: [  0.921159035000000,  0.078840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Se # 47    coordinates: [  0.421159035000000,  0.578840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Se # 48    coordinates: [  0.921159035000000,  0.578840965000000,  0.750000000000000 ]    mass: 78.960000    reduced_to: 45  - symbol: Tl # 49    coordinates: [  0.184848405000000,  0.331321675000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 49  - symbol: Tl # 50    coordinates: [  0.684848405000000,  0.331321675000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 49  - symbol: Tl # 51    coordinates: [  0.184848405000000,  0.831321675000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 49  - symbol: Tl # 52    coordinates: [  0.684848405000000,  0.831321675000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 49  - symbol: Tl # 53    coordinates: [  0.418678325000000,  0.434848405000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 53  - symbol: Tl # 54    coordinates: [  0.918678325000000,  0.434848405000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 53  - symbol: Tl # 55    coordinates: [  0.418678325000000,  0.934848405000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 53  - symbol: Tl # 56    coordinates: [  0.918678325000000,  0.934848405000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 53  - symbol: Tl # 57    coordinates: [  0.081321675000000,  0.065151595000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 57  - symbol: Tl # 58    coordinates: [  0.581321675000000,  0.065151595000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 57  - symbol: Tl # 59    coordinates: [  0.081321675000000,  0.565151595000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 57  - symbol: Tl # 60    coordinates: [  0.581321675000000,  0.565151595000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 57  - symbol: Tl # 61    coordinates: [  0.434848405000000,  0.418678325000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 61  - symbol: Tl # 62    coordinates: [  0.934848405000000,  0.418678325000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 61  - symbol: Tl # 63    coordinates: [  0.434848405000000,  0.918678325000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 61  - symbol: Tl # 64    coordinates: [  0.934848405000000,  0.918678325000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 61  - symbol: Tl # 65    coordinates: [  0.065151595000000,  0.081321675000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 65  - symbol: Tl # 66    coordinates: [  0.565151595000000,  0.081321675000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 65  - symbol: Tl # 67    coordinates: [  0.065151595000000,  0.581321675000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 65  - symbol: Tl # 68    coordinates: [  0.565151595000000,  0.581321675000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 65  - symbol: Tl # 69    coordinates: [  0.315151595000000,  0.168678325000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 69  - symbol: Tl # 70    coordinates: [  0.815151595000000,  0.168678325000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 69  - symbol: Tl # 71    coordinates: [  0.315151595000000,  0.668678325000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 69  - symbol: Tl # 72    coordinates: [  0.815151595000000,  0.668678325000000,  0.602118930000000 ]    mass: 204.383300    reduced_to: 69  - symbol: Tl # 73    coordinates: [  0.331321675000000,  0.184848405000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 73  - symbol: Tl # 74    coordinates: [  0.831321675000000,  0.184848405000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 73  - symbol: Tl # 75    coordinates: [  0.331321675000000,  0.684848405000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 73  - symbol: Tl # 76    coordinates: [  0.831321675000000,  0.684848405000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 73  - symbol: Tl # 77    coordinates: [  0.168678325000000,  0.315151595000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 77  - symbol: Tl # 78    coordinates: [  0.668678325000000,  0.315151595000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 77  - symbol: Tl # 79    coordinates: [  0.168678325000000,  0.815151595000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 77  - symbol: Tl # 80    coordinates: [  0.668678325000000,  0.815151595000000,  0.897881070000000 ]    mass: 204.383300    reduced_to: 77  - symbol: Tl # 81    coordinates: [  0.081321675000000,  0.434848405000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 81  - symbol: Tl # 82    coordinates: [  0.581321675000000,  0.434848405000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 81  - symbol: Tl # 83    coordinates: [  0.081321675000000,  0.934848405000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 81  - symbol: Tl # 84    coordinates: [  0.581321675000000,  0.934848405000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 81  - symbol: Tl # 85    coordinates: [  0.418678325000000,  0.065151595000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 85  - symbol: Tl # 86    coordinates: [  0.918678325000000,  0.065151595000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 85  - symbol: Tl # 87    coordinates: [  0.418678325000000,  0.565151595000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 85  - symbol: Tl # 88    coordinates: [  0.918678325000000,  0.565151595000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 85  - symbol: Tl # 89    coordinates: [  0.434848405000000,  0.081321675000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 89  - symbol: Tl # 90    coordinates: [  0.934848405000000,  0.081321675000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 89  - symbol: Tl # 91    coordinates: [  0.434848405000000,  0.581321675000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 89  - symbol: Tl # 92    coordinates: [  0.934848405000000,  0.581321675000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 89  - symbol: Tl # 93    coordinates: [  0.184848405000000,  0.168678325000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 93  - symbol: Tl # 94    coordinates: [  0.684848405000000,  0.168678325000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 93  - symbol: Tl # 95    coordinates: [  0.184848405000000,  0.668678325000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 93  - symbol: Tl # 96    coordinates: [  0.684848405000000,  0.668678325000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 93  - symbol: Tl # 97    coordinates: [  0.315151595000000,  0.331321675000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 97  - symbol: Tl # 98    coordinates: [  0.815151595000000,  0.331321675000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 97  - symbol: Tl # 99    coordinates: [  0.315151595000000,  0.831321675000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 97  - symbol: Tl # 100    coordinates: [  0.815151595000000,  0.831321675000000,  0.102118930000000 ]    mass: 204.383300    reduced_to: 97  - symbol: Tl # 101    coordinates: [  0.168678325000000,  0.184848405000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 101  - symbol: Tl # 102    coordinates: [  0.668678325000000,  0.184848405000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 101  - symbol: Tl # 103    coordinates: [  0.168678325000000,  0.684848405000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 101  - symbol: Tl # 104    coordinates: [  0.668678325000000,  0.684848405000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 101  - symbol: Tl # 105    coordinates: [  0.331321675000000,  0.315151595000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 105  - symbol: Tl # 106    coordinates: [  0.831321675000000,  0.315151595000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 105  - symbol: Tl # 107    coordinates: [  0.331321675000000,  0.815151595000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 105  - symbol: Tl # 108    coordinates: [  0.831321675000000,  0.815151595000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 105  - symbol: Tl # 109    coordinates: [  0.065151595000000,  0.418678325000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 109  - symbol: Tl # 110    coordinates: [  0.565151595000000,  0.418678325000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 109  - symbol: Tl # 111    coordinates: [  0.065151595000000,  0.918678325000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 109  - symbol: Tl # 112    coordinates: [  0.565151595000000,  0.918678325000000,  0.397881070000000 ]    mass: 204.383300    reduced_to: 109  - symbol: Tl # 113    coordinates: [  0.250000000000000,  0.000000000000000,  0.801896650000000 ]    mass: 204.383300    reduced_to: 113  - symbol: Tl # 114    coordinates: [  0.750000000000000,  0.000000000000000,  0.801896650000000 ]    mass: 204.383300    reduced_to: 113  - symbol: Tl # 115    coordinates: [  0.250000000000000,  0.500000000000000,  0.801896650000000 ]    mass: 204.383300    reduced_to: 113  - symbol: Tl # 116    coordinates: [  0.750000000000000,  0.500000000000000,  0.801896650000000 ]    mass: 204.383300    reduced_to: 113  - symbol: Tl # 117    coordinates: [  0.000000000000000,  0.250000000000000,  0.698103350000000 ]    mass: 204.383300    reduced_to: 117  - symbol: Tl # 118    coordinates: [  0.500000000000000,  0.250000000000000,  0.698103350000000 ]    mass: 204.383300    reduced_to: 117  - symbol: Tl # 119    coordinates: [  0.000000000000000,  0.750000000000000,  0.698103350000000 ]    mass: 204.383300    reduced_to: 117  - symbol: Tl # 120    coordinates: [  0.500000000000000,  0.750000000000000,  0.698103350000000 ]    mass: 204.383300    reduced_to: 117  - symbol: Tl # 121    coordinates: [  0.000000000000000,  0.250000000000000,  0.198103350000000 ]    mass: 204.383300    reduced_to: 121  - symbol: Tl # 122    coordinates: [  0.500000000000000,  0.250000000000000,  0.198103350000000 ]    mass: 204.383300    reduced_to: 121  - symbol: Tl # 123    coordinates: [  0.000000000000000,  0.750000000000000,  0.198103350000000 ]    mass: 204.383300    reduced_to: 121  - symbol: Tl # 124    coordinates: [  0.500000000000000,  0.750000000000000,  0.198103350000000 ]    mass: 204.383300    reduced_to: 121  - symbol: Tl # 125    coordinates: [  0.250000000000000,  0.000000000000000,  0.301896650000000 ]    mass: 204.383300    reduced_to: 125  - symbol: Tl # 126    coordinates: [  0.750000000000000,  0.000000000000000,  0.301896650000000 ]    mass: 204.383300    reduced_to: 125  - symbol: Tl # 127    coordinates: [  0.250000000000000,  0.500000000000000,  0.301896650000000 ]    mass: 204.383300    reduced_to: 125  - symbol: Tl # 128    coordinates: [  0.750000000000000,  0.500000000000000,  0.301896650000000 ]    mass: 204.383300    reduced_to: 125displacements:- atom:    1  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0170099300000000,  0.0000006500000000, -0.0000579900000000 ]  - [   0.0003631900000000, -0.0000172600000000,  0.0000117700000000 ]  - [  -0.0000642600000000,  0.0000167800000000,  0.0000120500000000 ]  - [   0.0000834300000000, -0.0000002300000000,  0.0000118200000000 ]  - [   0.0000034400000000, -0.0001164700000000, -0.0001110900000000 ]  - [   0.0000010300000000,  0.0001763400000000,  0.0001205100000000 ]  - [   0.0000030200000000,  0.0001742600000000, -0.0001433200000000 ]  - [   0.0000006000000000, -0.0001166700000000,  0.0000878800000000 ]  - [   0.0002262900000000, -0.0003245900000000,  0.0002187100000000 ]  - [   0.0002259300000000,  0.0003280600000000, -0.0001064000000000 ]  - [   0.0002269700000000,  0.0003254700000000,  0.0000834600000000 ]  - [   0.0002254800000000, -0.0003280300000000, -0.0002456500000000 ]  - [  -0.0000513300000000, -0.0000293100000000,  0.0000080200000000 ]  - [   0.0000459100000000, -0.0000731300000000,  0.0000117900000000 ]  - [  -0.0000753900000000, -0.0000731500000000,  0.0000115700000000 ]  - [   0.0001140000000000, -0.0000872200000000,  0.0000116500000000 ]  - [  -0.0004092600000000, -0.0001123600000000, -0.0000640200000000 ]  - [   0.0004930400000000, -0.0003454800000000,  0.0003323600000000 ]  - [  -0.0002062300000000, -0.0002207900000000, -0.0001306100000000 ]  - [   0.0002068800000000, -0.0000579500000000,  0.0000225900000000 ]  - [  -0.0005406300000000,  0.0001455200000000, -0.0000495200000000 ]  - [   0.0006506900000000,  0.0001777000000000, -0.0005021000000000 ]  - [   0.0000594200000000,  0.0001112200000000,  0.0000668100000000 ]  - [   0.0000468500000000,  0.0000382100000000,  0.0000329800000000 ]  - [   0.0000147600000000,  0.0000676800000000, -0.0000659300000000 ]  - [   0.0000066400000000, -0.0000036300000000, -0.0000326900000000 ]  - [  -0.0005914000000000,  0.0001047600000000,  0.0000496300000000 ]  - [   0.0006052800000000,  0.0001341800000000,  0.0004963700000000 ]  - [  -0.0002476800000000, -0.0001810900000000,  0.0001318100000000 ]  - [   0.0001625700000000, -0.0000136600000000, -0.0000225900000000 ]  - [  -0.0004464400000000, -0.0000644900000000,  0.0000624500000000 ]  - [   0.0004536400000000, -0.0003070900000000, -0.0003366500000000 ]  - [  -0.0000542400000000, -0.0001136300000000,  0.0001039200000000 ]  - [   0.0001485800000000, -0.0000101700000000,  0.0000135500000000 ]  - [   0.0010887300000000,  0.0008335800000000, -0.0013279800000000 ]  - [   0.0025006400000000, -0.0001564400000000,  0.0018580000000000 ]  - [  -0.0001575200000000,  0.0009608800000000,  0.0006719500000000 ]  - [   0.0002241400000000, -0.0000599800000000,  0.0000473300000000 ]  - [  -0.0005484000000000, -0.0008777400000000,  0.0006552900000000 ]  - [   0.0004524300000000,  0.0002121700000000, -0.0001308900000000 ]  - [  -0.0005795100000000, -0.0009265100000000, -0.0006564100000000 ]  - [   0.0004086900000000,  0.0001733200000000,  0.0001330900000000 ]  - [  -0.0002012300000000,  0.0009275300000000, -0.0006745200000000 ]  - [   0.0001813800000000, -0.0001043100000000, -0.0000483100000000 ]  - [   0.0010544700000000,  0.0008881900000000,  0.0013461400000000 ]  - [   0.0024390500000000, -0.0001093400000000, -0.0018352800000000 ]  - [  -0.0001001500000000, -0.0000726500000000, -0.0001046700000000 ]  - [   0.0001088800000000,  0.0000317700000000, -0.0000134200000000 ]  - [   0.0002570800000000, -0.0000344000000000, -0.0000810900000000 ]  - [  -0.0001292100000000, -0.0000812300000000,  0.0000131300000000 ]  - [   0.0014102400000000,  0.0010641100000000,  0.0003052600000000 ]  - [  -0.0003738200000000,  0.0001138800000000,  0.0001226900000000 ]  - [   0.0000196800000000, -0.0000796100000000,  0.0000467800000000 ]  - [   0.0000454500000000,  0.0000407900000000, -0.0000031000000000 ]  - [   0.0038393800000000, -0.0018306800000000, -0.0009622800000000 ]  - [  -0.0003949400000000, -0.0003826000000000, -0.0000009300000000 ]  - [   0.0034984200000000, -0.0016858600000000,  0.0009524200000000 ]  - [  -0.0005009800000000, -0.0003506800000000, -0.0000424800000000 ]  - [  -0.0000861700000000, -0.0000427300000000, -0.0000894600000000 ]  - [  -0.0000575600000000,  0.0000793100000000, -0.0000386600000000 ]  - [  -0.0000878500000000, -0.0000162700000000,  0.0000617700000000 ]  - [  -0.0000535100000000,  0.0000816800000000, -0.0000006200000000 ]  - [   0.0001956100000000,  0.0001301900000000, -0.0001476800000000 ]  - [  -0.0003946000000000, -0.0001539400000000,  0.0002679500000000 ]  - [   0.0002247100000000,  0.0000262700000000,  0.0001870300000000 ]  - [  -0.0003550000000000, -0.0002600800000000, -0.0002282800000000 ]  - [  -0.0000519600000000, -0.0001205400000000, -0.0000203100000000 ]  - [  -0.0000142900000000, -0.0000216300000000,  0.0000422400000000 ]  - [   0.0014557100000000,  0.0012215600000000, -0.0003337700000000 ]  - [  -0.0003340600000000,  0.0002152400000000, -0.0001627300000000 ]  - [   0.0002968000000000,  0.0000681800000000,  0.0000385200000000 ]  - [  -0.0000921000000000,  0.0000235200000000, -0.0000549700000000 ]  - [   0.0004428100000000, -0.0001695100000000, -0.0001630500000000 ]  - [  -0.0003154600000000,  0.0002550200000000,  0.0000489800000000 ]  - [   0.0000240100000000,  0.0001015800000000, -0.0000501100000000 ]  - [  -0.0001749100000000, -0.0000382400000000,  0.0000556800000000 ]  - [   0.0001269200000000,  0.0001407600000000,  0.0000934300000000 ]  - [  -0.0000693600000000, -0.0000019500000000, -0.0000133500000000 ]  - [   0.0005436300000000, -0.0001339400000000,  0.0002048800000000 ]  - [  -0.0002115000000000,  0.0002986300000000, -0.0000086500000000 ]  - [  -0.0000202300000000,  0.0000015400000000,  0.0000333100000000 ]  - [  -0.0001156300000000, -0.0000063000000000, -0.0000554700000000 ]  - [   0.0000347300000000, -0.0000250200000000,  0.0000489700000000 ]  - [   0.0000157800000000,  0.0000507800000000, -0.0001045800000000 ]  - [   0.0001451800000000,  0.0000143700000000, -0.0000907000000000 ]  - [   0.0001170800000000,  0.0000871800000000,  0.0000623000000000 ]  - [   0.0000852700000000,  0.0000394700000000, -0.0000750400000000 ]  - [  -0.0000127000000000,  0.0000319100000000,  0.0000137900000000 ]  - [   0.0001536400000000, -0.0000894100000000,  0.0006959500000000 ]  - [  -0.0002702600000000,  0.0001169200000000, -0.0004978800000000 ]  - [   0.0000206800000000,  0.0000140300000000,  0.0000372700000000 ]  - [  -0.0001045700000000, -0.0000893300000000, -0.0000073600000000 ]  - [   0.0001002400000000,  0.0000883300000000, -0.0000063100000000 ]  - [  -0.0002706900000000, -0.0001137800000000, -0.0000010600000000 ]  - [   0.0000990700000000,  0.0000573500000000, -0.0000082500000000 ]  - [  -0.0000756900000000,  0.0001279900000000, -0.0000417000000000 ]  - [   0.0001377900000000, -0.0000469000000000, -0.0000337400000000 ]  - [  -0.0000386900000000,  0.0000222600000000, -0.0000009400000000 ]  - [   0.0001399900000000, -0.0000201200000000, -0.0000351400000000 ]  - [  -0.0002335400000000, -0.0002169400000000, -0.0000414400000000 ]  - [   0.0004418700000000,  0.0000789800000000, -0.0002570900000000 ]  - [  -0.0001619700000000, -0.0001003800000000,  0.0000236900000000 ]  - [   0.0001067400000000, -0.0001075400000000, -0.0001085700000000 ]  - [  -0.0000709200000000,  0.0000424500000000,  0.0000308800000000 ]  - [   0.0000037800000000, -0.0000673400000000,  