# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/582725f7-1398-4877-b90b-95d4f95c9ec8/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 Sr2MgH6 / P-3m1 (164) / materials id 644225](https://mdr.nims.go.jp/datasets/8697e64a-8882-4148-aed9-6122cd5f3d5b) ## Fulltext phonopy: version: 2.17.1 frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05 nac_unit_conversion_factor: 14.399652 configuration: save_params: ".true."physical_unit: atomic_mass: "AMU" length: "angstrom" force_constants: "eV/angstrom^2"space_group: type: "P-3m1" number: 164 Hall_symbol: "-P 3 2\""supercell_matrix:- [ 2, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 3 ]primitive_cell: lattice: - [ 5.412616290000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.706308150000000, 4.687463210000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 4.147500850000000 ] # c points: - symbol: Sr # 1 coordinates: [ 0.333333330000000, 0.666666670000000, 0.262627360000000 ] mass: 87.620000 - symbol: Sr # 2 coordinates: [ 0.666666670000000, 0.333333330000000, 0.737372640000000 ] mass: 87.620000 - symbol: Mg # 3 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 24.305000 - symbol: H # 4 coordinates: [ 0.178866300000000, 0.821133700000000, 0.762411270000000 ] mass: 1.007940 - symbol: H # 5 coordinates: [ 0.642267420000000, 0.821133700000000, 0.762411270000000 ] mass: 1.007940 - symbol: H # 6 coordinates: [ 0.178866300000000, 0.357732580000000, 0.762411270000000 ] mass: 1.007940 - symbol: H # 7 coordinates: [ 0.821133700000000, 0.178866300000000, 0.237588730000000 ] mass: 1.007940 - symbol: H # 8 coordinates: [ 0.357732580000000, 0.178866300000000, 0.237588730000000 ] mass: 1.007940 - symbol: H # 9 coordinates: [ 0.821133700000000, 0.642267420000000, 0.237588730000000 ] mass: 1.007940 reciprocal_lattice: # without 2pi - [ 0.184753536260742, 0.106667504047198, 0.000000000000000 ] # a* - [ 0.000000000000000, 0.213335007700252, 0.000000000000000 ] # b* - [ 0.000000000000000, 0.000000000000000, 0.241109052455047 ] # c*unit_cell: lattice: - [ 5.412616290000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.706308150000000, 4.687463210000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 4.147500850000000 ] # c points: - symbol: Sr # 1 coordinates: [ 0.333333330000000, 0.666666670000000, 0.262627360000000 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 2 coordinates: [ 0.666666670000000, 0.333333330000000, 0.737372640000000 ] mass: 87.620000 reduced_to: 2 - symbol: Mg # 3 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 24.305000 reduced_to: 3 - symbol: H # 4 coordinates: [ 0.178866300000000, 0.821133700000000, 0.762411270000000 ] mass: 1.007940 reduced_to: 4 - symbol: H # 5 coordinates: [ 0.642267420000000, 0.821133700000000, 0.762411270000000 ] mass: 1.007940 reduced_to: 5 - symbol: H # 6 coordinates: [ 0.178866300000000, 0.357732580000000, 0.762411270000000 ] mass: 1.007940 reduced_to: 6 - symbol: H # 7 coordinates: [ 0.821133700000000, 0.178866300000000, 0.237588730000000 ] mass: 1.007940 reduced_to: 7 - symbol: H # 8 coordinates: [ 0.357732580000000, 0.178866300000000, 0.237588730000000 ] mass: 1.007940 reduced_to: 8 - symbol: H # 9 coordinates: [ 0.821133700000000, 0.642267420000000, 0.237588730000000 ] mass: 1.007940 reduced_to: 9supercell: lattice: - [ 10.825232580000000, 0.000000000000000, 0.000000000000000 ] # a - [ -5.412616300000000, 9.374926420000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 12.442502550000000 ] # c points: - symbol: Sr # 1 coordinates: [ 0.166666665000000, 0.333333335000000, 0.087542453333333 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 2 coordinates: [ 0.666666665000000, 0.333333335000000, 0.087542453333333 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 3 coordinates: [ 0.166666665000000, 0.833333335000000, 0.087542453333333 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 4 coordinates: [ 0.666666665000000, 0.833333335000000, 0.087542453333333 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 5 coordinates: [ 0.166666665000000, 0.333333335000000, 