# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/ef8aab24-b240-431a-af93-24c6369f3b7e/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 LuAlO3 / Pnma (62) / materials id 755574](https://mdr.nims.go.jp/datasets/0b7b34bf-6f36-4a74-80be-ba544ed3b6c2) ## 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: "Pnma" number: 62 Hall_symbol: "-P 2ac 2n"supercell_matrix:- [ 2, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 5.315506630000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 7.265487990000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 5.052549970000000 ] # c points: - symbol: Lu # 1 coordinates: [ 0.433428220000000, 0.750000000000000, 0.017716750000000 ] mass: 174.966800 - symbol: Lu # 2 coordinates: [ 0.933428220000000, 0.750000000000000, 0.482283250000000 ] mass: 174.966800 - symbol: Lu # 3 coordinates: [ 0.066571780000000, 0.250000000000000, 0.517716750000000 ] mass: 174.966800 - symbol: Lu # 4 coordinates: [ 0.566571780000000, 0.250000000000000, 0.982283250000000 ] mass: 174.966800 - symbol: Al # 5 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 26.981539 - symbol: Al # 6 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 - symbol: Al # 7 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 - symbol: Al # 8 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 26.981539 - symbol: O # 9 coordinates: [ 0.967970780000000, 0.250000000000000, 0.102382240000000 ] mass: 15.999400 - symbol: O # 10 coordinates: [ 0.698680090000000, 0.552870980000000, 0.196533030000000 ] mass: 15.999400 - symbol: O # 11 coordinates: [ 0.698680090000000, 0.947129020000000, 0.196533030000000 ] mass: 15.999400 - symbol: O # 12 coordinates: [ 0.198680090000000, 0.947129020000000, 0.303466970000000 ] mass: 15.999400 - symbol: O # 13 coordinates: [ 0.198680090000000, 0.552870980000000, 0.303466970000000 ] mass: 15.999400 - symbol: O # 14 coordinates: [ 0.467970780000000, 0.250000000000000, 0.397617760000000 ] mass: 15.999400 - symbol: O # 15 coordinates: [ 0.532029220000000, 0.750000000000000, 0.602382240000000 ] mass: 15.999400 - symbol: O # 16 coordinates: [ 0.801319910000000, 0.052870980000000, 0.696533030000000 ] mass: 15.999400 - symbol: O # 17 coordinates: [ 0.801319910000000, 0.447129020000000, 0.696533030000000 ] mass: 15.999400 - symbol: O # 18 coordinates: [ 0.301319910000000, 0.052870980000000, 0.803466970000000 ] mass: 15.999400 - symbol: O # 19 coordinates: [ 0.301319910000000, 0.447129020000000, 0.803466970000000 ] mass: 15.999400 - symbol: O # 20 coordinates: [ 0.032029220000000, 0.750000000000000, 0.897617760000000 ] mass: 15.999400 reciprocal_lattice: # without 2pi - [ 0.188128821880521, 0.000000000000000, 0.000000000000000 ] # a* - [ 0.000000000000000, 0.137637004063095, 0.000000000000000 ] # b* - [ 0.000000000000000, 0.000000000000000, 0.197919863422944 ] # c*unit_cell: lattice: - [ 5.315506630000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 7.265487990000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 5.052549970000000 ] # c points: - symbol: Lu # 1 coordinates: [ 0.433428220000000, 0.750000000000000, 0.017716750000000 ] mass: 174.966800 reduced_to: 1 - symbol: Lu # 2 coordinates: [ 0.933428220000000, 0.750000000000000, 0.482283250000000 ] mass: 174.966800 reduced_to: 2 - symbol: Lu # 3 coordinates: [ 0.066571780000000, 0.250000000000000, 0.517716750000000 ] mass: 174.966800 reduced_to: 3 - symbol: Lu # 4 coordinates: [ 0.566571780000000, 0.250000000000000, 0.982283250000000 ] mass: 174.966800 reduced_to: 4 - symbol: Al # 5 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 5 - symbol: Al # 6 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 6 - symbol: Al # 7 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 7 - symbol: Al # 8 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 8 - symbol: O # 9 coordinates: [ 0.967970780000000, 0.250000000000000, 0.102382240000000 ] mass: 15.999400 reduced_to: 9 - symbol: O # 10 coordinates: [ 0.698680090000000, 0.552870980000000, 0.196533030000000 ] mass: 15.999400 reduced_to: 10 - symbol: O # 11 coordinates: [ 0.698680090000000, 0.947129020000000, 0.196533030000000 ] mass: 15.999400 reduced_to: 11 - symbol: O # 12 coordinates: [ 0.198680090000000, 0.947129020000000, 0.303466970000000 ] mass: 15.999400 reduced_to: 12 - symbol: O # 13 coordinates: [ 0.198680090000000, 0.552870980000000, 0.303466970000000 ] mass: 15.999400 reduced_to: 13 - symbol: O # 14 coordinates: [ 0.467970780000000, 0.250000000000000, 0.397617760000000 ] mass: 15.999400 reduced_to: 14 - symbol: O # 15 coordinates: [ 0.532029220000000, 0.750000000000000, 0.602382240000000 ] mass: 15.999400 reduced_to: 15 - symbol: O # 16 coordinates: [ 0.801319910000000, 0.052870980000000, 0.696533030000000 ] mass: 15.999400 reduced_to: 16 - symbol: O # 17 coordinates: [ 0.801319910000000, 0.447129020000000, 0.696533030000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 18 coordinates: [ 0.301319910000000, 0.052870980000000, 0.803466970000000 ] mass: 15.999400 reduced_to: 18 - symbol: O # 19 coordinates: [ 0.301319910000000, 0.447129020000000, 0.803466970000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 20 coordinates: [ 0.032029220000000, 0.750000000000000, 0.897617760000000 ] mass: 15.999400 reduced_to: 20supercell: lattice: - [ 10.631013260000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 7.265487990000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 10.105099940000001 ] # c points: - symbol: Lu # 1 coordinates: [ 0.216714110000000, 0.750000000000000, 0.008858375000000 ] mass: 174.966800 reduced_to: 1 - symbol: Lu # 2 coordinates: [ 0.716714110000000, 0.750000000000000, 0.008858375000000 ] mass: 174.966800 reduced_to: 1 - symbol: Lu # 3 coordinates: [ 0.216714110000000, 0.750000000000000, 0.508858375000000 ] mass: 174.966800 reduced_to: 1 - symbol: Lu # 4 coordinates: [ 0.716714110000000, 0.750000000000000, 0.508858375000000 ] mass: 174.966800 reduced_to: 1 - symbol: Lu # 5 coordinates: [ 0.466714110000000, 0.750000000000000, 0.241141625000000 ] mass: 174.966800 reduced_to: 5 - symbol: Lu # 6 coordinates: [ 0.966714110000000, 0.750000000000000, 0.241141625000000 ] mass: 174.966800 reduced_to: 5 - symbol: Lu # 7 coordinates: [ 0.466714110000000, 0.750000000000000, 0.741141625000000 ] mass: 174.966800 reduced_to: 5 - symbol: Lu # 8 coordinates: [ 0.966714110000000, 0.750000000000000, 0.741141625000000 ] mass: 174.966800 reduced_to: 5 - symbol: Lu # 9 coordinates: [ 0.033285890000000, 0.250000000000000, 0.258858375000000 ] mass: 174.966800 reduced_to: 9 - symbol: Lu # 10 coordinates: [ 0.533285890000000, 0.250000000000000, 0.258858375000000 ] mass: 174.966800 reduced_to: 9 - symbol: Lu # 11 coordinates: [ 0.033285890000000, 0.250000000000000, 0.758858375000000 ] mass: 174.966800 reduced_to: 9 - symbol: Lu # 12 coordinates: [ 0.533285890000000, 0.250000000000000, 0.758858375000000 ] mass: 174.966800 reduced_to: 9 - symbol: Lu # 13 coordinates: [ 0.283285890000000, 0.250000000000000, 0.491141625000000 ] mass: 174.966800 reduced_to: 13 - symbol: Lu # 14 coordinates: [ 0.783285890000000, 0.250000000000000, 0.491141625000000 ] mass: 174.966800 reduced_to: 13 - symbol: Lu # 15 coordinates: [ 0.283285890000000, 0.250000000000000, 0.991141625000000 ] mass: 174.966800 reduced_to: 13 - symbol: Lu # 16 coordinates: [ 0.783285890000000, 0.250000000000000, 0.991141625000000 ] mass: 174.966800 reduced_to: 13 - symbol: Al # 17 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 17 - symbol: Al # 18 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 17 - symbol: Al # 19 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 17 - symbol: Al # 20 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 17 - symbol: Al # 21 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 21 - symbol: Al # 22 coordinates: [ 0.500000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 21 - symbol: Al # 23 coordinates: [ 0.000000000000000, 0.500000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 21 - symbol: Al # 24 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 21 - symbol: Al # 25 coordinates: [ 0.250000000000000, 0.000000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 26 coordinates: [ 0.750000000000000, 0.000000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 27 coordinates: [ 0.250000000000000, 0.000000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 28 coordinates: [ 0.750000000000000, 0.000000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 29 coordinates: [ 0.250000000000000, 0.500000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: Al # 30 coordinates: [ 0.750000000000000, 0.500000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: Al # 31 coordinates: [ 0.250000000000000, 0.500000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: Al # 32 coordinates: [ 0.750000000000000, 0.500000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: O # 33 coordinates: [ 0.483985390000000, 0.250000000000000, 0.051191120000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 34 coordinates: [ 0.983985390000000, 0.250000000000000, 0.051191120000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 35 coordinates: [ 0.483985390000000, 0.250000000000000, 0.551191120000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 36 coordinates: [ 0.983985390000000, 0.250000000000000, 0.551191120000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 37 coordinates: [ 0.349340045000000, 0.552870980000000, 0.098266515000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 38 coordinates: [ 0.849340045000000, 0.552870980000000, 0.098266515000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 39 coordinates: [ 0.349340045000000, 0.552870980000000, 0.598266515000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 40 coordinates: [ 0.849340045000000, 0.552870980000000, 0.598266515000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 41 coordinates: [ 0.349340045000000, 0.947129020000000, 0.098266515000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 42 coordinates: [ 0.849340045000000, 0.947129020000000, 0.098266515000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 43 coordinates: [ 0.349340045000000, 0.947129020000000, 0.598266515000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 44 coordinates: [ 0.849340045000000, 0.947129020000000, 0.598266515000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 45 coordinates: [ 0.099340045000000, 0.947129020000000, 0.151733485000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 46 coordinates: [ 0.599340045000000, 0.947129020000000, 0.151733485000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 47 coordinates: [ 0.099340045000000, 0.947129020000000, 0.651733485000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 48 coordinates: [ 0.599340045000000, 0.947129020000000, 0.651733485000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 49 coordinates: [ 0.099340045000000, 0.552870980000000, 0.151733485000000 ] mass: 15.999400 reduced_to: 49 - symbol: O # 50 coordinates: [ 0.599340045000000, 0.552870980000000, 0.151733485000000 ] mass: 15.999400 reduced_to: 49 - symbol: O # 51 coordinates: [ 0.099340045000000, 0.552870980000000, 0.651733485000000 ] mass: 15.999400 reduced_to: 49 - symbol: O # 52 coordinates: [ 0.599340045000000, 0.552870980000000, 0.651733485000000 ] mass: 15.999400 reduced_to: 49 - symbol: O # 53 coordinates: [ 0.233985390000000, 0.250000000000000, 0.198808880000000 ] mass: 15.999400 reduced_to: 53 - symbol: O # 54 coordinates: [ 0.733985390000000, 0.250000000000000, 0.198808880000000 ] mass: 15.999400 reduced_to: 53 - symbol: O # 55 coordinates: [ 0.233985390000000, 0.250000000000000, 0.698808880000000 ] mass: 15.999400 reduced_to: 53 - symbol: O # 56 coordinates: [ 0.733985390000000, 0.250000000000000, 0.698808880000000 ] mass: 15.999400 reduced_to: 53 - symbol: O # 57 coordinates: [ 0.266014610000000, 0.750000000000000, 0.301191120000000 ] mass: 15.999400 reduced_to: 57 - symbol: O # 58 coordinates: [ 0.766014610000000, 0.750000000000000, 0.301191120000000 ] mass: 15.999400 reduced_to: 57 - symbol: O # 59 coordinates: [ 0.266014610000000, 0.750000000000000, 0.801191120000000 ] mass: 15.999400 reduced_to: 57 - symbol: O # 60 coordinates: [ 0.766014610000000, 0.750000000000000, 0.801191120000000 ] mass: 15.999400 reduced_to: 57 - symbol: O # 61 coordinates: [ 0.400659955000000, 0.052870980000000, 0.348266515000000 ] mass: 15.999400 reduced_to: 61 - symbol: O # 62 coordinates: [ 0.900659955000000, 0.052870980000000, 0.348266515000000 ] mass: 15.999400 reduced_to: 61 - symbol: O # 63 coordinates: [ 0.400659955000000, 0.052870980000000, 0.848266515000000 ] mass: 15.999400 reduced_to: 61 - symbol: O # 64 coordinates: [ 0.900659955000000, 0.052870980000000, 0.848266515000000 ] mass: 15.999400 reduced_to: 61 - symbol: O # 65 coordinates: [ 0.400659955000000, 0.447129020000000, 0.348266515000000 ] mass: 15.999400 reduced_to: 65 - symbol: O # 66 coordinates: [ 0.900659955000000, 0.447129020000000, 0.348266515000000 ] mass: 15.999400 reduced_to: 65 - symbol: O # 67 coordinates: [ 0.400659955000000, 0.447129020000000, 0.848266515000000 ] mass: 15.999400 reduced_to: 65 - symbol: O # 68 coordinates: [ 0.900659955000000, 0.447129020000000, 0.848266515000000 ] mass: 15.999400 reduced_to: 65 - symbol: O # 69 coordinates: [ 0.150659955000000, 0.052870980000000, 0.401733485000000 ] mass: 15.999400 reduced_to: 69 - symbol: O # 70 coordinates: [ 0.650659955000000, 0.052870980000000, 0.401733485000000 ] mass: 15.999400 reduced_to: 69 - symbol: O # 71 coordinates: [ 0.150659955000000, 0.052870980000000, 0.901733485000000 ] mass: 15.999400 reduced_to: 69 - symbol: O # 72 coordinates: [ 0.650659955000000, 0.052870980000000, 0.901733485000000 ] mass: 15.999400 reduced_to: 69 - symbol: O # 73 coordinates: [ 0.150659955000000, 0.447129020000000, 0.401733485000000 ] mass: 15.999400 reduced_to: 73 - symbol: O # 74 coordinates: [ 0.650659955000000, 0.447129020000000, 0.401733485000000 ] mass: 15.999400 reduced_to: 73 - symbol: O # 75 coordinates: [ 0.150659955000000, 0.447129020000000, 0.901733485000000 ] mass: 15.999400 reduced_to: 73 - symbol: O # 76 coordinates: [ 0.650659955000000, 0.447129020000000, 0.901733485000000 ] mass: 15.999400 reduced_to: 73 - symbol: O # 77 coordinates: [ 0.016014610000000, 0.750000000000000, 0.448808880000000 ] mass: 15.999400 reduced_to: 77 - symbol: O # 78 coordinates: [ 0.516014610000000, 0.750000000000000, 0.448808880000000 ] mass: 15.999400 reduced_to: 77 - symbol: O # 79 coordinates: [ 0.016014610000000, 0.750000000000000, 0.948808880000000 ] mass: 