0.0001502300000000 ]  - [  -0.0001747200000000,  0.0000790600000000,  0.0000110700000000 ]  - [   0.0003430400000000,  0.0001094500000000,  0.0002932000000000 ]  - [  -0.0002662300000000, -0.0000616000000000,  0.0000176700000000 ]  - [   0.0000570600000000,  0.0001175700000000,  0.0000051500000000 ]  - [  -0.0000657700000000,  0.0000140900000000,  0.0000493000000000 ]  - [   0.0001743600000000,  0.0000103900000000, -0.0006592900000000 ]  - [  -0.0002358200000000,  0.0002232800000000,  0.0005489200000000 ]  - [   0.0009595500000000,  0.0000365400000000, -0.0000378200000000 ]  - [  -0.0006610900000000, -0.0002258000000000, -0.0000488000000000 ]  - [   0.0002947300000000, -0.0001376300000000, -0.0000500000000000 ]  - [  -0.0000941900000000,  0.0000472200000000, -0.0000497600000000 ]  - [  -0.0001525100000000,  0.0005563500000000,  0.0002004300000000 ]  - [  -0.0002561000000000, -0.0002989000000000,  0.0000716400000000 ]  - [  -0.0002593600000000, -0.0002984200000000,  0.0000294200000000 ]  - [  -0.0001506100000000,  0.0005654300000000, -0.0001047600000000 ]  - [   0.0000520500000000, -0.0000050600000000, -0.0000445500000000 ]  - [   0.0000189400000000, -0.0000305100000000,  0.0001081400000000 ]  - [   0.0000163100000000, -0.0000295700000000, -0.0000090200000000 ]  - [   0.0000542500000000, -0.0000055000000000,  0.0001449700000000 ]  - [   0.0001906000000000,  0.0000195000000000, -0.0000504700000000 ]  - [  -0.0003421800000000, -0.0000047400000000, -0.0000499600000000 ]  - [   0.0001279000000000,  0.0000164800000000, -0.0000494700000000 ]  - [  -0.0000827700000000,  0.0000301200000000, -0.0000498300000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0173016200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000310100000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000310100000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000026500000000 ]  - [  -0.0001322900000000,  0.0001002900000000,  0.0001333900000000 ]  - [   0.0001002900000000,  0.0001322900000000,  0.0001333900000000 ]  - [  -0.0001002900000000, -0.0001322900000000,  0.0001333900000000 ]  - [   0.0001322900000000, -0.0001002900000000,  0.0001333900000000 ]  - [   0.0002323300000000, -0.0000952200000000, -0.0001184900000000 ]  - [  -0.0000952200000000, -0.0002323300000000, -0.0001184900000000 ]  - [   0.0000952200000000,  0.0002323300000000, -0.0001184900000000 ]  - [  -0.0002323300000000,  0.0000952200000000, -0.0001184900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0063397300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0002142000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0002142000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000390900000000 ]  - [  -0.0002986500000000, -0.0009730800000000, -0.0001712400000000 ]  - [   0.0000571400000000, -0.0000077400000000, -0.0000280200000000 ]  - [   0.0000780900000000,  0.0004318200000000,  0.0002180300000000 ]  - [   0.0000959300000000, -0.0000130500000000, -0.0000251000000000 ]  - [   0.0009730800000000, -0.0002986500000000, -0.0001712400000000 ]  - [  -0.0004318200000000,  0.0000780900000000,  0.0002180300000000 ]  - [   0.0000077400000000,  0.0000571400000000, -0.0000280200000000 ]  - [   0.0000130500000000,  0.0000959300000000, -0.0000251000000000 ]  - [  -0.0000077400000000, -0.0000571400000000, -0.0000280200000000 ]  - [  -0.0000130500000000, -0.0000959300000000, -0.0000251000000000 ]  - [  -0.0009730800000000,  0.0002986500000000, -0.0001712400000000 ]  - [   0.0004318200000000, -0.0000780900000000,  0.0002180300000000 ]  - [  -0.0000780900000000, -0.0004318200000000,  0.0002180300000000 ]  - [  -0.0000959300000000,  0.0000130500000000, -0.0000251000000000 ]  - [   0.0002986500000000,  0.0009730800000000, -0.0001712400000000 ]  - [  -0.0000571400000000,  0.0000077400000000, -0.0000280200000000 ]  - [  -0.0000573600000000,  0.0000501200000000, -0.0001159900000000 ]  - [   0.0000324800000000,  0.0000300900000000, -0.0000003300000000 ]  - [  -0.0015349100000000, -0.0007327800000000,  0.0004559300000000 ]  - [   0.0001928900000000,  0.0000265200000000, -0.0000959400000000 ]  - [  -0.0000265200000000,  0.0001928900000000, -0.0000959400000000 ]  - [  -0.0000300900000000,  0.0000324800000000, -0.0000003300000000 ]  - [   0.0007327800000000, -0.0015349100000000,  0.0004559300000000 ]  - [  -0.0000501200000000, -0.0000573600000000, -0.0001159900000000 ]  - [  -0.0007327800000000,  0.0015349100000000,  0.0004559300000000 ]  - [   0.0000501200000000,  0.0000573600000000, -0.0001159900000000 ]  - [   0.0000265200000000, -0.0001928900000000, -0.0000959400000000 ]  - [   0.0000300900000000, -0.0000324800000000, -0.0000003300000000 ]  - [   0.0015349100000000,  0.0007327800000000,  0.0004559300000000 ]  - [  -0.0001928900000000, -0.0000265200000000, -0.0000959400000000 ]  - [   0.0000573600000000, -0.0000501200000000, -0.0001159900000000 ]  - [  -0.0000324800000000, -0.0000300900000000, -0.0000003300000000 ]  - [  -0.0000278200000000, -0.0002011700000000,  0.0001774400000000 ]  - [  -0.0000222000000000, -0.0000657400000000,  0.0000240600000000 ]  - [  -0.0002894300000000, -0.0005059300000000,  0.0007717500000000 ]  - [  -0.0000223900000000, -0.0000061800000000,  0.0000740300000000 ]  - [   0.0000061800000000, -0.0000223900000000,  0.0000740300000000 ]  - [   0.0000657400000000, -0.0000222000000000,  0.0000240600000000 ]  - [   0.0005059300000000, -0.0002894300000000,  0.0007717500000000 ]  - [   0.0002011700000000, -0.0000278200000000,  0.0001774400000000 ]  - [  -0.0005059300000000,  0.0002894300000000,  0.0007717500000000 ]  - [  -0.0002011700000000,  0.0000278200000000,  0.0001774400000000 ]  - [  -0.0000061800000000,  0.0000223900000000,  0.0000740300000000 ]  - [  -0.0000657400000000,  0.0000222000000000,  0.0000240600000000 ]  - [  -0.0000430500000000,  0.0000404600000000, -0.0000268300000000 ]  - [  -0.0000113100000000,  0.0000326400000000, -0.0000144500000000 ]  - [  -0.0005152400000000,  0.0001641600000000, -0.0001834600000000 ]  - [   0.0002444700000000,  0.0001411000000000, -0.0002343400000000 ]  - [   0.0005152400000000, -0.0001641600000000, -0.0001834600000000 ]  - [  -0.0002444700000000, -0.0001411000000000, -0.0002343400000000 ]  - [   0.0000430500000000, -0.0000404600000000, -0.0000268300000000 ]  - [   0.0000113100000000, -0.0000326400000000, -0.0000144500000000 ]  - [   0.0002894300000000,  0.0005059300000000,  0.0007717500000000 ]  - [   0.0000223900000000,  0.0000061800000000,  0.0000740300000000 ]  - [   0.0000278200000000,  0.0002011700000000,  0.0001774400000000 ]  - [   0.0000222000000000,  0.0000657400000000,  0.0000240600000000 ]  - [  -0.0001641600000000, -0.0005152400000000, -0.0001834600000000 ]  - [  -0.0000404600000000, -0.0000430500000000, -0.0000268300000000 ]  - [  -0.0001411000000000,  0.0002444700000000, -0.0002343400000000 ]  - [  -0.0000326400000000, -0.0000113100000000, -0.0000144500000000 ]  - [   0.0001411000000000, -0.0002444700000000, -0.0002343400000000 ]  - [   0.0000326400000000,  0.0000113100000000, -0.0000144500000000 ]  - [   0.0001641600000000,  0.0005152400000000, -0.0001834600000000 ]  - [   0.0000404600000000,  0.0000430500000000, -0.0000268300000000 ]  - [  -0.0000807600000000,  0.0000382900000000, -0.0000809000000000 ]  - [  -0.0000357200000000, -0.0000186800000000, -0.0000658500000000 ]  - [  -0.0002102400000000, -0.0000779600000000, -0.0003666500000000 ]  - [   0.0000332900000000,  0.0000108400000000, -0.0002268900000000 ]  - [   0.0002102400000000,  0.0000779600000000, -0.0003666500000000 ]  - [  -0.0000332900000000, -0.0000108400000000, -0.0002268900000000 ]  - [   0.0000807600000000, -0.0000382900000000, -0.0000809000000000 ]  - [   0.0000357200000000,  0.0000186800000000, -0.0000658500000000 ]  - [   0.0002878200000000,  0.0000117200000000, -0.0000759400000000 ]  - [  -0.0002491000000000, -0.0000682200000000,  0.0002954400000000 ]  - [   0.0000184500000000, -0.0000889500000000,  0.0001198800000000 ]  - [  -0.0000247100000000, -0.0000688100000000,  0.0000427000000000 ]  - [  -0.0000779600000000,  0.0002102400000000, -0.0003666500000000 ]  - [   0.0000382900000000,  0.0000807600000000, -0.0000809000000000 ]  - [   0.0000108400000000, -0.0000332900000000, -0.0002268900000000 ]  - [  -0.0000186800000000,  0.0000357200000000, -0.0000658500000000 ]  - [  -0.0000108400000000,  0.0000332900000000, -0.0002268900000000 ]  - [   0.0000186800000000, -0.0000357200000000, -0.0000658500000000 ]  - [   0.0000779600000000, -0.0002102400000000, -0.0003666500000000 ]  - [  -0.0000382900000000, -0.0000807600000000, -0.0000809000000000 ]  - [  -0.0000117200000000,  0.0002878200000000, -0.0000759400000000 ]  - [   0.0000889500000000,  0.0000184500000000,  0.0001198800000000 ]  - [   0.0000682200000000, -0.0002491000000000,  0.0002954400000000 ]  - [   0.0000688100000000, -0.0000247100000000,  0.0000427000000000 ]  - [  -0.0000682200000000,  0.0002491000000000,  0.0002954400000000 ]  - [  -0.0000688100000000,  0.0000247100000000,  0.0000427000000000 ]  - [   0.0000117200000000, -0.0002878200000000, -0.0000759400000000 ]  - [  -0.0000889500000000, -0.0000184500000000,  0.0001198800000000 ]  - [  -0.0000184500000000,  0.0000889500000000,  0.0001198800000000 ]  - [   0.0000247100000000,  0.0000688100000000,  0.0000427000000000 ]  - [  -0.0002878200000000, -0.0000117200000000, -0.0000759400000000 ]  - [   0.0002491000000000,  0.0000682200000000,  0.0002954400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0038673300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000280800000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000280800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000326600000000 ]  - [   0.0002550600000000, -0.0001108900000000,  0.0001365700000000 ]  - [  -0.0001108900000000, -0.0002550600000000,  0.0001365700000000 ]  - [   0.0001108900000000,  0.0002550600000000,  0.0001365700000000 ]  - [  -0.0002550600000000,  0.0001108900000000,  0.0001365700000000 ]  - [  -0.0000681400000000,  0.0001402600000000,  0.0000189200000000 ]  - [   0.0001402600000000,  0.0000681400000000,  0.0000189200000000 ]  - [  -0.0001402600000000, -0.0000681400000000,  0.0000189200000000 ]  - [   0.0000681400000000, -0.0001402600000000,  0.0000189200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0040905200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000308300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000308300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000401600000000 ]- atom:    1  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0172862500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000533900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000533900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000195600000000 ]  - [   0.0001315200000000, -0.0000986700000000, -0.0001571200000000 ]  - [  -0.0000986700000000, -0.0001315200000000, -0.0001571200000000 ]  - [   0.0000986700000000,  0.0001315200000000, -0.0001571200000000 ]  - [  -0.0001315200000000,  0.0000986700000000, -0.0001571200000000 ]  - [  -0.0002320200000000,  0.0000945700000000,  0.0000981900000000 ]  - [   0.0000945700000000,  0.0002320200000000,  0.0000981900000000 ]  - [  -0.0000945700000000, -0.0002320200000000,  0.0000981900000000 ]  - [   0.0002320200000000, -0.0000945700000000,  0.0000981900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0063175200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001924800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001924800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000168500000000 ]  - [   0.0003452400000000,  0.0009421100000000,  0.0001769100000000 ]  - [  -0.0000156900000000, -0.0000356600000000,  0.0000289000000000 ]  - [  -0.0000373000000000, -0.0004767000000000, -0.0002157000000000 ]  - [  -0.0000557400000000, -0.0000306800000000,  0.0000256700000000 ]  - [  -0.0009421100000000,  0.0003452400000000,  0.0001769100000000 ]  - [   0.0004767000000000, -0.0000373000000000, -0.0002157000000000 ]  - [   0.0000356600000000, -0.0000156900000000,  0.0000289000000000 ]  - [   0.0000306800000000, -0.0000557400000000,  0.0000256700000000 ]  - [  -0.0000356600000000,  0.0000156900000000,  0.0000289000000000 ]  - [  -0.0000306800000000,  0.0000557400000000,  0.0000256700000000 ]  - [   0.0009421100000000, -0.0003452400000000,  0.0001769100000000 ]  - [  -0.0004767000000000,  0.0000373000000000, -0.0002157000000000 ]  - [   0.0000373000000000,  0.0004767000000000, -0.0002157000000000 ]  - [   0.0000557400000000,  0.0000306800000000,  0.0000256700000000 ]  - [  -0.0003452400000000, -0.0009421100000000,  0.0001769100000000 ]  - [   0.0000156900000000,  0.0000356600000000,  0.0000289000000000 ]  - [   0.0000984900000000, -0.0000928400000000,  0.0001139500000000 ]  - [   0.0000088100000000, -0.0000737500000000, -0.0000000500000000 ]  - [   0.0015634100000000,  0.0006855900000000, -0.0004593900000000 ]  - [  -0.0001600700000000, -0.0000723100000000,  0.0000870700000000 ]  - [   0.0000723100000000, -0.0001600700000000,  0.0000870700000000 ]  - [   0.0000737500000000,  0.0000088100000000, -0.0000000500000000 ]  - [  -0.0006855900000000,  0.0015634100000000, -0.0004593900000000 ]  - [   0.0000928400000000,  0.0000984900000000,  0.0001139500000000 ]  - [   0.0006855900000000, -0.0015634100000000, -0.0004593900000000 ]  - [  -0.0000928400000000, -0.0000984900000000,  0.0001139500000000 ]  - [  -0.0000723100000000,  0.0001600700000000,  0.0000870700000000 ]  - [  -0.0000737500000000, -0.0000088100000000, -0.0000000500000000 ]  - [  -0.0015634100000000, -0.0006855900000000, -0.0004593900000000 ]  - [   0.0001600700000000,  0.0000723100000000,  0.0000870700000000 ]  - [  -0.0000984900000000,  0.0000928400000000,  0.0001139500000000 ]  - [  -0.0000088100000000,  0.0000737500000000, -0.0000000500000000 ]  - [  -0.0000117900000000,  0.0000979700000000, -0.0002195400000000 ]  - [  -0.0000152500000000, -0.0000381900000000, -0.0000664500000000 ]  - [   0.0002471800000000,  0.0003763300000000, -0.0008075300000000 ]  - [  -0.0000146500000000, -0.0000983300000000, -0.0001171500000000 ]  - [   0.0000983300000000, -0.0000146500000000, -0.0001171500000000 ]  - [   0.0000381900000000, -0.0000152500000000, -0.0000664500000000 ]  - [  -0.0003763300000000,  0.0002471800000000, -0.0008075300000000 ]  - [  -0.0000979700000000, -0.0000117900000000, -0.0002195400000000 ]  - [   0.0003763300000000, -0.0002471800000000, -0.0008075300000000 ]  - [   0.0000979700000000,  0.0000117900000000, -0.0002195400000000 ]  - [  -0.0000983300000000,  0.0000146500000000, -0.0001171500000000 ]  - [  -0.0000381900000000,  0.0000152500000000, -0.0000664500000000 ]  - [   0.0000062800000000,  0.0000641300000000,  0.0000682000000000 ]  - [  -0.0000266700000000,  0.0000714400000000,  0.0000565700000000 ]  - [   0.0004686300000000, -0.0000556500000000,  0.0002297300000000 ]  - [  -0.0002820200000000, -0.0000378000000000,  0.0002774300000000 ]  - [  -0.0004686300000000,  0.0000556500000000,  0.0002297300000000 ]  - [   0.0002820200000000,  0.0000378000000000,  0.0002774300000000 ]  - [  -0.0000062800000000, -0.0000641300000000,  0.0000682000000000 ]  - [   0.0000266700000000, -0.0000714400000000,  0.0000565700000000 ]  - [  -0.0002471800000000, -0.0003763300000000, -0.0008075300000000 ]  - [   0.0000146500000000,  0.0000983300000000, -0.0001171500000000 ]  - [   0.0000117900000000, -0.0000979700000000, -0.0002195400000000 ]  - [   0.0000152500000000,  0.0000381900000000, -0.0000664500000000 ]  - [   0.0000556500000000,  0.0004686300000000,  0.0002297300000000 ]  - [  -0.0000641300000000,  0.0000062800000000,  0.0000682000000000 ]  - [   0.0000378000000000, -0.0002820200000000,  0.0002774300000000 ]  - [  -0.0000714400000000, -0.0000266700000000,  0.0000565700000000 ]  - [  -0.0000378000000000,  0.0002820200000000,  0.0002774300000000 ]  - [   0.0000714400000000,  0.0000266700000000,  0.0000565700000000 ]  - [  -0.0000556500000000, -0.0004686300000000,  0.0002297300000000 ]  - [   0.0000641300000000, -0.0000062800000000,  0.0000682000000000 ]  - [  -0.0000233000000000, -0.0000769800000000,  0.0000395500000000 ]  - [  -0.0000686800000000, -0.0000192900000000,  0.0000246500000000 ]  - [   0.0001186100000000,  0.0000443400000000,  0.0003254200000000 ]  - [  -0.0001393900000000, -0.0000478900000000,  0.0001866800000000 ]  - [  -0.0001186100000000, -0.0000443400000000,  0.0003254200000000 ]  - [   0.0001393900000000,  0.0000478900000000,  0.0001866800000000 ]  - [   0.0000233000000000,  0.0000769800000000,  0.0000395500000000 ]  - [   0.0000686800000000,  0.0000192900000000,  0.0000246500000000 ]  - [  -0.0003233300000000, -0.0001138200000000,  0.0001098300000000 ]  - [   0.0002145800000000, -0.0000342500000000, -0.0002595300000000 ]  - [  -0.0000564100000000, -0.0000148700000000, -0.0000785200000000 ]  - [  -0.0000126800000000, -0.0000354500000000, -0.0000012200000000 ]  - [   0.0000443400000000, -0.0001186100000000,  0.0003254200000000 ]  - [  -0.0000769800000000,  0.0000233000000000,  0.0000395500000000 ]  - [  -0.0000478900000000,  0.0001393900000000,  0.0001866800000000 ]  - [  -0.0000192900000000,  0.0000686800000000,  0.0000246500000000 ]  - [   0.0000478900000000, -0.0001393900000000,  0.0001866800000000 ]  - [   0.0000192900000000, -0.0000686800000000,  0.0000246500000000 ]  - [  -0.0000443400000000,  0.0001186100000000,  0.0003254200000000 ]  - [   0.0000769800000000, -0.0000233000000000,  0.0000395500000000 ]  - [   0.0001138200000000, -0.0003233300000000,  0.0001098300000000 ]  - [   0.0000148700000000, -0.0000564100000000, -0.0000785200000000 ]  - [   0.0000342500000000,  0.0002145800000000, -0.0002595300000000 ]  - [   0.0000354500000000, -0.0000126800000000, -0.0000012200000000 ]  - [  -0.0000342500000000, -0.0002145800000000, -0.0002595300000000 ]  - [  -0.0000354500000000,  0.0000126800000000, -0.0000012200000000 ]  - [  -0.0001138200000000,  0.0003233300000000,  0.0001098300000000 ]  - [  -0.0000148700000000,  0.0000564100000000, -0.0000785200000000 ]  - [   0.0000564100000000,  0.0000148700000000, -0.0000785200000000 ]  - [   0.0000126800000000,  0.0000354500000000, -0.0000012200000000 ]  - [   0.0003233300000000,  0.0001138200000000,  0.0001098300000000 ]  - [  -0.0002145800000000,  