0.420875786666667 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 6 coordinates: [ 0.666666665000000, 0.333333335000000, 0.420875786666667 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 7 coordinates: [ 0.166666665000000, 0.833333335000000, 0.420875786666667 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 8 coordinates: [ 0.666666665000000, 0.833333335000000, 0.420875786666667 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 9 coordinates: [ 0.166666665000000, 0.333333335000000, 0.754209120000000 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 10 coordinates: [ 0.666666665000000, 0.333333335000000, 0.754209120000000 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 11 coordinates: [ 0.166666665000000, 0.833333335000000, 0.754209120000000 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 12 coordinates: [ 0.666666665000000, 0.833333335000000, 0.754209120000000 ] mass: 87.620000 reduced_to: 1 - symbol: Sr # 13 coordinates: [ 0.333333335000000, 0.166666665000000, 0.245790880000000 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 14 coordinates: [ 0.833333335000000, 0.166666665000000, 0.245790880000000 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 15 coordinates: [ 0.333333335000000, 0.666666665000000, 0.245790880000000 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 16 coordinates: [ 0.833333335000000, 0.666666665000000, 0.245790880000000 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 17 coordinates: [ 0.333333335000000, 0.166666665000000, 0.579124213333333 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 18 coordinates: [ 0.833333335000000, 0.166666665000000, 0.579124213333333 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 19 coordinates: [ 0.333333335000000, 0.666666665000000, 0.579124213333333 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 20 coordinates: [ 0.833333335000000, 0.666666665000000, 0.579124213333333 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 21 coordinates: [ 0.333333335000000, 0.166666665000000, 0.912457546666667 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 22 coordinates: [ 0.833333335000000, 0.166666665000000, 0.912457546666667 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 23 coordinates: [ 0.333333335000000, 0.666666665000000, 0.912457546666667 ] mass: 87.620000 reduced_to: 13 - symbol: Sr # 24 coordinates: [ 0.833333335000000, 0.666666665000000, 0.912457546666667 ] mass: 87.620000 reduced_to: 13 - symbol: Mg # 25 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 26 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 27 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 28 coordinates: [ 0.500000000000000, 0.500000000000000, 0.000000000000000 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 29 coordinates: [ 0.000000000000000, 0.000000000000000, 0.333333333333333 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 30 coordinates: [ 0.500000000000000, 0.000000000000000, 0.333333333333333 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 31 coordinates: [ 0.000000000000000, 0.500000000000000, 0.333333333333333 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 32 coordinates: [ 0.500000000000000, 0.500000000000000, 0.333333333333333 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 33 coordinates: [ 0.000000000000000, 0.000000000000000, 0.666666666666667 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 34 coordinates: [ 0.500000000000000, 0.000000000000000, 0.666666666666667 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 35 coordinates: [ 0.000000000000000, 0.500000000000000, 0.666666666666667 ] mass: 24.305000 reduced_to: 25 - symbol: Mg # 36 coordinates: [ 0.500000000000000, 0.500000000000000, 0.666666666666667 ] mass: 24.305000 reduced_to: 25 - symbol: H # 37 coordinates: [ 0.089433150000000, 0.410566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 37 - symbol: H # 38 coordinates: [ 0.589433150000000, 0.410566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 37 - symbol: H # 39 coordinates: [ 0.089433150000000, 