15.999400 reduced_to: 77 - symbol: O # 80 coordinates: [ 0.516014610000000, 0.750000000000000, 0.948808880000000 ] mass: 15.999400 reduced_to: 77displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.1794394700000000, 0.0000000000000000, -0.0208512000000000 ] - [ 0.0169427900000000, 0.0000000000000000, 0.0010263700000000 ] - [ -0.0063464100000000, 0.0000000000000000, -0.0004025700000000 ] - [ 0.0051325900000000, 0.0000000000000000, 0.0000545500000000 ] - [ 0.0137143900000000, 0.0000000000000000, 0.0185826700000000 ] - [ 0.0136598900000000, 0.0000000000000000, -0.0175257700000000 ] - [ 0.0066321500000000, 0.0000000000000000, -0.0129545800000000 ] - [ 0.0066861700000000, 0.0000000000000000, 0.0185124800000000 ] - [ 0.0000442000000000, 0.0000000000000000, -0.0055111500000000 ] - [ 0.0052326600000000, 0.0000000000000000, 0.0037966300000000 ] - [ 0.0000735000000000, 0.0000000000000000, 0.0057905600000000 ] - [ 0.0052402900000000, 0.0000000000000000, -0.0035080800000000 ] - [ -0.0054627800000000, 0.0000000000000000, 0.0011288800000000 ] - [ 0.0039924400000000, 0.0000000000000000, -0.0001658500000000 ] - [ -0.0207085600000000, 0.0000000000000000, -0.0081467900000000 ] - [ 0.0088783300000000, 0.0000000000000000, 0.0000970400000000 ] - [ 0.0239806000000000, -0.0322586300000000, -0.0001187400000000 ] - [ 0.0171736300000000, 0.0109103000000000, -0.0029023100000000 ] - [ -0.0004979300000000, -0.0004860600000000, -0.0002578200000000 ] - [ 0.0017089400000000, 0.0003766800000000, 0.0005733200000000 ] - [ 0.0239806000000000, 0.0322586300000000, -0.0001187400000000 ] - [ 0.0171736300000000, -0.0109103000000000, -0.0029023100000000 ] - [ -0.0004979300000000, 0.0004860600000000, -0.0002578200000000 ] - [ 0.0017089400000000, -0.0003766800000000, 0.0005733200000000 ] - [ -0.0209090100000000, 0.0035967900000000, 0.0080130900000000 ] - [ 0.0064084200000000, -0.0002667700000000, -0.0005040400000000 ] - [ -0.0121664000000000, 0.0068293700000000, -0.0015399400000000 ] - [ 0.0060834900000000, -0.0003501400000000, 0.0005642800000000 ] - [ -0.0209090100000000, -0.0035967900000000, 0.0080130900000000 ] - [ 0.0064084200000000, 0.0002667700000000, -0.0005040400000000 ] - [ -0.0121664000000000, -0.0068293700000000, -0.0015399400000000 ] - [ 0.0060834900000000, 0.0003501400000000, 0.0005642800000000 ] - [ -0.0032116100000000, 0.0000000000000000, 0.0004428600000000 ] - [ -0.0028181300000000, 0.0000000000000000, 0.0000757100000000 ] - [ -0.0002023400000000, 0.0000000000000000, -0.0000847300000000 ] - [ -0.0002941600000000, 0.0000000000000000, -0.0007410900000000 ] - [ 0.0269990100000000, -0.0112614600000000, 0.0074613100000000 ] - [ -0.0091700400000000, -0.0017193900000000, 0.0026957100000000 ] - [ 0.0018228400000000, 0.0011297900000000, 0.0019260900000000 ] - [ -0.0027065700000000, -0.0009047100000000, -0.0012858900000000 ] - [ 0.0269990100000000, 0.0112614600000000, 0.0074613100000000 ] - [ -0.0091700400000000, 0.0017193900000000, 0.0026957100000000 ] - [ 0.0018228400000000, -0.0011297900000000, 0.0019260900000000 ] - [ -0.0027065700000000, 0.0009047100000000, -0.0012858900000000 ] - [ 0.0133535400000000, 0.0041410800000000, 0.0071504200000000 ] - [ -0.0075743200000000, -0.0010964500000000, -0.0020716400000000 ] - [ 0.0038097500000000, -0.0005543900000000, -0.0013034200000000 ] - [ -0.0030229400000000, -0.0002755700000000, 0.0006877500000000 ] - [ 0.0133535400000000, -0.0041410800000000, 0.0071504200000000 ] - [ -0.0075743200000000, 0.0010964500000000, -0.0020716400000000 ] - [ 0.0038097500000000, 0.0005543900000000, -0.0013034200000000 ] - [ -0.0030229400000000, 0.0002755700000000, 0.0006877500000000 ] - [ 0.0095920400000000, 0.0000000000000000, -0.0026523300000000 ] - [ -0.0040181800000000, 0.0000000000000000, 0.0009396000000000 ] - [ 0.0050969600000000, 0.0000000000000000, -0.0031764900000000 ] - [ -0.0039015600000000, 0.0000000000000000, 0.0002845500000000 ] - [ 0.0086045200000000, 0.0000000000000000, -0.0061772500000000 ] - [ -0.0045091400000000, 0.0000000000000000, 0.0012676000000000 ] - [ 0.0149887500000000, 0.0000000000000000, -0.0102236400000000 ] - [ -0.0059469200000000, 0.0000000000000000, 0.0001966500000000 ] - [ 0.0000683600000000, -0.0018495200000000, -0.0041938300000000 ] - [ -0.0022291800000000, 0.0006855300000000, 0.0015445700000000 ] - [ -0.0000262500000000, -0.0051661200000000, 0.0058633400000000 ] - [ -0.0048193700000000, 0.0038002700000000, -0.0029664800000000 ] - [ 0.0000683600000000, 0.0018495200000000, -0.0041938300000000 ] - [ -0.0022291800000000, -0.0006855300000000, 0.0015445700000000 ] - [ -0.0000262500000000, 0.0051661200000000, 0.0058633400000000 ] - [ -0.0048193700000000, -0.0038002700000000, -0.0029664800000000 ] - [ 0.0039086100000000, 0.0003945700000000, 0.0022564600000000 ] - [ -0.0029021800000000, -0.0001317900000000, -0.0004847200000000 ] - [ 0.0134250100000000, 0.0098797900000000, -0.0051783400000000 ] - [ -0.0058713700000000, -0.0014039100000000, 0.0008544400000000 ] - [ 0.0039086100000000, -0.0003945700000000, 0.0022564600000000 ] - [ -0.0029021800000000, 0.0001317900000000, -0.0004847200000000 ] - [ 0.0134250100000000, -0.0098797900000000, -0.0051783400000000 ] - [ -0.0058713700000000, 0.0014039100000000, 0.0008544400000000 ] - [ 0.0017516100000000, 0.0000000000000000, 0.0016566400000000 ] - [ -0.0019607300000000, 0.0000000000000000, -0.0028771300000000 ] - [ 0.0354318700000000, 0.0000000000000000, 0.0039040200000000 ] - [ -0.0165684300000000, 0.0000000000000000, 0.0036746400000000 ]- atom: 1 displacement: [ -0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.1822373600000000, 0.0000000000000000, 0.0201034600000000 ] - [ -0.0168543500000000, 0.0000000000000000, -0.0009714400000000 ] - [ 0.0064130500000000, 0.0000000000000000, 0.0004892800000000 ] - [ -0.0051027100000000, 0.0000000000000000, -0.0000154900000000 ] - [ -0.0136396300000000, 0.0000000000000000, -0.0184423200000000 ] - [ -0.0136893200000000, 0.0000000000000000, 0.0177132100000000 ] - [ -0.0067117500000000, 0.0000000000000000, 0.0127995400000000 ] - [ -0.0066551600000000, 0.0000000000000000, -0.0187138800000000 ] - [ -0.0000612400000000, 0.0000000000000000, 0.0055537900000000 ] - [ -0.0053168200000000, 0.0000000000000000, -0.0037466700000000 ] - [ -0.0000373600000000, 0.0000000000000000, -0.0057132600000000 ] - [ -0.0052981400000000, 0.0000000000000000, 0.0035270900000000 ] - [ 0.0054262700000000, 0.0000000000000000, -0.0011610300000000 ] - [ -0.0040260800000000, 0.0000000000000000, 0.0001055500000000 ] - [ 0.0205482500000000, 0.0000000000000000, 0.0080756900000000 ] - [ -0.0089180200000000, 0.0000000000000000, -0.0001565900000000 ] - [ -0.0241875600000000, 0.0328261800000000, 0.0001235100000000 ] - [ -0.0171286200000000, -0.0107361300000000, 0.0029109500000000 ] - [ 0.0005152700000000, 0.0005137700000000, 0.0002554400000000 ] - [ -0.0017418300000000, -0.0003795200000000, -0.0005729500000000 ] - [ -0.0241875600000000, -0.0328261800000000, 0.0001235100000000 ] - [ -0.0171286200000000, 0.0107361300000000, 0.0029109500000000 ] - [ 0.0005152700000000, -0.0005137700000000, 0.0002554400000000 ] - [ -0.0017418300000000, 0.0003795200000000, -0.0005729500000000 ] - [ 0.0208999500000000, -0.0036854900000000, -0.0080807400000000 ] - [ -0.0063985500000000, 0.0002728700000000, 0.0005521100000000 ] - [ 0.0121419000000000, -0.0069410500000000, 0.0016432200000000 ] - [ -0.0060998800000000, 0.0003730100000000, -0.0005855700000000 ] - [ 0.0208999500000000, 0.0036854900000000, -0.0080807400000000 ] - [ -0.0063985500000000, -0.0002728700000000, 0.0005521100000000 ] - [ 0.0121419000000000, 0.0069410500000000, 0.0016432200000000 ] - [ -0.0060998800000000, -0.0003730100000000, -0.0005855700000000 ] - [ 0.0032135900000000, 0.0000000000000000, -0.0003745100000000 ] - [ 0.0027495400000000, 0.0000000000000000, 0.0000029400000000 ] - [ 0.0001872500000000, 0.0000000000000000, 0.0001680600000000 ] - [ 0.0002462600000000, 0.0000000000000000, 0.0007468600000000 ] - [ -0.0261697900000000, 0.0103104900000000, -0.0068768800000000 ] - [ 0.0092333700000000, 0.0017404000000000, -0.0027782700000000 ] - [ -0.0017581900000000, -0.0011865200000000, -0.0020022500000000 ] - [ 0.0026933300000000, 0.0008657500000000, 0.0012582100000000 ] - [ -0.0261697900000000, -0.0103104900000000, -0.0068768800000000 ] - [ 0.0092333700000000, -0.0017404000000000, -0.0027782700000000 ] - [ -0.0017581900000000, 0.0011865200000000, -0.0020022500000000 ] - [ 0.0026933300000000, -0.0008657500000000, 0.0012582100000000 ] - [ -0.0136610600000000, -0.0039413000000000, -0.0069039000000000 ] - [ 0.0075969800000000, 0.0010885600000000, 0.0021072300000000 ] - [ -0.0038506900000000, 0.0005997200000000, 0.0013392600000000 ] - [ 0.0030638600000000, 0.0003383200000000, -0.0006413400000000 ] - [ -0.0136610600000000, 0.0039413000000000, -0.0069039000000000 ] - [ 0.0075969800000000, -0.0010885600000000, 0.0021072300000000 ] - [ -0.0038506900000000, -0.0005997200000000, 0.0013392600000000 ] - [ 0.0030638600000000, -0.0003383200000000, -0.0006413400000000 ] - [ -0.0096871100000000, 0.0000000000000000, 0.0025555300000000 ] - [ 0.0039887300000000, 0.0000000000000000, -0.0010089300000000 ] - [ -0.0050903600000000, 0.0000000000000000, 0.0031068600000000 ] - [ 0.0038922700000000, 0.0000000000000000, -0.0002696600000000 ] - [ -0.0085537200000000, 0.0000000000000000, 0.0062591500000000 ] - [ 0.0045655000000000, 0.0000000000000000, -0.0011909700000000 ] - [ -0.0148928600000000, 0.0000000000000000, 0.0101371300000000 ] - [ 0.0059960500000000, 0.0000000000000000, -0.0000583200000000 ] - [ -0.0000702300000000, 0.0018242400000000, 0.0041577500000000 ] - [ 0.0021879900000000, -0.0007023900000000, -0.0015900200000000 ] - [ 0.0000468900000000, 0.0051216900000000, -0.0058747400000000 ] - [ 0.0047796900000000, -0.0038387100000000, 0.0029471900000000 ] - [ -0.0000702300000000, -0.0018242400000000, 0.0041577500000000 ] - [ 0.0021879900000000, 0.0007023900000000, -0.0015900200000000 ] - [ 0.0000468900000000, -0.0051216900000000, -0.0058747400000000 ] - [ 0.0047796900000000, 0.0038387100000000, 0.0029471900000000 ] - [ -0.0039393700000000, -0.0004074700000000, -0.0022384100000000 ] - [ 0.0028988000000000, 0.0001143500000000, 0.0005281200000000 ] - [ -0.0136440000000000, -0.0097553200000000, 0.0051972800000000 ] - [ 0.0058649900000000, 0.0013784300000000, -0.0008425900000000 ] - [ -0.0039393700000000, 0.0004074700000000, -0.0022384100000000 ] - [ 0.0028988000000000, -0.0001143500000000, 0.0005281200000000 ] - [ -0.0136440000000000, 0.0097553200000000, 0.0051972800000000 ] - [ 0.0058649900000000, -0.0013784300000000, -0.0008425900000000 ] - [ -0.0017279900000000, 0.0000000000000000, -0.0018219800000000 ] - [ 0.0020195900000000, 0.0000000000000000, 0.0028008900000000 ] - [ -0.0381575700000000, 0.0000000000000000, -0.0048479000000000 ] - [ 0.0163900100000000, 0.0000000000000000, -0.0037172900000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ -0.0002977300000000, -0.1410791400000000, -0.0009546600000000 ] - [ 0.0000407300000000, -0.0021078200000000, 0.0000217000000000 ] - [ 0.0000293900000000, -0.0018861200000000, 0.0000503100000000 ] - [ 0.0000242300000000, -0.0005326200000000, 0.0000363400000000 ] - [ 0.0000089200000000, -0.0119243700000000, -0.0000212200000000 ] - [ 0.0000376700000000, -0.0119212700000000, -0.0000624100000000 ] - [ -0.0000239000000000, -0.0038854200000000, -0.0000085900000000 ] - [ 0.0000418200000000, -0.0038769800000000, 0.0000301900000000 ] - [ -0.0000391200000000, 0.0098447800000000, 0.0000474100000000 ] - [ -0.0000167000000000, 0.0038929800000000, 0.0000285300000000 ] - [ -0.0000546100000000, 0.0098620600000000, -0.0000005500000000 ] - [ 0.0000020700000000, 0.0038955400000000, 0.0000137700000000 ] - [ -0.0000215000000000, 0.0020132900000000, -0.0000196800000000 ] - [ -0.0000235100000000, 0.0007349800000000, -0.0000292000000000 ] - [ 0.0000523600000000, 0.0414953600000000, -0.0000341600000000 ] - [ -0.0000297100000000, 0.0018897400000000, -0.0000293000000000 ] - [ -0.0311489700000000, 0.0091673900000000, -0.0022268500000000 ] - [ 0.0140602300000000, 0.0036145500000000, -0.0036054500000000 ] - [ -0.0010466800000000, 0.0000344600000000, 0.0001804800000000 ] - [ 0.0005681000000000, -0.0002016200000000, 0.0004980700000000 ] - [ 0.0308120700000000, 0.0092622000000000, 0.0022148600000000 ] - [ -0.0139822300000000, 0.0036366400000000, 0.0036050200000000 ] - [ 0.0010434500000000, 0.0000274300000000, -0.0001721300000000 ] - [ -0.0005797800000000, -0.0001917600000000, -0.0004869500000000 ] - [ 0.0026776400000000, 0.0102236400000000, 0.0248914300000000 ] - [ 0.0001467000000000, 0.0002792400000000, 0.0009356300000000 ] - [ 0.0048658700000000, 0.0013139300000000, -0.0192456800000000 ] - [ -0.0003851700000000, -0.0002316100000000, -0.0005913300000000 ] - [ -0.0026530600000000, 0.0102255500000000, -0.0246714200000000 ] - [ -0.0001355100000000, 0.0002797900000000, -0.0009418300000000 ] - [ -0.0048211800000000, 0.0014745400000000, 0.0190799000000000 ] - [ 0.0003874600000000, -0.0002181600000000, 0.0005895700000000 ] - [ -0.0000631700000000, -0.0070570700000000, 0.0000340200000000 ] - [ -0.0000198300000000, -0.0077538500000000, 0.0000289500000000 ] - [ -0.0000388300000000, -0.0007957800000000, 0.0000479600000000 ] - [ -0.0000470900000000, -0.0003732700000000, 0.0000402100000000 ] - [ -0.0108269300000000, 0.0270189000000000, -0.0096241400000000 ] - [ -0.0020537400000000, 0.0004592200000000, -0.0004547700000000 ] - [ -0.0003628100000000, 0.0007721100000000, -0.0000355200000000 ] - [ -0.0002439400000000, 0.0001313200000000, -0.0001215100000000 ] - [ 0.0117668600000000, 0.0279008900000000, 0.0102330300000000 ] - [ 0.0020627800000000, 0.0004826300000000, 0.0004492800000000 ] - [ 0.0004056800000000, 0.0008038200000000, -0.0000248900000000 ] - [ 0.0002417700000000, 0.0001382600000000, 0.0000785900000000 ] - [ 0.0049498800000000, 0.0098166600000000, -0.0047158900000000 ] - [ -0.0033581800000000, 0.0004028900000000, -0.0012426300000000 ] - [ 0.0008106300000000, 0.0010975100000000, 0.0028143200000000 ] - [ -0.0001959200000000, 0.0000817500000000, 0.0002162000000000 ] - [ -0.0051878300000000, 0.0093831900000000, 0.0050604800000000 ] - [ 0.0033658300000000, 0.0004037400000000, 0.0012810100000000 ] - [ -0.0008021800000000, 0.0010568100000000, -0.0027601000000000 ] - [ 0.0002077000000000, 0.0000734000000000, -0.0002058300000000 ] - [ -0.0000420700000000, -0.0111476100000000, -0.0000745700000000 ] - [ -0.0000487400000000, -0.0009746300000000, -0.0000404800000000 ] - [ -0.0000528200000000, -0.0056039700000000, -0.0000170000000000 ] - [ -0.0000520600000000, -0.0004106000000000, -0.0000375400000000 ] - [ 0.0000572500000000, 0.0084867600000000, 0.0000469400000000 ] - [ 0.0000450100000000, 0.0005950500000000, 0.0000460600000000 ] - [ 0.0000537800000000, 0.0152734300000000, 0.0000325300000000 ] - [ 0.0000273200000000, 0.0005952700000000, 0.0000349400000000 ] - [ -0.0010810800000000, -0.0010667100000000, -0.0032856300000000 ] - [ 0.0007818600000000, -0.0003809900000000, -0.0007631600000000 ] - [ -0.0054171100000000, -0.0041339000000000, 0.0049796900000000 ] - [ 0.0026883300000000, 0.0000228200000000, 0.0009031400000000 ] - [ 0.0010610900000000, -0.0010809900000000, 0.0032444800000000 ] - [ -0.0008070700000000, -0.0003838900000000, 0.0007376600000000 ] - [ 0.0053307200000000, -0.0041494100000000, -0.0049475900000000 ] - [ -0.0026738700000000, -0.0000212000000000, -0.0009207700000000 ] - [ -0.0006053900000000, -0.0012633500000000, -0.0022622800000000 ] - [ -0.0001515100000000, -0.0001596100000000, -0.0002382500000000 ] - [ 0.0055338900000000, -0.0134636900000000, 0.0100377600000000 ] - [ -0.0005262000000000, -0.0000888900000000, 0.0000690200000000 ] - [ 0.0006044100000000, -0.0012731900000000, 0.0022702900000000 ] - [ 0.0001317900000000, -0.0001621700000000, 0.0002635700000000 ] - [ -0.0056078200000000, -0.0138896800000000, -0.0100644600000000 ] - [ 0.0005069400000000, -0.0001059100000000, -0.0000413300000000 ] - [ 0.0000466100000000, 0.0013119900000000, -0.0000509600000000 ] - [ 0.0000519800000000, 0.0001646300000000, -0.0000488000000000 ] - [ -0.0000682500000000, 0.0182436800000000, -0.0000667000000000 ] - [ 0.0000629800000000, 0.0059124100000000, -0.0000270800000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ -0.0210684800000000, 0.0000000000000000, -0.1607587400000000 ] - [ 0.0010316400000000, 0.0000000000000000, -0.0053793300000000 ] - [ -0.0004397700000000, 0.0000000000000000, 0.0208374800000000 ] - [ 0.0000633800000000, 0.0000000000000000, 0.0045909700000000 ] - [ 0.0177118000000000, 0.0000000000000000, 0.0075989400000000 ] - [ -0.0185308900000000, 0.0000000000000000, 0.0076292700000000 ] - [ -0.0185117700000000, 0.0000000000000000, 0.0091611200000000 ] - [ 0.0128394500000000, 0.0000000000000000, 0.0091887000000000 ] - [ -0.0057795600000000, 0.0000000000000000, 0.0052422400000000 ] - [ 0.0034872200000000, 0.0000000000000000, 0.0012591600000000 ] - [ 0.0054782700000000, 0.0000000000000000, 0.0052807300000000 ] - [ -0.0037747000000000, 0.0000000000000000, 0.0012863000000000 ] - [ 0.0011098800000000, 0.0000000000000000, 0.0091151300000000 ] - [ -0.0001743500000000, 0.0000000000000000, 0.0041242100000000 ] - [ -0.0081409000000000, 0.0000000000000000, -0.0211671100000000 ] - [ 0.0001070800000000, 0.0000000000000000, -0.0046440700000000 ] - [ 0.0017812900000000, -0.0038179400000000, -0.0214500700000000 ] - [ 0.0037988400000000, 0.0000801700000000, -0.0119290000000000 ] - [ 0.0001231900000000, 0.0002727000000000, 0.0068298400000000 ] - [ -0.0003541100000000, 0.0001694300000000, 0.0056042500000000 ] - [ 0.0017812900000000, 0.0038179400000000, -0.0214500700000000 ] - [ 0.0037988400000000, -0.0000801700000000, -0.0119290000000000 ] - [ 0.0001231900000000, -0.0002727000000000, 0.0068298400000000 ] - [ -0.0003541100000000, -0.0001694300000000, 0.0056042500000000 ] - [ 0.0056201600000000, 0.0225615800000000, 0.0222984500000000 ] - [ -0.0003432200000000, 0.0007579200000000, 0.0002533600000000 ] - [ -0.0026271600000000, -0.0237730600000000, 0.0198127900000000 ] - [ 0.0004588800000000, -0.0001905400000000, 0.0003144900000000 ] - [ 0.0056201600000000, -0.0225615800000000, 0.0222984500000000 ] - [ -0.0003432200000000, -0.0007579200000000, 0.0002533600000000 ] - [ -0.0026271600000000, 0.0237730600000000, 0.0198127900000000 ] - [ 0.0004588800000000, 0.0001905400000000, 0.0003144900000000 ] - [ -0.0007781700000000, 0.0000000000000000, 0.0052353400000000 ] - [ 0.0009701100000000, 0.0000000000000000, 0.0080543400000000 ] - [ -0.0004021900000000, 0.0000000000000000, -0.0033918000000000 ] - [ -0.0009371300000000, 0.0000000000000000, -0.0046948400000000 ] - [ 0.0059291600000000, -0.0072419000000000, 0.0183315600000000 ] - [ 0.0017958400000000, -0.0008232200000000, 0.0041073200000000 ] - [ 0.0024173700000000, -0.0025994200000000, -0.0085634600000000 ] - [ -0.0007564100000000, -0.0001859900000000, -0.0024420900000000 ] - [ 0.0059291600000000, 0.0072419000000000, 0.0183315600000000 ] - [ 0.0017958400000000, 0.0008232200000000, 0.0041073200000000 ] - [ 0.0024173700000000, 0.0025994200000000, -0.0085634600000000 ] - [ -0.0007564100000000, 0.0001859900000000, -0.0024420900000000 ] - [ 0.0076394000000000, -0.0044362000000000, 0.0098058500000000 ] - [ -0.0032740100000000, -0.0005135300000000, 0.0013415100000000 ] - [ -0.0041835000000000, 0.0015743700000000, -0.0079486100000000 ] - [ 0.0018274700000000, 0.0012661700000000, -0.0025205800000000 ] - [ 0.0076394000000000, 0.0044362000000000, 0.0098058500000000 ] - [ -0.0032740100000000, 0.0005135300000000, 0.0013415100000000 ] - [ -0.0041835000000000, -0.0015743700000000, -0.0079486100000000 ] - [ 0.0018274700000000, -0.0012661700000000, -0.0025205800000000 ] - [ -0.0012735000000000, 0.0000000000000000, -0.0001975000000000 ] - [ -0.0005513200000000, 0.0000000000000000, 0.0007772800000000 ] - [ 0.0009573800000000, 0.0000000000000000, -0.0045856100000000 ] - [ 0.0004713300000000, 0.0000000000000000, -0.0012087400000000 ] - [ -0.0048166100000000, 0.0000000000000000, -0.0219771000000000 ] - [ 0.0020112900000000, 0.0000000000000000, -0.0014271100000000 ] - [ -0.0052728900000000, 0.0000000000000000, 0.0499368800000000 ] - [ -0.0015486000000000, 0.0000000000000000, 0.0005617300000000 ] - [ -0.0025969300000000, -0.0024961500000000, -0.0048590300000000 ] - [ 0.0023970600000000, -0.0005877800000000, -0.0029122100000000 ] - [ 0.0063859300000000, 0.0057770100000000, 0.0041898800000000 ] - [ -0.0032010700000000, 0.0012710400000000, 0.0009413500000000 ] - [ -0.0025969300000000, 0.0024961500000000, -0.0048590300000000 ] - [ 0.0023970600000000, 0.0005877800000000, -0.0029122100000000 ] - [ 0.0063859300000000, -0.0057770100000000, 0.0041898800000000 ] - [ -0.0032010700000000, -0.0012710400000000, 0.0009413500000000 ] - [ 0.0007846400000000, -0.0016172900000000, -0.0065436700000000 ] - [ -0.0001591800000000, -0.0001578000000000, -0.0018108400000000 ] - [ -0.0040316700000000, 0.0116536300000000, 0.0084123600000000 ] - [ 0.0004189800000000, 0.0001670100000000, 0.0022193400000000 ] - [ 0.0007846400000000, 0.0016172900000000, -0.0065436700000000 ] - [ -0.0001591800000000, 0.0001578000000000, -0.0018108400000000 ] - [ -0.0040316700000000, -0.0116536300000000, 0.0084123600000000 ] - [ 0.0004189800000000, -0.0001670100000000, 0.0022193400000000 ] - [ 0.0001428000000000, 0.0000000000000000, -0.0056283400000000 ] - [ -0.0016140400000000, 0.0000000000000000, -0.0051902200000000 ] - [ 0.0041078600000000, 0.0000000000000000, 0.0154183600000000 ] - [ 0.0034234800000000, 0.0000000000000000, 0.0079867400000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0198254400000000, 0.0000000000000000, 0.1638885500000000 ] - [ -0.0009830800000000, 0.0000000000000000, 0.0054510100000000 ] - [ 0.0004449700000000, 0.0000000000000000, -0.0207573000000000 ] - [ -0.0000124200000000, 0.0000000000000000, -0.0045573700000000 ] - [ -0.0175266300000000, 0.0000000000000000, -0.0077236200000000 ] - [ 0.0184828800000000, 0.0000000000000000, -0.0076991600000000 ] - [ 0.0187102100000000, 0.0000000000000000, -0.0092638400000000 ] - [ -0.0129300700000000, 0.0000000000000000, -0.0092389500000000 ] - [ 0.0057450300000000, 0.0000000000000000, -0.0052400900000000 ] - [ -0.0035433500000000, 0.0000000000000000, -0.0012499300000000 ] - [ -0.0055475000000000, 0.0000000000000000, -0.0052047800000000 ] - [ 0.0037698000000000, 0.0000000000000000, -0.0012312300000000 ] - [ -0.0011624000000000, 0.0000000000000000, -0.0091842200000000 ] - [ 0.0001201200000000, 0.0000000000000000, -0.0041877600000000 ] - [ 0.0081048400000000, 0.0000000000000000, 0.0212126600000000 ] - [ -0.0001351400000000, 0.0000000000000000, 0.0046087700000000 ] - [ -0.0016440800000000, 0.0036936900000000, 0.0215054800000000 ] - [ -0.0038679000000000, -0.0001006200000000, 0.0119725600000000 ] - [ -0.0001547300000000, -0.0002393800000000, -0.0068815400000000 ] - [ 0.0003796100000000, -0.0001682100000000, -0.0056161400000000 ] - [ -0.0016440800000000, -0.0036936900000000, 0.0215054800000000 ] - [ -0.0038679000000000, 0.0001006200000000, 0.0119725600000000 ] - [ -0.0001547300000000, 0.0002393800000000, -0.0068815400000000 ] - [ 0.0003796100000000, 0.0001682100000000, -0.0056161400000000 ] - [ -0.0055949300000000, -0.0222273100000000, -0.0221911900000000 ] - [ 0.0003717900000000, -0.0007584300000000, -0.0002570100000000 ] - [ 0.0026627600000000, 0.0241326800000000, -0.0200023300000000 ] - [ -0.0004603500000000, 0.0002073300000000, -0.0002984300000000 ] - [ -0.0055949300000000, 0.0222273100000000, -0.0221911900000000 ] - [ 0.0003717900000000, 0.0007584300000000, -0.0002570100000000 ] - [ 0.0026627600000000, -0.0241326800000000, -0.0200023300000000 ] - [ -0.0004603500000000, -0.0002073300000000, -0.0002984300000000 ] - [ 0.0007096200000000, 0.0000000000000000, -0.0051414300000000 ] - [ -0.0010570100000000, 0.0000000000000000, -0.0079518200000000 ] - [ 0.0003014100000000, 0.0000000000000000, 0.0035110300000000 ] - [ 0.0008584600000000, 0.0000000000000000, 0.0048318600000000 ] - [ -0.0055702300000000, 0.0069540000000000, -0.0182505300000000 ] - [ -0.0017988200000000, 0.0008344400000000, -0.0041495500000000 ] - [ -0.0024336600000000, 0.0026313900000000, 0.0085442700000000 ] - [ 0.0007742200000000, 0.0002029700000000, 0.0023987600000000 ] - [ -0.0055702300000000, -0.0069540000000000, -0.0182505300000000 ] - [ -0.0017988200000000, -0.0008344400000000, -0.0041495500000000 ] - [ -0.0024336600000000, -0.0026313900000000, 0.0085442700000000 ] - [ 0.0007742200000000, -0.0002029700000000, 0.0023987600000000 ] - [ -0.0079659700000000, 0.0047999700000000, -0.0092165200000000 ] - [ 0.0033029600000000, 0.0004965100000000, -0.0012814700000000 ] - [ 0.0042535600000000, -0.0016239900000000, 0.0080307400000000 ] - [ -0.0018447500000000, -0.0012957200000000, 0.0025639900000000 ] - [ -0.0079659700000000, -0.0047999700000000, -0.0092165200000000 ] - [ 0.0033029600000000, -0.0004965100000000, -0.0012814700000000 ] - [ 0.0042535600000000, 0.0016239900000000, 0.0080307400000000 ] - [ -0.0018447500000000, 0.0012957200000000, 0.0025639900000000 ] - [ 0.0011701900000000, 0.0000000000000000, 0.0000971300000000 ] - [ 0.0004484100000000, 0.0000000000000000, -0.0008878200000000 ] - [ -0.0010383100000000, 0.0000000000000000, 0.0044524200000000 ] - [ -0.0005776100000000, 0.0000000000000000, 0.0010722700000000 ] - [ 0.0048252700000000, 0.0000000000000000, 0.0218574100000000 ] - [ -0.0019255700000000, 0.0000000000000000, 0.0015586400000000 ] - [ 0.0063689700000000, 0.0000000000000000, -0.0535662600000000 ] - [ 0.0016466900000000, 0.0000000000000000, -0.0004664100000000 ] - [ 0.0025796200000000, 0.0024933900000000, 0.0048437100000000 ] - [ -0.0024252500000000, 0.0006056600000000, 0.0028948800000000 ] - [ -0.0064416300000000, -0.0058180000000000, -0.0042797200000000 ] - [ 0.0031996200000000, -0.0012489300000000, -0.0010029700000000 ] - [ 0.0025796200000000, -0.0024933900000000, 0.0048437100000000 ] - [ -0.0024252500000000, -0.0006056600000000, 0.0028948800000000 ] - [ -0.0064416300000000, 0.0058180000000000, -0.0042797200000000 ] - [ 0.0031996200000000, 0.0012489300000000, -0.0010029700000000 ] - [ -0.0007635300000000, 0.0016079200000000, 0.0066198400000000 ] - [ 0.0001423700000000, 0.0001757200000000, 0.0018635800000000 ] - [ 0.0040142500000000, -0.0116334200000000, -0.0085560800000000 ] - [ -0.0004296400000000, -0.0001443300000000, -0.0021834000000000 ] - [ -0.0007635300000000, -0.0016079200000000, 0.0066198400000000 ] - [ 0.0001423700000000, -0.0001757200000000, 0.0018635800000000 ] - [ 0.0040142500000000, 0.0116334200000000, -0.0085560800000000 ] - [ -0.0004296400000000, 0.0001443300000000, -0.0021834000000000 ] - [ -0.0000236200000000, 0.0000000000000000, 0.0055358100000000 ] - [ 0.0016845300000000, 0.0000000000000000, 0.0050870200000000 ] - [ -0.0040073700000000, 0.0000000000000000, -0.0156094300000000 ] - [ -0.0033173500000000, 0.0000000000000000, -0.0081450400000000 ]- atom: 17 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0242170000000000, -0.0311898100000000, 0.0017652000000000 ] - [ 0.0171087300000000, 0.0139856700000000, 0.0038922400000000 ] - [ -0.0004880700000000, -0.0010438400000000, 0.0001491000000000 ] - [ 0.0017267400000000, 0.0005910800000000, -0.0003454900000000 ] - [ 0.0064069900000000, 0.0001297000000000, 0.0003389800000000 ] - [ -0.0208531700000000, 0.0026788900000000, -0.0056892800000000 ] - [ 0.0060951100000000, -0.0004014600000000, -0.0004954700000000 ] - [ -0.0121455300000000, 0.0048838500000000, 0.0026542700000000 ] - [ -0.0122044200000000, 0.0048360700000000, 0.0026547200000000 ] - [ 0.0061137800000000, -0.0004053000000000, -0.0004325400000000 ] - [ -0.0209799500000000, 0.0026449900000000, -0.0055147600000000 ] - [ 0.0063803000000000, 0.0001330300000000, 0.0003756800000000 ] - [ 0.0017211900000000, 0.0005791800000000, -0.0003628600000000 ] - [ -0.0005103600000000, -0.0010207000000000, 0.0001263800000000 ] - [ 0.0171976000000000, 0.0140586300000000, 0.0037897100000000 ] - [ 0.0239561100000000, -0.0307699700000000, 0.0016602900000000 ] - [ -0.1907005400000000, 0.0292144000000000, -0.0082161300000000 ] - [ 0.0087896600000000, -0.0006335600000000, -0.0000135500000000 ] - [ -0.0058767000000000, 0.0003998000000000, -0.0000325600000000 ] - [ 0.0031999200000000, -0.0000472800000000, -0.0000166300000000 ] - [ -0.0053482400000000, -0.0025849800000000, 0.0015914500000000 ] - [ 0.0056445800000000, 0.0009107300000000, -0.0006665400000000 ] - [ -0.0025771900000000, -0.0000819900000000, 0.0001435700000000 ] - [ 0.0028982700000000, 0.0000829000000000, 0.0000950000000000 ] - [ 0.0096341300000000, 0.0008747600000000, 0.0083610800000000 ] - [ 0.0096461600000000, -0.0028845300000000, -0.0145951600000000 ] - [ 0.0096963900000000, -0.0028408800000000, -0.0146458500000000 ] - [ 0.0096656200000000, 0.0009264600000000, 0.0082874500000000 ] - [ -0.0000169400000000, 0.0008163600000000, 0.0017143100000000 ] - [ 0.0000046100000000, -0.0000847400000000, -0.0016788000000000 ] - [ 0.0000145100000000, -0.0001099400000000, -0.0017006500000000 ] - [ 0.0000055600000000, 0.0007650900000000, 0.0017212000000000 ] - [ -0.0054204900000000, 0.0002497800000000, -0.0009509100000000 ] - [ 