0.0000342500000000, -0.0002595300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0036477900000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001272000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001272000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000668600000000 ]  - [  -0.0002555600000000,  0.0001138500000000, -0.0000349700000000 ]  - [   0.0001138500000000,  0.0002555600000000, -0.0000349700000000 ]  - [  -0.0001138500000000, -0.0002555600000000, -0.0000349700000000 ]  - [   0.0002555600000000, -0.0001138500000000, -0.0000349700000000 ]  - [   0.0000695500000000, -0.0001430200000000,  0.0000803800000000 ]  - [  -0.0001430200000000, -0.0000695500000000,  0.0000803800000000 ]  - [   0.0001430200000000,  0.0000695500000000,  0.0000803800000000 ]  - [  -0.0000695500000000,  0.0001430200000000,  0.0000803800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0044480800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001319200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001319200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000601900000000 ]- atom:   17  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0004283700000000, -0.0001256700000000, -0.0003107800000000 ]  - [   0.0004725200000000, -0.0000901600000000,  0.0000484100000000 ]  - [  -0.0002252700000000, -0.0001564100000000,  0.0000681700000000 ]  - [   0.0001842100000000, -0.0000173600000000,  0.0000873800000000 ]  - [   0.0006259600000000, -0.0001998500000000,  0.0004414200000000 ]  - [  -0.0005675300000000, -0.0000900700000000, -0.0009708700000000 ]  - [   0.0000269600000000, -0.0000362400000000, -0.0000023100000000 ]  - [   0.0000366400000000, -0.0003267100000000,  0.0000031100000000 ]  - [   0.0024615600000000, -0.0009413300000000, -0.0001872900000000 ]  - [   0.0010789100000000,  0.0009071700000000,  0.0015490700000000 ]  - [   0.0001285100000000,  0.0000824300000000, -0.0000229200000000 ]  - [  -0.0000778100000000, -0.0001923200000000,  0.0000667800000000 ]  - [  -0.0005621200000000,  0.0008607600000000,  0.0007207800000000 ]  - [   0.0004302700000000, -0.0000936800000000, -0.0000606500000000 ]  - [  -0.0001763500000000, -0.0001396900000000, -0.0000379100000000 ]  - [   0.0002024100000000,  0.0000113800000000, -0.0000411300000000 ]  - [  -0.0304008400000000,  0.0067320800000000, -0.0030263000000000 ]  - [   0.0012844600000000,  0.0000627300000000,  0.0000931900000000 ]  - [   0.0000115800000000,  0.0000626600000000, -0.0000786700000000 ]  - [   0.0006858800000000,  0.0004638000000000, -0.0001257400000000 ]  - [   0.0016435200000000,  0.0014495600000000, -0.0008263900000000 ]  - [   0.0016640100000000, -0.0003399300000000, -0.0005570700000000 ]  - [  -0.0001446900000000,  0.0000922700000000, -0.0002684500000000 ]  - [  -0.0001491100000000,  0.0004869000000000, -0.0000269100000000 ]  - [  -0.0007044800000000,  0.0003310100000000, -0.0000731500000000 ]  - [   0.0006953400000000, -0.0004840100000000, -0.0000462400000000 ]  - [  -0.0006975500000000, -0.0014518700000000, -0.0000940100000000 ]  - [   0.0006943500000000, -0.0000937900000000, -0.0000804400000000 ]  - [   0.0019432000000000, -0.0041260500000000, -0.0002422600000000 ]  - [   0.0033166000000000,  0.0012926400000000,  0.0010456400000000 ]  - [  -0.0000876000000000,  0.0012901300000000,  0.0003895100000000 ]  - [   0.0002861300000000, -0.0005154200000000, -0.0000938300000000 ]  - [   0.0007115100000000, -0.0003406100000000,  0.0002764000000000 ]  - [  -0.0000985100000000,  0.0004120900000000,  0.0000648900000000 ]  - [  -0.0000944000000000,  0.0010865400000000,  0.0000701300000000 ]  - [   0.0007096900000000, -0.0003382600000000,  0.0001340000000000 ]  - [  -0.0010117400000000,  0.0001344900000000,  0.0000348100000000 ]  - [   0.0002058300000000,  0.0003098900000000,  0.0000463200000000 ]  - [  -0.0014133200000000, -0.0006579300000000,  0.0002075000000000 ]  - [   0.0000826800000000,  0.0001616600000000,  0.0000895000000000 ]  - [  -0.0002388300000000, -0.0001323800000000,  0.0002003800000000 ]  - [   0.0012436700000000,  0.0006556800000000,  0.0001206400000000 ]  - [  -0.0001105900000000, -0.0003099500000000,  0.0000534000000000 ]  - [   0.0003647300000000, -0.0001620800000000,  0.0000400900000000 ]  - [  -0.0005897500000000,  0.0000420100000000,  0.0001608600000000 ]  - [   0.0008921600000000, -0.0003840000000000,  0.0003394900000000 ]  - [  -0.0002332000000000, -0.0003869500000000, -0.0000009200000000 ]  - [   0.0003866300000000, -0.0004456000000000,  0.0001240700000000 ]  - [   0.0000827700000000,  0.0001524300000000,  0.0001991000000000 ]  - [  -0.0002470000000000, -0.0002393000000000, -0.0000975200000000 ]  - [   0.0002821500000000, -0.0002386300000000,  0.0000071100000000 ]  - [  -0.0002721800000000,  0.0000553800000000,  0.0000075100000000 ]  - [   0.0002400500000000, -0.0000307100000000, -0.0000615500000000 ]  - [  -0.0001309900000000, -0.0000927400000000,  0.0000476200000000 ]  - [   0.0005961400000000,  0.0001808100000000, -0.0006688600000000 ]  - [  -0.0001062900000000, -0.0002003700000000,  0.0000068200000000 ]  - [  -0.0002400000000000, -0.0003264200000000,  0.0004148700000000 ]  - [  -0.0004186800000000,  0.0000449100000000, -0.0005357300000000 ]  - [  -0.0000063200000000,  0.0001911600000000,  0.0000116900000000 ]  - [  -0.0000960500000000,  0.0000510800000000, -0.0000709800000000 ]  - [   0.0002949700000000, -0.0001108500000000,  0.0000621000000000 ]  - [  -0.0002527400000000,  0.0000191200000000, -0.0000293300000000 ]  - [   0.0002004600000000,  0.0001799200000000,  0.0005132300000000 ]  - [  -0.0002125400000000, -0.0001461500000000,  0.0000078000000000 ]  - [  -0.0006079700000000, -0.0003601600000000, -0.0008145900000000 ]  - [  -0.0003092600000000, -0.0000592300000000,  0.0005074300000000 ]  - [   0.0000214800000000,  0.0001561000000000, -0.0000034700000000 ]  - [  -0.0000162500000000,  0.0000978500000000,  0.0001306700000000 ]  - [   0.0009852200000000, -0.0002309400000000,  0.0000484700000000 ]  - [  -0.0003379700000000,  0.0002269100000000, -0.0000871300000000 ]  - [   0.0002102100000000,  0.0002524800000000,  0.0000352900000000 ]  - [  -0.0001303900000000,  0.0001366600000000, -0.0001029900000000 ]  - [   0.0009096300000000, -0.0002796000000000, -0.0000918400000000 ]  - [  -0.0003916500000000,  0.0000635800000000,  0.0001389700000000 ]  - [   0.0001382600000000,  0.0001844700000000, -0.0000425000000000 ]  - [  -0.0001173800000000,  0.0000760900000000,  0.0001242700000000 ]  - [  -0.0000451100000000,  0.0004994300000000, -0.0006576100000000 ]  - [  -0.0001990500000000, -0.0002303400000000,  0.0002141400000000 ]  - [   0.0002699800000000, -0.0001319500000000,  0.0000156800000000 ]  - [  -0.0002223100000000,  0.0001348600000000,  0.0000142300000000 ]  - [  -0.0004075800000000,  0.0004886700000000, -0.0005434200000000 ]  - [  -0.0000903600000000, -0.0008194500000000,  0.0002877600000000 ]  - [  -0.0000951600000000, -0.0003249100000000, -0.0001658500000000 ]  - [  -0.0004491700000000,  0.0006139100000000,  0.0000411600000000 ]  - [   0.0045929800000000, -0.0042220400000000, -0.0053834200000000 ]  - [  -0.0005544700000000, -0.0000558200000000, -0.0001030200000000 ]  - [   0.0001770300000000, -0.0000945300000000,  0.0000940200000000 ]  - [  -0.0001473500000000,  0.0000770300000000, -0.0000042800000000 ]  - [   0.0048368200000000, -0.0033861500000000,  0.0053232300000000 ]  - [  -0.0007756300000000, -0.0002858600000000,  0.0000503900000000 ]  - [   0.0000956900000000, -0.0002129100000000, -0.0000916800000000 ]  - [  -0.0002483000000000, -0.0000709000000000, -0.0000564100000000 ]  - [   0.0057498900000000, -0.0001619300000000,  0.0050274200000000 ]  - [  -0.0010995600000000,  0.0001319700000000,  0.0004058000000000 ]  - [   0.0001127800000000, -0.0000484000000000, -0.0001521900000000 ]  - [  -0.0000964200000000,  0.0000418900000000,  0.0000183600000000 ]  - [   0.0006033700000000,  0.0001327500000000,  0.0002635600000000 ]  - [  -0.0006351600000000,  0.0000322200000000,  0.0003578200000000 ]  - [   0.0005513200000000,  0.0000027900000000, -0.0000291800000000 ]  - [  -0.0002486300000000, -0.0000526100000000, -0.0000306500000000 ]  - [   0.0014700900000000,  0.0005443900000000, -0.0020345900000000 ]  - [  -0.0003470000000000,  0.0000674600000000, -0.0002819100000000 ]  - [   0.0003012000000000, -0.0001052300000000,  0.0002041200000000 ]  - [   0.0000681800000000, -0.0000040300000000, -0.0000691100000000 ]  - [   0.0009485300000000, -0.0003940100000000, -0.0005783400000000 ]  - [  -0.0011286600000000,  0.0002620900000000, -0.0004049900000000 ]  - [   0.0003272600000000, -0.0000129900000000,  0.0001250500000000 ]  - [  -0.0003761200000000,  0.0000046200000000, -0.0000161800000000 ]  - [  -0.0002678300000000,  0.0006117600000000,  0.0004391800000000 ]  - [   0.0002366600000000, -0.0003692400000000, -0.0002055600000000 ]  - [  -0.0002515500000000, -0.0003256200000000,  0.0001138900000000 ]  - [  -0.0004248500000000,  0.0009130700000000,  0.0001371400000000 ]  - [   0.0004493900000000, -0.0001647100000000, -0.0001781000000000 ]  - [  -0.0003667800000000, -0.0000039200000000, -0.0000857500000000 ]  - [   0.0001911900000000,  0.0001341800000000, -0.0000877000000000 ]  - [  -0.0001548500000000,  0.0000112600000000, -0.0000650400000000 ]  - [  -0.0001632300000000,  0.0000041300000000,  0.0000514700000000 ]  - [   0.0001577300000000, -0.0001925200000000, -0.0000532100000000 ]  - [  -0.0001107800000000, -0.0000314000000000,  0.0000136500000000 ]  - [  -0.0000095100000000,  0.0002010100000000,  0.0000255800000000 ]  - [  -0.0008303700000000,  0.0004321500000000,  0.0002607900000000 ]  - [   0.0036029100000000,  0.0013761900000000, -0.0011653700000000 ]  - [  -0.0002210000000000, -0.0000646800000000,  0.0000970500000000 ]  - [   0.0000542100000000,  0.0001723700000000,  0.0001808600000000 ]  - [   0.0010357500000000,  0.0009504500000000, -0.0004168200000000 ]  - [  -0.0005703800000000,  0.0000670800000000, -0.0000390400000000 ]  - [   0.0005520400000000,  0.0001950900000000,  0.0001582300000000 ]  - [  -0.0003733800000000, -0.0004401000000000,  0.0000207600000000 ]- atom:   17  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0004275100000000,  0.0001247400000000,  0.0003336100000000 ]  - [  -0.0004738400000000,  0.0000888700000000, -0.0000241300000000 ]  - [   0.0002286400000000,  0.0001555900000000, -0.0000472800000000 ]  - [  -0.0001854100000000,  0.0000169700000000, -0.0000639300000000 ]  - [  -0.0006299800000000,  0.0002022300000000, -0.0004671500000000 ]  - [   0.0005645200000000,  0.0000869900000000,  0.0009439800000000 ]  - [  -0.0000265100000000,  0.0000350700000000, -0.0000204800000000 ]  - [  -0.0000372800000000,  0.0003260000000000, -0.0000248700000000 ]  - [  -0.0024782400000000,  0.0009473100000000,  0.0001656300000000 ]  - [  -0.0010642100000000, -0.0008971400000000, -0.0015495900000000 ]  - [  -0.0001289600000000, -0.0000821000000000,  0.0000004300000000 ]  - [   0.0000768500000000,  0.0001933000000000, -0.0000891200000000 ]  - [   0.0005657900000000, -0.0008608800000000, -0.0006970100000000 ]  - [  -0.0004307200000000,  0.0000926800000000,  0.0000824200000000 ]  - [   0.0001825200000000,  0.0001261900000000,  0.0000612300000000 ]  - [  -0.0002034800000000, -0.0000104300000000,  0.0000633000000000 ]  - [   0.0304926100000000, -0.0066457600000000,  0.0031292900000000 ]  - [  -0.0012445600000000, -0.0001050500000000, -0.0000952800000000 ]  - [   0.0000315500000000, -0.0001051100000000,  0.0000800400000000 ]  - [  -0.0006430600000000, -0.0005041100000000,  0.0001239700000000 ]  - [  -0.0016265100000000, -0.0014182100000000,  0.0008285300000000 ]  - [  -0.0016060200000000,  0.0003714400000000,  0.0005541900000000 ]  - [   0.0001909200000000, -0.0000498200000000,  0.0002683800000000 ]  - [   0.0001864800000000, -0.0004425600000000,  0.0000264700000000 ]  - [   0.0006457400000000, -0.0003803100000000,  0.0000772900000000 ]  - [  -0.0007347300000000,  0.0004455000000000,  0.0000456700000000 ]  - [   0.0006527200000000,  0.0014158300000000,  0.0000877200000000 ]  - [  -0.0007357500000000,  0.0000483700000000,  0.0000787000000000 ]  - [  -0.0019946100000000,  0.0042033500000000,  0.0002418300000000 ]  - [  -0.0033404500000000, -0.0012420100000000, -0.0010370100000000 ]  - [   0.0000474200000000, -0.0012445500000000, -0.0003865000000000 ]  - [  -0.0003271700000000,  0.0005532200000000,  0.0000928900000000 ]  - [  -0.0006673300000000,  0.0002975700000000, -0.0002790600000000 ]  - [   0.0001357400000000, -0.0004521500000000, -0.0000647100000000 ]  - [   0.0001398600000000, -0.0011354000000000, -0.0000697400000000 ]  - [  -0.0006691500000000,  0.0002998900000000, -0.0001345700000000 ]  - [   0.0010586800000000, -0.0000904100000000, -0.0000353600000000 ]  - [  -0.0001660400000000, -0.0002673600000000, -0.0000469400000000 ]  - [   0.0014548900000000,  0.0006990500000000, -0.0002060200000000 ]  - [  -0.0000411700000000, -0.0001191200000000, -0.0000901800000000 ]  - [   0.0002025000000000,  0.0000925200000000, -0.0002018300000000 ]  - [  -0.0012905100000000, -0.0007013000000000, -0.0001192000000000 ]  - [   0.0000704200000000,  0.0002672800000000, -0.0000535500000000 ]  - [  -0.0004081400000000,  0.0001188100000000, -0.0000401800000000 ]  - [   0.0005460200000000,  0.0000013800000000, -0.0001608000000000 ]  - [  -0.0009396600000000,  0.0004273200000000, -0.0003419000000000 ]  - [   0.0001907600000000,  0.0004243500000000, -0.0000014000000000 ]  - [  -0.0004299200000000,  0.0004890600000000, -0.0001235800000000 ]  - [  -0.0001256400000000, -0.0002610200000000, -0.0002403500000000 ]  - [   0.0002098600000000,  0.0001339500000000,  0.0000527400000000 ]  - [  -0.0003226300000000,  0.0001355600000000, -0.0000483200000000 ]  - [   0.0002348900000000, -0.0001593400000000, -0.0000485500000000 ]  - [  -0.0001336000000000, -0.0000053900000000,  0.0000237400000000 ]  - [   0.0002352600000000,  0.0000529400000000, -0.0000911500000000 ]  - [  -0.0004913100000000, -0.0002164900000000,  0.0006223500000000 ]  - [   0.0002113500000000,  0.0001634600000000, -0.0000485000000000 ]  - [   0.0001373800000000,  0.0003698100000000, -0.0004622900000000 ]  - [   0.0003115900000000, -0.0000051400000000,  0.0004915700000000 ]  - [  -0.0000993800000000, -0.0001539000000000, -0.0000533100000000 ]  - [  -0.0000071800000000, -0.0000126400000000,  0.0000293400000000 ]  - [  -0.0003300200000000,  0.0002137700000000, -0.0000213700000000 ]  - [   0.0002158100000000,  0.0000828700000000,  0.0000717600000000 ]  - [  -0.0002383900000000, -0.0000742300000000, -0.0004693400000000 ]  - [   0.0001760500000000,  0.0002514700000000,  0.0000344900000000 ]  - [   0.0006526700000000,  0.0002633400000000,  0.0008681900000000 ]  - [   0.0003461100000000, -0.0000422200000000, -0.0004653800000000 ]  - [   0.0000154900000000, -0.0002606300000000,  0.0000446900000000 ]  - [   0.0000552600000000, -0.0002018400000000, -0.0000892300000000 ]  - [  -0.0009498900000000,  0.0003324500000000, -0.0000851400000000 ]  - [   0.0003780300000000, -0.0001228800000000,  0.0000438300000000 ]  - [  -0.0001729800000000, -0.0001474700000000, -0.0000772600000000 ]  - [   0.0001683300000000, -0.0000324400000000,  0.0000615600000000 ]  - [  -0.0010157000000000,  0.0002402600000000,  0.0001279400000000 ]  - [   0.0002892300000000, -0.0001009900000000, -0.0000970800000000 ]  - [  -0.0002432400000000, -0.0002209000000000,  0.0000838700000000 ]  - [   0.0000137000000000, -0.0001137100000000, -0.0000826000000000 ]  - [   0.0001466500000000, -0.0004695600000000,  0.0007050500000000 ]  - [   0.0003026000000000,  0.0002671100000000, -0.0001697900000000 ]  - [  -0.0001677700000000,  0.0001713400000000,  0.0000255200000000 ]  - [   0.0003268400000000, -0.0000971200000000,  0.0000269000000000 ]  - [   0.0003014500000000, -0.0005273400000000,  0.0005049100000000 ]  - [  -0.0000132500000000,  0.0007693900000000, -0.0003274700000000 ]  - [  -0.0000120700000000,  0.0002886100000000,  0.0001248300000000 ]  - [   0.0003469600000000, -0.0006511200000000, -0.0000811600000000 ]  - [  -0.0044414200000000,  0.0041422000000000,  0.0052296200000000 ]  - [   0.0006595200000000,  0.0000948300000000,  0.0000640100000000 ]  - [  -0.0000717800000000,  0.0001353300000000, -0.0001367600000000 ]  - [   0.0002506000000000, -0.0000396100000000, -0.0000374200000000 ]  - [  -0.0047715700000000,  0.0031602100000000, -0.0051323700000000 ]  - [   0.0007404800000000,  0.0001851500000000, -0.0000110000000000 ]  - [  -0.0001328400000000,  0.0001113000000000,  0.0001327100000000 ]  - [   0.0002096200000000, -0.0000337900000000,  0.0000987200000000 ]  - [  -0.0060274000000000,  0.0002617300000000, -0.0052927900000000 ]  - [   0.0010546000000000, -0.0000253000000000, -0.0004417700000000 ]  - [  -0.0001548500000000,  0.0001539800000000,  0.0001096900000000 ]  - [   0.0000589400000000,  0.0000620800000000, -0.0000607300000000 ]  - [  -0.0005724000000000, -0.0002220200000000, -0.0003089700000000 ]  - [   0.0006724500000000, -0.0001355800000000, -0.0003962100000000 ]  - [  -0.0005139100000000, -0.0001057100000000, -0.0000137900000000 ]  - [   0.0002874500000000, -0.0000507600000000, -0.0000095300000000 ]  - [  -0.0014801600000000, -0.0005734800000000,  0.0021812500000000 ]  - [   0.0004535500000000, -0.0001023900000000,  0.0003210000000000 ]  - [  -0.0001991300000000,  0.0000679600000000, -0.0001622000000000 ]  - [   0.0000365900000000, -0.0000339600000000,  0.0001111200000000 ]  - [  -0.0010479400000000,  0.0004331200000000,  0.0006140800000000 ]  - [   0.0010246300000000, -0.0002243300000000,  0.0004470800000000 ]  - [  -0.0004338400000000,  0.0000521800000000, -0.0000822500000000 ]  - [   0.0002736600000000,  0.0000347600000000,  0.0000567100000000 ]  - [   0.0003027500000000, -0.0005080500000000, -0.0003995700000000 ]  - [  -0.0001930400000000,  0.0004700900000000,  0.0002465100000000 ]  - [   0.0002876500000000,  0.0004308000000000, -0.0000723100000000 ]  - [   0.0004622700000000, -0.0008063500000000, -0.0000966200000000 ]  - [  -0.0004511900000000,  0.0001655000000000,  0.0000776000000000 ]  - [   0.0003684200000000,  0.0000045300000000, -0.0000139100000000 ]  - [  -0.0001926800000000, -0.0001346600000000, -0.0000124000000000 ]  - [   0.0001559500000000, -0.0000113700000000, -0.0000349000000000 ]  - [   0.0001626400000000, -0.0000053200000000,  0.0000482900000000 ]  - [  -0.0001570300000000,  0.0001919800000000,  0.0001548200000000 ]  - [   0.0001109700000000,  0.0000324300000000,  0.0000869000000000 ]  - [   0.0000099100000000, -0.0002004200000000,  0.0000744900000000 ]  - [   0.0008302300000000, -0.0004370300000000, -0.0001603500000000 ]  - [  -0.0034084200000000, -0.0012788500000000,  0.0012146600000000 ]  - [   0.0002192700000000,  0.0000662000000000,  0.0000035100000000 ]  - [  -0.0000519200000000, -0.0001729400000000, -0.0000790100000000 ]  - [  -0.0010374300000000, -0.0009909500000000,  0.0003237700000000 ]  - [   0.0005695800000000, -0.0000641900000000, -0.0000607500000000 ]  - [  -0.0005576200000000, -0.0001917700000000, -0.0002597100000000 ]  - [   0.0003736200000000,  0.0004354300000000, -0.0001204700000000 ]- atom:   17  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0000636000000000,  0.0000486500000000, -0.0001668400000000 ]  - [   0.0003356200000000, -0.0000670400000000, -0.0000174000000000 ]  - [  -0.0001318600000000,  0.0005014600000000,  0.0002291900000000 ]  - [   0.0000230200000000, -0.0000326900000000, -0.0000141400000000 ]  - [   0.0004969200000000, -0.0001303900000000,  0.0002050200000000 ]  - [   0.0000506200000000, -0.0000631700000000, -0.0001811400000000 ]  - [  -0.0000326500000000,  0.0000220500000000, -0.0000364700000000 ]  - [  -0.0000659600000000,  0.0003332500000000, -0.0000390900000000 ]  - [  -0.0018515800000000,  0.0006750700000000, -0.0001024100000000 ]  - [   0.0013440900000000,  0.0006588600000000,  0.0004504500000000 ]  - [  -0.0000136400000000,  0.0000477400000000, -0.0000113100000000 ]  - [  -0.0001045300000000, -0.0001327700000000, -0.0001260800000000 ]  - [   0.0006525600000000,  0.0013302200000000,  0.0004652100000000 ]  - [  -0.0001312100000000, -0.0001040700000000, -0.0001035100000000 ]  - [   0.0006714100000000, -0.0018417600000000, -0.0000803300000000 ]  - [   0.0000476300000000, -0.0000132700000000,  0.0000116200000000 ]  - [  -0.0030860300000000, -0.0030694100000000, -0.0261139700000000 ]  - [   0.0001165400000000, -0.0001006200000000,  0.0000094500000000 ]  - [  -0.0000580700000000,  0.0000718700000000,  0.0000086500000000 ]  - [  -0.0001021800000000, -0.0001475500000000,  0.0002693200000000 ]  - [   0.0005819100000000, -0.0000693700000000, -0.0013278600000000 ]  - [   0.0008493100000000, -0.0000491400000000, -0.0013300000000000 ]  - [   0.0000478900000000, -0.0000576700000000,  0.0000489300000000 ]  - [   0.0002905800000000, -0.0000250600000000,  0.0000482000000000 ]  - [  -0.0001123200000000,  0.0005293100000000, -0.0013291800000000 ]  - [  -0.0001014600000000,  0.0000055000000000,  0.0000489200000000 ]  - [  -0.0001012600000000,  0.0008055900000000, -0.0013269600000000 ]  - [  -0.0000668700000000,  0.0002462500000000,  0.0000496600000000 ]  - [   0.0002283600000000,  0.0002556800000000, -0.0009061100000000 ]  - [  -0.0010706400000000, -0.0003681200000000, -0.0000384900000000 ]  - [  -0.0004078600000000, -0.0010120000000000, -0.0000298100000000 ]  - [   0.0000744800000000,  0.0001122100000000, -0.0004998300000000 ]  - [  -0.0001122100000000, -0.0001562900000000,  0.0010725300000000 ]  - [  -0.0000488600000000, -0.0000853800000000,  0.0004016600000000 ]  - [  -0.0000441900000000, -0.0000909700000000,  0.0004011100000000 ]  - [  -0.0002583800000000, -0.0002970400000000,  0.0010725200000000 ]  - [   0.0000565500000000, -0.0001762200000000,  0.0010216100000000 ]  - [   0.0000671300000000, -0.0000320800000000, -0.0000949900000000 ]  - [   0.0002257700000000, -0.0001001400000000,  0.0014147200000000 ]  - [   0.0001108900000000, -0.0000192100000000, -0.0000444900000000 ]  - [  -0.0002259100000000,  0.0000136300000000,  0.0010238700000000 ]  - [  -0.0001397300000000,  0.0001877400000000,  0.0014135200000000 ]  - [  -0.0000747500000000,  0.0000260700000000, -0.0000954400000000 ]  - [  -0.0000610600000000,  0.0000687400000000, -0.0000447400000000 ]  - [   0.0001428600000000,  0.0001787500000000,  0.0015542900000000 ]  - [   0.0003204200000000,  0.0000210300000000,  0.0003255100000000 ]  - [  -0.0000205900000000,  0.0003609100000000,  0.0003255500000000 ]  - [   0.0001037700000000,  0.0001438700000000,  0.0000100500000000 ]  - [   0.0004202300000000, -0.0003374000000000, -0.0009163000000000 ]  - [  -0.0000839400000000,  0.0000035700000000, -0.0001104900000000 ]  - [  -0.0000377200000000,  0.0000874400000000, -0.0000528900000000 ]  - [   0.0000612400000000, -0.0000571400000000, -0.0000159100000000 ]  - [  -0.0001802800000000, -0.0003804200000000, -0.0006879800000000 ]  - [   0.0000145100000000, -0.0000274800000000, -0.0000631600000000 ]  - [   0.0003517800000000,  0.0002853600000000, -0.0009903700000000 ]  - [   0.0000179500000000, -0.0000207200000000, -0.0000481900000000 ]  - [   0.0001231500000000,  0.0002054700000000, -0.0003999000000000 ]  - [  -0.0002964100000000, -0.0000504400000000, -0.0009654500000000 ]  - [   0.0001098600000000,  0.0000438200000000, -0.0000723400000000 ]  - [  -0.0001256900000000, -0.0000376200000000, -0.0000236600000000 ]  - [   0.0001649700000000,  0.0002250300000000, -0.0003567100000000 ]  - [   0.0000063100000000,  0.0002129300000000, -0.0000304500000000 ]  - [  -0.0000879200000000, -0.0001874900000000, -0.0009173800000000 ]  - [  -0.0000752600000000, -0.0000214600000000,  0.0000177800000000 ]  - [  -0.0003379500000000, -0.0002791000000000, -0.0006410900000000 ]  - [   0.0003180200000000,  0.0002461300000000, -0.0009423500000000 ]  - [   0.0000112900000000, -0.0000893000000000, -0.0000223800000000 ]  - [   0.0000172900000000, -0.0000853400000000, -0.0000060700000000 ]  - [   0.0001388300000000,  0.0001449500000000, -0.0012590000000000 ]  - [   0.0000324500000000, -0.0000095400000000, -0.0001255400000000 ]  - [   0.0000235200000000, -0.0001758900000000, -0.0000524600000000 ]  - [  -0.0000141800000000,  0.0000334500000000, -0.0000099500000000 ]  - [   0.0000380200000000,  0.0001012700000000, -0.0012199500000000 ]  - [  -0.0002800000000000, -0.0000146000000000, -0.0000113500000000 ]  - [  -0.0001133600000000, -0.0000050800000000, -0.0000845900000000 ]  - [  -0.0000705000000000, -0.0000517500000000,  0.0000314800000000 ]  - [  -0.0002308900000000,  0.0004517300000000, -0.0008681200000000 ]  - [   0.0001918100000000, -0.0000002600000000, -0.0000123600000000 ]  - [   0.0001080500000000, -0.0000451300000000, -0.0000696100000000 ]  - [   0.0000458100000000,  0.0000996300000000,  0.0000261800000000 ]  - [  -0.0002515100000000, -0.0000291100000000,  0.0000973000000000 ]  - [  -0.0002665800000000,  0.0001213300000000, -0.0001010400000000 ]  - [  -0.0002494100000000, -0.0001493600000000,  0.0001896900000000 ]  - [   0.0007450200000000, -0.0005042700000000,  0.0004023700000000 ]  - [  -0.0037084700000000,  0.0044000800000000,  0.0069516900000000 ]  - [  -0.0000135400000000,  0.0000124800000000, -0.0000347900000000 ]  - [   0.0003767800000000,  0.0000971700000000,  0.0000321000000000 ]  - [   0.0001282400000000,  0.0000769700000000, -0.0000558900000000 ]  - [   0.0045274500000000, -0.0039580500000000,  0.0071340200000000 ]  - [   0.0000570900000000,  0.0002719600000000,  0.0000755000000000 ]  - [  -0.0000260700000000, -0.0001165200000000,  0.0000082700000000 ]  - [   0.0000394800000000,  0.0000241400000000, -0.0000145500000000 ]  - [   0.0042058900000000, -0.0000173200000000,  0.0051378000000000 ]  - [  -0.0001955300000000, -0.0001014700000000,  0.0000283300000000 ]  - [  -0.0002319000000000,  0.0004640500000000,  0.0001936500000000 ]  - [  -0.0000417400000000,  0.0000830500000000, -0.0000519500000000 ]  - [  -0.0000295500000000, -0.0008056900000000,  0.0026900400000000 ]  - [   0.0000601800000000, -0.0001278000000000, -0.0001549000000000 ]  - [   0.0000115900000000, -0.0003213900000000,  0.0001277800000000 ]  - [   0.0000021700000000, -0.0001462400000000, -0.0000622100000000 ]  - [  -0.0007771100000000, -0.0000629000000000,  0.0027796300000000 ]  - [  -0.0002163800000000, -0.0000274200000000,  0.0001714400000000 ]  - [  -0.0000233800000000,  0.0000219200000000, -0.0001107000000000 ]  - [  -0.0000423000000000, -0.0000330000000000, -0.0000197300000000 ]  - [  -0.0001187500000000,  0.0044163200000000,  0.0052786800000000 ]  - [   0.0003615300000000, -0.0001949200000000,  0.0002379900000000 ]  - [  -0.0002023600000000, -0.0001604300000000,  0.0000713600000000 ]  - [  -0.0000223300000000, -0.0000029400000000, -0.0000103200000000 ]  - [   0.0000076800000000, -0.0001457300000000,  0.0001422200000000 ]  - [  -0.0001115100000000, -0.0001436900000000,  0.0002328700000000 ]  - [   0.0001565900000000, -0.0001633800000000, -0.0000576400000000 ]  - [  -0.0004706300000000,  0.0008548900000000,  0.0004507500000000 ]  - [   0.0000281700000000, -0.0000263100000000, -0.0003112300000000 ]  - [  -0.0000203000000000, -0.0000664200000000, -0.0000422500000000 ]  - [   0.0000194400000000,  0.0000825200000000, -0.0002573400000000 ]  - [  -0.0000165200000000, -0.0000193300000000,  0.0000238700000000 ]  - [   0.0000836800000000,  0.0000189400000000, -0.0001570700000000 ]  - [  -0.0000283000000000,  0.0000274400000000, -0.0002124100000000 ]  - [  -0.0000189200000000, -0.0000160600000000,  0.0001236500000000 ]  - [  -0.0000665500000000, -0.0000199900000000,  0.0000574600000000 ]  - [  -0.0003228000000000,  0.0001831700000000,  0.0004086100000000 ]  - [  -0.0012979500000000, -0.0007898600000000,  0.0010043300000000 ]  - [   0.0001058300000000,  0.0000349500000000, -0.0001029800000000 ]  - [  -0.0000943600000000, -0.0000880200000000, -0.0000553500000000 ]  - [  -0.0007970000000000, -0.0013100100000000,  0.0008889800000000 ]  - [  -0.0000873700000000, -0.0000928000000000, -0.0001553700000000 ]  - [   0.0001854800000000, -0.0003249200000000,  0.0003101100000000 ]  - [   0.0000348800000000,  0.0001062300000000, -0.0002031400000000 ]- atom:   49  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0002783900000000,  0.0003676700000000,  0.0000036600000000 ]  - [  -0.0001103500000000, -0.0000602800000000,  0.0000082300000000 ]  - [   0.0014329700000000,  0.0017700000000000, -0.0002574000000000 ]  - [  -0.0003531700000000,  0.0000603700000000,  0.0000076700000000 ]  - [   0.0002116000000000, -0.0001513300000000,  0.0004773900000000 ]  - [  -0.0003729800000000,  0.0001206500000000, -0.0002743300000000 ]  - [  -0.0000699700000000,  0.0002768900000000,  0.0000128700000000 ]  - [  -0.0000335800000000, -0.0000205100000000, -0.0000191800000000 ]  - [   0.0001574900000000, -0.0000958100000000, -0.0003196200000000 ]  - [  -0.0002530200000000,  0.0000880300000000,  0.0002213600000000 ]  - [   0.0000388400000000,  0.0000811700000000, -0.0000484700000000 ]  - [  -0.0000851900000000, -0.0000604900000000, -0.0000053400000000 ]  - [   0.0001188700000000,  0.0000692200000000,  0.0000406900000000 ]  - [  -0.0000577300000000,  0.0000128800000000,  0.0000113900000000 ]  - [   0.0001201000000000, -0.0000048400000000, -0.0000500500000000 ]  - [  -0.0002525700000000,  0.0000209500000000,  0.0000688600000000 ]  - [   0.0001289900000000,  0.0004643400000000,  0.0004341100000000 ]  - [  -0.0002063400000000, -0.0001718100000000, -0.0000638800000000 ]  - [   0.0003247800000000, -0.0002693400000000, -0.0000184900000000 ]  - [  -0.0002322400000000,  0.0000951000000000,  0.0000801200000000 ]  - [   0.0002363000000000, -0.0000069100000000,  0.0000634700000000 ]  - [  -0.0001734000000000, -0.0000100300000000,  0.0000565500000000 ]  - [   0.0003340200000000,  0.0003700200000000, -0.0001859400000000 ]  - [  -0.0002136500000000, -0.0001512300000000, -0.0000247700000000 ]  - [  -0.0003480400000000, -0.0002195700000000,  0.0003014400000000 ]  - [  -0.0006530000000000, -0.0000097200000000, -0.0003601800000000 ]  - [  -0.0000562700000000,  0.0001607900000000, -0.0000020100000000 ]  - [  -0.0000185200000000,  0.0000506000000000, -0.0000074000000000 ]  - [   0.0009466200000000, -0.0002375200000000, -0.0001194500000000 ]  - [  -0.0003801500000000,  0.0002239500000000, -0.0000131100000000 ]  - [   0.0001705300000000,  0.0001025000000000, -0.0000045300000000 ]  - [  -0.0001709700000000,  0.0001157100000000,  0.0000327400000000 ]  - [   0.0047744500000000, -0.0041343100000000, -0.0043775800000000 ]  - [  -0.0007371900000000, -0.0001358600000000, -0.0000772600000000 ]  - [   0.0001361300000000, -0.0000966900000000,  0.0000067700000000 ]  - [  -0.0002066900000000,  0.0000381000000000, -0.0000579300000000 ]  - [   0.0060370300000000,  0.0004373600000000,  0.0044295300000000 ]  - [  -0.0010520200000000,  0.0000521400000000, -0.0001787600000000 ]  - [   0.0001571700000000, -0.0002224700000000, -0.0002125200000000 ]  - [  -0.0000568000000000,  0.0000367000000000, -0.0000224200000000 ]  - [   0.0005669000000000, -0.0005839500000000,  0.0000514800000000 ]  - [  -0.0006742200000000,  0.0000653200000000, -0.0000410100000000 ]  - [   0.0005123900000000, -0.0001084300000000,  0.0000076800000000 ]  - [  -0.0002885500000000, -0.0000364900000000,  0.0000155900000000 ]  - [  -0.0004671500000000,  0.0006554700000000, -0.0004884200000000 ]  - [  -0.0002894400000000, -0.0007680500000000,  0.0001381100000000 ]  - [   0.0001929900000000, -0.0002875000000000, -0.0001311000000000 ]  - [  -0.0003078100000000,  0.0005283800000000, -0.0000114900000000 ]  - [  -0.0202099900000000,  0.0032113900000000,  0.0013797000000000 ]  - [   0.0003751300000000, -0.0000551800000000,  0.0000256300000000 ]  - [  -0.0001134800000000, -0.0000718500000000,  0.0000545200000000 ]  - [   0.0000756600000000, -0.0000282400000000, -0.0000607500000000 ]  - [   0.0019578300000000,  0.0011319400000000, -0.0004948300000000 ]  - [   0.0008307400000000, -0.0003010800000000,  0.0001191800000000 ]  - [   0.0000858700000000, -0.0001435900000000, -0.0000678400000000 ]  - [   0.0000431100000000,  0.0001005000000000,  0.0000905300000000 ]  - [  -0.0001481300000000,  0.0003037000000000,  0.0000515800000000 ]  - [   0.0001130300000000, -0.0001013600000000, -0.0000680000000000 ]  - [  -0.0005517300000000, -0.0011238400000000,  0.0005162900000000 ]  - [   0.0001677000000000,  0.0001433300000000, -0.0000220500000000 ]  - [   0.0009686800000000,  0.0011071600000000,  0.0007461400000000 ]  - [   0.0009676400000000,  0.0001466600000000, -0.0004318400000000 ]  - [  -0.0000081600000000, -0.0000705400000000,  0.0000635100000000 ]  - [  -0.0000072100000000,  0.0001148300000000,  0.0000236600000000 ]  - [  -0.0000621900000000,  0.0000266600000000, -0.0000458600000000 ]  - [   0.0001986500000000, -0.0000963000000000,  0.0000010900000000 ]  - [  -0.0000655200000000, -0.0010436000000000, -0.0001991600000000 ]  - [   0.0001985700000000,  0.0001294800000000, -0.0000668100000000 ]  - [   0.0016352300000000, -0.0041381600000000,  0.0001203100000000 ]  - [   0.0003325100000000,  0.0001858300000000,  0.0000343200000000 ]  - [   0.0000429300000000,  0.0005048700000000,  0.0001674000000000 ]  - [   0.0002046100000000, -0.0000872600000000,  0.0000289000000000 ]  - [  -0.0003028600000000, -0.0013431500000000,  0.0009173800000000 ]  - [   0.0001361000000000,  0.0000754200000000, -0.0000453900000000 ]  - [  -0.0002167100000000,  0.0000763600000000,  0.0000571000000000 ]  - [   0.0001045500000000, -0.0001381000000000, -0.0000699700000000 ]  - [  -0.0019892000000000,  0.0005208700000000, -0.0007780700000000 ]  - [   0.0004347800000000,  0.0000268200000000, -0.0000177300000000 ]  - [  -0.0000459400000000,  0.0000276900000000,  0.0000701500000000 ]  - [   0.0001349000000000,  0.0000116800000000,  0.0000372900000000 ]  - [  -0.0002558100000000,  0.0000645500000000, -0.0001617200000000 ]  - [   0.0001536900000000, -0.0000755300000000,  0.0001409200000000 ]  - [  -0.0001262500000000, -0.0000742900000000, -0.0000883700000000 ]  - [   0.0000194700000000, -0.0000832500000000,  0.0000132700000000 ]  - [   0.0001565300000000, -0.0000988000000000,  0.0000498100000000 ]  - [   0.0000320400000000,  0.0000851300000000, -0.0000796000000000 ]  - [  -0.0000330800000000,  0.0001711100000000,  0.0001432200000000 ]  - [   0.0001172000000000, -0.0000997600000000, -0.0001294000000000 ]  - [   0.0000692500000000, -0.0001703500000000, -0.0000175200000000 ]  - [   0.0000268800000000,  0.0002033900000000,  0.0001605900000000 ]  - [   0.0000260300000000,  0.0000949200000000, -0.0001137800000000 ]  - [   0.0000694100000000, -0.0001695200000000,  0.0001269900000000 ]  - [  -0.0002320400000000,  0.0001473900000000, -0.0000027000000000 ]  - [   0.0001157000000000,  0.0000816100000000, -0.0000096700000000 ]  - [  -0.0002860200000000,  0.0000298200000000, -0.0000790500000000 ]  - [   0.0001074100000000,  0.0000903200000000, -0.0000414600000000 ]  - [  -0.0002178300000000, -0.0001773600000000,  0.0000550600000000 ]  - [   0.0002968500000000,  0.0001006200000000, -0.0001088700000000 ]  - [  -0.0000285400000000, -0.0000557500000000, -0.0000377500000000 ]  - [   0.0000848700000000, -0.0000953000000000, -0.0000405100000000 ]  - [  -0.0009268100000000,  0.0002021000000000,  0.0001096600000000 ]  - [   0.0001696300000000, -0.0000088500000000,  0.0000543600000000 ]  - [  -0.0002090300000000, -0.0000549700000000,  0.0000079000000000 ]  - [   0.0001582200000000,  0.0000217400000000,  0.0000290700000000 ]  - [   0.0017772700000000, -0.0001980100000000, -0.0028903000000000 ]  - [   0.0003235400000000,  0.0000556600000000,  0.0001503300000000 ]  - [  -0.0000621200000000,  0.0000092900000000,  0.0000130200000000 ]  - [  -0.0000179600000000, -0.0000214100000000,  0.0000086700000000 ]  - [   0.0005448000000000, -0.0008665400000000,  0.0022239000000000 ]  - [   0.0002262600000000,  0.0000380600000000, -0.0000767500000000 ]  - [  -0.0000452100000000,  0.0000295100000000,  0.0000514000000000 ]  - [   0.0000926800000000,  0.0000042200000000,  0.0000215000000000 ]  - [  -0.0002634600000000,  0.0000782300000000,  0.0000076500000000 ]  - [   0.0002327800000000,  0.0000066100000000, -0.0000597000000000 ]  - [  -0.0013151500000000,  0.0011335200000000,  0.0008720400000000 ]  - [   0.0003405200000000, -0.0001239800000000, -0.0000083500000000 ]  - [   0.0038264400000000,  0.0026423900000000, -0.0013220700000000 ]  - [   0.0010382800000000, -0.0003645400000000, -0.0001434600000000 ]  - [  -0.0000591500000000, -0.0000968900000000,  0.0001025200000000 ]  - [   0.0000738300000000,  0.0000766100000000,  0.0000631100000000 ]  - [  -0.0000950300000000,  0.0001023000000000,  0.0002904600000000 ]  - [   0.0000905900000000, -0.0000294900000000,  0.0000131500000000 ]  - [  -0.0000344700000000, -0.0000836600000000,  0.0000089600000000 ]  - [   0.0000559900000000,  0.0000226800000000,  0.0000655300000000 ]  - [  -0.0001010500000000, -0.0001179700000000, -0.0000586700000000 ]  - [   0.0001029900000000, -0.0000019800000000, -0.0000480700000000 ]  - [  -0.0002712300000000,  0.0000728600000000, -0.0004403700000000 ]  - [   0.0002084700000000, -0.0000205300000000, -0.0000584300000000 ]- atom:   49  displacement:    [  -0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [  -0.0002757700000000, -0.0003654600000000,  0.0000198300000000 ]  - [   0.0001111000000000,  0.0000600600000000,  0.0000152400000000 ]  - [  -0.0014330400000000, -0.0017451500000000,  0.0002791000000000 ]  - [   0.0003547900000000, -0.0000616700000000,  0.0000154800000000 ]  - [  -0.0002083000000000,  0.0001522400000000, -0.0005067100000000 ]  - [   0.0003768100000000, -0.0001217800000000,  0.0002521800000000 ]  - [   0.0000699200000000, -0.0002769500000000, -0.0000364900000000 ]  - [   0.0000342600000000,  0.0000199800000000, -0.0000040000000000 ]  - [  -0.0001707800000000,  0.0000919500000000,  0.0002915500000000 ]  - [   0.0002530500000000, -0.0000871400000000, -0.0002423000000000 ]  - [  -0.0000389000000000, -0.0000809200000000,  0.0000264700000000 ]  - [   0.0000851700000000,  0.0000608300000000, -0.0000173200000000 ]  - [  -0.0001184700000000, -0.0000687300000000, -0.0000177400000000 ]  - [   0.0000561100000000, -0.0000127400000000,  0.0000108800000000 ]  - [  -0.0001200600000000,  0.0000060200000000,  0.0000721800000000 ]  - [   0.0002517000000000, -0.0000204300000000, -0.0000463300000000 ]  - [  -0.0000794300000000, -0.0005044900000000, -0.0004381000000000 ]  - [   0.0002498500000000,  0.0001313200000000,  0.0000649900000000 ]  - [  -0.0002801900000000,  0.0002280100000000,  0.0000197600000000 ]  - [   0.0002751500000000, -0.0001365500000000, -0.0000800800000000 ]  - [  -0.0002025900000000,  0.0000428500000000, -0.0000746600000000 ]  - [   0.0002150000000000,  0.0000533700000000, -0.0000566400000000 ]  - [  -0.0002910800000000, -0.0003259600000000,  0.0001847700000000 ]  - [   0.0002548000000000,  0.0001940800000000,  0.0000250300000000 ]  - [   0.0003066300000000,  0.0001773200000000, -0.0003020000000000 ]  - [   0.0006074000000000, -0.0000348600000000,  0.0003583000000000 ]  - [   0.0000156600000000, -0.0002032700000000,  0.0000016300000000 ]  - [  -0.0000243400000000, -0.0000948900000000,  0.0000087200000000 ]  - [  -0.0009881200000000,  0.0002821900000000,  0.0001203400000000 ]  - [   0.0003362000000000, -0.0001815100000000,  0.0000144800000000 ]  - [  -0.0002123800000000, -0.0000621500000000,  0.0000047800000000 ]  - [   0.0001278400000000, -0.0000741800000000, -0.0000333700000000 ]  - [  -0.0048344100000000,  0.0042304400000000,  0.0045493100000000 ]  - [   0.0007787400000000,  0.0000939700000000,  0.0000769400000000 ]  - [  -0.0000924800000000,  0.0000542100000000, -0.0000067600000000 ]  - [   0.0002507700000000, -0.0000782700000000,  0.0000588600000000 ]  - [  -0.0057412200000000, -0.0003898500000000, -0.0041933900000000 ]  - [   0.0011023300000000, -0.0000131200000000,  0.0001773500000000 ]  - [  -0.0001118300000000,  0.0002639100000000,  0.0002146400000000 ]  - [   0.0000977300000000,  0.0000065800000000,  0.0000223100000000 ]  - [  -0.0006094500000000,  0.0005343900000000, -0.0000410400000000 ]  - [   0.0006329500000000, -0.0001078800000000,  0.0000410000000000 ]  - [  -0.0005528200000000,  0.0000612200000000, -0.0000083800000000 ]  - [   0.0002470800000000, -0.0000067900000000, -0.0000149900000000 ]  - [   0.0004195500000000, -0.0006093300000000,  0.0004865200000000 ]  - [   0.0002492500000000,  0.0008204500000000, -0.0001399200000000 ]  - [  -0.0002371100000000,  0.0003258200000000,  0.0001301000000000 ]  - [   0.0002622100000000, -0.0004876200000000,  0.0000097300000000 ]  - [   0.0199672500000000, -0.0034121100000000, -0.0017825200000000 ]  - [  -0.0004136400000000, -0.0000497400000000, -0.0000692500000000 ]  - [   0.0000756900000000, -0.0000322300000000, -0.0000961500000000 ]  - [  -0.0001130100000000, -0.0000764200000000,  0.0000186400000000 ]  - [  -0.0018312200000000, -0.0011550400000000,  0.0004518900000000 ]  - [  -0.0007317600000000,  0.0002667200000000, -0.0001595800000000 ]  - [   0.0000185800000000,  0.0001040700000000,  0.0000262500000000 ]  - [   0.0000621200000000, -0.0001398400000000, -0.0001338000000000 ]  - [   0.0000476300000000, -0.0002642400000000, -0.0000921300000000 ]  - [  -0.0002166400000000,  0.0001387000000000,  0.0000257400000000 ]  - [   0.0004494700000000,  0.0011632600000000, -0.0005578600000000 ]  - [  -0.0002705400000000, -0.0001045400000000, -0.0000196800000000 ]  - [  -0.0010000300000000, -0.0010030600000000, -0.0007018600000000 ]  - [  -0.0010010500000000, -0.0000388900000000,  0.0004754900000000 ]  - [  -0.0000293100000000,  0.0001728400000000, -0.0000212100000000 ]  - [  -0.0000283900000000, -0.0000118100000000,  0.0000194700000000 ]  - [   0.0001064100000000, -0.0001297200000000,  0.0000872600000000 ]  - [  -0.0001605600000000, -0.0000069300000000,  0.0000411000000000 ]  - [   0.0001030900000000,  0.0009383100000000,  0.0002421900000000 ]  - [  -0.0001606600000000, -0.0002336900000000,  0.0001096200000000 ]  - [  -0.0015857000000000,  0.0041837000000000, -0.0001619600000000 ]  - [  -0.0002954300000000, -0.0000818400000000, -0.0000769600000000 ]  - [  -0.0000044100000000, -0.0004015900000000, -0.0002118400000000 ]  - [  -0.0001660400000000,  0.0001916200000000, -0.0000702600000000 ]  - [   0.0001994000000000,  0.0013000500000000, -0.0008736100000000 ]  - [  -0.0002397300000000, -0.0001135000000000,  0.0000887300000000 ]  - [   0.0001135300000000, -0.0001125700000000, -0.0000150700000000 ]  - [  -0.0002075900000000,  0.0001008200000000,  0.0001112200000000 ]  - [   0.0020928800000000, -0.0004853700000000,  0.0008069000000000 ]  - [  -0.0003313400000000,  0.0000104000000000,  0.0000609100000000 ]  - [   0.0001499700000000,  0.0000112700000000, -0.0000279000000000 ]  - [  -0.0000307200000000,  0.0000256400000000,  0.0000045300000000 ]  - [   0.0001519100000000, -0.0001021200000000,  0.0001200700000000 ]  - [  -0.0002571200000000,  0.0000375500000000, -0.0001828500000000 ]  - [   0.0000216700000000,  0.0000387700000000,  0.0000463200000000 ]  - [  -0.0001212700000000,  0.0000446300000000, -0.0000547600000000 ]  - [  -0.0000526000000000,  0.0001367700000000, -0.0000907300000000 ]  - [   0.0000746500000000, -0.0000481300000000,  0.0000370000000000 ]  - [   0.0001376200000000, -0.0001338100000000, -0.0001855900000000 ]  - [  -0.0000129300000000,  0.0001358200000000,  0.0000878400000000 ]  - [  -0.0001069300000000,  0.0000661200000000,  0.0000578500000000 ]  - [  -0.0000632400000000, -0.0003094600000000, -0.0001205700000000 ]  - [  -0.0000640700000000, -0.0001988700000000,  0.0001547400000000 ]  - [  -0.0001067700000000,  0.0000646100000000, -0.0000863700000000 ]  - [   0.0001930300000000, -0.0000450500000000, -0.0000369600000000 ]  - [  -0.0001525400000000,  0.0000225000000000, -0.0000314400000000 ]  - [   0.0002479500000000,  0.0000735200000000,  0.0000372400000000 ]  - [  -0.0001443400000000,  0.0000132900000000,  0.0000003400000000 ]  - [   0.0002555700000000,  0.0000739300000000, -0.0000956700000000 ]  - [  -0.0002582300000000, -0.0002029800000000,  0.0000667200000000 ]  - [   0.0000657300000000, -0.0000480000000000, -0.0000037400000000 ]  - [  -0.0000469000000000, -0.0000085400000000, -0.0000004100000000 ]  - [   0.0010402400000000, -0.0002272800000000, -0.0000456800000000 ]  - [  -0.0000649100000000, -0.0000284300000000, -0.0000129800000000 ]  - [   0.0003140900000000,  0.0000174900000000,  0.0000332900000000 ]  - [  -0.0000530300000000, -0.0000594700000000,  0.0000122600000000 ]  - [  -0.0018544400000000,  0.0002314900000000,  0.0028809500000000 ]  - [  -0.0004286400000000, -0.0000169800000000, -0.0001098700000000 ]  - [  -0.0000422800000000,  0.0000287100000000,  0.0000285300000000 ]  - [  -0.0000860000000000,  0.0000596200000000,  0.0000323300000000 ]  - [  -0.0005035700000000,  0.0009814700000000, -0.0022019600000000 ]  - [  -0.0001871900000000,  0.0000658500000000,  0.0001173200000000 ]  - [   0.0000837500000000,  0.0000759100000000, -0.0000106100000000 ]  - [  -0.0000540900000000,  0.0000998600000000,  0.0000195900000000 ]  - [   0.0002610500000000, -0.0000755700000000, -0.0001065800000000 ]  - [  -0.0002336100000000, -0.0000078000000000, -0.0000406500000000 ]  - [   0.0013097400000000, -0.0011299000000000, -0.0009724400000000 ]  - [  -0.0003390600000000,  0.0001258100000000, -0.0000912900000000 ]  - [  -0.0038856600000000, -0.0026875300000000,  0.0014509600000000 ]  - [  -0.0010352700000000,  0.0003651000000000,  0.0002441300000000 ]  - [   0.0000593000000000,  0.0000973200000000, -0.0000024600000000 ]  - [  -0.0000739600000000, -0.0000758200000000,  0.0000359100000000 ]  - [   0.0000955000000000, -0.0001030200000000, -0.0001914500000000 ]  - [  -0.0000908200000000,  0.0000293500000000,  0.0000872400000000 ]  - [   0.0000350400000000,  0.0000838300000000,  0.0000905900000000 ]  - [  -0.0000556800000000, -0.0000227500000000,  0.0000344000000000 ]  - [   0.0000997000000000,  0.0001194700000000, -0.0000402300000000 ]  - [  -0.0001021200000000,  0.0000018800000000, -0.0000513400000000 ]  - [   0.0002706000000000, -0.0000730600000000,  0.0003420600000000 ]  - [  -0.0002074200000000,  0.0000200500000000, -0.0000415300000000 ]- atom:   49  displacement:    [   0.0000000000000000,  0.0100000000000000,  0.0000000000000000 ]  forces:  - [   0.0000170300000000, -0.0004466800000000, -0.0001370000000000 ]  - [  -0.0000285000000000, -0.0000064100000000, -0.0000018300000000 ]  - [   0.0011929700000000,  0.0037928000000000, -0.0004504000000000 ]  - [   0.0001648900000000, -0.0000332400000000,  0.0000578500000000 ]  - [  -0.0000770500000000,  0.0004921300000000,  0.0000976100000000 ]  - [   0.0002080900000000,  0.0000739000000000,  0.0000794800000000 ]  - [   0.0000684000000000, -0.0002625500000000, -0.0000236400000000 ]  - [  -0.0000300900000000, -0.0001216400000000, -0.0000310800000000 ]  - [  -0.0000409100000000,  0.0003916500000000, -0.0000760700000000 ]  - [   0.0001713200000000,  0.0000544700000000,  0.0000055700000000 ]  - [   0.0000659300000000, -0.0002139500000000,  0.0000256800000000 ]  - [  -0.0000381100000000, -0.0001227100000000,  0.0000051900000000 ]  - [  -0.0000057300000000,  0.0000660500000000,  0.0000974200000000 ]  - [  -0.0000753100000000, -0.0000637300000000,  0.0000277000000000 ]  - [  -0.0000346500000000,  0.0000896700000000, -0.0001540600000000 ]  - [   0.0001650900000000,  0.0000329500000000, -0.0000174100000000 ]  - [   0.0002267100000000, -0.0001217500000000, -0.0002864700000000 ]  - [  -0.0001656600000000,  0.0001959600000000,  0.0000562100000000 ]  - [  -0.0001670500000000, -0.0002726500000000,  0.0001409400000000 ]  - [   0.0001278400000000, -0.0002964500000000, -0.0000045300000000 ]  - [  -0.0001051000000000, -0.0003443600000000, -0.0002416300000000 ]  - [   0.0002202700000000, -0.0000246400000000, -0.0000728500000000 ]  - [   0.0001858400000000, -0.0001659100000000,  0.0001741800000000 ]  - [   0.0000534400000000,  0.0000674600000000,  0.0001620500000000 ]  - [  -0.0000128400000000,  0.0005258100000000, -0.0003000500000000 ]  - [   0.0002860900000000,  0.0001653700000000,  0.0002280400000000 ]  - [  -0.0001716100000000, -0.0001794700000000,  0.0000343900000000 ]  - [  -0.0002297000000000, -0.0002029000000000,  0.0000375700000000 ]  - [  -0.0003024900000000,  0.0009822200000000, -0.0000909100000000 ]  - [   0.0001543300000000,  0.0002117000000000,  0.0000626000000000 ]  - [   0.0001789800000000, -0.0003188800000000,  0.0002281500000000 ]  - [   0.0000635300000000, -0.0000434900000000,  0.0000187400000000 ]  - [  -0.0033100700000000,  0.0045241600000000,  0.0038964100000000 ]  - [  -0.0002158500000000,  0.0001026800000000, -0.0003260200000000 ]  - [  -0.0001415700000000, -0.0006274800000000,  0.0000644300000000 ]  - [   0.0000013400000000, -0.0002205200000000, -0.0000759200000000 ]  - [   0.0002333900000000,  0.0010183300000000,  0.0000669100000000 ]  - [  -0.0000560200000000,  0.0003997400000000,  0.0001501500000000 ]  - [   0.0001247400000000, -0.0010571700000000, -0.0004115500000000 ]  - [   0.0000322500000000, -0.0003042200000000, -0.0000304900000000 ]  - [  -0.0002068200000000,  0.0013924300000000, -0.0007408200000000 ]  - [  -0.0001047000000000,  0.0002289500000000, -0.0000750400000000 ]  - [  -0.0000753900000000, -0.0004212500000000, -0.0002706200000000 ]  - [  -0.0000204900000000, -0.0000040800000000, -0.0000947700000000 ]  - [   0.0008343900000000, -0.0003727500000000,  0.0007943600000000 ]  - [  -0.0003966900000000, -0.0000167500000000, -0.0002150400000000 ]  - [  -0.0004415300000000, -0.0000190800000000, -0.0001970100000000 ]  - [   0.0005392500000000, -0.0003308600000000, -0.0002010000000000 ]  - [   0.0032816900000000, -0.0184263400000000, -0.0057021700000000 ]  - [  -0.0000217700000000, -0.0000716300000000, -0.0000371500000000 ]  - [  -0.0000384900000000,  0.0003101100000000, -0.0000302000000000 ]  - [   0.0000053800000000,  0.0000187900000000,  0.0000097100000000 ]  - [   0.0016534700000000, -0.0005242700000000,  0.0004543700000000 ]  - [  -0.0006243900000000, -0.0001169700000000, -0.0002191800000000 ]  - [  -0.0000725100000000,  0.0001991600000000,  0.0000146700000000 ]  - [   0.0001202200000000,  0.0001451300000000, -0.0000345500000000 ]  - [   0.0006226600000000,  0.0007954500000000,  0.0004863700000000 ]  - [  -0.0001202100000000,  0.0000094900000000,  0.0000303200000000 ]  - [  -0.0016593000000000,  0.0019230200000000,  0.0001802800000000 ]  - [   0.0000733200000000,  0.0000521000000000, -0.0000409300000000 ]  - [  -0.0001135900000000, -0.0000794900000000,  0.0001023300000000 ]  - [  -0.0010718400000000, -0.0000724900000000,  0.0005053200000000 ]  - [  -0.0000824000000000,  0.0002891500000000, -0.0000072200000000 ]  - [   0.0001025400000000,  0.0002896400000000,  0.0000438900000000 ]  - [   0.0010079400000000,  0.0004163300000000, -0.0004906600000000 ]  - [  -0.0001611500000000, -0.0000925100000000,  0.0000045100000000 ]  - [  -0.0000593500000000,  0.0004147400000000,  0.0003002400000000 ]  - [   0.0000637200000000, -0.0000936100000000,  0.0001325900000000 ]  - [  -0.0041015000000000,  0.0037584100000000, -0.0002202600000000 ]  - [   0.0001520000000000, -0.0000569600000000,  0.0000199100000000 ]  - [   0.0004735200000000,  0.0013790300000000,  0.0005509600000000 ]  - [  -0.0001206500000000,  0.0002395400000000, -0.0000992000000000 ]  - [  -0.0006998200000000, -0.0002658800000000, -0.0004171600000000 ]  - [   0.0000229200000000, -0.0001839800000000, -0.0000448900000000 ]  - [   0.0000236200000000,  0.0001687900000000,  0.0000429100000000 ]  - [  -0.0001915400000000,  0.0001368700000000,  0.0000634700000000 ]  - [   0.0005404100000000, -0.0020171700000000, -0.0002964100000000 ]  - [   0.0000317300000000, -0.0000789600000000,  0.0000343600000000 ]  - [   0.0000320700000000,  0.0004018200000000, -0.0000022000000000 ]  - [   0.0000600200000000,  0.0001016300000000, -0.0000152400000000 ]  - [   0.0000137900000000, -0.0002229900000000,  0.0000930900000000 ]  - [  -0.0002037700000000, -0.0000934500000000, -0.0000090700000000 ]  - [  -0.0002032200000000,  0.0001861900000000, -0.0001625400000000 ]  - [  -0.0000672500000000,  0.0000503200000000, -0.0000520100000000 ]  - [   0.0000306400000000,  0.0000844800000000, -0.0000170000000000 ]  - [   0.0002246400000000, -0.0000023700000000, -0.0001583200000000 ]  - [   0.0003030700000000, -0.0000671700000000, -0.0000422000000000 ]  - [   0.0000312500000000,  0.0001227800000000,  0.0000978600000000 ]  - [  -0.0001355600000000,  0.0000483000000000,  0.0001083900000000 ]  - [   0.0001279300000000, -0.0000208300000000,  0.0001106000000000 ]  - [   0.0002386300000000, -0.0000213600000000, -0.0002487300000000 ]  - [  -0.0001370700000000,  0.0000471600000000, -0.0001191700000000 ]  - [  -0.0001147900000000, -0.0001347700000000, -0.0000510600000000 ]  - [  -0.0000484800000000,  0.0000283400000000, -0.0000092400000000 ]  - [   0.0000019200000000,  0.0002658000000000,  0.0000273800000000 ]  - [  -0.0000573800000000,  0.0001234200000000,  0.0000178500000000 ]  - [   0.0001453100000000, -0.0001708600000000,  0.0000074000000000 ]  - [  -0.0001318900000000, -0.0002728500000000,  0.0000943900000000 ]  - [   0.0000228700000000,  0.0000075000000000, -0.0000188900000000 ]  - [   0.0000624400000000,  0.0000289600000000,  0.0000137600000000 ]  - [   0.0004979400000000,  0.0017844100000000,  0.0028721700000000 ]  - [   0.0000311300000000, -0.0000283200000000,  0.0000157000000000 ]  - [   0.0000143000000000,  0.0003576100000000, -0.0002739800000000 ]  - [   0.0000249700000000,  0.0000150100000000,  0.0000193200000000 ]  - [  -0.0005073200000000, -0.0009631300000000,  0.0006938100000000 ]  - [  -0.0000142500000000, -0.0002422800000000,  0.0000397200000000 ]  - [  -0.0000312900000000,  0.0001361800000000, -0.0000455700000000 ]  - [  -0.0000248300000000,  0.0001243600000000,  0.0000353100000000 ]  - [  -0.0009058000000000, -0.0002905700000000, -0.0015496700000000 ]  - [   0.0000049900000000, -0.0000490900000000, -0.0000598300000000 ]  - [  -0.0000044900000000,  0.0001942500000000,  0.0000772500000000 ]  - [  -0.0000287000000000,  0.0001138900000000,  0.0000234100000000 ]  - [  -0.0003768700000000,  0.0008564300000000, -0.0001517100000000 ]  - [   0.0000799000000000,  0.0000247200000000, -0.0000165200000000 ]  - [   0.0012122100000000,  0.0014609400000000,  0.0028002500000000 ]  - [  -0.0001123300000000, -0.0000093000000000, -0.0000340800000000 ]  - [   0.0021117900000000, -0.0009367500000000, -0.0005662600000000 ]  - [  -0.0000643600000000, -0.0002312400000000,  0.0000637300000000 ]  - [  -0.0000738800000000,  0.0003283000000000,  0.0000796800000000 ]  - [   0.0000375000000000,  