0.910566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 37 - symbol: H # 40 coordinates: [ 0.589433150000000, 0.910566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 37 - symbol: H # 41 coordinates: [ 0.089433150000000, 0.410566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 37 - symbol: H # 42 coordinates: [ 0.589433150000000, 0.410566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 37 - symbol: H # 43 coordinates: [ 0.089433150000000, 0.910566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 37 - symbol: H # 44 coordinates: [ 0.589433150000000, 0.910566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 37 - symbol: H # 45 coordinates: [ 0.089433150000000, 0.410566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 37 - symbol: H # 46 coordinates: [ 0.589433150000000, 0.410566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 37 - symbol: H # 47 coordinates: [ 0.089433150000000, 0.910566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 37 - symbol: H # 48 coordinates: [ 0.589433150000000, 0.910566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 37 - symbol: H # 49 coordinates: [ 0.321133710000000, 0.410566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 49 - symbol: H # 50 coordinates: [ 0.821133710000000, 0.410566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 49 - symbol: H # 51 coordinates: [ 0.321133710000000, 0.910566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 49 - symbol: H # 52 coordinates: [ 0.821133710000000, 0.910566850000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 49 - symbol: H # 53 coordinates: [ 0.321133710000000, 0.410566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 49 - symbol: H # 54 coordinates: [ 0.821133710000000, 0.410566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 49 - symbol: H # 55 coordinates: [ 0.321133710000000, 0.910566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 49 - symbol: H # 56 coordinates: [ 0.821133710000000, 0.910566850000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 49 - symbol: H # 57 coordinates: [ 0.321133710000000, 0.410566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 49 - symbol: H # 58 coordinates: [ 0.821133710000000, 0.410566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 49 - symbol: H # 59 coordinates: [ 0.321133710000000, 0.910566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 49 - symbol: H # 60 coordinates: [ 0.821133710000000, 0.910566850000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 49 - symbol: H # 61 coordinates: [ 0.089433150000000, 0.178866290000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 61 - symbol: H # 62 coordinates: [ 0.589433150000000, 0.178866290000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 61 - symbol: H # 63 coordinates: [ 0.089433150000000, 0.678866290000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 61 - symbol: H # 64 coordinates: [ 0.589433150000000, 0.678866290000000, 0.254137090000000 ] mass: 1.007940 reduced_to: 61 - symbol: H # 65 coordinates: [ 0.089433150000000, 0.178866290000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 61 - symbol: H # 66 coordinates: [ 0.589433150000000, 0.178866290000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 61 - symbol: H # 67 coordinates: [ 0.089433150000000, 0.678866290000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 61 - symbol: H # 68 coordinates: [ 0.589433150000000, 0.678866290000000, 0.587470423333333 ] mass: 1.007940 reduced_to: 61 - symbol: H # 69 coordinates: [ 0.089433150000000, 0.178866290000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 61 - symbol: H # 70 coordinates: [ 0.589433150000000, 0.178866290000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 61 - symbol: H # 71 coordinates: [ 0.089433150000000, 0.678866290000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 61 - symbol: H # 72 coordinates: [ 0.589433150000000, 0.678866290000000, 0.920803756666667 ] mass: 1.007940 reduced_to: 61 - symbol: H # 73 coordinates: [ 0.410566850000000, 