0.0212590100000000, -0.0007450500000000, 0.0009722200000000 ] - [ -0.0021190100000000, -0.0000183900000000, -0.0005015100000000 ] - [ 0.0024452500000000, 0.0006089800000000, 0.0012247900000000 ] - [ -0.0038432700000000, 0.0001720200000000, -0.0014122700000000 ] - [ 0.0033408200000000, -0.0027287500000000, 0.0002388000000000 ] - [ -0.0014923600000000, -0.0000784700000000, 0.0009907500000000 ] - [ 0.0013163200000000, -0.0003244100000000, -0.0009797700000000 ] - [ -0.0077068500000000, 0.0011088500000000, -0.0019489500000000 ] - [ 0.0250899200000000, -0.0009305300000000, -0.0037427600000000 ] - [ -0.0017256000000000, 0.0001603000000000, 0.0011861600000000 ] - [ 0.0005562900000000, -0.0013879200000000, -0.0041009100000000 ] - [ 0.0304275700000000, -0.0007295900000000, 0.0090476200000000 ] - [ -0.0084945300000000, -0.0001611400000000, 0.0011093000000000 ] - [ 0.0054370000000000, 0.0014282700000000, 0.0043304300000000 ] - [ -0.0028171700000000, -0.0002043800000000, -0.0005616000000000 ] - [ 0.0041072400000000, 0.0032105300000000, -0.0007335500000000 ] - [ -0.0035712600000000, -0.0004303900000000, 0.0007359900000000 ] - [ 0.0029450400000000, -0.0002158800000000, 0.0001315100000000 ] - [ -0.0024494700000000, 0.0001006800000000, -0.0004977600000000 ] - [ -0.0007365900000000, -0.0037546100000000, -0.0033409600000000 ] - [ -0.0036061400000000, 0.0044399700000000, 0.0040916200000000 ] - [ -0.0005490700000000, -0.0044768000000000, 0.0057327400000000 ] - [ -0.0025723100000000, 0.0019785700000000, -0.0022692500000000 ] - [ -0.0024517900000000, 0.0019366200000000, -0.0022886800000000 ] - [ -0.0004613400000000, -0.0044624100000000, 0.0057541700000000 ] - [ -0.0035357700000000, 0.0044795400000000, 0.0041455600000000 ] - [ -0.0006717100000000, -0.0037642300000000, -0.0033377100000000 ] - [ -0.0028659200000000, -0.0001931300000000, -0.0006070800000000 ] - [ 0.0054074600000000, 0.0014154600000000, 0.0043013600000000 ] - [ -0.0084814400000000, -0.0001360800000000, 0.0010991400000000 ] - [ 0.0296970600000000, -0.0004335500000000, 0.0079651600000000 ] - [ -0.0025115900000000, 0.0001354400000000, -0.0005024300000000 ] - [ 0.0029282900000000, -0.0002434600000000, 0.0000906800000000 ] - [ -0.0035620400000000, -0.0004706200000000, 0.0007131000000000 ] - [ 0.0040657300000000, 0.0031813300000000, -0.0007795300000000 ] - [ 0.0005224000000000, -0.0013825600000000, -0.0040748900000000 ] - [ -0.0017471200000000, 0.0001730100000000, 0.0012046400000000 ] - [ 0.0274286000000000, -0.0003903500000000, -0.0052043900000000 ] - [ -0.0077165100000000, 0.0011140900000000, -0.0018967900000000 ] - [ 0.0013153200000000, -0.0003343100000000, -0.0009685600000000 ] - [ -0.0015299400000000, -0.0000992000000000, 0.0010389200000000 ] - [ 0.0033330400000000, -0.0027757100000000, 0.0002745200000000 ] - [ -0.0038692500000000, 0.0001677500000000, -0.0014124400000000 ] - [ 0.0025333200000000, 0.0006391800000000, 0.0012189900000000 ] - [ -0.0020418500000000, -0.0000443000000000, -0.0005331000000000 ] - [ 0.0212988000000000, -0.0004437400000000, 0.0010543900000000 ] - [ -0.0053259600000000, 0.0002469700000000, -0.0009211200000000 ]- atom: 17 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ -0.0323977300000000, 0.0092134200000000, -0.0037392500000000 ] - [ 0.0108272000000000, 0.0036646200000000, 0.0001031900000000 ] - [ -0.0004889900000000, 0.0000259200000000, 0.0002614100000000 ] - [ 0.0004056400000000, -0.0002048300000000, 0.0001644800000000 ] - [ -0.0002443800000000, 0.0002859000000000, -0.0007581700000000 ] - [ 0.0036452400000000, 0.0102283400000000, -0.0223038800000000 ] - [ -0.0003526800000000, -0.0002207600000000, 0.0001928900000000 ] - [ 0.0068914800000000, 0.0014215000000000, 0.0238969200000000 ] - [ 0.0068598400000000, 0.0013825100000000, 0.0240055200000000 ] - [ -0.0003908300000000, -0.0002274700000000, 0.0001976500000000 ] - [ 0.0036347500000000, 0.0102171000000000, -0.0224970600000000 ] - [ -0.0002971700000000, 0.0002634900000000, -0.0007528500000000 ] - [ 0.0003622100000000, -0.0002101600000000, 0.0001607200000000 ] - [ -0.0005383000000000, 0.0000219200000000, 0.0002543300000000 ] - [ 0.0108300700000000, 0.0035985000000000, 0.0000741000000000 ] - [ -0.0326945400000000, 0.0092090000000000, -0.0037681400000000 ] - [ 0.0292292600000000, -0.2107454200000000, 0.0083462400000000 ] - [ -0.0006394500000000, -0.0011903000000000, 0.0017242000000000 ] - [ 0.0003917600000000, -0.0015676600000000, 0.0001418900000000 ] - [ -0.0000411900000000, -0.0001865100000000, -0.0000352300000000 ] - [ 0.0025723200000000, 0.0415344500000000, -0.0085943900000000 ] - [ -0.0009071700000000, 0.0009724400000000, 0.0008930400000000 ] - [ 0.0000644700000000, 0.0018875200000000, 0.0012073900000000 ] - [ -0.0000785800000000, 0.0002268900000000, 0.0001106900000000 ] - [ -0.0028953000000000, -0.0023160000000000, -0.0019315800000000 ] - [ 0.0009125500000000, -0.0023115200000000, -0.0032115900000000 ] - [ 0.0008912200000000, -0.0022844600000000, -0.0031826300000000 ] - [ -0.0028653800000000, -0.0022841800000000, -0.0019264100000000 ] - [ 0.0001012200000000, 0.0019526900000000, -0.0008049400000000 ] - [ -0.0008011200000000, 0.0019547400000000, -0.0001228400000000 ] - [ -0.0007804200000000, 0.0019428800000000, -0.0001416900000000 ] - [ 0.0000794000000000, 0.0019358500000000, -0.0008219000000000 ] - [ -0.0001453300000000, 0.0000422200000000, -0.0005054400000000 ] - [ -0.0003565700000000, 0.0408682600000000, 0.0036878200000000 ] - [ -0.0000563000000000, -0.0000179300000000, 0.0002995200000000 ] - [ 0.0005240000000000, 0.0000213300000000, 0.0012675100000000 ] - [ 0.0011111500000000, -0.0022509100000000, 0.0007837000000000 ] - [ -0.0007388200000000, -0.0102332900000000, 0.0019334500000000 ] - [ 0.0001066400000000, -0.0003730700000000, -0.0001612500000000 ] - [ -0.0008598700000000, -0.0017290000000000, -0.0007014500000000 ] - [ 0.0019126500000000, 0.0023776500000000, -0.0000631900000000 ] - [ 0.0005213400000000, 0.0190064400000000, -0.0009424400000000 ] - [ 0.0000774100000000, 0.0004380000000000, -0.0000250900000000 ] - [ -0.0006325300000000, 0.0024095700000000, 0.0010682200000000 ] - [ -0.0014784300000000, 0.0208846700000000, -0.0012380000000000 ] - [ -0.0017233100000000, 0.0004033200000000, 0.0002585800000000 ] - [ 0.0008004600000000, 0.0025133900000000, 0.0007924900000000 ] - [ -0.0001569800000000, 0.0005592000000000, 0.0001607800000000 ] - [ 0.0000244800000000, -0.0102215000000000, 0.0032995600000000 ] - [ -0.0000930800000000, -0.0006265800000000, 0.0001278100000000 ] - [ 0.0007507200000000, -0.0020283800000000, -0.0006283200000000 ] - [ -0.0002333500000000, -0.0005543500000000, 0.0000818800000000 ] - [ -0.0025040000000000, 0.0012314700000000, -0.0017854900000000 ] - [ 0.0023682300000000, 0.0016140200000000, -0.0018908100000000 ] - [ -0.0006665900000000, -0.0006450700000000, 0.0005656100000000 ] - [ 0.0000712200000000, -0.0005472400000000, 0.0004781800000000 ] - [ 0.0001933800000000, -0.0005281800000000, 0.0006573800000000 ] - [ -0.0005530500000000, -0.0006845700000000, 0.0007270300000000 ] - [ 0.0024536200000000, 0.0015884600000000, -0.0017398000000000 ] - [ -0.0023404900000000, 0.0012503800000000, -0.0015903800000000 ] - [ -0.0001379300000000, 0.0006004100000000, 0.0001022500000000 ] - [ 0.0008170500000000, 0.0025807100000000, 0.0007535800000000 ] - [ -0.0016900800000000, 0.0004401000000000, 0.0001972800000000 ] - [ -0.0013904000000000, 0.0208634500000000, -0.0011566500000000 ] - [ -0.0001853600000000, -0.0006278100000000, 0.0000483000000000 ] - [ 0.0007231000000000, -0.0020546400000000, -0.0006982800000000 ] - [ -0.0001237600000000, -0.0006742100000000, 0.0000526800000000 ] - [ 0.0000802100000000, -0.0102837200000000, 0.0033098200000000 ] - [ -0.0006345800000000, 0.0024691100000000, 0.0011313400000000 ] - [ 0.0000935300000000, 0.0004821200000000, 0.0000120000000000 ] - [ 0.0004318500000000, 0.0190325100000000, -0.0008269400000000 ] - [ 0.0019053000000000, 0.0024115500000000, -0.0000157800000000 ] - [ -0.0008876600000000, -0.0017879800000000, -0.0006307400000000 ] - [ 0.0001384600000000, -0.0004106600000000, -0.0001303100000000 ] - [ -0.0007706700000000, -0.0102879700000000, 0.0019905200000000 ] - [ 0.0011434700000000, -0.0023142200000000, 0.0008580400000000 ] - [ 0.0006272300000000, 0.0000188200000000, 0.0011115400000000 ] - [ 0.0000721000000000, -0.0000167600000000, 0.0001401600000000 ] - [ 0.0001565200000000, 0.0365326100000000, 0.0023686500000000 ] - [ -0.0000303800000000, 0.0000678800000000, -0.0006774600000000 ]- atom: 17 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ -0.0001919700000000, -0.0021793900000000, -0.0214793600000000 ] - [ -0.0028588600000000, -0.0035928400000000, -0.0118948100000000 ] - [ -0.0002392400000000, 0.0001764400000000, 0.0069003000000000 ] - [ 0.0005812000000000, 0.0004861300000000, 0.0056503100000000 ] - [ 0.0005498700000000, -0.0009399200000000, 0.0002075500000000 ] - [ -0.0080734100000000, -0.0249380100000000, 0.0223037500000000 ] - [ -0.0005821800000000, 0.0005965200000000, 0.0002756800000000 ] - [ 0.0015784900000000, 0.0190508000000000, 0.0197925000000000 ] - [ 0.0015993000000000, 0.0193060900000000, 0.0200242300000000 ] - [ -0.0005791500000000, 0.0005925100000000, 0.0003426200000000 ] - [ -0.0080187200000000, -0.0246493300000000, 0.0221924800000000 ] - [ 0.0005234700000000, -0.0009346300000000, 0.0002880800000000 ] - [ 0.0005807000000000, 0.0005037700000000, 0.0055840800000000 ] - [ -0.0002745700000000, 0.0001977500000000, 0.0068238900000000 ] - [ -0.0029330400000000, -0.0036143900000000, -0.0120069400000000 ] - [ -0.0000500100000000, -0.0022648000000000, -0.0214920100000000 ] - [ -0.0082794000000000, 0.0083789500000000, -0.1994671100000000 ] - [ 0.0000053700000000, 0.0017354400000000, -0.0050098500000000 ] - [ -0.0000189300000000, 0.0001490800000000, 0.0094920900000000 ] - [ -0.0000109000000000, -0.0000316300000000, 0.0027278700000000 ] - [ 0.0016023600000000, 0.0085916400000000, -0.0091229800000000 ] - [ -0.0006678800000000, -0.0008929100000000, -0.0021423200000000 ] - [ 0.0001658700000000, -0.0012103900000000, 0.0051443000000000 ] - [ 0.0000735900000000, -0.0001087700000000, 0.0023317400000000 ] - [ 0.0146463100000000, 0.0031877000000000, 0.0090175100000000 ] - [ -0.0083493400000000, 0.0019204100000000, 0.0089833700000000 ] - [ -0.0082939100000000, 0.0019396300000000, 0.0090033900000000 ] - [ 0.0146095400000000, 0.0032186300000000, 0.0089711000000000 ] - [ 0.0016937500000000, -0.0001238600000000, 0.0004457400000000 ] - [ -0.0017199700000000, -0.0008105800000000, 0.0004428100000000 ] - [ -0.0017137600000000, -0.0008140100000000, 0.0004583200000000 ] - [ 0.0016888100000000, -0.0001392100000000, 0.0004506300000000 ] - [ 0.0011601800000000, -0.0003149100000000, 0.0024815200000000 ] - [ 0.0010962800000000, 0.0048945300000000, 0.0245281500000000 ] - [ -0.0004682200000000, 0.0000097500000000, -0.0018160800000000 ] - [ -0.0010280100000000, 0.0000791600000000, -0.0063287700000000 ] - [ -0.0001581000000000, 0.0005391400000000, 0.0022836300000000 ] - [ 0.0004872700000000, 0.0007502900000000, 0.0035510500000000 ] - [ 0.0005203300000000, 0.0002252800000000, -0.0018024000000000 ] - [ -0.0004438700000000, -0.0005142200000000, -0.0029741600000000 ] - [ -0.0042472100000000, -0.0002612100000000, 0.0049675000000000 ] - [ -0.0034317000000000, -0.0004330400000000, 0.0247071300000000 ] - [ 0.0007583100000000, -0.0003577700000000, -0.0021661700000000 ] - [ -0.0012832800000000, -0.0011773700000000, -0.0075986100000000 ] - [ 0.0098347400000000, -0.0016743400000000, 0.0347240800000000 ] - [ 0.0041108600000000, -0.0002165600000000, 0.0004693600000000 ] - [ 0.0022691700000000, -0.0017500300000000, -0.0078703300000000 ] - [ -0.0009232400000000, -0.0003138200000000, -0.0015419900000000 ] - [ -0.0006691200000000, 0.0009926300000000, 0.0042000500000000 ] - [ 0.0010091000000000, 0.0004682500000000, 0.0007822900000000 ] - [ 0.0015873500000000, 0.0004269700000000, -0.0033072600000000 ] - [ -0.0008056800000000, 0.0003146400000000, -0.0012896500000000 ] - [ -0.0048961200000000, -0.0050867500000000, 0.0004644900000000 ] - [ 0.0023898200000000, -0.0032256700000000, 0.0006504100000000 ] - [ 0.0035512400000000, 0.0017155300000000, -0.0041766100000000 ] - [ -0.0038414700000000, 0.0031808900000000, -0.0040796100000000 ] - [ -0.0037242600000000, 0.0031632300000000, -0.0039880500000000 ] - [ 0.0036701100000000, 0.0017020200000000, -0.0040801700000000 ] - [ 0.0024800000000000, -0.0032322700000000, 0.0007225100000000 ] - [ -0.0047720000000000, -0.0050644400000000, 0.0005263200000000 ] - [ -0.0009335700000000, -0.0002848700000000, -0.0015714500000000 ] - [ 0.0022827100000000, -0.0017315400000000, -0.0079267500000000 ] - [ 0.0041164700000000, -0.0001931500000000, 0.0004299300000000 ] - [ 0.0081119200000000, -0.0010922800000000, 0.0323226600000000 ] - [ -0.0008223200000000, 0.0002905000000000, -0.0013075000000000 ] - [ 0.0015900300000000, 0.0003989300000000, -0.0033329900000000 ] - [ 0.0009996000000000, 0.0004418800000000, 0.0007426500000000 ] - [ -0.0006823700000000, 0.0009571400000000, 0.0041481300000000 ] - [ -0.0013217200000000, -0.0011523700000000, -0.0075647600000000 ] - [ 0.0007593400000000, -0.0003283900000000, -0.0021389900000000 ] - [ -0.0026698600000000, -0.0002178600000000, 0.0242269600000000 ] - [ -0.0042389600000000, -0.0002518900000000, 0.0049793200000000 ] - [ -0.0004678900000000, -0.0005450900000000, -0.0029405400000000 ] - [ 0.0005204100000000, 0.0002008200000000, -0.0017750300000000 ] - [ 0.0004919300000000, 0.0007109800000000, 0.0035567700000000 ] - [ -0.0001737700000000, 0.0005207700000000, 0.0023051000000000 ] - [ -0.0009308100000000, 0.0000707000000000, -0.0064043300000000 ] - [ -0.0003635900000000, 0.0000095000000000, -0.0018968100000000 ] - [ 0.0011932600000000, 0.0048890600000000, 0.0244674400000000 ] - [ 0.0012633300000000, -0.0003195700000000, 0.0024026100000000 ]- atom: 33 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0032236600000000, 0.0000000000000000, -0.0007505000000000 ] - [ -0.0027590500000000, 0.0000000000000000, 0.0010023800000000 ] - [ -0.0001966900000000, 0.0000000000000000, -0.0003564400000000 ] - [ -0.0002487500000000, 0.0000000000000000, -0.0008895400000000 ] - [ 0.0096116600000000, 0.0000000000000000, 0.0012294500000000 ] - [ -0.0039761000000000, 0.0000000000000000, 0.0004881100000000 ] - [ 0.0051214500000000, 0.0000000000000000, -0.0010079600000000 ] - [ -0.0038807200000000, 0.0000000000000000, -0.0005283600000000 ] - [ -0.0059934300000000, 0.0000000000000000, 0.0015842700000000 ] - [ 0.0149218000000000, 0.0000000000000000, 0.0058512700000000 ] - [ -0.0045257800000000, 