0.0001656000000000,  0.0000749300000000 ]  - [   0.0000359900000000, -0.0001616400000000,  0.0001726500000000 ]  - [  -0.0000715300000000, -0.0000734400000000,  0.0000318500000000 ]  - [   0.0000184600000000,  0.0001644300000000,  0.0000246600000000 ]  - [   0.0000074600000000,  0.0000493700000000,  0.0000195000000000 ]  - [  -0.0000203500000000,  0.0001418500000000,  0.0000110400000000 ]  - [   0.0000136100000000,  0.0000460800000000, -0.0000789100000000 ]  - [   0.0001259200000000, -0.0000882700000000, -0.0012319600000000 ]  - [  -0.0000741500000000, -0.0000377900000000, -0.0000332100000000 ]- atom:   49  displacement:    [   0.0000000000000000, -0.0100000000000000,  0.0000000000000000 ]  forces:  - [  -0.0000168100000000,  0.0004493200000000,  0.0001619100000000 ]  - [   0.0000291100000000,  0.0000055500000000,  0.0000253400000000 ]  - [  -0.0010943600000000, -0.0035452700000000,  0.0004320200000000 ]  - [  -0.0001642100000000,  0.0000324200000000, -0.0000347200000000 ]  - [   0.0000793200000000, -0.0004944200000000, -0.0001222300000000 ]  - [  -0.0002061300000000, -0.0000770600000000, -0.0000993900000000 ]  - [  -0.0000686700000000,  0.0002644500000000,  0.0000003000000000 ]  - [   0.0000301500000000,  0.0001218600000000,  0.0000080300000000 ]  - [   0.0000381800000000, -0.0003930900000000,  0.0000496700000000 ]  - [  -0.0001689400000000, -0.0000560800000000, -0.0000285400000000 ]  - [  -0.0000654700000000,  0.0002143000000000, -0.0000482500000000 ]  - [   0.0000371200000000,  0.0001227700000000, -0.0000281300000000 ]  - [   0.0000048100000000, -0.0000669300000000, -0.0000754100000000 ]  - [   0.0000749900000000,  0.0000639900000000, -0.0000051800000000 ]  - [   0.0000338700000000, -0.0000899800000000,  0.0001746500000000 ]  - [  -0.0001659800000000, -0.0000319300000000,  0.0000398500000000 ]  - [  -0.0001870700000000,  0.0000701000000000,  0.0002819800000000 ]  - [   0.0002075100000000, -0.0002421800000000, -0.0000554600000000 ]  - [   0.0002070400000000,  0.0002285300000000, -0.0001380700000000 ]  - [  -0.0000870200000000,  0.0002529900000000,  0.0000063700000000 ]  - [   0.0001486800000000,  0.0003855200000000,  0.0002422500000000 ]  - [  -0.0001776600000000,  0.0000645300000000,  0.0000741100000000 ]  - [  -0.0001385800000000,  0.0002110000000000, -0.0001740200000000 ]  - [  -0.0000100600000000, -0.0000251900000000, -0.0001606400000000 ]  - [  -0.0000302100000000, -0.0005614700000000,  0.0002972200000000 ]  - [  -0.0003371500000000, -0.0002081900000000, -0.0002317800000000 ]  - [   0.0001279300000000,  0.0001377500000000, -0.0000328000000000 ]  - [   0.0001871300000000,  0.0001627800000000, -0.0000369700000000 ]  - [   0.0002607600000000, -0.0009426500000000,  0.0000919600000000 ]  - [  -0.0001955200000000, -0.0001694700000000, -0.0000603000000000 ]  - [  -0.0002210600000000,  0.0003623700000000, -0.0002277600000000 ]  - [  -0.0001057000000000,  0.0000876300000000, -0.0000184200000000 ]  - [   0.0032361400000000, -0.0045104900000000, -0.0037695000000000 ]  - [   0.0002552700000000, -0.0001462000000000,  0.0003228000000000 ]  - [   0.0001828300000000,  0.0005863900000000, -0.0000654000000000 ]  - [   0.0000387500000000,  0.0001771400000000,  0.0000760700000000 ]  - [  -0.0001902500000000, -0.0009788900000000, -0.0000691200000000 ]  - [   0.0001012000000000, -0.0003614700000000, -0.0001537100000000 ]  - [  -0.0000777100000000,  0.0010954800000000,  0.0004138900000000 ]  - [   0.0000120100000000,  0.0003452300000000,  0.0000301900000000 ]  - [   0.0001473700000000, -0.0015583100000000,  0.0008414300000000 ]  - [   0.0000631100000000, -0.0002725100000000,  0.0000757300000000 ]  - [   0.0000332300000000,  0.0003797200000000,  0.0002668300000000 ]  - [  -0.0000225100000000, -0.0000365800000000,  0.0000940400000000 ]  - [  -0.0008853900000000,  0.0004231100000000, -0.0008055900000000 ]  - [   0.0003593800000000,  0.0000599500000000,  0.0002146300000000 ]  - [   0.0003975100000000,  0.0000636700000000,  0.0001960500000000 ]  - [  -0.0005804200000000,  0.0003776800000000,  0.0001964800000000 ]  - [  -0.0033382500000000,  0.0182371500000000,  0.0055181000000000 ]  - [  -0.0000163200000000, -0.0000324100000000, -0.0000048800000000 ]  - [   0.0000012000000000, -0.0004142200000000, -0.0000118100000000 ]  - [  -0.0000427400000000, -0.0001231200000000, -0.0000518600000000 ]  - [  -0.0015407900000000,  0.0004769500000000, -0.0004902400000000 ]  - [   0.0007287500000000,  0.0000788700000000,  0.0001782900000000 ]  - [   0.0001766100000000, -0.0002390700000000, -0.0000568100000000 ]  - [  -0.0000175200000000, -0.0001844600000000, -0.0000072400000000 ]  - [  -0.0007307100000000, -0.0007671100000000, -0.0005287700000000 ]  - [   0.0000173700000000,  0.0000283900000000, -0.0000725600000000 ]  - [   0.0015344500000000, -0.0018660200000000, -0.0002156700000000 ]  - [  -0.0001760100000000, -0.0000153200000000, -0.0000010400000000 ]  - [   0.0000717100000000,  0.0001746000000000, -0.0000651600000000 ]  - [   0.0010382900000000,  0.0001815800000000, -0.0004629500000000 ]  - [   0.0000441400000000, -0.0001871200000000,  0.0000481100000000 ]  - [  -0.0001409900000000, -0.0001866300000000, -0.0000017300000000 ]  - [  -0.0009741800000000, -0.0005259500000000,  0.0005354400000000 ]  - [   0.0002018400000000, -0.0000112800000000,  0.0000372800000000 ]  - [   0.0000968400000000, -0.0005274700000000, -0.0002575100000000 ]  - [  -0.0000258700000000, -0.0000124200000000, -0.0000896500000000 ]  - [   0.0042211500000000, -0.0037156800000000,  0.0001841000000000 ]  - [  -0.0001157200000000,  0.0001608300000000, -0.0000617800000000 ]  - [  -0.0004330000000000, -0.0012678900000000, -0.0005923200000000 ]  - [   0.0001581700000000, -0.0001365300000000,  0.0000580500000000 ]  - [   0.0006016000000000,  0.0002364100000000,  0.0004587800000000 ]  - [  -0.0001281500000000,  0.0001462900000000,  0.0000871100000000 ]  - [  -0.0001274800000000, -0.0002070000000000, -0.0000019900000000 ]  - [   0.0000876300000000, -0.0001752500000000, -0.0000226900000000 ]  - [  -0.0004324900000000,  0.0020648200000000,  0.0003226800000000 ]  - [   0.0000721100000000,  0.0001168700000000,  0.0000077300000000 ]  - [   0.0000725000000000, -0.0003643600000000,  0.0000442300000000 ]  - [   0.0000445100000000, -0.0000640400000000,  0.0000569100000000 ]  - [  -0.0001205100000000,  0.0001847600000000, -0.0001354800000000 ]  - [   0.0000983800000000,  0.0000544800000000, -0.0000334500000000 ]  - [   0.0000989900000000, -0.0002245500000000,  0.0001220000000000 ]  - [  -0.0000367200000000, -0.0000904200000000,  0.0000105000000000 ]  - [   0.0000728100000000, -0.0000457400000000, -0.0000237200000000 ]  - [  -0.0001204200000000,  0.0000401900000000,  0.0001173600000000 ]  - [  -0.0001964200000000,  0.0001034700000000, -0.0000010200000000 ]  - [   0.0000734400000000, -0.0000863900000000, -0.0001397300000000 ]  - [   0.0000986000000000, -0.0001512400000000, -0.0000682100000000 ]  - [  -0.0001658200000000, -0.0000819500000000, -0.0000696200000000 ]  - [  -0.0002741500000000, -0.0000824600000000,  0.0002888500000000 ]  - [   0.0000994900000000, -0.0001523700000000,  0.0001598400000000 ]  - [   0.0000775500000000,  0.0002391400000000,  0.0000102200000000 ]  - [   0.0000104700000000,  0.0000767700000000, -0.0000320700000000 ]  - [  -0.0000419200000000, -0.0001617100000000, -0.0000695700000000 ]  - [   0.0000195300000000, -0.0000196300000000, -0.0000589900000000 ]  - [  -0.0001062100000000,  0.0000652800000000, -0.0000486200000000 ]  - [   0.0001714700000000,  0.0001702200000000, -0.0001367100000000 ]  - [   0.0000149000000000, -0.0001125900000000, -0.0000224400000000 ]  - [  -0.0000244800000000, -0.0001345100000000, -0.0000549200000000 ]  - [  -0.0004017800000000, -0.0018472400000000, -0.0028820200000000 ]  - [   0.0000719100000000, -0.0000084000000000,  0.0000266000000000 ]  - [   0.0000885700000000, -0.0003945400000000,  0.0003138600000000 ]  - [   0.0000790900000000, -0.0000529700000000,  0.0000220900000000 ]  - [   0.0003920000000000,  0.0010039300000000, -0.0006366100000000 ]  - [  -0.0000887100000000,  0.0002807700000000,  0.0000011500000000 ]  - [  -0.0000722400000000, -0.0000984400000000,  0.0000876400000000 ]  - [  -0.0000791200000000, -0.0000870000000000,  0.0000061200000000 ]  - [   0.0009420800000000,  0.0003856500000000,  0.0015899800000000 ]  - [   0.0000327400000000,  0.0001516800000000,  0.0001012400000000 ]  - [   0.0000418400000000, -0.0000911500000000, -0.0000362000000000 ]  - [   0.0000668600000000, -0.0000110800000000,  0.0000180600000000 ]  - [   0.0003782400000000, -0.0008607300000000,  0.0000541600000000 ]  - [  -0.0000805700000000, -0.0000250600000000, -0.0000833100000000 ]  - [  -0.0012002600000000, -0.0014505200000000, -0.0028660200000000 ]  - [   0.0001132800000000,  0.0000085700000000, -0.0000655500000000 ]  - [  -0.0021186600000000,  0.0009505600000000,  0.0006659500000000 ]  - [   0.0000594900000000,  0.0002364600000000,  0.0000388700000000 ]  - [   0.0000726800000000, -0.0003288300000000,  0.0000207000000000 ]  - [  -0.0000379000000000, -0.0001661100000000,  0.0000248800000000 ]  - [  -0.0000362400000000,  0.0001624500000000, -0.0000726900000000 ]  - [   0.0000712100000000,  0.0000736000000000,  0.0000679400000000 ]  - [  -0.0000184500000000, -0.0001658500000000,  0.0000741500000000 ]  - [  -0.0000071400000000, -0.0000502300000000,  0.0000798600000000 ]  - [   0.0000207300000000, -0.0001409500000000, -0.0001114200000000 ]  - [  -0.0000135700000000, -0.0000463100000000, -0.0000209200000000 ]  - [  -0.0001254400000000,  0.0000871600000000,  0.0011219100000000 ]  - [   0.0000752600000000,  0.0000365400000000, -0.0000672900000000 ]- atom:   49  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [  -0.0000602400000000, -0.0000206500000000,  0.0002097100000000 ]  - [   0.0000344500000000, -0.0000178700000000,  0.0000569700000000 ]  - [   0.0003197300000000,  0.0009568200000000,  0.0007986800000000 ]  - [   0.0001434900000000, -0.0000685100000000,  0.0001071400000000 ]  - [   0.0001690100000000,  0.0001837100000000, -0.0002164000000000 ]  - [  -0.0002464000000000,  0.0000700500000000, -0.0002647500000000 ]  - [  -0.0000418600000000, -0.0000270800000000, -0.0000582700000000 ]  - [   0.0000215900000000, -0.0000346700000000, -0.0000468300000000 ]  - [  -0.0006757800000000, -0.0002741500000000, -0.0001046200000000 ]  - [   0.0005196400000000, -0.0001280200000000,  0.0002653300000000 ]  - [  -0.0000163800000000,  0.0000032300000000,  0.0000876900000000 ]  - [   0.0000281200000000,  0.0000102200000000,  0.0000106300000000 ]  - [   0.0000120600000000, -0.0000821800000000, -0.0001943800000000 ]  - [  -0.0000205400000000, -0.0000342600000000, -0.0000333000000000 ]  - [   0.0000140100000000,  0.0000697400000000, -0.0003337500000000 ]  - [   0.0000198300000000,  0.0000549000000000, -0.0000472600000000 ]  - [   0.0002388900000000, -0.0006986100000000, -0.0008877000000000 ]  - [  -0.0000531100000000, -0.0000260400000000, -0.0000885900000000 ]  - [   0.0000480300000000,  0.0001699800000000, -0.0000310600000000 ]  - [   0.0000486800000000, -0.0000268500000000,  0.0000058000000000 ]  - [  -0.0004660400000000, -0.0004888200000000, -0.0009369300000000 ]  - [   0.0000349700000000, -0.0000285200000000, -0.0000031600000000 ]  - [  -0.0000209200000000,  0.0004564800000000, -0.0003770300000000 ]  - [   0.0000718300000000,  0.0000531000000000, -0.0000512400000000 ]  - [   0.0004614700000000,  0.0006198600000000, -0.0009606900000000 ]  - [  -0.0008580100000000,  0.0000217000000000, -0.0006612300000000 ]  - [   0.0000879500000000, -0.0000484500000000, -0.0000272900000000 ]  - [  -0.0000448800000000, -0.0000897000000000, -0.0000425800000000 ]  - [  -0.0000868400000000,  0.0001296600000000, -0.0012322200000000 ]  - [   0.0000441100000000,  0.0000838300000000, -0.0001031400000000 ]  - [  -0.0000774200000000, -0.0000958100000000, -0.0000314300000000 ]  - [   0.0000611000000000, -0.0000816700000000,  0.0000098000000000 ]  - [  -0.0053068700000000,  0.0053681800000000,  0.0071271900000000 ]  - [  -0.0000085400000000, -0.0001368500000000,  0.0000529800000000 ]  - [   0.0001332200000000,  0.0000619500000000, -0.0000139300000000 ]  - [   0.0000980300000000, -0.0000374900000000, -0.0000355900000000 ]  - [   0.0052808100000000,  0.0006198800000000,  0.0052674000000000 ]  - [   0.0004440100000000, -0.0000830000000000,  0.0000468600000000 ]  - [  -0.0001083900000000,  0.0004458600000000,  0.0002167200000000 ]  - [   0.0000610600000000,  0.0000572400000000, -0.0000317000000000 ]  - [  -0.0003144800000000, -0.0021695600000000,  0.0027604600000000 ]  - [  -0.0003990000000000,  0.0001629200000000, -0.0001326700000000 ]  - [  -0.0000134600000000, -0.0003228600000000,  0.0001480000000000 ]  - [  -0.0000108300000000, -0.0001103000000000, -0.0000415500000000 ]  - [   0.0000970100000000,  0.0000827200000000,  0.0004279000000000 ]  - [   0.0000719800000000,  0.0003275800000000, -0.0000794300000000 ]  - [  -0.0002480000000000, -0.0001241900000000,  0.0002112600000000 ]  - [   0.0003979400000000, -0.0005017700000000,  0.0001194300000000 ]  - [   0.0015695300000000, -0.0057013900000000, -0.0258481600000000 ]  - [   0.0000292700000000, -0.0000678200000000, -0.0002396400000000 ]  - [   0.0000566700000000, -0.0000609200000000, -0.0001090400000000 ]  - [  -0.0000585800000000, -0.0000213200000000, -0.0000177500000000 ]  - [  -0.0001493300000000,  0.0005181300000000, -0.0009492900000000 ]  - [  -0.0004562400000000,  0.0000528100000000, -0.0006153100000000 ]  - [   0.0000718000000000, -0.0000203400000000, -0.0000410000000000 ]  - [   0.0000001700000000, -0.0000659000000000, -0.0000604400000000 ]  - [  -0.0002513600000000, -0.0001209400000000, -0.0006156400000000 ]  - [  -0.0000658600000000, -0.0000933400000000, -0.0000606500000000 ]  - [   0.0004231100000000,  0.0004902100000000, -0.0009498500000000 ]  - [  -0.0000159600000000,  0.0000657700000000, -0.0000411500000000 ]  - [   0.0004330800000000,  0.0005318200000000,  0.0008172600000000 ]  - [  -0.0007384100000000,  0.0001393900000000,  0.0008183100000000 ]  - [  -0.0000215700000000,  0.0000749900000000,  0.0000782800000000 ]  - [  -0.0000613600000000,  0.0000250400000000,  0.0000789300000000 ]  - [  -0.0001988900000000, -0.0003316000000000,  0.0005717600000000 ]  - [  -0.0000694400000000, -0.0001629300000000,  0.0001146400000000 ]  - [  -0.0000475900000000,  0.0004554600000000,  0.0005721400000000 ]  - [  -0.0000016200000000, -0.0000372300000000,  0.0001153100000000 ]  - [  -0.0001301600000000,  0.0002655700000000, -0.0019969000000000 ]  - [  -0.0000369000000000,  0.0000114500000000, -0.0002658000000000 ]  - [  -0.0001711800000000, -0.0005210600000000, -0.0004036800000000 ]  - [  -0.0000304500000000,  0.0001305600000000, -0.0001903600000000 ]  - [   0.0003878000000000, -0.0009132700000000,  0.0009413800000000 ]  - [  -0.0000741800000000, -0.0000547700000000,  0.0000819300000000 ]  - [   0.0000142800000000,  0.0000486400000000,  0.0000820100000000 ]  - [  -0.0000951100000000,  0.0000715900000000,  0.0002077600000000 ]  - [  -0.0002634500000000, -0.0007781500000000,  0.0054716600000000 ]  - [   0.0000287800000000,  0.0000684200000000,  0.0001155600000000 ]  - [   0.0000652900000000, -0.0000202300000000,  0.0001155600000000 ]  - [   0.0000161300000000,  0.0000351500000000,  0.0000565200000000 ]  - [   0.0000603300000000, -0.0001579500000000,  0.0002952600000000 ]  - [  -0.0001938900000000, -0.0000860400000000,  0.0001249600000000 ]  - [  -0.0000402900000000,  0.0001418900000000,  0.0001259100000000 ]  - [  -0.0000821700000000,  0.0000136600000000, -0.0000177400000000 ]  - [  -0.0000656500000000,  0.0001269400000000,  0.0000771400000000 ]  - [   0.0001896100000000,  0.0000767100000000,  0.0001396800000000 ]  - [   0.0000735400000000, -0.0001452800000000,  0.0001279100000000 ]  - [   0.0000485900000000, -0.0000516200000000,  0.0000769100000000 ]  - [  -0.0001245500000000,  0.0000863400000000, -0.0001111800000000 ]  - [   0.0001145500000000,  0.0002161900000000, -0.0000423700000000 ]  - [  -0.0001596200000000, -0.0001414900000000, -0.0000417800000000 ]  - [   0.0000182400000000, -0.0001394900000000, -0.0001115800000000 ]  - [  -0.0000023400000000,  0.0000816900000000,  0.0004042800000000 ]  - [  -0.0000083600000000,  0.0000408600000000,  0.0000557500000000 ]  - [  -0.0000774200000000,  0.0000039200000000,  0.0001178400000000 ]  - [  -0.0000399400000000,  0.0000134200000000,  0.0000131800000000 ]  - [  -0.0000545100000000, -0.0000236800000000,  0.0004557800000000 ]  - [   0.0001068000000000,  0.0000634800000000,  0.0002666800000000 ]  - [   0.0000358200000000, -0.0000505400000000,  0.0000246600000000 ]  - [   0.0000388600000000, -0.0000180100000000,  0.0000406800000000 ]  - [   0.0007113100000000,  0.0028374500000000,  0.0031343800000000 ]  - [  -0.0000142200000000, -0.0000109600000000,  0.0000502500000000 ]  - [   0.0000719200000000, -0.0001487800000000, -0.0000471700000000 ]  - [   0.0000666900000000, -0.0000068500000000, -0.0000327300000000 ]  - [  -0.0029015600000000,  0.0000961000000000,  0.0031340200000000 ]  - [   0.0002407000000000,  0.0000060900000000, -0.0000479500000000 ]  - [  -0.0000464800000000,  0.0000522900000000,  0.0000506100000000 ]  - [  -0.0000508100000000,  0.0000271000000000, -0.0000326400000000 ]  - [   0.0022097700000000, -0.0015019500000000,  0.0024736400000000 ]  - [  -0.0000773200000000, -0.0000282000000000, -0.0000999500000000 ]  - [   0.0000497100000000,  0.0001081000000000, -0.0000646300000000 ]  - [   0.0000200000000000,  0.0000544900000000, -0.0000109400000000 ]  - [   0.0002254300000000, -0.0003055800000000, -0.0000162400000000 ]  - [  -0.0000523900000000, -0.0000755800000000, -0.0000461500000000 ]  - [   0.0009150700000000,  0.0021581700000000,  0.0004277200000000 ]  - [  -0.0000706000000000, -0.0000089600000000,  0.0000150400000000 ]  - [  -0.0017631500000000, -0.0010951300000000, -0.0005324000000000 ]  - [   0.0006250500000000, -0.0004243200000000, -0.0000303600000000 ]  - [   0.0000095400000000,  0.0000591400000000,  0.0000658400000000 ]  - [  -0.0000104900000000,  0.0000202200000000,  0.0000424400000000 ]  - [   0.0002055200000000,  0.0000812700000000,  0.0003963200000000 ]  - [  -0.0001799800000000,  0.0000379100000000,  