0.089433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 73 - symbol: H # 74 coordinates: [ 0.910566850000000, 0.089433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 73 - symbol: H # 75 coordinates: [ 0.410566850000000, 0.589433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 73 - symbol: H # 76 coordinates: [ 0.910566850000000, 0.589433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 73 - symbol: H # 77 coordinates: [ 0.410566850000000, 0.089433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 73 - symbol: H # 78 coordinates: [ 0.910566850000000, 0.089433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 73 - symbol: H # 79 coordinates: [ 0.410566850000000, 0.589433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 73 - symbol: H # 80 coordinates: [ 0.910566850000000, 0.589433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 73 - symbol: H # 81 coordinates: [ 0.410566850000000, 0.089433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 73 - symbol: H # 82 coordinates: [ 0.910566850000000, 0.089433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 73 - symbol: H # 83 coordinates: [ 0.410566850000000, 0.589433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 73 - symbol: H # 84 coordinates: [ 0.910566850000000, 0.589433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 73 - symbol: H # 85 coordinates: [ 0.178866290000000, 0.089433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 85 - symbol: H # 86 coordinates: [ 0.678866290000000, 0.089433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 85 - symbol: H # 87 coordinates: [ 0.178866290000000, 0.589433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 85 - symbol: H # 88 coordinates: [ 0.678866290000000, 0.589433150000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 85 - symbol: H # 89 coordinates: [ 0.178866290000000, 0.089433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 85 - symbol: H # 90 coordinates: [ 0.678866290000000, 0.089433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 85 - symbol: H # 91 coordinates: [ 0.178866290000000, 0.589433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 85 - symbol: H # 92 coordinates: [ 0.678866290000000, 0.589433150000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 85 - symbol: H # 93 coordinates: [ 0.178866290000000, 0.089433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 85 - symbol: H # 94 coordinates: [ 0.678866290000000, 0.089433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 85 - symbol: H # 95 coordinates: [ 0.178866290000000, 0.589433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 85 - symbol: H # 96 coordinates: [ 0.678866290000000, 0.589433150000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 85 - symbol: H # 97 coordinates: [ 0.410566850000000, 0.321133710000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 97 - symbol: H # 98 coordinates: [ 0.910566850000000, 0.321133710000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 97 - symbol: H # 99 coordinates: [ 0.410566850000000, 0.821133710000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 97 - symbol: H # 100 coordinates: [ 0.910566850000000, 0.821133710000000, 0.079196243333333 ] mass: 1.007940 reduced_to: 97 - symbol: H # 101 coordinates: [ 0.410566850000000, 0.321133710000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 97 - symbol: H # 102 coordinates: [ 0.910566850000000, 0.321133710000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 97 - symbol: H # 103 coordinates: [ 0.410566850000000, 0.821133710000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 97 - symbol: H # 104 coordinates: [ 0.910566850000000, 0.821133710000000, 0.412529576666667 ] mass: 1.007940 reduced_to: 97 - symbol: H # 105 coordinates: [ 0.410566850000000, 0.321133710000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 97 - symbol: H # 106 coordinates: [ 0.910566850000000, 0.321133710000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 97 - symbol: H # 107 coordinates: [ 0.410566850000000, 0.821133710000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 