0.0000000000000000, -0.0019567300000000 ] - [ 0.0085822300000000, 0.0000000000000000, 0.0047690900000000 ] - [ 0.0017211000000000, 0.0000000000000000, 0.0000862900000000 ] - [ -0.0020027600000000, 0.0000000000000000, -0.0016406400000000 ] - [ 0.0353740300000000, 0.0000000000000000, 0.0036446800000000 ] - [ -0.0165193200000000, 0.0000000000000000, 0.0033934900000000 ] - [ -0.0053541900000000, -0.0000767200000000, 0.0012075000000000 ] - [ 0.0212271900000000, -0.0000947800000000, 0.0011395800000000 ] - [ -0.0020902200000000, 0.0000136900000000, -0.0004262100000000 ] - [ 0.0024928400000000, 0.0005698700000000, -0.0009730000000000 ] - [ -0.0053541900000000, 0.0000767200000000, 0.0012075000000000 ] - [ 0.0212271900000000, 0.0000947800000000, 0.0011395800000000 ] - [ -0.0020902200000000, -0.0000136900000000, -0.0004262100000000 ] - [ 0.0024928400000000, -0.0005698700000000, -0.0009730000000000 ] - [ -0.0007140900000000, -0.0024102700000000, 0.0048336400000000 ] - [ -0.0035558100000000, 0.0024329500000000, -0.0024252200000000 ] - [ -0.0005307000000000, -0.0005896600000000, -0.0036017500000000 ] - [ -0.0025000200000000, 0.0001411900000000, 0.0037754500000000 ] - [ -0.0007140900000000, 0.0024102700000000, 0.0048336400000000 ] - [ -0.0035558100000000, -0.0024329500000000, -0.0024252200000000 ] - [ -0.0005307000000000, 0.0005896600000000, -0.0036017500000000 ] - [ -0.0025000200000000, -0.0001411900000000, 0.0037754500000000 ] - [ -0.1192134900000000, 0.0000000000000000, -0.0272963900000000 ] - [ 0.0040291900000000, 0.0000000000000000, 0.0001295700000000 ] - [ -0.0017785700000000, 0.0000000000000000, 0.0001887000000000 ] - [ 0.0014423900000000, 0.0000000000000000, 0.0009399400000000 ] - [ 0.0029335300000000, -0.0134257000000000, -0.0037190000000000 ] - [ 0.0031640000000000, 0.0006791300000000, -0.0001303300000000 ] - [ -0.0008552000000000, -0.0001466700000000, 0.0017135500000000 ] - [ 0.0012019900000000, 0.0000702700000000, -0.0001966500000000 ] - [ 0.0029335300000000, 0.0134257000000000, -0.0037190000000000 ] - [ 0.0031640000000000, -0.0006791300000000, -0.0001303300000000 ] - [ -0.0008552000000000, 0.0001466700000000, 0.0017135500000000 ] - [ 0.0012019900000000, -0.0000702700000000, -0.0001966500000000 ] - [ 0.0027222100000000, 0.0006298700000000, -0.0009205200000000 ] - [ 0.0004600800000000, -0.0111458500000000, 0.0051336700000000 ] - [ 0.0014364500000000, 0.0003293100000000, 0.0009919000000000 ] - [ -0.0020065800000000, -0.0005312700000000, -0.0005351400000000 ] - [ 0.0027222100000000, -0.0006298700000000, -0.0009205200000000 ] - [ 0.0004600800000000, 0.0111458500000000, 0.0051336700000000 ] - [ 0.0014364500000000, -0.0003293100000000, 0.0009919000000000 ] - [ -0.0020065800000000, 0.0005312700000000, -0.0005351400000000 ] - [ 0.0078859500000000, 0.0000000000000000, -0.0080384100000000 ] - [ 0.0079769700000000, 0.0000000000000000, 0.0062272200000000 ] - [ 0.0002397900000000, 0.0000000000000000, 0.0020264500000000 ] - [ 0.0002369300000000, 0.0000000000000000, -0.0016450000000000 ] - [ -0.0006311700000000, 0.0000000000000000, -0.0023170200000000 ] - [ 0.0021860900000000, 0.0000000000000000, 0.0013381700000000 ] - [ -0.0006534300000000, 0.0000000000000000, 0.0015886000000000 ] - [ 0.0022010900000000, 0.0000000000000000, -0.0018792300000000 ] - [ -0.0040813600000000, -0.0010805300000000, -0.0006777600000000 ] - [ 0.0026342200000000, -0.0001162400000000, 0.0005752700000000 ] - [ -0.0031671300000000, 0.0063405800000000, 0.0093757000000000 ] - [ 0.0038908800000000, -0.0000703700000000, -0.0003207200000000 ] - [ -0.0040813600000000, 0.0010805300000000, -0.0006777600000000 ] - [ 0.0026342200000000, 0.0001162400000000, 0.0005752700000000 ] - [ -0.0031671300000000, -0.0063405800000000, 0.0093757000000000 ] - [ 0.0038908800000000, 0.0000703700000000, -0.0003207200000000 ] - [ 0.0007838400000000, 0.0004486600000000, -0.0010646000000000 ] - [ 0.0001586400000000, -0.0009052800000000, 0.0020451900000000 ] - [ 0.0053601400000000, 0.0056659200000000, 0.0038859100000000 ] - [ 0.0088744500000000, -0.0091851300000000, -0.0123589500000000 ] - [ 0.0007838400000000, -0.0004486600000000, -0.0010646000000000 ] - [ 0.0001586400000000, 0.0009052800000000, 0.0020451900000000 ] - [ 0.0053601400000000, -0.0056659200000000, 0.0038859100000000 ] - [ 0.0088744500000000, 0.0091851300000000, -0.0123589500000000 ] - [ 0.0013427700000000, 0.0000000000000000, 0.0004855600000000 ] - [ -0.0012605900000000, 0.0000000000000000, -0.0001838000000000 ] - [ 0.0033637000000000, 0.0000000000000000, 0.0000224300000000 ] - [ -0.0043439000000000, 0.0000000000000000, -0.0011606800000000 ]- atom: 33 displacement: [ -0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0032151000000000, 0.0000000000000000, 0.0007819600000000 ] - [ 0.0028153400000000, 0.0000000000000000, -0.0009876800000000 ] - [ 0.0001981200000000, 0.0000000000000000, 0.0003846300000000 ] - [ 0.0002792600000000, 0.0000000000000000, 0.0009419100000000 ] - [ -0.0096311100000000, 0.0000000000000000, -0.0012430700000000 ] - [ 0.0040171600000000, 0.0000000000000000, -0.0005328800000000 ] - [ -0.0050937100000000, 0.0000000000000000, 0.0009517900000000 ] - [ 0.0039179900000000, 0.0000000000000000, 0.0005012600000000 ] - [ 0.0059736800000000, 0.0000000000000000, -0.0015622600000000 ] - [ -0.0150041500000000, 0.0000000000000000, -0.0057446800000000 ] - [ 0.0045157900000000, 0.0000000000000000, 0.0020207100000000 ] - [ -0.0085674000000000, 0.0000000000000000, -0.0048349500000000 ] - [ -0.0017824300000000, 0.0000000000000000, -0.0001255000000000 ] - [ 0.0019981600000000, 0.0000000000000000, 0.0016020700000000 ] - [ -0.0382349800000000, 0.0000000000000000, -0.0045276400000000 ] - [ 0.0164228900000000, 0.0000000000000000, -0.0033938100000000 ] - [ 0.0053880600000000, 0.0001034100000000, -0.0012151200000000 ] - [ -0.0213166900000000, 0.0000858600000000, -0.0011496500000000 ] - [ 0.0020875200000000, 0.0000072800000000, 0.0004075800000000 ] - [ -0.0024952000000000, -0.0005845500000000, 0.0009855900000000 ] - [ 0.0053880600000000, -0.0001034100000000, -0.0012151200000000 ] - [ -0.0213166900000000, -0.0000858600000000, -0.0011496500000000 ] - [ 0.0020875200000000, -0.0000072800000000, 0.0004075800000000 ] - [ -0.0024952000000000, 0.0005845500000000, 0.0009855900000000 ] - [ 0.0006693300000000, 0.0024364300000000, -0.0048405900000000 ] - [ 0.0036083300000000, -0.0024021300000000, 0.0024398100000000 ] - [ 0.0004927900000000, 0.0006215300000000, 0.0036232000000000 ] - [ 0.0025148000000000, -0.0001272500000000, -0.0037872000000000 ] - [ 0.0006693300000000, -0.0024364300000000, -0.0048405900000000 ] - [ 0.0036083300000000, 0.0024021300000000, 0.0024398100000000 ] - [ 0.0004927900000000, -0.0006215300000000, 0.0036232000000000 ] - [ 0.0025148000000000, 0.0001272500000000, -0.0037872000000000 ] - [ 0.1222485900000000, 0.0000000000000000, 0.0282586200000000 ] - [ -0.0041161900000000, 0.0000000000000000, -0.0000370600000000 ] - [ 0.0017102000000000, 0.0000000000000000, -0.0000894000000000 ] - [ -0.0015099200000000, 0.0000000000000000, -0.0008762400000000 ] - [ -0.0028935100000000, 0.0135337700000000, 0.0037191600000000 ] - [ -0.0031748800000000, -0.0006769000000000, 0.0001020300000000 ] - [ 0.0008914300000000, 0.0001489600000000, -0.0017443500000000 ] - [ -0.0012102100000000, -0.0000718800000000, 0.0001625000000000 ] - [ -0.0028935100000000, -0.0135337700000000, 0.0037191600000000 ] - [ -0.0031748800000000, 0.0006769000000000, 0.0001020300000000 ] - [ 0.0008914300000000, -0.0001489600000000, -0.0017443500000000 ] - [ -0.0012102100000000, 0.0000718800000000, 0.0001625000000000 ] - [ -0.0027064800000000, -0.0006402500000000, 0.0009792900000000 ] - [ -0.0004910000000000, 0.0111405800000000, -0.0050972000000000 ] - [ -0.0014335900000000, -0.0003373900000000, -0.0009731700000000 ] - [ 0.0020178700000000, 0.0005309000000000, 0.0005565300000000 ] - [ -0.0027064800000000, 0.0006402500000000, 0.0009792900000000 ] - [ -0.0004910000000000, -0.0111405800000000, -0.0050972000000000 ] - [ -0.0014335900000000, 0.0003373900000000, -0.0009731700000000 ] - [ 0.0020178700000000, -0.0005309000000000, 0.0005565300000000 ] - [ -0.0080808100000000, 0.0000000000000000, 0.0080808000000000 ] - [ -0.0079545500000000, 0.0000000000000000, -0.0061810700000000 ] - [ -0.0002758400000000, 0.0000000000000000, -0.0021173400000000 ] - [ -0.0003013300000000, 0.0000000000000000, 0.0015798700000000 ] - [ 0.0006855200000000, 0.0000000000000000, 0.0023808500000000 ] - [ -0.0021404700000000, 0.0000000000000000, -0.0012668500000000 ] - [ 0.0007706300000000, 0.0000000000000000, -0.0015008100000000 ] - [ -0.0021432300000000, 0.0000000000000000, 0.0019777200000000 ] - [ 0.0040878100000000, 0.0010789000000000, 0.0006316300000000 ] - [ -0.0026455400000000, 0.0001084400000000, -0.0005946200000000 ] - [ 0.0032740100000000, -0.0063379600000000, -0.0094004800000000 ] - [ -0.0039307000000000, 0.0000786500000000, 0.0002815500000000 ] - [ 0.0040878100000000, -0.0010789000000000, 0.0006316300000000 ] - [ -0.0026455400000000, -0.0001084400000000, -0.0005946200000000 ] - [ 0.0032740100000000, 0.0063379600000000, -0.0094004800000000 ] - [ -0.0039307000000000, -0.0000786500000000, 0.0002815500000000 ] - [ -0.0008036100000000, -0.0004643000000000, 0.0010923700000000 ] - [ -0.0001900600000000, 0.0009255500000000, -0.0020299100000000 ] - [ -0.0054298000000000, -0.0057634600000000, -0.0039069700000000 ] - [ -0.0088563900000000, 0.0090810800000000, 0.0122816700000000 ] - [ -0.0008036100000000, 0.0004643000000000, 0.0010923700000000 ] - [ -0.0001900600000000, -0.0009255500000000, -0.0020299100000000 ] - [ -0.0054298000000000, 0.0057634600000000, -0.0039069700000000 ] - [ -0.0088563900000000, -0.0090810800000000, 0.0122816700000000 ] - [ -0.0012723200000000, 0.0000000000000000, -0.0005894700000000 ] - [ 0.0013242500000000, 0.0000000000000000, 0.0001184900000000 ] - [ -0.0033062900000000, 0.0000000000000000, -0.0001159700000000 ] - [ 0.0044134500000000, 0.0000000000000000, 0.0010987000000000 ]- atom: 33 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ 0.0000293400000000, -0.0070704000000000, 0.0000419200000000 ] - [ -0.0000192200000000, -0.0077492200000000, 0.0000447900000000 ] - [ 0.0000085600000000, -0.0007933600000000, 0.0000204600000000 ] - [ 0.0000116500000000, -0.0003723200000000, 0.0000270100000000 ] - [ 0.0000262800000000, -0.0111522000000000, -0.0000609700000000 ] - [ 0.0000062300000000, -0.0009787200000000, -0.0000244000000000 ] - [ 0.0000085600000000, -0.0055961100000000, -0.0000137600000000 ] - [ -0.0000049300000000, -0.0004062000000000, -0.0000283900000000 ] - [ -0.0000247400000000, 0.0006028500000000, 0.0000339600000000 ] - [ -0.0000305400000000, 0.0152632600000000, -0.0001279900000000 ] - [ -0.0000285000000000, 0.0005960500000000, 0.0000353600000000 ] - [ -0.0000069000000000, 0.0084940000000000, 0.0000175000000000 ] - [ -0.0000077200000000, 0.0013103200000000, -0.0000188900000000 ] - [ -0.0000099300000000, 0.0001748800000000, -0.0000241600000000 ] - [ 0.0000807100000000, 0.0182504500000000, -0.0000349200000000 ] - [ -0.0000053000000000, 0.0059183900000000, -0.0000457800000000 ] - [ 0.0002370600000000, 0.0000557700000000, -0.0003103100000000 ] - [ -0.0003753100000000, 0.0365392900000000, 0.0042319900000000 ] - [ -0.0000376700000000, -0.0000151400000000, 0.0000090200000000 ] - [ 0.0006188800000000, 0.0000178400000000, 0.0000796700000000 ] - [ -0.0002512600000000, 0.0000598400000000, 0.0003214700000000 ] - [ 0.0008208700000000, 0.0408519800000000, -0.0055799800000000 ] - [ 0.0000324700000000, -0.0000165000000000, -0.0000113900000000 ] - [ -0.0006176200000000, 0.0000330200000000, -0.0000699600000000 ] - [ -0.0037437000000000, 0.0012022100000000, 0.0050728400000000 ] - [ 0.0044595300000000, 0.0015782500000000, 0.0032187600000000 ] - [ -0.0044748000000000, -0.0006512300000000, -0.0017173300000000 ] - [ 0.0019394900000000, -0.0005292300000000, -0.0031726500000000 ] - [ 0.0037491900000000, 0.0012529100000000, -0.0050905900000000 ] - [ -0.0044730700000000, 0.0016138400000000, -0.0032385700000000 ] - [ 0.0044798300000000, -0.0006521600000000, 0.0017065700000000 ] - [ -0.0019466100000000, -0.0005341400000000, 0.0031746200000000 ] - [ -0.0005089200000000, -0.2043163500000000, 0.0015201400000000 ] - [ -0.0000416800000000, -0.0005820500000000, 0.0000379500000000 ] - [ -0.0000499700000000, -0.0008192900000000, 0.0000336900000000 ] - [ -0.0000484500000000, -0.0000766800000000, 0.0000344200000000 ] - [ -0.0183307300000000, 0.0234110100000000, 0.0054791000000000 ] - [ 0.0012253600000000, 0.0002160900000000, -0.0002242900000000 ] - [ -0.0005464600000000, 0.0007975600000000, -0.0016286100000000 ] - [ 0.0000695200000000, 0.0000482500000000, -0.0001386700000000 ] - [ 0.0180585100000000, 0.0231299200000000, -0.0054109100000000 ] - [ -0.0011948200000000, 0.0002116100000000, 0.0001950400000000 ] - [ 0.0005440100000000, 0.0007784200000000, 0.0015970600000000 ] - [ -0.0000596900000000, 0.0000272000000000, 0.0001064900000000 ] - [ 0.0014112900000000, 0.0001278200000000, -0.0001927400000000 ] - [ -0.0120605500000000, 0.0187303800000000, -0.0103454600000000 ] - [ 0.0000881900000000, -0.0000056600000000, -0.0000090600000000 ] - [ 0.0000658100000000, 0.0004403300000000, 0.0010376500000000 ] - [ -0.0014154600000000, 0.0001357900000000, 0.0002221400000000 ] - [ 0.0122446600000000, 0.0189732200000000, 0.0105341800000000 ] - [ -0.0000728000000000, 0.0000025100000000, 0.0000393100000000 ] - [ -0.0000538900000000, 0.0004495800000000, -0.0010181100000000 ] - [ -0.0000160400000000, -0.0030239000000000, -0.0000512800000000 ] - [ -0.0000688800000000, -0.0030218300000000, -0.0000388600000000 ] - [ -0.0000475800000000, -0.0015535000000000, -0.0000363700000000 ] - [ -0.0000448200000000, -0.0015564300000000, -0.0000393500000000 ] - [ 0.0000417700000000, 0.0027723700000000, 0.0000561100000000 ] - [ 0.0000573900000000, 0.0023547100000000, 0.0000466800000000 ] - [ 0.0000471100000000, 0.0027697700000000, 0.0000343800000000 ] - [ 0.0000528700000000, 0.0023573700000000, 0.0000225200000000 ] - [ -0.0003345200000000, -0.0007026100000000, -0.0018782000000000 ] - [ 0.0000552200000000, 0.0000332000000000, -0.0001318300000000 ] - [ 0.0081917400000000, 0.0057788400000000, 0.0157417800000000 ] - [ -0.0011583400000000, -0.0001863800000000, 0.0002185400000000 ] - [ 0.0003309500000000, -0.0007491700000000, 0.0018486600000000 ] - [ -0.0000516500000000, -0.0000001700000000, 0.0001065600000000 ] - [ -0.0082506600000000, 0.0057320800000000, -0.0158731900000000 ] - [ 0.0011837600000000, -0.0002294200000000, -0.0002522800000000 ] - [ 