0.0001194600000000 ]  - [   0.0000014000000000, -0.0000635500000000,  0.0000339800000000 ]  - [  -0.0000219100000000, -0.0000007900000000,  0.0000352000000000 ]  - [  -0.0000369100000000,  0.0002693400000000, -0.0000467100000000 ]  - [  -0.0000023100000000,  0.0000365500000000, -0.0000427300000000 ]  - [  -0.0001231100000000, -0.0004172800000000,  0.0004674000000000 ]  - [   0.0001182500000000, -0.0000727900000000, -0.0001132800000000 ]- atom:   49  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000595000000000,  0.0000207500000000, -0.0001873700000000 ]  - [  -0.0000337400000000,  0.0000173100000000, -0.0000337000000000 ]  - [  -0.0003191900000000, -0.0009580000000000, -0.0007808800000000 ]  - [  -0.0001419900000000,  0.0000674400000000, -0.0000845200000000 ]  - [  -0.0001659600000000, -0.0001843800000000,  0.0001972000000000 ]  - [   0.0002498500000000, -0.0000734700000000,  0.0002469200000000 ]  - [   0.0000401600000000,  0.0000307200000000,  0.0000368200000000 ]  - [  -0.0000215500000000,  0.0000345300000000,  0.0000246900000000 ]  - [   0.0006796800000000,  0.0002760200000000,  0.0000810100000000 ]  - [  -0.0005270000000000,  0.0001305800000000, -0.0002893700000000 ]  - [   0.0000160000000000, -0.0000026500000000, -0.0001104200000000 ]  - [  -0.0000284200000000, -0.0000096700000000, -0.0000334600000000 ]  - [  -0.0000131300000000,  0.0000846400000000,  0.0002191000000000 ]  - [   0.0000202600000000,  0.0000351600000000,  0.0000567200000000 ]  - [  -0.0000148800000000, -0.0000699700000000,  0.0003581300000000 ]  - [  -0.0000204900000000, -0.0000535200000000,  0.0000729800000000 ]  - [  -0.0002006200000000,  0.0006641300000000,  0.0008972200000000 ]  - [   0.0000969400000000, -0.0000162600000000,  0.0000912600000000 ]  - [  -0.0000070400000000, -0.0002137500000000,  0.0000341400000000 ]  - [  -0.0000068000000000, -0.0000149800000000, -0.0000043800000000 ]  - [   0.0005168300000000,  0.0005385500000000,  0.0009462200000000 ]  - [   0.0000079800000000,  0.0000716700000000,  0.0000029600000000 ]  - [   0.0000628100000000, -0.0004206300000000,  0.0003799000000000 ]  - [  -0.0000295300000000, -0.0000116300000000,  0.0000518200000000 ]  - [  -0.0005114900000000, -0.0006720200000000,  0.0009725200000000 ]  - [   0.0008248400000000, -0.0000640400000000,  0.0006681800000000 ]  - [  -0.0001317900000000,  0.0000070600000000,  0.0000272100000000 ]  - [   0.0000031600000000,  0.0000492700000000,  0.0000433100000000 ]  - [   0.0000465600000000, -0.0000901700000000,  0.0012471000000000 ]  - [  -0.0000867500000000, -0.0000425300000000,  0.0001069600000000 ]  - [   0.0000354900000000,  0.0001403000000000,  0.0000322900000000 ]  - [  -0.0001037100000000,  0.0001251300000000, -0.0000094800000000 ]  - [   0.0051484700000000, -0.0052452000000000, -0.0069578000000000 ]  - [   0.0000527900000000,  0.0000940000000000, -0.0000539100000000 ]  - [  -0.0000910800000000, -0.0001048400000000,  0.0000132200000000 ]  - [  -0.0000568300000000, -0.0000049000000000,  0.0000353900000000 ]  - [  -0.0050364800000000, -0.0005726700000000, -0.0051486300000000 ]  - [  -0.0004033500000000,  0.0001242500000000, -0.0000513100000000 ]  - [   0.0001538100000000, -0.0004062000000000, -0.0002151400000000 ]  - [  -0.0000180900000000, -0.0000156100000000,  0.0000311700000000 ]  - [   0.0002584400000000,  0.0020447000000000, -0.0027087800000000 ]  - [   0.0003548200000000, -0.0002039800000000,  0.0001328200000000 ]  - [  -0.0000288200000000,  0.0002800300000000, -0.0001497900000000 ]  - [  -0.0000317800000000,  0.0000701200000000,  0.0000405500000000 ]  - [  -0.0001361000000000, -0.0000396900000000, -0.0004257400000000 ]  - [  -0.0001143400000000, -0.0002879100000000,  0.0000786100000000 ]  - [   0.0002044000000000,  0.0001666700000000, -0.0002119100000000 ]  - [  -0.0004408100000000,  0.0005470100000000, -0.0001207400000000 ]  - [  -0.0015927700000000,  0.0055198400000000,  0.0253917100000000 ]  - [  -0.0000663000000000, -0.0000354700000000,  0.0001992500000000 ]  - [  -0.0000939800000000, -0.0000431900000000,  0.0000682100000000 ]  - [   0.0000208100000000, -0.0000828900000000, -0.0000234100000000 ]  - [   0.0002465700000000, -0.0005560800000000,  0.0009107500000000 ]  - [   0.0005588500000000, -0.0000909600000000,  0.0005772600000000 ]  - [   0.0000318000000000, -0.0000179500000000,  0.0000008200000000 ]  - [   0.0001030200000000,  0.0000278500000000,  0.0000202700000000 ]  - [   0.0001462300000000,  0.0001576900000000,  0.0005769400000000 ]  - [  -0.0000385200000000,  0.0001310100000000,  0.0000200700000000 ]  - [  -0.0005213900000000, -0.0004565400000000,  0.0009102100000000 ]  - [  -0.0000874700000000, -0.0000283900000000,  0.0000006300000000 ]  - [  -0.0004741800000000, -0.0004364200000000, -0.0007769800000000 ]  - [   0.0007095700000000, -0.0000281000000000, -0.0007759900000000 ]  - [  -0.0000173600000000,  0.0000294000000000, -0.0000368200000000 ]  - [   0.0000233900000000,  0.0000803200000000, -0.0000361500000000 ]  - [   0.0002423500000000,  0.0002261200000000, -0.0005299100000000 ]  - [   0.0001069000000000,  0.0000593600000000, -0.0000727300000000 ]  - [   0.0000854600000000, -0.0005705900000000, -0.0005295400000000 ]  - [   0.0000383300000000, -0.0000699700000000, -0.0000721000000000 ]  - [   0.0001521200000000, -0.0001387600000000,  0.0019564200000000 ]  - [   0.0000743800000000,  0.0000930800000000,  0.0002251700000000 ]  - [   0.0002080100000000,  0.0006222000000000,  0.0003592500000000 ]  - [   0.0000686400000000, -0.0000267400000000,  0.0001498600000000 ]  - [  -0.0004881000000000,  0.0008777200000000, -0.0008989400000000 ]  - [  -0.0000292400000000,  0.0000174600000000, -0.0000419100000000 ]  - [  -0.0001177600000000, -0.0000854700000000, -0.0000418100000000 ]  - [  -0.0000089500000000, -0.0001095700000000, -0.0001673000000000 ]  - [   0.0003559000000000,  0.0008070000000000, -0.0053268700000000 ]  - [   0.0000752200000000, -0.0000296800000000, -0.0000743600000000 ]  - [   0.0000387000000000,  0.0000583500000000, -0.0000743500000000 ]  - [   0.0000882800000000,  0.0000023200000000, -0.0000146900000000 ]  - [  -0.0001681700000000,  0.0001238400000000, -0.0003422200000000 ]  - [   0.0000907200000000,  0.0000486700000000, -0.0001691300000000 ]  - [  -0.0000646100000000, -0.0001818800000000, -0.0001681800000000 ]  - [  -0.0000196800000000, -0.0000543300000000, -0.0000239000000000 ]  - [   0.0001719800000000, -0.0000903300000000, -0.0001201600000000 ]  - [  -0.0000860800000000, -0.0000400000000000, -0.0001829700000000 ]  - [   0.0000323300000000,  0.0001835600000000, -0.0001724400000000 ]  - [   0.0000552700000000,  0.0000890200000000, -0.0001203600000000 ]  - [   0.0000889100000000, -0.0001927900000000,  0.0001546700000000 ]  - [  -0.0001539100000000, -0.0003214600000000,  0.0000849900000000 ]  - [   0.0001216800000000,  0.0000387300000000,  0.0000855800000000 ]  - [  -0.0000571200000000,  0.0000370700000000,  0.0001542900000000 ]  - [  -0.0000365400000000,  0.0000203400000000, -0.0004494300000000 ]  - [  -0.0000300700000000,  0.0000636200000000, -0.0000975600000000 ]  - [   0.0000388800000000,  0.0001007800000000, -0.0001604300000000 ]  - [   0.0000018600000000,  0.0000901700000000, -0.0000546800000000 ]  - [   0.0000961600000000, -0.0000796700000000, -0.0005020700000000 ]  - [  -0.0000688400000000, -0.0001676000000000, -0.0003116000000000 ]  - [   0.0000018500000000, -0.0000540400000000, -0.0000660500000000 ]  - [  -0.0000012100000000, -0.0000867100000000, -0.0000820600000000 ]  - [  -0.0006193700000000, -0.0029337700000000, -0.0031331500000000 ]  - [   0.0001190000000000, -0.0000264500000000, -0.0000076600000000 ]  - [   0.0000333600000000,  0.0001115100000000,  0.0000915000000000 ]  - [   0.0000374500000000, -0.0000305300000000,  0.0000757100000000 ]  - [   0.0028525300000000, -0.0000596000000000, -0.0031335000000000 ]  - [  -0.0003471200000000,  0.0000313800000000,  0.0000907600000000 ]  - [  -0.0000573000000000, -0.0000151300000000, -0.0000072800000000 ]  - [  -0.0000535900000000,  0.0000102700000000,  0.0000757900000000 ]  - [  -0.0022161600000000,  0.0016377900000000, -0.0024644400000000 ]  - [   0.0001167100000000,  0.0001328700000000,  0.0001434000000000 ]  - [  -0.0000123700000000, -0.0000053600000000,  0.0001077200000000 ]  - [   0.0000180400000000,  0.0000491100000000,  0.0000530300000000 ]  - [  -0.0002267800000000,  0.0003091600000000, -0.0000807000000000 ]  - [   0.0000530900000000,  0.0000754600000000, -0.0000529800000000 ]  - [  -0.0009087500000000, -0.0021414200000000, -0.0005248600000000 ]  - [   0.0000725100000000,  0.0000071100000000, -0.0001121600000000 ]  - [   0.0017650700000000,  0.0010972300000000,  0.0006228300000000 ]  - [  -0.0006288400000000,  0.0004262400000000,  0.0001363000000000 ]  - [  -0.0000098500000000, -0.0000598400000000,  0.0000351300000000 ]  - [   0.0000098800000000, -0.0000204900000000,  0.0000577400000000 ]  - [  -0.0002095000000000, -0.0000823600000000, -0.0002996400000000 ]  - [   0.0001827000000000, -0.0000383300000000, -0.0000208600000000 ]  - [  -0.0000014000000000,  0.0000640600000000,  0.0000653500000000 ]  - [   0.0000221900000000,  0.0000008500000000,  0.0000647100000000 ]  - [   0.0000377400000000, -0.0002728800000000, -0.0000525300000000 ]  - [   0.0000019200000000, -0.0000371600000000, -0.0000565900000000 ]  - [   0.0001258300000000,  0.0004251700000000, -0.0005657700000000 ]  - [  -0.0001199300000000,  0.0000738400000000,  0.0000138400000000 ]- atom:  113  displacement:    [   0.0100000000000000,  0.0000000000000000,  0.0000000000000000 ]  forces:  - [   0.0009599800000000, -0.0000367700000000,  0.0000208900000000 ]  - [  -0.0006606300000000,  0.0001373700000000,  0.0000105900000000 ]  - [   0.0002955700000000,  0.0002255300000000,  0.0000110200000000 ]  - [  -0.0000940600000000, -0.0000474900000000,  0.0000111600000000 ]  - [  -0.0002563800000000,  0.0005575900000000,  0.0001014700000000 ]  - [  -0.0001503000000000, -0.0002995500000000, -0.0002674800000000 ]  - [  -0.0001515700000000, -0.0002978900000000,  0.0002434100000000 ]  - [  -0.0002578800000000,  0.0005636100000000, -0.0001234400000000 ]  - [   0.0000531700000000,  0.0000302500000000, -0.0000800200000000 ]  - [   0.0000179100000000,  0.0000055800000000,  0.0001306100000000 ]  - [   0.0000172300000000,  0.0000054900000000, -0.0001522400000000 ]  - [   0.0000530600000000,  0.0000303600000000,  0.0000574600000000 ]  - [   0.0001905300000000,  0.0000196900000000,  0.0000230200000000 ]  - [  -0.0003421800000000,  0.0000166700000000,  0.0000109800000000 ]  - [   0.0001282900000000, -0.0000045700000000,  0.0000111700000000 ]  - [  -0.0000830100000000,  0.0000302800000000,  0.0000112200000000 ]  - [   0.0004723100000000, -0.0002123400000000,  0.0000280500000000 ]  - [  -0.0003459500000000,  0.0001798400000000, -0.0000199600000000 ]  - [   0.0002136100000000, -0.0000163600000000,  0.0000195800000000 ]  - [  -0.0001340100000000, -0.0000529700000000, -0.0000165800000000 ]  - [   0.0001772000000000,  0.0001871400000000,  0.0000277300000000 ]  - [  -0.0001412600000000, -0.0001135500000000, -0.0000835000000000 ]  - [   0.0000114900000000,  0.0000252400000000,  0.0000665200000000 ]  - [  -0.0000892300000000,  0.0000099100000000,  0.0000195000000000 ]  - [  -0.0000305700000000, -0.0000174800000000, -0.0000662000000000 ]  - [  -0.0001316000000000, -0.0000323200000000, -0.0000194500000000 ]  - [   0.0001381000000000,  0.0001431200000000, -0.0000269200000000 ]  - [  -0.0001838300000000, -0.0001552000000000,  0.0000828100000000 ]  - [   0.0001713200000000,  0.0000257500000000, -0.0000187600000000 ]  - [  -0.0001755300000000, -0.0000110800000000,  0.0000160500000000 ]  - [   0.0004286700000000, -0.0001722200000000, -0.0000280300000000 ]  - [  -0.0003890800000000,  0.0002222300000000,  0.0000200900000000 ]  - [   0.0000744900000000,  0.0000445600000000,  0.0000930700000000 ]  - [  -0.0001977500000000, -0.0004591200000000, -0.0001062200000000 ]  - [   0.0034159700000000,  0.0008984900000000,  0.0012747500000000 ]  - [  -0.0008107200000000,  0.0001741400000000,  0.0003250400000000 ]  - [   0.0005748900000000, -0.0004136600000000,  0.0001841800000000 ]  - [  -0.0003531800000000,  0.0000879100000000,  0.0000354300000000 ]  - [   0.0010619900000000, -0.0013280300000000, -0.0008001400000000 ]  - [  -0.0005488400000000, -0.0001508500000000, -0.0000875200000000 ]  - [   0.0010115700000000, -0.0013261500000000,  0.0007868000000000 ]  - [  -0.0005911900000000, -0.0001939000000000,  0.0000881300000000 ]  - [   0.0005349300000000, -0.0004557400000000, -0.0001850300000000 ]  - [  -0.0003935100000000,  0.0000434200000000, -0.0000345900000000 ]  - [   0.0035956500000000,  0.0010444600000000, -0.0013348800000000 ]  - [  -0.0008496600000000,  0.0002130400000000, -0.0003225100000000 ]  - [   0.0000323100000000,  0.0000861800000000, -0.0000939300000000 ]  - [  -0.0002425400000000, -0.0004167900000000,  0.0001060500000000 ]  - [  -0.0002817000000000, -0.0004306500000000,  0.0002058200000000 ]  - [   0.0002148200000000,  0.0000286500000000, -0.0000730500000000 ]  - [  -0.0013254200000000,  0.0011552600000000,  0.0008898700000000 ]  - [   0.0003210700000000, -0.0001652800000000, -0.0000928600000000 ]  - [   0.0000433600000000,  0.0001062000000000, -0.0000131900000000 ]  - [   0.0000769400000000, -0.0000258500000000,  0.0000548400000000 ]  - [   0.0015133800000000, -0.0011579800000000, -0.0021841300000000 ]  - [   0.0009111300000000, -0.0000967400000000,  0.0002865200000000 ]  - [   0.0013983300000000, -0.0011061400000000,  0.0021153500000000 ]  - [   0.0008061600000000, -0.0000573000000000, -0.0003282800000000 ]  - [  -0.0000610100000000,  0.0001433200000000, -0.0000292600000000 ]  - [  -0.0000269400000000,  0.0000112100000000, -0.0000959300000000 ]  - [  -0.0000778700000000,  0.0001254200000000,  0.0000112100000000 ]  - [   0.0000550800000000,  0.0000147600000000,  0.0000306700000000 ]  - [   0.0038677400000000, -0.0020846400000000,  0.0018027300000000 ]  - [   0.0010156000000000,  0.0001126100000000, -0.0006067900000000 ]  - [   0.0038449800000000, -0.0021462500000000, -0.0017262400000000 ]  - [   0.0010583500000000,  0.0000113000000000,  0.0006469600000000 ]  - [  -0.0000400700000000,  0.0000211800000000,  0.0000306100000000 ]  - [   0.0000932900000000, -0.0000901000000000,  0.0000102900000000 ]  - [  -0.0012993600000000,  0.0012566400000000, -0.0009334200000000 ]  - [   0.0003585700000000, -0.0000604200000000,  0.0000503600000000 ]  - [  -0.0002426900000000, -0.0003245800000000, -0.0002464000000000 ]  - [   0.0002516500000000,  0.0001316600000000,  0.0000322000000000 ]  - [  -0.0010057500000000,  0.0026483400000000,  0.0011220000000000 ]  - [   0.0002762100000000, -0.0001155100000000, -0.0000383900000000 ]  - [  -0.0002855500000000, -0.0003830400000000,  0.0004450800000000 ]  - [   0.0001138200000000,  0.0000572000000000,  0.0000004400000000 ]  - [  -0.0001819300000000, -0.0003466800000000, -0.0004054600000000 ]  - [   0.0002181000000000,  0.0000952600000000,  0.0000412200000000 ]  - [  -0.0008813700000000,  0.0026810000000000, -0.0010704500000000 ]  - [   0.0003811300000000, -0.0000786800000000,  0.0000806400000000 ]  - [  -0.0000888100000000, -0.0000392800000000, -0.0000941100000000 ]  - [  -0.0000056700000000, -0.0000208400000000,  0.0000160500000000 ]  - [  -0.0001350900000000,  0.0000550000000000, -0.0004417600000000 ]  - [   0.0000895800000000, -0.0001379300000000,  0.0002511700000000 ]  - [  -0.0000400600000000,  0.0000906600000000,  0.0004006900000000 ]  - [   0.0001934500000000, -0.0000997200000000, -0.0002909100000000 ]  - [   0.0000146600000000, -0.0000014800000000,  0.0000526600000000 ]  - [   0.0000982500000000,  0.0000167400000000, -0.0000575800000000 ]  - [  -0.0001145200000000, -0.0000161300000000, -0.0001871000000000 ]  - [   0.0000722100000000, -0.0001235700000000,  0.0002018300000000 ]  - [  -0.0000538500000000, -0.0000335200000000,  0.0000197000000000 ]  - [   0.0000370800000000, -0.0000449100000000,  0.0000429900000000 ]  - [  -0.0002879200000000, -0.0000779900000000, -0.0001461700000000 ]  - [   0.0001889700000000,  0.0001267000000000,  0.0000983200000000 ]  - [  -0.0001189400000000,  0.0000725100000000, -0.0000580500000000 ]  - [   0.0000837300000000,  0.0000384000000000, -0.0000228700000000 ]  - [  -0.0000818500000000, -0.0000313800000000,  0.0000165600000000 ]  - [   0.0001212900000000, -0.0000654800000000, -0.0000186100000000 ]  - [  -0.0002540400000000, -0.0001734100000000,  0.0001028200000000 ]  - [   0.0002268400000000,  0.0000229100000000, -0.0001398700000000 ]  - [  -0.0001096500000000, -0.0001219700000000,  0.0001022700000000 ]  - [   0.0002172500000000,  0.0000648500000000, -0.0000428100000000 ]  - [  -0.0000212600000000,  0.0000106800000000,  0.0000586500000000 ]  - [   0.0001018500000000, -0.0000415500000000,  0.0000199800000000 ]  - [  -0.0001255300000000,  0.0000485100000000, -0.0000176300000000 ]  - [  -0.0000020900000000, -0.0000034700000000,  0.0000215600000000 ]  - [  -0.0002142400000000, -0.0000830500000000, -0.0000614000000000 ]  - [   0.0001132000000000,  0.0001030800000000,  0.0000847700000000 ]  - [  -0.0000153500000000,  0.0000703200000000,  0.0000225800000000 ]  - [   0.0000748100000000,  0.0000593000000000, -0.0000010500000000 ]  - [  -0.0000756900000000,  0.0000884000000000,  0.0002279800000000 ]  - [   0.0001095200000000, -0.0000192900000000, -0.0001607400000000 ]  - [  -0.0188570800000000,  0.0000001200000000, -0.0000079400000000 ]  - [   0.0005285200000000,  0.0000029900000000, -0.0000500500000000 ]  - [  -0.0002939400000000, -0.0000030400000000, -0.0000500800000000 ]  - [   0.0003096000000000, -0.0000000300000000, -0.0000496900000000 ]  - [   0.0002922500000000, -0.0002996300000000,  0.0001743900000000 ]  - [   0.0002919800000000,  0.0010319400000000, -0.0001259300000000 ]  - [   0.0002895900000000,  0.0010298500000000,  0.0002247300000000 ]  - [   0.0002893300000000, -0.0003010400000000, -0.0000757400000000 ]  - [  -0.0000087600000000, -0.0000292200000000, -0.0000220800000000 ]  - [   0.0000036900000000,  0.0000290200000000,  0.0000930900000000 ]  - [   0.0000042100000000,  0.0000291000000000,  0.0000067500000000 ]  - [  -0.0000092600000000, -0.0000287300000000,  