0.0001558800000000, -0.0000694400000000, -0.0000907500000000 ] - [ 0.0004582800000000, -0.0015874100000000, -0.0003336300000000 ] - [ 0.0004134500000000, -0.0012494700000000, -0.0006139200000000 ] - [ -0.0108016300000000, 0.0037440600000000, 0.0096704200000000 ] - [ -0.0001649600000000, -0.0000892100000000, 0.0001138900000000 ] - [ -0.0004746300000000, -0.0016459900000000, 0.0003609000000000 ] - [ -0.0004112600000000, -0.0013042700000000, 0.0006514500000000 ] - [ 0.0108625100000000, 0.0037131100000000, -0.0096998200000000 ] - [ 0.0000501900000000, 0.0000563500000000, -0.0000417800000000 ] - [ 0.0000496700000000, 0.0006774900000000, -0.0000306300000000 ] - [ 0.0000468500000000, 0.0001830800000000, -0.0000395500000000 ] - [ 0.0000525900000000, 0.0078188700000000, -0.0000556900000000 ]- atom: 33 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0003911500000000, 0.0000000000000000, 0.0052097300000000 ] - [ 0.0000610800000000, 0.0000000000000000, 0.0080299200000000 ] - [ -0.0001004600000000, 0.0000000000000000, -0.0034267300000000 ] - [ -0.0007669000000000, 0.0000000000000000, -0.0047387300000000 ] - [ 0.0026185800000000, 0.0000000000000000, -0.0001383800000000 ] - [ -0.0009723400000000, 0.0000000000000000, 0.0008130200000000 ] - [ 0.0031351300000000, 0.0000000000000000, -0.0045697600000000 ] - [ -0.0003103400000000, 0.0000000000000000, -0.0011790000000000 ] - [ -0.0001534400000000, 0.0000000000000000, 0.0005524000000000 ] - [ 0.0106671500000000, 0.0000000000000000, 0.0535928300000000 ] - [ -0.0012540900000000, 0.0000000000000000, -0.0014783000000000 ] - [ 0.0062104900000000, 0.0000000000000000, -0.0218511900000000 ] - [ 0.0017272500000000, 0.0000000000000000, -0.0056259400000000 ] - [ -0.0028613100000000, 0.0000000000000000, -0.0051915400000000 ] - [ 0.0042288000000000, 0.0000000000000000, 0.0154864800000000 ] - [ 0.0037251700000000, 0.0000000000000000, 0.0080489700000000 ] - [ -0.0009385400000000, -0.0005990800000000, 0.0024533100000000 ] - [ 0.0010404700000000, 0.0028451800000000, 0.0245301400000000 ] - [ -0.0005442500000000, 0.0002203300000000, -0.0018617500000000 ] - [ 0.0012488400000000, 0.0012049300000000, -0.0063924900000000 ] - [ -0.0009385400000000, 0.0005990800000000, 0.0024533100000000 ] - [ 0.0010404700000000, -0.0028451800000000, 0.0245301400000000 ] - [ -0.0005442500000000, -0.0002203300000000, -0.0018617500000000 ] - [ 0.0012488400000000, -0.0012049300000000, -0.0063924900000000 ] - [ 0.0033375800000000, 0.0016906500000000, 0.0005325500000000 ] - [ -0.0041219900000000, 0.0018256200000000, 0.0007157200000000 ] - [ -0.0057257300000000, -0.0006390000000000, -0.0041427200000000 ] - [ 0.0022868800000000, -0.0005700700000000, -0.0040529100000000 ] - [ 0.0033375800000000, -0.0016906500000000, 0.0005325500000000 ] - [ -0.0041219900000000, -0.0018256200000000, 0.0007157200000000 ] - [ -0.0057257300000000, 0.0006390000000000, -0.0041427200000000 ] - [ 0.0022868800000000, 0.0005700700000000, -0.0040529100000000 ] - [ -0.0282813500000000, 0.0000000000000000, -0.1441626100000000 ] - [ 0.0000471500000000, 0.0000000000000000, -0.0019690200000000 ] - [ 0.0001162600000000, 0.0000000000000000, 0.0064725100000000 ] - [ 0.0008523600000000, 0.0000000000000000, 0.0016940700000000 ] - [ -0.0042634700000000, 0.0048851400000000, -0.0058379300000000 ] - [ 0.0008084500000000, 0.0001234100000000, -0.0021932500000000 ] - [ 0.0000287300000000, -0.0001787800000000, 0.0049346600000000 ] - [ 0.0003273100000000, 0.0000040900000000, 0.0018344300000000 ] - [ -0.0042634700000000, -0.0048851400000000, -0.0058379300000000 ] - [ 0.0008084500000000, -0.0001234100000000, -0.0021932500000000 ] - [ 0.0000287300000000, 0.0001787800000000, 0.0049346600000000 ] - [ 0.0003273100000000, -0.0000040900000000, 0.0018344300000000 ] - [ -0.0003764400000000, -0.0001704600000000, -0.0011845000000000 ] - [ 0.0050898300000000, -0.0096614900000000, -0.0020750800000000 ] - [ 0.0008214700000000, 0.0001918200000000, 0.0015034800000000 ] - [ -0.0011563200000000, 0.0004855900000000, 0.0038065400000000 ] - [ -0.0003764400000000, 0.0001704600000000, -0.0011845000000000 ] - [ 0.0050898300000000, 0.0096614900000000, -0.0020750800000000 ] - [ 0.0008214700000000, -0.0001918200000000, 0.0015034800000000 ] - [ -0.0011563200000000, -0.0004855900000000, 0.0038065400000000 ] - [ -0.0062620700000000, 0.0000000000000000, -0.0020864900000000 ] - [ 0.0080701600000000, 0.0000000000000000, -0.0020979800000000 ] - [ 0.0015459100000000, 0.0000000000000000, 0.0030824100000000 ] - [ -0.0021037300000000, 0.0000000000000000, 0.0030977200000000 ] - [ -0.0015564900000000, 0.0000000000000000, 0.0002779000000000 ] - [ 0.0019643700000000, 0.0000000000000000, 0.0006129300000000 ] - [ 0.0024078800000000, 0.0000000000000000, 0.0003488500000000 ] - [ -0.0012848500000000, 0.0000000000000000, 0.0006222400000000 ] - [ -0.0042643400000000, -0.0033667700000000, 0.0038945300000000 ] - [ 0.0014165600000000, -0.0003345400000000, 0.0006586600000000 ] - [ 0.0119327300000000, 0.0156663300000000, 0.0178079700000000 ] - [ -0.0010948500000000, -0.0000437200000000, -0.0001736600000000 ] - [ -0.0042643400000000, 0.0033667700000000, 0.0038945300000000 ] - [ 0.0014165600000000, 0.0003345400000000, 0.0006586600000000 ] - [ 0.0119327300000000, -0.0156663300000000, 0.0178079700000000 ] - [ -0.0010948500000000, 0.0000437200000000, -0.0001736600000000 ] - [ -0.0007252900000000, -0.0001685300000000, 0.0011381400000000 ] - [ 0.0042019600000000, -0.0048310000000000, 0.0052598000000000 ] - [ 0.0024097500000000, 0.0017279000000000, -0.0000044800000000 ] - [ -0.0123738700000000, 0.0082302100000000, 0.0050565500000000 ] - [ -0.0007252900000000, 0.0001685300000000, 0.0011381400000000 ] - [ 0.0042019600000000, 0.0048310000000000, 0.0052598000000000 ] - [ 0.0024097500000000, -0.0017279000000000, -0.0000044800000000 ] - [ -0.0123738700000000, -0.0082302100000000, 0.0050565500000000 ] - [ 0.0005412700000000, 0.0000000000000000, 0.0010388900000000 ] - [ -0.0001146500000000, 0.0000000000000000, 0.0026546200000000 ] - [ 0.0000966300000000, 0.0000000000000000, -0.0012801400000000 ] - [ -0.0011156700000000, 0.0000000000000000, -0.0042551200000000 ]- atom: 33 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ -0.0003965200000000, 0.0000000000000000, -0.0051685900000000 ] - [ 0.0000096600000000, 0.0000000000000000, -0.0079751500000000 ] - [ 0.0001529500000000, 0.0000000000000000, 0.0034667600000000 ] - [ 0.0007788900000000, 0.0000000000000000, 0.0047769300000000 ] - [ -0.0025684400000000, 0.0000000000000000, 0.0001729700000000 ] - [ 0.0009905100000000, 0.0000000000000000, -0.0008438800000000 ] - [ -0.0031176800000000, 0.0000000000000000, 0.0044742700000000 ] - [ 0.0003281200000000, 0.0000000000000000, 0.0011084800000000 ] - [ 0.0001041100000000, 0.0000000000000000, -0.0004739000000000 ] - [ -0.0097077800000000, 0.0000000000000000, -0.0499012100000000 ] - [ 0.0011970800000000, 0.0000000000000000, 0.0015026600000000 ] - [ -0.0062601200000000, 0.0000000000000000, 0.0219782500000000 ] - [ -0.0017134000000000, 0.0000000000000000, 0.0055503200000000 ] - [ 0.0027672200000000, 0.0000000000000000, 0.0050975300000000 ] - [ -0.0045090300000000, 0.0000000000000000, -0.0155411100000000 ] - [ -0.0036689300000000, 0.0000000000000000, -0.0080908900000000 ] - [ 0.0009157600000000, 0.0006038200000000, -0.0024314500000000 ] - [ -0.0009885900000000, -0.0032033600000000, -0.0244672600000000 ] - [ 0.0005306600000000, -0.0002035200000000, 0.0018442300000000 ] - [ -0.0012275300000000, -0.0011707600000000, 0.0063484000000000 ] - [ 0.0009157600000000, -0.0006038200000000, -0.0024314500000000 ] - [ -0.0009885900000000, 0.0032033600000000, -0.0244672600000000 ] - [ 0.0005306600000000, 0.0002035200000000, 0.0018442300000000 ] - [ -0.0012275300000000, 0.0011707600000000, 0.0063484000000000 ] - [ -0.0033362300000000, -0.0016787700000000, -0.0004591300000000 ] - [ 0.0041152600000000, -0.0017921700000000, -0.0006584100000000 ] - [ 0.0057518000000000, 0.0006449000000000, 0.0041107300000000 ] - [ -0.0022883300000000, 0.0005786500000000, 0.0040115500000000 ] - [ -0.0033362300000000, 0.0016787700000000, -0.0004591300000000 ] - [ 0.0041152600000000, 0.0017921700000000, -0.0006584100000000 ] - [ 0.0057518000000000, -0.0006449000000000, 0.0041107300000000 ] - [ -0.0022883300000000, -0.0005786500000000, 0.0040115500000000 ] - [ 0.0272885500000000, 0.0000000000000000, 0.1407426700000000 ] - [ -0.0001070000000000, 0.0000000000000000, 0.0020361900000000 ] - [ -0.0002051800000000, 0.0000000000000000, -0.0063585700000000 ] - [ -0.0008983300000000, 0.0000000000000000, -0.0016160800000000 ] - [ 0.0043229300000000, -0.0049673900000000, 0.0057212700000000 ] - [ -0.0007900100000000, -0.0001128800000000, 0.0021443600000000 ] - [ -0.0000247300000000, 0.0001932500000000, -0.0049586000000000 ] - [ -0.0003162900000000, 0.0000026800000000, -0.0018517800000000 ] - [ 0.0043229300000000, 0.0049673900000000, 0.0057212700000000 ] - [ -0.0007900100000000, 0.0001128800000000, 0.0021443600000000 ] - [ -0.0000247300000000, -0.0001932500000000, -0.0049586000000000 ] - [ -0.0003162900000000, -0.0000026800000000, -0.0018517800000000 ] - [ 0.0004033700000000, 0.0001581900000000, 0.0012148400000000 ] - [ -0.0050840200000000, 0.0096172200000000, 0.0020293400000000 ] - [ -0.0008150300000000, -0.0001965200000000, -0.0014514200000000 ] - [ 0.0011746900000000, -0.0004904100000000, -0.0037426600000000 ] - [ 0.0004033700000000, -0.0001581900000000, 0.0012148400000000 ] - [ -0.0050840200000000, -0.0096172200000000, 0.0020293400000000 ] - [ -0.0008150300000000, 0.0001965200000000, -0.0014514200000000 ] - [ 0.0011746900000000, 0.0004904100000000, -0.0037426600000000 ] - [ 0.0061616100000000, 0.0000000000000000, 0.0019473200000000 ] - [ -0.0080652300000000, 0.0000000000000000, 0.0019381700000000 ] - [ -0.0015968700000000, 0.0000000000000000, -0.0031216100000000 ] - [ 0.0020692900000000, 0.0000000000000000, -0.0031253500000000 ] - [ 0.0015997900000000, 0.0000000000000000, -0.0002608600000000 ] - [ -0.0018879000000000, 0.0000000000000000, -0.0005486300000000 ] - [ -0.0023454200000000, 0.0000000000000000, -0.0002274200000000 ] - [ 0.0013459700000000, 0.0000000000000000, -0.0005317500000000 ] - [ 0.0041838900000000, 0.0033048100000000, -0.0039298100000000 ] - [ -0.0014083900000000, 0.0003357600000000, -0.0007018500000000 ] - [ -0.0121019900000000, -0.0158769400000000, -0.0179945200000000 ] - [ 0.0010848100000000, 0.0000535700000000, 0.0001371800000000 ] - [ 0.0041838900000000, -0.0033048100000000, -0.0039298100000000 ] - [ -0.0014083900000000, -0.0003357600000000, -0.0007018500000000 ] - [ -0.0121019900000000, 0.0158769400000000, -0.0179945200000000 ] - [ 0.0010848100000000, -0.0000535700000000, 0.0001371800000000 ] - [ 0.0007039500000000, 0.0001736500000000, -0.0011127500000000 ] - [ -0.0041265500000000, 0.0047400400000000, -0.0051620600000000 ] - [ -0.0023845500000000, -0.0016742300000000, 0.0000702700000000 ] - [ 0.0124108600000000, -0.0082640300000000, -0.0049724300000000 ] - [ 0.0007039500000000, -0.0001736500000000, -0.0011127500000000 ] - [ -0.0041265500000000, -0.0047400400000000, -0.0051620600000000 ] - [ -0.0023845500000000, 0.0016742300000000, 0.0000702700000000 ] - [ 0.0124108600000000, 0.0082640300000000, -0.0049724300000000 ] - [ -0.0004749700000000, 0.0000000000000000, -0.0011375100000000 ] - [ 0.0001676200000000, 0.0000000000000000, -0.0027289300000000 ] - [ -0.0000121800000000, 0.0000000000000000, 0.0011948200000000 ] - [ 0.0011621400000000, 0.0000000000000000, 0.0041880600000000 ]- atom: 37 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0262408300000000, -0.0108832100000000, 0.0054565400000000 ] - [ -0.0092135900000000, -0.0020569800000000, 0.0018040000000000 ] - [ 0.0017992000000000, -0.0003916400000000, 0.0024139200000000 ] - [ -0.0027249500000000, -0.0002291000000000, -0.0007834200000000 ] - [ 0.0136598500000000, -0.0049604700000000, -0.0076777000000000 ] - [ -0.0075829400000000, 0.0033368000000000, 0.0032730500000000 ] - [ 0.0038435100000000, -0.0008269500000000, 0.0042249500000000 ] - [ -0.0030665700000000, 0.0002326200000000, -0.0018195100000000 ] - [ -0.0048542800000000, -0.0026801100000000, 0.0031966400000000 ] - [ -0.0000017100000000, 0.0053831800000000, -0.0064363100000000 ] - [ -0.0022172100000000, -0.0007644300000000, -0.0024173200000000 ] - [ 0.0001006600000000, 0.0010417700000000, 0.0025899300000000 ] - [ 0.0039012000000000, 0.0005966600000000, 0.0008162700000000 ] - [ -0.0029157300000000, 0.0001457500000000, -0.0001339700000000 ] - [ 0.0135036000000000, -0.0056200400000000, -0.0040359100000000 ] - [ -0.0058691100000000, 0.0005193200000000, 0.0004292200000000 ] - [ -0.0038663900000000, 0.0011231700000000, -0.0001529200000000 ] - [ 0.0033390000000000, -0.0007668800000000, 0.0004645500000000 ] - [ -0.0015345100000000, 0.0001303100000000, 0.0005099300000000 ] - [ 0.0013255500000000, -0.0008698000000000, -0.0004619600000000 ] - [ -0.0076944000000000, -0.0018892400000000, -0.0042331400000000 ] - [ 0.0274560000000000, -0.0007870700000000, -0.0038680300000000 ] - [ -0.0017486600000000, -0.0000904200000000, 0.0007427700000000 ] - [ 0.0005792000000000, 0.0006580600000000, -0.0012822400000000 ] - [ 0.0040781600000000, 0.0000498700000000, 0.0006740600000000 ] - [ -0.0035403700000000, -0.0001097500000000, -0.0009963000000000 ] - [ 0.0029274400000000, 0.0007365200000000, -0.0015901300000000 ] - [ -0.0024737000000000, -0.0002062200000000, 0.0008173400000000 ] - [ 0.0296827600000000, 0.0012696400000000, -0.0083164400000000 ] - [ -0.0085013200000000, 0.0017165900000000, -0.0041283600000000 ] - [ 0.0054201000000000, -0.0008060400000000, -0.0022789900000000 ] - [ -0.0028403100000000, 0.0001369300000000, 0.0009348200000000 ] - [ 0.0028604900000000, -0.0182468000000000, -0.0042369700000000 ] - [ 0.0031434800000000, 0.0012059600000000, 0.0008594200000000 ] - [ -0.0009064800000000, -0.0005418100000000, 0.0000745400000000 ] - [ 0.0011730600000000, 0.0000766500000000, 0.0003912500000000 ] - [ -0.1611993400000000, 0.0257514800000000, 0.0405669000000000 ] - [ 0.0081752800000000, -0.0003305800000000, -0.0003426100000000 ] - [ -0.0026153800000000, 0.0004862600000000, -0.0000151700000000 ] - [ 0.0017371700000000, -0.0000963000000000, -0.0001395500000000 ] - [ -0.0081290700000000, 0.0000889700000000, -0.0005305100000000 ] - [ 0.0036349100000000, 0.0001350100000000, 0.0000710100000000 ] - [ -0.0020861000000000, -0.0000561200000000, -0.0000170800000000 ] - [ 0.0016083800000000, 0.0000720000000000, -0.0000938700000000 ] - [ 0.0021073100000000, -0.0016098200000000, -0.0012964000000000 ] - [ 0.0020875900000000, 