0.0001224300000000 ]  - [  -0.0001150100000000,  0.0000522800000000, -0.0000534100000000 ]  - [   0.0001459200000000,  0.0000166100000000, -0.0000494500000000 ]  - [  -0.0001072100000000,  0.0000165700000000, -0.0000495800000000 ]  - [   0.0001022100000000, -0.0000038300000000, -0.0000497200000000 ]- atom:  113  displacement:    [   0.0000000000000000,  0.0000000000000000,  0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000,  0.0035960000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000892000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000892000000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000290800000000 ]  - [  -0.0000215200000000, -0.0001522900000000,  0.0000747800000000 ]  - [  -0.0001522900000000,  0.0000215200000000,  0.0000747800000000 ]  - [   0.0001522900000000, -0.0000215200000000,  0.0000747800000000 ]  - [   0.0000215200000000,  0.0001522900000000,  0.0000747800000000 ]  - [  -0.0000939600000000,  0.0000577800000000, -0.0000432200000000 ]  - [   0.0000577800000000,  0.0000939600000000, -0.0000432200000000 ]  - [  -0.0000577800000000, -0.0000939600000000, -0.0000432200000000 ]  - [   0.0000939600000000, -0.0000577800000000, -0.0000432200000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0044158500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000939900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000939900000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000222000000000 ]  - [  -0.0001071400000000, -0.0001273900000000, -0.0002626500000000 ]  - [  -0.0000144100000000, -0.0000459300000000,  0.0000076300000000 ]  - [  -0.0000172800000000, -0.0000174200000000, -0.0002083500000000 ]  - [   0.0000063900000000, -0.0000581400000000,  0.0000738900000000 ]  - [   0.0001273900000000, -0.0001071400000000, -0.0002626500000000 ]  - [   0.0000174200000000, -0.0000172800000000, -0.0002083500000000 ]  - [   0.0000459300000000, -0.0000144100000000,  0.0000076300000000 ]  - [   0.0000581400000000,  0.0000063900000000,  0.0000738900000000 ]  - [  -0.0000459300000000,  0.0000144100000000,  0.0000076300000000 ]  - [  -0.0000581400000000, -0.0000063900000000,  0.0000738900000000 ]  - [  -0.0001273900000000,  0.0001071400000000, -0.0002626500000000 ]  - [  -0.0000174200000000,  0.0000172800000000, -0.0002083500000000 ]  - [   0.0000172800000000,  0.0000174200000000, -0.0002083500000000 ]  - [  -0.0000063900000000,  0.0000581400000000,  0.0000738900000000 ]  - [   0.0001071400000000,  0.0001273900000000, -0.0002626500000000 ]  - [   0.0000144100000000,  0.0000459300000000,  0.0000076300000000 ]  - [  -0.0001086000000000, -0.0000313800000000, -0.0001056500000000 ]  - [  -0.0000255000000000, -0.0000914300000000, -0.0001524300000000 ]  - [   0.0012018700000000,  0.0003422100000000,  0.0009553300000000 ]  - [  -0.0001916900000000, -0.0002305400000000,  0.0003591400000000 ]  - [   0.0002305400000000, -0.0001916900000000,  0.0003591400000000 ]  - [   0.0000914300000000, -0.0000255000000000, -0.0001524300000000 ]  - [  -0.0003422100000000,  0.0012018700000000,  0.0009553300000000 ]  - [   0.0000313800000000, -0.0001086000000000, -0.0001056500000000 ]  - [   0.0003422100000000, -0.0012018700000000,  0.0009553300000000 ]  - [  -0.0000313800000000,  0.0001086000000000, -0.0001056500000000 ]  - [  -0.0002305400000000,  0.0001916900000000,  0.0003591400000000 ]  - [  -0.0000914300000000,  0.0000255000000000, -0.0001524300000000 ]  - [  -0.0012018700000000, -0.0003422100000000,  0.0009553300000000 ]  - [   0.0001916900000000,  0.0002305400000000,  0.0003591400000000 ]  - [   0.0001086000000000,  0.0000313800000000, -0.0001056500000000 ]  - [   0.0000255000000000,  0.0000914300000000, -0.0001524300000000 ]  - [   0.0000362300000000, -0.0001570300000000,  0.0000127100000000 ]  - [  -0.0000287400000000, -0.0000188900000000, -0.0000170700000000 ]  - [   0.0008986100000000,  0.0027675900000000,  0.0004581500000000 ]  - [   0.0000226100000000, -0.0000368900000000,  0.0000432300000000 ]  - [   0.0000368900000000,  0.0000226100000000,  0.0000432300000000 ]  - [   0.0000188900000000, -0.0000287400000000, -0.0000170700000000 ]  - [  -0.0027675900000000,  0.0008986100000000,  0.0004581500000000 ]  - [   0.0001570300000000,  0.0000362300000000,  0.0000127100000000 ]  - [   0.0027675900000000, -0.0008986100000000,  0.0004581500000000 ]  - [  -0.0001570300000000, -0.0000362300000000,  0.0000127100000000 ]  - [  -0.0000368900000000, -0.0000226100000000,  0.0000432300000000 ]  - [  -0.0000188900000000,  0.0000287400000000, -0.0000170700000000 ]  - [  -0.0000708900000000,  0.0000818500000000,  0.0000360800000000 ]  - [  -0.0000324300000000,  0.0000771900000000,  0.0000130800000000 ]  - [   0.0013658400000000, -0.0005642000000000, -0.0005650500000000 ]  - [   0.0001768800000000,  0.0000637000000000, -0.0000660000000000 ]  - [  -0.0013658400000000,  0.0005642000000000, -0.0005650500000000 ]  - [  -0.0001768800000000, -0.0000637000000000, -0.0000660000000000 ]  - [   0.0000708900000000, -0.0000818500000000,  0.0000360800000000 ]  - [   0.0000324300000000, -0.0000771900000000,  0.0000130800000000 ]  - [  -0.0008986100000000, -0.0027675900000000,  0.0004581500000000 ]  - [  -0.0000226100000000,  0.0000368900000000,  0.0000432300000000 ]  - [  -0.0000362300000000,  0.0001570300000000,  0.0000127100000000 ]  - [   0.0000287400000000,  0.0000188900000000, -0.0000170700000000 ]  - [   0.0005642000000000,  0.0013658400000000, -0.0005650500000000 ]  - [  -0.0000818500000000, -0.0000708900000000,  0.0000360800000000 ]  - [  -0.0000637000000000,  0.0001768800000000, -0.0000660000000000 ]  - [  -0.0000771900000000, -0.0000324300000000,  0.0000130800000000 ]  - [   0.0000637000000000, -0.0001768800000000, -0.0000660000000000 ]  - [   0.0000771900000000,  0.0000324300000000,  0.0000130800000000 ]  - [  -0.0005642000000000, -0.0013658400000000, -0.0005650500000000 ]  - [   0.0000818500000000,  0.0000708900000000,  0.0000360800000000 ]  - [  -0.0000354300000000, -0.0000274700000000, -0.0000851800000000 ]  - [  -0.0000810500000000, -0.0000172500000000, -0.0000140700000000 ]  - [  -0.0012377200000000, -0.0004129100000000,  0.0004990300000000 ]  - [   0.0000095000000000, -0.0000282600000000, -0.0000189900000000 ]  - [   0.0012377200000000,  0.0004129100000000,  0.0004990300000000 ]  - [  -0.0000095000000000,  0.0000282600000000, -0.0000189900000000 ]  - [   0.0000354300000000,  0.0000274700000000, -0.0000851800000000 ]  - [   0.0000810500000000,  0.0000172500000000, -0.0000140700000000 ]  - [  -0.0002581500000000, -0.0001740200000000,  0.0003689800000000 ]  - [   0.0000176500000000, -0.0000336500000000,  0.0000913800000000 ]  - [   0.0000223000000000, -0.0000274500000000,  0.0000057500000000 ]  - [  -0.0000343800000000, -0.0000218400000000,  0.0000064500000000 ]  - [  -0.0004129100000000,  0.0012377200000000,  0.0004990300000000 ]  - [  -0.0000274700000000,  0.0000354300000000, -0.0000851800000000 ]  - [  -0.0000282600000000, -0.0000095000000000, -0.0000189900000000 ]  - [  -0.0000172500000000,  0.0000810500000000, -0.0000140700000000 ]  - [   0.0000282600000000,  0.0000095000000000, -0.0000189900000000 ]  - [   0.0000172500000000, -0.0000810500000000, -0.0000140700000000 ]  - [   0.0004129100000000, -0.0012377200000000,  0.0004990300000000 ]  - [   0.0000274700000000, -0.0000354300000000, -0.0000851800000000 ]  - [   0.0001740200000000, -0.0002581500000000,  0.0003689800000000 ]  - [   0.0000274500000000,  0.0000223000000000,  0.0000057500000000 ]  - [   0.0000336500000000,  0.0000176500000000,  0.0000913800000000 ]  - [   0.0000218400000000, -0.0000343800000000,  0.0000064500000000 ]  - [  -0.0000336500000000, -0.0000176500000000,  0.0000913800000000 ]  - [  -0.0000218400000000,  0.0000343800000000,  0.0000064500000000 ]  - [  -0.0001740200000000,  0.0002581500000000,  0.0003689800000000 ]  - [  -0.0000274500000000, -0.0000223000000000,  0.0000057500000000 ]  - [  -0.0000223000000000,  0.0000274500000000,  0.0000057500000000 ]  - [   0.0000343800000000,  0.0000218400000000,  0.0000064500000000 ]  - [   0.0002581500000000,  0.0001740200000000,  0.0003689800000000 ]  - [  -0.0000176500000000,  0.0000336500000000,  0.0000913800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0179270600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001995700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0001995700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000299700000000 ]  - [   0.0001781300000000, -0.0001249700000000,  0.0002347900000000 ]  - [  -0.0001249700000000, -0.0001781300000000,  0.0002347900000000 ]  - [   0.0001249700000000,  0.0001781300000000,  0.0002347900000000 ]  - [  -0.0001781300000000,  0.0001249700000000,  0.0002347900000000 ]  - [  -0.0000730100000000,  0.0000437100000000,  0.0000481400000000 ]  - [   0.0000437100000000,  0.0000730100000000,  0.0000481400000000 ]  - [  -0.0000437100000000, -0.0000730100000000,  0.0000481400000000 ]  - [   0.0000730100000000, -0.0000437100000000,  0.0000481400000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0024349500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001514600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001514600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000631000000000 ]- atom:  113  displacement:    [   0.0000000000000000,  0.0000000000000000, -0.0100000000000000 ]  forces:  - [   0.0000000000000000,  0.0000000000000000, -0.0039199000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000664000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000664000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000051600000000 ]  - [   0.0000205300000000,  0.0001531000000000, -0.0000971500000000 ]  - [   0.0001531000000000, -0.0000205300000000, -0.0000971500000000 ]  - [  -0.0001531000000000,  0.0000205300000000, -0.0000971500000000 ]  - [  -0.0000205300000000, -0.0001531000000000, -0.0000971500000000 ]  - [   0.0000952700000000, -0.0000590400000000,  0.0000185800000000 ]  - [  -0.0000590400000000, -0.0000952700000000,  0.0000185800000000 ]  - [   0.0000590400000000,  0.0000952700000000,  0.0000185800000000 ]  - [  -0.0000952700000000,  0.0000590400000000,  0.0000185800000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0041229000000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000692300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000692300000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000021800000000 ]  - [   0.0001480900000000,  0.0000806700000000,  0.0002613100000000 ]  - [   0.0000570800000000,  0.0000027500000000, -0.0000067100000000 ]  - [   0.0000580000000000, -0.0000207500000000,  0.0002064900000000 ]  - [   0.0000365400000000,  0.0000159200000000, -0.0000730300000000 ]  - [  -0.0000806700000000,  0.0001480900000000,  0.0002613100000000 ]  - [   0.0000207500000000,  0.0000580000000000,  0.0002064900000000 ]  - [  -0.0000027500000000,  0.0000570800000000, -0.0000067100000000 ]  - [  -0.0000159200000000,  0.0000365400000000, -0.0000730300000000 ]  - [   0.0000027500000000, -0.0000570800000000, -0.0000067100000000 ]  - [   0.0000159200000000, -0.0000365400000000, -0.0000730300000000 ]  - [   0.0000806700000000, -0.0001480900000000,  0.0002613100000000 ]  - [  -0.0000207500000000, -0.0000580000000000,  0.0002064900000000 ]  - [  -0.0000580000000000,  0.0000207500000000,  0.0002064900000000 ]  - [  -0.0000365400000000, -0.0000159200000000, -0.0000730300000000 ]  - [  -0.0001480900000000, -0.0000806700000000,  0.0002613100000000 ]  - [  -0.0000570800000000, -0.0000027500000000, -0.0000067100000000 ]  - [   0.0001513600000000, -0.0000098100000000,  0.0001056500000000 ]  - [   0.0000682000000000,  0.0000500700000000,  0.0001543100000000 ]  - [  -0.0011771600000000, -0.0003977100000000, -0.0009375700000000 ]  - [   0.0002296100000000,  0.0001880400000000, -0.0003593200000000 ]  - [  -0.0001880400000000,  0.0002296100000000, -0.0003593200000000 ]  - [  -0.0000500700000000,  0.0000682000000000,  0.0001543100000000 ]  - [   0.0003977100000000, -0.0011771600000000, -0.0009375700000000 ]  - [   0.0000098100000000,  0.0001513600000000,  0.0001056500000000 ]  - [  -0.0003977100000000,  0.0011771600000000, -0.0009375700000000 ]  - [  -0.0000098100000000, -0.0001513600000000,  0.0001056500000000 ]  - [   0.0001880400000000, -0.0002296100000000, -0.0003593200000000 ]  - [   0.0000500700000000, -0.0000682000000000,  0.0001543100000000 ]  - [   0.0011771600000000,  0.0003977100000000, -0.0009375700000000 ]  - [  -0.0002296100000000, -0.0001880400000000, -0.0003593200000000 ]  - [  -0.0001513600000000,  0.0000098100000000,  0.0001056500000000 ]  - [  -0.0000682000000000, -0.0000500700000000,  0.0001543100000000 ]  - [  -0.0000779900000000,  0.0000488900000000, -0.0000515700000000 ]  - [  -0.0000094000000000, -0.0000852400000000, -0.0000236600000000 ]  - [  -0.0009463300000000, -0.0028985200000000, -0.0004942500000000 ]  - [  -0.0000603000000000, -0.0000682800000000, -0.0000838400000000 ]  - [   0.0000682800000000, -0.0000603000000000, -0.0000838400000000 ]  - [   0.0000852400000000, -0.0000094000000000, -0.0000236600000000 ]  - [   0.0028985200000000, -0.0009463300000000, -0.0004942500000000 ]  - [  -0.0000488900000000, -0.0000779900000000, -0.0000515700000000 ]  - [  -0.0028985200000000,  0.0009463300000000, -0.0004942500000000 ]  - [   0.0000488900000000,  0.0000779900000000, -0.0000515700000000 ]  - [  -0.0000682800000000,  0.0000603000000000, -0.0000838400000000 ]  - [  -0.0000852400000000,  0.0000094000000000, -0.0000236600000000 ]  - [   0.0000340700000000,  0.0000227500000000,  0.0000056800000000 ]  - [  -0.0000052000000000,  0.0000271000000000,  0.0000287200000000 ]  - [  -0.0014065100000000,  0.0006678500000000,  0.0005905200000000 ]  - [  -0.0002106200000000,  0.0000387600000000,  0.0001009700000000 ]  - [   0.0014065100000000, -0.0006678500000000,  0.0005905200000000 ]  - [   0.0002106200000000, -0.0000387600000000,  0.0001009700000000 ]  - [  -0.0000340700000000, -0.0000227500000000,  0.0000056800000000 ]  - [   0.0000052000000000, -0.0000271000000000,  0.0000287200000000 ]  - [   0.0009463300000000,  0.0028985200000000, -0.0004942500000000 ]  - [   0.0000603000000000,  0.0000682800000000, -0.0000838400000000 ]  - [   0.0000779900000000, -0.0000488900000000, -0.0000515700000000 ]  - [   0.0000094000000000,  0.0000852400000000, -0.0000236600000000 ]  - [  -0.0006678500000000, -0.0014065100000000,  0.0005905200000000 ]  - [  -0.0000227500000000,  0.0000340700000000,  0.0000056800000000 ]  - [  -0.0000387600000000, -0.0002106200000000,  0.0001009700000000 ]  - [  -0.0000271000000000, -0.0000052000000000,  0.0000287200000000 ]  - [   0.0000387600000000,  0.0002106200000000,  0.0001009700000000 ]  - [   0.0000271000000000,  0.0000052000000000,  0.0000287200000000 ]  - [   0.0006678500000000,  0.0014065100000000,  0.0005905200000000 ]  - [   0.0000227500000000, -0.0000340700000000,  0.0000056800000000 ]  - [  -0.0000694200000000, -0.0000106100000000,  0.0000421200000000 ]  - [  -0.0000229500000000, -0.0000205300000000, -0.0000278300000000 ]  - [   0.0011163400000000,  0.0003693300000000, -0.0005340100000000 ]  - [  -0.0001128200000000, -0.0000098300000000, -0.0000246500000000 ]  - [  -0.0011163400000000, -0.0003693300000000, -0.0005340100000000 ]  - [   0.0001128200000000,  0.0000098300000000, -0.0000246500000000 ]  - [   0.0000694200000000,  0.0000106100000000,  0.0000421200000000 ]  - [   0.0000229500000000,  0.0000205300000000, -0.0000278300000000 ]  - [   0.0002237300000000,  0.0000713600000000, -0.0003267100000000 ]  - [  -0.0000564700000000, -0.0000696800000000, -0.0000486700000000 ]  - [  -0.0000592700000000, -0.0000769200000000,  0.0000373600000000 ]  - [  -0.0000032600000000, -0.0000821400000000,  0.0000362800000000 ]  - [   0.0003693300000000, -0.0011163400000000, -0.0005340100000000 ]  - [  -0.0000106100000000,  0.0000694200000000,  0.0000421200000000 ]  - [  -0.0000098300000000,  0.0001128200000000, -0.0000246500000000 ]  - [  -0.0000205300000000,  0.0000229500000000, -0.0000278300000000 ]  - [   0.0000098300000000, -0.0001128200000000, -0.0000246500000000 ]  - [   0.0000205300000000, -0.0000229500000000, -0.0000278300000000 ]  - [  -0.0003693300000000,  0.0011163400000000, -0.0005340100000000 ]  - [   0.0000106100000000, -0.0000694200000000,  0.0000421200000000 ]  - [  -0.0000713600000000,  0.0002237300000000, -0.0003267100000000 ]  - [   0.0000769200000000, -0.0000592700000000,  0.0000373600000000 ]  - [   0.0000696800000000, -0.0000564700000000, -0.0000486700000000 ]  - [   0.0000821400000000, -0.0000032600000000,  0.0000362800000000 ]  - [  -0.0000696800000000,  0.0000564700000000, -0.0000486700000000 ]  - [  -0.0000821400000000,  0.0000032600000000,  0.0000362800000000 ]  - [   0.0000713600000000, -0.0002237300000000, -0.0003267100000000 ]  - [  -0.0000769200000000,  0.0000592700000000,  0.0000373600000000 ]  - [   0.0000592700000000,  0.0000769200000000,  0.0000373600000000 ]  - [   0.0000032600000000,  0.0000821400000000,  0.0000362800000000 ]  - [  -0.0002237300000000, -0.0000713600000000, -0.0003267100000000 ]  - [   0.0000564700000000,  0.0000696800000000, -0.0000486700000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0178468200000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002997300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0002997300000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0001312300000000 ]  - [  -0.0001725000000000,  0.0001252100000000, -0.0001339700000000 ]  - [   0.0001252100000000,  0.0001725000000000, -0.0001339700000000 ]  - [  -0.0001252100000000, -0.0001725000000000, -0.0001339700000000 ]  - [   0.0001725000000000, -0.0001252100000000, -0.0001339700000000 ]  - [   0.0000715600000000, -0.0000426200000000,  0.0000522500000000 ]  - [  -0.0000426200000000, -0.0000715600000000,  0.0000522500000000 ]  - [   0.0000426200000000,  0.0000715600000000,  0.0000522500000000 ]  - [  -0.0000715600000000,  0.0000426200000000,  0.0000522500000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0025334500000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000511600000000 ]  - [   0.0000000000000000,  0.0000000000000000,  0.0000511600000000 ]  - [   0.0000000000000000,  0.0000000000000000, -0.0000372300000000 ]