0.0012754500000000, 0.0006206900000000 ] - [ 0.0002879800000000, -0.0001040400000000, 0.0002579900000000 ] - [ 0.0002794500000000, 0.0002551700000000, -0.0001195900000000 ] - [ 0.0277328400000000, -0.0011487200000000, -0.0055627100000000 ] - [ 0.0282368100000000, -0.0000315000000000, 0.0080372500000000 ] - [ 0.0004229700000000, -0.0000625700000000, 0.0006070600000000 ] - [ 0.0003989700000000, -0.0001534400000000, -0.0000062200000000 ] - [ 0.0004731000000000, 0.0121440500000000, -0.0051600100000000 ] - [ 0.0026939000000000, -0.0014127700000000, 0.0003414800000000 ] - [ -0.0020135800000000, -0.0000514700000000, 0.0010866100000000 ] - [ 0.0013943100000000, -0.0001026700000000, -0.0008934700000000 ] - [ -0.0031495100000000, -0.0082475000000000, -0.0119728000000000 ] - [ 0.0039226100000000, 0.0011772800000000, 0.0011580000000000 ] - [ -0.0040676600000000, 0.0003251200000000, 0.0042809900000000 ] - [ 0.0026711200000000, -0.0000484600000000, -0.0013633700000000 ] - [ -0.0037500100000000, 0.0002248800000000, 0.0001883000000000 ] - [ 0.0024625100000000, -0.0000123000000000, -0.0004729700000000 ] - [ -0.0037363000000000, 0.0003322700000000, -0.0008933100000000 ] - [ 0.0024535400000000, -0.0001182500000000, 0.0003685800000000 ] - [ -0.0048245900000000, -0.0021972400000000, 0.0071880200000000 ] - [ 0.0030112400000000, 0.0001483400000000, -0.0009085700000000 ] - [ -0.0048199400000000, -0.0027771000000000, -0.0079664600000000 ] - [ 0.0030254900000000, 0.0001655400000000, 0.0004656400000000 ] - [ 0.0000241000000000, -0.0001857600000000, -0.0020744800000000 ] - [ 0.0009612000000000, 0.0000523700000000, 0.0008910700000000 ] - [ 0.0009393100000000, -0.0031649000000000, 0.0027500700000000 ] - [ 0.0027937400000000, 0.0011889500000000, -0.0014722400000000 ] - [ -0.0005652100000000, 0.0006917100000000, -0.0029036600000000 ] - [ 0.0014372900000000, -0.0005933800000000, 0.0021410200000000 ] - [ 0.0037928200000000, 0.0037223100000000, 0.0077403100000000 ] - [ 0.0033273600000000, -0.0012058300000000, -0.0025135500000000 ] - [ 0.0008147800000000, -0.0001767300000000, -0.0007609500000000 ] - [ 0.0001985800000000, -0.0004714200000000, 0.0041058900000000 ] - [ 0.0054405500000000, -0.0004052500000000, 0.0023301200000000 ] - [ 0.0089276500000000, 0.0108941100000000, -0.0125410400000000 ]- atom: 37 displacement: [ -0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0269053700000000, 0.0117290500000000, -0.0060154700000000 ] - [ 0.0092008000000000, 0.0020446800000000, -0.0017393700000000 ] - [ -0.0018047800000000, 0.0003876300000000, -0.0023775000000000 ] - [ 0.0027273000000000, 0.0002317000000000, 0.0007958000000000 ] - [ -0.0133388600000000, 0.0051934500000000, 0.0078661000000000 ] - [ 0.0076022300000000, -0.0033951200000000, -0.0033302300000000 ] - [ -0.0038038900000000, 0.0008036400000000, -0.0042468400000000 ] - [ 0.0030440600000000, -0.0001740400000000, 0.0018059300000000 ] - [ 0.0047826800000000, 0.0027190900000000, -0.0031732200000000 ] - [ 0.0000467200000000, -0.0053636900000000, 0.0064387000000000 ] - [ 0.0021704000000000, 0.0007826900000000, 0.0024711300000000 ] - [ -0.0000651400000000, -0.0010706800000000, -0.0025574600000000 ] - [ -0.0039382200000000, -0.0006132400000000, -0.0007801700000000 ] - [ 0.0028817200000000, -0.0001338500000000, 0.0001062000000000 ] - [ -0.0136158600000000, 0.0055129000000000, 0.0039462700000000 ] - [ 0.0058740100000000, -0.0005055400000000, -0.0004624400000000 ] - [ 0.0038511000000000, -0.0011233500000000, 0.0001597300000000 ] - [ -0.0033256000000000, 0.0007423800000000, -0.0004951500000000 ] - [ 0.0015158700000000, -0.0001290200000000, -0.0005138000000000 ] - [ -0.0013111000000000, 0.0008537600000000, 0.0004525900000000 ] - [ 0.0076982600000000, 0.0018873200000000, 0.0042615600000000 ] - [ -0.0250348700000000, 0.0002135700000000, 0.0022503800000000 ] - [ 0.0017198300000000, 0.0000817600000000, -0.0007784100000000 ] - [ -0.0005270700000000, -0.0006242000000000, 0.0013222500000000 ] - [ -0.0040900200000000, -0.0000508300000000, -0.0006732700000000 ] - [ 0.0035611100000000, 0.0001060700000000, 0.0010073200000000 ] - [ -0.0029270900000000, -0.0007321100000000, 0.0015867000000000 ] - [ 0.0024824900000000, 0.0002200500000000, -0.0008136300000000 ] - [ -0.0304139900000000, -0.0015885500000000, 0.0096027100000000 ] - [ 0.0084732800000000, -0.0016966900000000, 0.0041060000000000 ] - [ -0.0054342800000000, 0.0007965300000000, 0.0022734700000000 ] - [ 0.0028348200000000, -0.0001540400000000, -0.0009212600000000 ] - [ -0.0029669000000000, 0.0181376000000000, 0.0043069100000000 ] - [ -0.0032158900000000, -0.0012151900000000, -0.0007642300000000 ] - [ 0.0008089800000000, 0.0005551100000000, -0.0000008700000000 ] - [ -0.0012392100000000, -0.0000637700000000, -0.0003003500000000 ] - [ 0.1599557600000000, -0.0258347000000000, -0.0397949400000000 ] - [ -0.0081459000000000, 0.0003223600000000, 0.0002890900000000 ] - [ 0.0026099200000000, -0.0004856800000000, -0.0000350100000000 ] - [ -0.0017052300000000, 0.0001062200000000, 0.0000803000000000 ] - [ 0.0081335100000000, -0.0001616600000000, 0.0004978800000000 ] - [ -0.0036244300000000, -0.0001402300000000, -0.0001322500000000 ] - [ 0.0020930100000000, 0.0000454300000000, -0.0000404800000000 ] - [ -0.0015872300000000, -0.0000862800000000, 0.0000603200000000 ] - [ -0.0020755100000000, 0.0016208600000000, 0.0013412300000000 ] - [ -0.0020825500000000, -0.0012541000000000, -0.0005802300000000 ] - [ -0.0002764400000000, 0.0000781000000000, -0.0001987800000000 ] - [ -0.0002737400000000, -0.0002577400000000, 0.0001641100000000 ] - [ -0.0282237400000000, 0.0011558600000000, 0.0057308000000000 ] - [ -0.0277232500000000, 0.0000496000000000, -0.0078443100000000 ] - [ -0.0003736200000000, 0.0000463800000000, -0.0005989700000000 ] - [ -0.0004172300000000, 0.0001771700000000, 0.0000666600000000 ] - [ -0.0004873700000000, -0.0121475000000000, 0.0050590000000000 ] - [ -0.0027781900000000, 0.0014033100000000, -0.0004153400000000 ] - [ 0.0019518000000000, 0.0000620600000000, -0.0012201500000000 ] - [ -0.0014763600000000, 0.0000908800000000, 0.0007857800000000 ] - [ 0.0033162300000000, 0.0081860900000000, 0.0120315200000000 ] - [ -0.0038365000000000, -0.0011721100000000, -0.0010407400000000 ] - [ 0.0041474900000000, -0.0003455500000000, -0.0041953500000000 ] - [ -0.0025828300000000, 0.0000589500000000, 0.0014344700000000 ] - [ 0.0037218300000000, -0.0001994600000000, -0.0002321600000000 ] - [ -0.0024670400000000, 0.0000373500000000, 0.0004316900000000 ] - [ 0.0037228000000000, -0.0003096900000000, 0.0008509600000000 ] - [ -0.0024482900000000, 0.0001314500000000, -0.0004271900000000 ] - [ 0.0047159800000000, 0.0022296600000000, -0.0073352500000000 ] - [ -0.0030049500000000, -0.0001700900000000, 0.0008718900000000 ] - [ 0.0047311300000000, 0.0027994400000000, 0.0080187500000000 ] - [ -0.0030106300000000, -0.0001970600000000, -0.0005218500000000 ] - [ -0.0000167600000000, 0.0001861600000000, 0.0021068900000000 ] - [ -0.0009756100000000, -0.0000261600000000, -0.0008412100000000 ] - [ -0.0009503400000000, 0.0032185800000000, -0.0027145600000000 ] - [ -0.0028059600000000, -0.0011812200000000, 0.0015107200000000 ] - [ 0.0005567000000000, -0.0006829000000000, 0.0029600500000000 ] - [ -0.0014554000000000, 0.0005710900000000, -0.0020792600000000 ] - [ -0.0038327700000000, -0.0037528600000000, -0.0077637900000000 ] - [ -0.0033359200000000, 0.0011856600000000, 0.0025528200000000 ] - [ -0.0007266900000000, 0.0001578600000000, 0.0006799700000000 ] - [ -0.0001322300000000, 0.0004615300000000, -0.0041879700000000 ] - [ -0.0053539200000000, 0.0004266800000000, -0.0024268200000000 ] - [ -0.0087870500000000, -0.0107688600000000, 0.0122856600000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ -0.0112377700000000, 0.0278486700000000, -0.0073944600000000 ] - [ -0.0017278900000000, 0.0004963300000000, -0.0008197200000000 ] - [ 0.0011495400000000, 0.0007922800000000, -0.0026008200000000 ] - [ -0.0009158200000000, 0.0001364200000000, -0.0001755800000000 ] - [ -0.0038888000000000, 0.0098095500000000, -0.0044651800000000 ] - [ 0.0011023000000000, 0.0004170000000000, -0.0005197900000000 ] - [ 0.0005708200000000, 0.0010698000000000, 0.0015745500000000 ] - [ 0.0002812700000000, 0.0001005700000000, 0.0012792900000000 ] - [ -0.0038307200000000, -0.0000151500000000, 0.0012721000000000 ] - [ 0.0051309600000000, -0.0041660900000000, 0.0057840100000000 ] - [ -0.0007038000000000, -0.0003840800000000, -0.0005848500000000 ] - [ 0.0018548700000000, -0.0010963300000000, -0.0024741100000000 ] - [ -0.0004209300000000, -0.0012849200000000, 0.0016146700000000 ] - [ 0.0001317000000000, -0.0001606600000000, 0.0001680700000000 ] - [ -0.0098453300000000, -0.0138836100000000, -0.0117054600000000 ] - [ 0.0013909900000000, -0.0001122000000000, -0.0001800800000000 ] - [ 0.0001813300000000, -0.0022934300000000, 0.0005406700000000 ] - [ -0.0027709700000000, -0.0102399800000000, 0.0007256700000000 ] - [ -0.0000784700000000, -0.0003922300000000, 0.0002048200000000 ] - [ -0.0003172500000000, -0.0017730600000000, -0.0005373100000000 ] - [ -0.0011148600000000, 0.0023932600000000, 0.0002340200000000 ] - [ 0.0007376400000000, 0.0190440000000000, 0.0002737200000000 ] - [ -0.0001814300000000, 0.0004402700000000, 0.0003391200000000 ] - [ 0.0013876700000000, 0.0024496500000000, 0.0011849200000000 ] - [ 0.0031904700000000, -0.0102331700000000, -0.0009888800000000 ] - [ -0.0004345300000000, -0.0006495400000000, -0.0004535900000000 ] - [ -0.0002080200000000, -0.0020321400000000, -0.0003990000000000 ] - [ 0.0001159000000000, -0.0005777300000000, -0.0003054400000000 ] - [ 0.0005406400000000, 0.0209250400000000, -0.0013287300000000 ] - [ 0.0001560800000000, 0.0004054000000000, -0.0001908200000000 ] - [ -0.0014348100000000, 0.0025360800000000, -0.0017449900000000 ] - [ 0.0001963000000000, 0.0005747500000000, -0.0003017300000000 ] - [ -0.0133919200000000, 0.0231440000000000, 0.0049338700000000 ] - [ 0.0006213500000000, 0.0002178500000000, 0.0001756700000000 ] - [ -0.0002076700000000, 0.0007990600000000, -0.0001413300000000 ] - [ -0.0000060700000000, 0.0000271300000000, 0.0000575900000000 ] - [ 0.0261632700000000, -0.1118930200000000, 0.0157498500000000 ] - [ -0.0003068800000000, -0.0006667800000000, 0.0003735000000000 ] - [ 0.0004971000000000, -0.0016092000000000, 0.0000028600000000 ] - [ -0.0000893000000000, -0.0003303900000000, -0.0000960300000000 ] - [ -0.0001031900000000, 0.0186208200000000, -0.0007986600000000 ] - [ -0.0001354300000000, 0.0005784300000000, 0.0001852800000000 ] - [ 0.0000608600000000, 0.0009725800000000, 0.0002595600000000 ] - [ -0.0000656300000000, 0.0003087600000000, -0.0000814700000000 ] - [ -0.0012590400000000, 0.0035793100000000, 0.0016755400000000 ] - [ 0.0016365600000000, 0.0035848100000000, -0.0013847300000000 ] - [ -0.0002460700000000, 0.0007870800000000, 0.0000920100000000 ] - [ 0.0001146000000000, 0.0007961300000000, 0.0004127400000000 ] - [ 0.0000245100000000, -0.0048349500000000, 0.0003811700000000 ] - [ -0.0012090300000000, -0.0048199500000000, -0.0006641800000000 ] - [ -0.0001397500000000, -0.0009395800000000, 0.0003319000000000 ] - [ -0.0000573400000000, -0.0009154200000000, 0.0005927100000000 ] - [ 0.0110054900000000, 0.0187686400000000, -0.0096137500000000 ] - [ -0.0006865200000000, 0.0001317600000000, -0.0002133500000000 ] - [ 0.0004636500000000, 0.0004453900000000, 0.0004149700000000 ] - [ -0.0003993900000000, 0.0000101600000000, 0.0001214900000000 ] - [ -0.0063113900000000, 0.0057432900000000, 0.0158840800000000 ] - [ 0.0001098800000000, -0.0002138600000000, 0.0000068200000000 ] - [ 0.0011502900000000, -0.0007387600000000, -0.0033012800000000 ] - [ 0.0001731700000000, 0.0000112200000000, -0.0002796600000000 ] - [ -0.0003258600000000, 0.0031416300000000, 0.0003463700000000 ] - [ 0.0001101700000000, 0.0005317700000000, -0.0001169200000000 ] - [ -0.0002039900000000, 0.0031535100000000, 0.0011829000000000 ] - [ 0.0000126900000000, 0.0005089300000000, -0.0000430700000000 ] - [ -0.0028218200000000, -0.0020164100000000, -0.0101409800000000 ] - [ 0.0001653500000000, -0.0005976600000000, -0.0001892400000000 ] - [ -0.0022312200000000, -0.0020217700000000, 0.0090089400000000 ] - [ 0.0001461400000000, -0.0006135300000000, -0.0000064100000000 ] - [ 0.0001868200000000, 0.0024404000000000, -0.0011262100000000 ] - [ -0.0000531500000000, 0.0007582800000000, -0.0001394200000000 ] - [ 0.0031367200000000, 0.0059187700000000, 0.0003355000000000 ] - [ -0.0011861400000000, 0.0022441600000000, 0.0009659800000000 ] - [ 0.0006793600000000, -0.0015812000000000, -0.0009549700000000 ] - [ -0.0006034300000000, -0.0006230000000000, -0.0002960300000000 ] - [ 0.0037212100000000, -0.0023043300000000, 0.0027260600000000 ] - [ -0.0012077500000000, -0.0013873600000000, 0.0005501000000000 ] - [ -0.0003982300000000, -0.0000668500000000, 0.0001207700000000 ] - [ 0.0009823300000000, -0.0016254000000000, 0.0047425300000000 ] - [ -0.0057311300000000, -0.0012906200000000, -0.0017492100000000 ] - [ 0.0092087300000000, 0.0037213900000000, -0.0083189900000000 ]- atom: 37 displacement: [ 0.0000000000000000, -0.0100000000000000, 0.0000000000000000 ] forces: - [ 0.0103269700000000, -0.0270689100000000, 0.0068122200000000 ] - [ 0.0017434600000000, -0.0004601300000000, 0.0008286800000000 ] - [ -0.0011457000000000, -0.0007875400000000, 0.0026331300000000 ] - [ 0.0009047900000000, -0.0001248800000000, 0.0002002800000000 ] - [ 0.0042090300000000, -0.0093811500000000, 0.0047723200000000 ] - [ -0.0010900400000000, -0.0003909000000000, 0.0004876700000000 ] - [ -0.0005608100000000, -0.0010724100000000, -0.0016148400000000 ] - [ -0.0002826300000000, -0.0000814700000000, -0.0012796200000000 ] - [ 0.0038293700000000, -0.0000244000000000, -0.0012446500000000 ] - [ -0.0051664800000000, 0.0041242500000000, -0.0058081900000000 ] - [ 0.0006893400000000, 0.0003916700000000, 0.0006046500000000 ] - [ -0.0018493300000000, 0.0010584200000000, 0.0025215900000000 ] - [ 0.0003862900000000, 0.0012584800000000, -0.0016257400000000 ] - [ -0.0001279800000000, 0.0001563900000000, -0.0001675700000000 ] - [ 0.0098121900000000, 0.0134534500000000, 0.0115780700000000 ] - [ -0.0014004000000000, 0.0000915800000000, 0.0001359100000000 ] - [ -0.0001567200000000, 0.0022787600000000, -0.0005247500000000 ] - [ 0.0027276100000000, 0.0102746200000000, -0.0007294600000000 ] - [ 0.0000781400000000, 0.0004083300000000, -0.0002258400000000 ] - [ 0.0003112400000000, 0.0017589800000000, 0.0005265100000000 ] - [ 0.0011043400000000, -0.0023966700000000, -0.0002740900000000 ] - [ -0.0006159000000000, -0.0190098500000000, -0.0003792700000000 ] - [ 0.0001741000000000, -0.0004531000000000, -0.0003417200000000 ] - [ -0.0013638600000000, -0.0024174600000000, -0.0011390000000000 ] - [ -0.0031954600000000, 0.0102575900000000, 0.0009532700000000 ] - [ 0.0004560700000000, 0.0006477900000000, 0.0004574700000000 ] - [ 0.0002257600000000, 0.0020475000000000, 0.0004248000000000 ] - [ -0.0001189500000000, 0.0005897200000000, 0.0003067200000000 ] - [ -0.0006711900000000, -0.0208688800000000, 0.0014264200000000 ] - [ -0.0001350600000000, -0.0004117600000000, 0.0002166100000000 ] - [ 0.0014241400000000, -0.0025403200000000, 0.0017304100000000 ] - [ -0.0001949900000000, -0.0005898200000000, 0.0003026800000000 ] - [ 0.0135557800000000, -0.0233876000000000, -0.0049154800000000 ] - [ -0.0007232400000000, -0.0002072200000000, -0.0000604100000000 ] - [ 0.0001032500000000, -0.0007822600000000, 0.0002322800000000 ] - [ -0.0000915100000000, -0.0000373400000000, 0.0000537500000000 ] - [ -0.0254248700000000, 0.1111378300000000, -0.0153821800000000 ] - [ 0.0003232000000000, 0.0006617800000000, -0.0003955100000000 ] - [ -0.0004877500000000, 0.0016104500000000, -0.0000440400000000 ] - [ 0.0001037000000000, 0.0003192800000000, 0.0000684700000000 ] - [ 0.0001204300000000, -0.0183364100000000, 0.0007798200000000 ] - [ 0.0001353800000000, -0.0005883300000000, -0.0002114300000000 ] - [ -0.0000508400000000, -0.0009711200000000, -0.0002886800000000 ] - [ 0.0000885000000000, -0.0003110900000000, 0.0000471700000000 ] - [ 0.0012529800000000, -0.0035997300000000, -0.0016207700000000 ] - [ -0.0016077000000000, -0.0035992000000000, 0.0014266000000000 ] - [ 0.0002534100000000, -0.0007835600000000, -0.0000760100000000 ] - [ -0.0000890100000000, -0.0007872900000000, -0.0003835900000000 ] - [ 0.0000785900000000, 0.0048209200000000, -0.0003519700000000 ] - [ 0.0010795600000000, 0.0048341500000000, 0.0006571700000000 ] - [ 0.0001701100000000, 0.0009226600000000, -0.0003082900000000 ] - [ 0.0000565600000000, 0.0009311400000000, -0.0005589300000000 ] - [ -0.0112928500000000, -0.0189375500000000, 0.0096535200000000 ] - [ 0.0005911000000000, -0.0001259400000000, 0.0001190100000000 ] - [ -0.0005537000000000, -0.0004404200000000, -0.0005443800000000 ] - [ 0.0002991400000000, -0.0000032000000000, -0.0002569500000000 ] - [ 0.0063748000000000, -0.0057687800000000, -0.0156576500000000 ] - [ -0.0000110600000000, 0.0002076100000000, 0.0001025600000000 ] - [ -0.0010404600000000, 0.0007213100000000, 0.0033742200000000 ] - [ -0.0000787300000000, -0.0000201200000000, 0.0003902800000000 ] - [ 0.0003165100000000, -0.0031407600000000, -0.0003721200000000 ] - [ -0.0000993600000000, -0.0005069000000000, 0.0000802100000000 ] - [ 0.0002263800000000, -0.0031394400000000, -0.0012465600000000 ] - [ -0.0000461900000000, -0.0005248800000000, 0.0000108400000000 ] - [ 0.0027772000000000, 0.0020924200000000, 0.0100528800000000 ] - [ -0.0001795600000000, 0.0006070600000000, 0.0001677300000000 ] - [ 0.0022028600000000, 0.0020858200000000, -0.0089816500000000 ] - [ -0.0001444500000000, 0.0005889600000000, -0.0000317300000000 ] - [ -0.0001876300000000, -0.0024376400000000, 0.0011812100000000 ] - [ 0.0000484800000000, -0.0007557700000000, 0.0001651700000000 ] - [ -0.0032229600000000, -0.0059603400000000, -0.0003430800000000 ] - [ 0.0011897100000000, -0.0022524000000000, -0.0009400200000000 ] - [ -0.0006901100000000, 0.0015944100000000, 0.0009773600000000 ] - [ 0.0005825100000000, 0.0006259700000000, 0.0003205300000000 ] - [ -0.0037325200000000, 0.0023371100000000, -0.0026837900000000 ] - [ 0.0011969400000000, 0.0013948800000000, -0.0005183400000000 ] - [ 0.0004933200000000, 0.0000742100000000, -0.0002280000000000 ] - [ -0.0008869600000000, 0.0016021900000000, -0.0048273700000000 ] - [ 0.0057414100000000, 0.0012585800000000, 0.0016368800000000 ] - [ -0.0090477100000000, -0.0037413000000000, 0.0081665800000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0070307300000000, -0.0097875700000000, 0.0183005700000000 ] - [ 0.0027707200000000, -0.0004329500000000, 0.0041445200000000 ] - [ 0.0019680400000000, -0.0000081700000000, -0.0085332800000000 ] - [ -0.0012459700000000, -0.0001008400000000, -0.0023841400000000 ] - [ -0.0069143200000000, -0.0047299400000000, 0.0096922400000000 ] - [ 0.0021064700000000, -0.0012752200000000, 0.0012922400000000 ] - [ 0.0013231700000000, 0.0027807700000000, -0.0080227700000000 ] - [ -0.0006415400000000, 0.0002163100000000, -0.0025821400000000 ] - [ 0.0029382200000000, 0.0009372900000000, 0.0010083000000000 ] - [ -0.0058840600000000, 0.0049683600000000, 0.0043008400000000 ] - [ -0.0015733600000000, -0.0007640700000000, -0.0028821200000000 ] - [ 0.0041398300000000, -0.0032534000000000, -0.0048366900000000 ] - [ 0.0022367300000000, 0.0022944500000000, -0.0066028300000000 ] - [ -0.0005264600000000, 0.0002591300000000, -0.0018623400000000 ] - [ -0.0052412200000000, -0.0101316000000000, 0.0083811000000000 ] - [ 0.0008120700000000, -0.0000551000000000, 0.0021907500000000 ] - [ -0.0014097300000000, 0.0008302800000000, 0.0022949700000000 ] - [ 0.0002647500000000, 0.0019558400000000, 0.0035395900000000 ] - [ 0.0009990600000000, -0.0001504300000000, -0.0017891900000000 ] - [ -0.0009772500000000, -0.0006611800000000, -0.0029538500000000 ] - [ -0.0019164700000000, 0.0000359000000000, 0.0049614000000000 ] - [ -0.0039635100000000, 0.0007231600000000, 0.0242103800000000 ] - [ 0.0012061600000000, 0.0000104500000000, -0.0021593500000000 ] - [ -0.0040738600000000, -0.0010891800000000, -0.0075928900000000 ] - [ 0.0007598700000000, -0.0033274100000000, 0.0041909200000000 ] - [ -0.0007290600000000, -0.0000850800000000, 0.0007701500000000 ] - [ -0.0001096500000000, 0.0006688200000000, -0.0033217500000000 ] - [ 0.0004950900000000, -0.0000657400000000, -0.0013038500000000 ] - [ -0.0094769300000000, -0.0015027800000000, 0.0347330000000000 ] - [ -0.0010791000000000, 0.0002313600000000, 0.0004689100000000 ] - [ -0.0042929400000000, 0.0007549200000000, -0.0078923700000000 ] - [ 0.0005800200000000, 0.0001253300000000, -0.0015586600000000 ] - [ -0.0038047200000000, 0.0054922500000000, -0.0057181600000000 ] - [ -0.0001651200000000, -0.0001973600000000, -0.0021325000000000 ] - [ 0.0016727200000000, -0.0016051400000000, 0.0050039700000000 ] - [ -0.0002379300000000, -0.0001436700000000, 0.0018825300000000 ] - [ 0.0406702300000000, 0.0158179400000000, -0.1491604500000000 ] - [ -0.0002919300000000, 0.0004003300000000, -0.0017145400000000 ] - [ 0.0000407300000000, 0.0000357400000000, 0.0063836100000000 ] - [ -0.0001199500000000, -0.0000527800000000, 0.0012142800000000 ] - [ -0.0004961700000000, 0.0007433200000000, -0.0066497500000000 ] - [ 0.0001094200000000, -0.0002200600000000, -0.0013402900000000 ] - [ 0.0000210300000000, -0.0002939600000000, 0.0030614900000000 ] - [ -0.0000437500000000, 0.0000419400000000, 0.0010744300000000 ] - [ -0.0005848300000000, -0.0014017700000000, -0.0044528300000000 ] - [ 0.0013411100000000, 0.0016472000000000, -0.0044781900000000 ] - [ 0.0001453200000000, 0.0003840200000000, 0.0022891600000000 ] - [ -0.0002179600000000, 0.0000553400000000, 0.0023085600000000 ] - [ -0.0079060100000000, 0.0006604300000000, -0.0049248400000000 ] - [ 0.0055791500000000, -0.0003459700000000, -0.0049466300000000 ] - [ 0.0000573700000000, -0.0005396300000000, 0.0028356600000000 ] - [ -0.0005727100000000, -0.0003232800000000, 0.0028106500000000 ] - [ -0.0051757800000000, -0.0104203300000000, -0.0021299300000000 ] - [ 0.0008709100000000, -0.0002125300000000, -0.0012667000000000 ] - [ 0.0004683000000000, 0.0010082100000000, 0.0037420400000000 ] - [ -0.0010357500000000, 0.0000041600000000, 0.0014405000000000 ] - [ -0.0093977200000000, 0.0159355700000000, 0.0180477200000000 ] - [ 0.0003815400000000, 0.0002447100000000, -0.0001309400000000 ] - [ 0.0007122400000000, -0.0018383300000000, 0.0039582600000000 ] - [ -0.0005302500000000, -0.0001387100000000, 0.0007317800000000 ] - [ 0.0008431500000000, 0.0012324500000000, 0.0006720300000000 ] - [ -0.0004064000000000, -0.0000278500000000, 0.0000485500000000 ] - [ -0.0002329900000000, 0.0003552600000000, 0.0007134700000000 ] - [ 0.0004437800000000, -0.0000761300000000, 0.0000246600000000 ] - [ 0.0080498000000000, -0.0090996800000000, 0.0258861800000000 ] - [ -0.0005010000000000, -0.0000332300000000, 0.0001739700000000 ] - [ -0.0071949000000000, 0.0099807400000000, 0.0254509800000000 ] - [ 0.0008560500000000, 0.0001874600000000, 0.0002107500000000 ] - [ -0.0021208900000000, 0.0011555800000000, 0.0014756500000000 ] - [ 0.0008720400000000, 0.0001798000000000, 0.0004405400000000 ] - [ 0.0027356500000000, -0.0003192700000000, 0.0013354000000000 ] - [ -0.0015131500000000, -0.0009377300000000, -0.0004064000000000 ] - [ -0.0029537300000000, -0.0009945900000000, 0.0024204100000000 ] - [ 0.0021019400000000, -0.0003330700000000, 0.0006716600000000 ] - [ 0.0077052800000000, 0.0026666100000000, 0.0041180000000000 ] - [ -0.0025416500000000, 0.0005163700000000, -0.0003801500000000 ] - [ -0.0010321900000000, 0.0001282300000000, 0.0010860600000000 ] - [ 0.0021053700000000, 0.0003380200000000, 0.0051794500000000 ] - [ 0.0039640500000000, 0.0006258900000000, -0.0000743200000000 ] - [ -0.0122451600000000, -0.0096542300000000, 0.0050126000000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ -0.0073089000000000, 0.0100623300000000, -0.0182742300000000 ] - [ -0.0026845000000000, 0.0004387800000000, -0.0041223700000000 ] - [ -0.0019248600000000, -0.0000134400000000, 0.0085833500000000 ] - [ 0.0013077500000000, 0.0001065300000000, 0.0024415500000000 ] - [ 0.0071809900000000, 0.0050431800000000, -0.0093090600000000 ] - [ -0.0020584300000000, 0.0012785900000000, -0.0013275700000000 ] - [ -0.0013318400000000, -0.0027897700000000, 0.0079669300000000 ] - [ 0.0006972100000000, -0.0002251100000000, 0.0025235300000000 ] - [ -0.0029697900000000, -0.0009413800000000, -0.0009540000000000 ] - [ 0.0058217200000000, -0.0049652300000000, -0.0041973500000000 ] - [ 0.0015691700000000, 0.0007583200000000, 0.0028871000000000 ] - [ -0.0042188200000000, 0.0032766400000000, 0.0048737300000000 ] - [ -0.0022609100000000, -0.0022644700000000, 0.0065478400000000 ] - [ 0.0004718100000000, -0.0002590600000000, 0.0018325600000000 ] - [ 0.0051467800000000, 0.0099717100000000, -0.0085562900000000 ] - [ -0.0008613100000000, 0.0000557300000000, -0.0022174800000000 ] - [ 0.0014182700000000, -0.0008361700000000, -0.0022761800000000 ] - [ -0.0002532300000000, -0.0019611800000000, -0.0035684300000000 ] - [ -0.0010025200000000, 0.0001554200000000, 0.0017822500000000 ] - [ 0.0009758200000000, 0.0006581400000000, 0.0029505200000000 ] - [ 0.0019068700000000, -0.0000383400000000, -0.0049825200000000 ] - [ 0.0049967900000000, -0.0010116100000000, -0.0247274200000000 ] - [ -0.0011920300000000, -0.0000116300000000, 0.0021697400000000 ] - [ 0.0040379700000000, 0.0010778500000000, 0.0075748500000000 ] - [ -0.0007774600000000, 0.0032814000000000, -0.0041422900000000 ] - [ 0.0007327900000000, 0.0000880300000000, -0.0007554700000000 ] - [ 0.0001217900000000, -0.0006620100000000, 0.0033139400000000 ] - [ -0.0005013400000000, 0.0000662600000000, 0.0012847000000000 ] - [ 0.0075971800000000, 0.0008982100000000, -0.0323278200000000 ] - [ 0.0011039100000000, -0.0002405900000000, -0.0004427400000000 ] - [ 0.0043270800000000, -0.0007605100000000, 0.0078899900000000 ] - [ -0.0005855900000000, -0.0001283700000000, 0.0015538600000000 ] - [ 0.0036404000000000, -0.0053887100000000, 0.0058532200000000 ] - [ 0.0000659900000000, 0.0002109700000000, 0.0022177500000000 ] - [ -0.0017656200000000, 0.0016100600000000, -0.0048936600000000 ] - [ 0.0001278600000000, 0.0001082600000000, -0.0017901900000000 ] - [ -0.0397170100000000, -0.0153383100000000, 0.1467770000000000 ] - [ 0.0002997900000000, -0.0003613000000000, 0.0016717400000000 ] - [ -0.0000267200000000, 0.0000056400000000, -0.0064166400000000 ] - [ 0.0000988000000000, 0.0000939600000000, -0.0012260000000000 ] - [ 0.0005141200000000, -0.0008232900000000, 0.0066066100000000 ] - [ -0.0001033200000000, 0.0001929800000000, 0.0013262900000000 ] - [ -0.0000117900000000, 0.0002644400000000, -0.0030705300000000 ] - [ 0.0000661400000000, -0.0000720200000000, -0.0011257400000000 ] - [ 0.0005860900000000, 0.0013974700000000, 0.0045069500000000 ] - [ -0.0013114100000000, -0.0016475500000000, 0.0044828500000000 ] - [ -0.0001514100000000, -0.0003923200000000, -0.0022726900000000 ] - [ 0.0002299400000000, -0.0000926900000000, -0.0022614300000000 ] - [ 0.0079637400000000, -0.0006671600000000, 0.0049044200000000 ] - [ -0.0057095200000000, 0.0003634500000000, 0.0048880900000000 ] - [ -0.0000647200000000, 0.0005811900000000, -0.0027903800000000 ] - [ 0.0006189900000000, 0.0003227400000000, -0.0027968600000000 ] - [ 0.0050679600000000, 0.0104542900000000, 0.0019660200000000 ] - [ -0.0009767300000000, 0.0002086600000000, 0.0011449600000000 ] - [ -0.0005946200000000, -0.0010262300000000, -0.0038057400000000 ] - [ 0.0009317100000000, 0.0000306200000000, -0.0015150300000000 ] - [ 0.0093502300000000, -0.0156780500000000, -0.0177536300000000 ] - [ -0.0002630800000000, -0.0002301100000000, 0.0001916500000000 ] - [ -0.0006032500000000, 0.0018742800000000, -0.0038759400000000 ] - [ 0.0006388100000000, 0.0001074400000000, -0.0006238600000000 ] - [ -0.0008703100000000, -0.0012092500000000, -0.0007305200000000 ] - [ 0.0004038400000000, 0.0000323100000000, -0.0000656300000000 ] - [ 0.0002260400000000, -0.0003398400000000, -0.0007149600000000 ] - [ -0.0004583800000000, 0.0000855800000000, -0.0000612400000000 ] - [ -0.0079258800000000, 0.0088952200000000, -0.0254779100000000 ] - [ 0.0004887600000000, 0.0000228500000000, -0.0002237500000000 ] - [ 0.0073374100000000, -0.0102055400000000, -0.0258989400000000 ] - [ -0.0008996300000000, -0.0001691000000000, -0.0002214100000000 ] - [ 0.0020883600000000, -0.0011263100000000, -0.0014671000000000 ] - [ -0.0008495200000000, -0.0001478800000000, -0.0004218100000000 ] - [ -0.0027216000000000, 0.0003422500000000, -0.0012903400000000 ] - [ 0.0014899900000000, 0.0009656700000000, 0.0004537500000000 ] - [ 0.0029381700000000, 0.0009478300000000, -0.0023989000000000 ] - [ -0.0021085800000000, 0.0003164500000000, -0.0006409200000000 ] - [ -0.0077885100000000, -0.0027174600000000, -0.0040899600000000 ] - [ 0.0025533100000000, -0.0005488200000000, 0.0004140100000000 ] - [ 0.0011273400000000, -0.0000890200000000, -0.0011702700000000 ] - [ -0.0019924100000000, -0.0003440700000000, -0.0052539400000000 ] - [ -0.0038463000000000, -0.0006372300000000, -0.0000078700000000 ] - [ 0.0124241900000000, 0.0097094100000000, -0.0050467200000000 ]