97 - symbol: H # 108 coordinates: [ 0.910566850000000, 0.821133710000000, 0.745862910000000 ] mass: 1.007940 reduced_to: 97born_effective_charge:- # 1 (Sr) - [ 2.134847010000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 2.134847010000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 2.396173180000000 ]- # 2 (Sr) - [ 2.134847010000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 2.134847010000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 2.396173180000000 ]- # 3 (Mg) - [ 1.749016370000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 1.749016370000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.510545690000000 ]- # 4 (H) - [ -0.957664310000000, -0.078728780000000, 0.095663710000000 ] - [ -0.078728780000000, -1.048572480000000, -0.055231470000000 ] - [ 0.069234640000000, -0.039972640000000, -1.050482010000000 ]- # 5 (H) - [ -0.957664314011044, 0.078728782380357, -0.095663711216347 ] - [ 0.078728782251197, -1.048572475988956, -0.055231468097309 ] - [ -0.069234641618175, -0.039972637049536, -1.050482010000000 ]- # 6 (H) - [ -1.094026560988957, -0.000000002138033, 0.000000001216347 ] - [ -0.000000002493521, -0.912210229011044, 0.110462938097309 ] - [ 0.000000001618175, 0.079945277049536, -1.050482010000000 ]- # 7 (H) - [ -0.957664310000000, -0.078728780000000, 0.095663710000000 ] - [ -0.078728780000000, -1.048572480000000, -0.055231470000000 ] - [ 0.069234640000000, -0.039972640000000, -1.050482010000000 ]- # 8 (H) - [ -0.957664314011044, 0.078728782380357, -0.095663711216347 ] - [ 0.078728782251197, -1.048572475988956, -0.055231468097309 ] - [ -0.069234641618175, -0.039972637049536, -1.050482010000000 ]- # 9 (H) - [ -1.094026560988957, -0.000000002138033, 0.000000001216347 ] - [ -0.000000002493521, -0.912210229011044, 0.110462938097309 ] - [ 0.000000001618175, 0.079945277049536, -1.050482010000000 ]dielectric_constant: - [ 4.994771370000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 4.994771380000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 5.350594190000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0510277800000000, -0.0000953100000000, -0.0001120600000000 ] - [ 0.0052102600000000, -0.0000022200000000, -0.0002061200000000 ] - [ 0.0009625700000000, -0.0024522900000000, -0.0001421700000000 ] - [ 0.0009603300000000, 0.0024533300000000, -0.0002658500000000 ] - [ -0.0016141200000000, -0.0000024300000000, -0.0002072700000000 ] - [ 0.0008659800000000, -0.0000008000000000, -0.0002029000000000 ] - [ 0.0000504800000000, -0.0004713800000000, -0.0001031200000000 ] - [ 0.0000513700000000, 0.0004701400000000, -0.0003035900000000 ] - [ -0.0016149500000000, -0.0000029700000000, -0.0002003100000000 ] - [ 0.0008662100000000, 0.0000001600000000, -0.0002012500000000 ] - [ 0.0000507200000000, -0.0004714000000000, -0.0003096900000000 ] - [ 0.0000520800000000, 0.0004697900000000, -0.0000960000000000 ] - [ 0.0046276700000000, -0.0044460300000000, 0.0066872700000000 ] - [ 0.0045979200000000, 0.0044071800000000, -0.0062236800000000 ] - [ -0.0030542700000000, -0.0000075600000000, 0.0001991400000000 ] - [ 0.0006525800000000, 0.0000015600000000, 0.0002038500000000 ] - [ -0.0000335600000000, -0.0002350500000000, 0.0002509300000000 ] - [ -0.0000329100000000, 0.0002346000000000, 0.0001555500000000 ] - [ -0.0004395200000000, 0.0000006400000000, 0.0002029800000000 ] - [ 0.0002358600000000, 0.0000009900000000, 0.0002034200000000 ] - [ 0.0034317100000000, -0.0035630900000000, -0.0054373400000000 ] - [ 0.0034057300000000, 0.0035345700000000, 0.0057951900000000 ] - [ -0.0027280900000000, -0.0000039900000000, 0.0002057900000000 ] - [ 0.0007080800000000, 0.0000000900000000, 0.0002017800000000 ] - [ -0.0038916600000000, 0.0000234500000000, 0.0000044300000000 ] - [ 0.0011834600000000, 0.0000010500000000, 0.0000009000000000 ] - [ 0.0087322900000000, -0.0072750300000000, 0.0056496200000000 ] - [ 0.0088595800000000, 0.0073755600000000, -0.0057286400000000 ] - [ -0.0002851000000000, 0.0000053900000000, -0.0000029600000000 ] - [ 0.0004891000000000, -0.0000002400000000, -0.0000007700000000 ] - [ 0.0009729900000000, -0.0007259000000000, -0.0009696100000000 ] - [ 0.0009713600000000, 0.0007258600000000, 0.0009719800000000 ] - [ -0.0002643100000000, 0.0000000400000000, 0.0000006900000000 ] - [ 0.0003304700000000, -0.0000003900000000, -0.0000001700000000 ] - [ 0.0001139400000000, -0.0002180100000000, 0.0003206200000000 ] - [ 0.0001144700000000, 0.0002189800000000, -0.0003200300000000 ] - [ 0.0037444100000000, -0.0004187000000000, -0.0019828100000000 ] - [ -0.0005338500000000, -0.0003589100000000, -0.0005827300000000 ] - [ 0.0003122800000000, 0.0002965700000000, -0.0004283400000000 ] - [ 0.0000668900000000, -0.0003834900000000, -0.0000858400000000 ] - [ 0.0003538900000000, -0.0001068300000000, -0.0002345400000000 ] - [ -0.0000412600000000, -0.0001392600000000, -0.0001722300000000 ] - [ 0.0001699600000000, -0.0000026300000000, -0.0001849200000000 ] - [ 0.0001345200000000, -0.0002020400000000, -0.0002178400000000 ] - [ 0.0046120300000000, -0.0005340600000000, 0.0001567600000000 ] - [ -0.0008973300000000, -0.0004554500000000, 0.0006551100000000 ] - [ 0.0003176300000000, 0.0005455900000000, 0.0002528600000000 ] - [ 0.0000879500000000, -0.0004410600000000, -0.0003413700000000 ] - [ 0.0034754600000000, 0.0002639900000000, 0.0016505200000000 ] - [ -0.0008444600000000, 0.0001779600000000, 0.0001811100000000 ] - [ -0.0002423400000000, 0.0002044800000000, -0.0003165400000000 ] - [ 0.0000015000000000, -0.0004768200000000, 0.0000251700000000 ] - [ 0.0000454500000000, -0.0000730600000000, -0.0001675800000000 ] - [ -0.0003499400000000, -0.0000409600000000, -0.0002304600000000 ] - [ -0.0001740800000000, 0.0000228300000000, -0.0001847400000000 ] - [ -0.0001390300000000, -0.0001772100000000, -0.0002176000000000 ] - [ 0.0043556000000000, 0.0003784500000000, -0.0006119200000000 ] - [ -0.0012127500000000, 0.0002776700000000, -0.0010604400000000 ] - [ -0.0002210400000000, 0.0002612100000000, -0.0000615400000000 ] - [ 0.0000077700000000, -0.0007257700000000, -0.0006544400000000 ] - [ 0.0030188000000000, 0.0001782900000000, -0.0002040800000000 ] - [ -0.0005969100000000, 0.0001777300000000, -0.0001996000000000 ] - [ -0.0001641000000000, 0.0005826800000000, -0.0000446500000000 ] - [ -0.0001632900000000, -0.0002276000000000, -0.0003549700000000 ] - [ 0.0001704700000000, 0.0001773700000000, -0.0001999300000000 ] - [ -0.0002145400000000, 0.0001769700000000, -0.0002001800000000 ] - [ -0.0000569200000000, 0.0002918700000000, -0.0002128100000000 ] - [ -0.0000571300000000, 0.0000628000000000, -0.0001872300000000 ] - [ 0.0036935800000000, 0.0001785100000000, -0.0001974400000000 ] - [ -0.0006747200000000, 0.0001774700000000, -0.0002004700000000 ] - [ -0.0002141900000000, 0.0007310900000000, -0.0006046500000000 ] - [ -0.0002120500000000, -0.0003758300000000, 0.0002037500000000 ] - [ -0.0006523800000000, 0.0007257700000000, 0.0003422200000000 ] - [ 0.0014305500000000, -0.0018738400000000, -0.0001536900000000 ] - [ 0.0017072100000000, -0.0033343500000000, -0.0000090000000000 ] - [ -0.0008667100000000, 0.0006542400000000, 0.0002536700000000 ] - [ -0.0005039600000000, 0.0002697400000000, -0.0000497700000000 ] - [ 0.0002013000000000, 0.0000248000000000, 0.0003196400000000 ] - [ 0.0000322700000000, -0.0004733800000000, -0.0003712700000000 ] - [ -0.0002995800000000, 0.0002115200000000, 0.0003135300000000 ] - [ -0.0004485900000000, 0.0002387400000000, 0.0004795400000000 ] - [ 0.0001365100000000, -0.0000007400000000, -0.0000128100000000 ] - [ -0.0000013300000000, -0.0002261500000000, 0.0005313700000000 ] - [ -0.0002602100000000, 0.0001886900000000, 0.0001401900000000 ] - [ 0.0017954500000000, 0.0020180400000000, 0.0005555700000000 ] - [ -0.0003524800000000, -0.0005499000000000, 0.0000604700000000 ] - [ 0.0019695700000000, 0.0035328000000000, 0.0004038600000000 ] - [ -0.0005579200000000, -0.0004762100000000, 0.0001488000000000 ] - [ 0.0005161500000000, 0.0001544400000000, 0.0000841600000000 ] - [ -0.0001942100000000, -0.0000888500000000, 0.0004488200000000 ] - [ 0.0003419600000000, 0.0006542300000000, 0.0007735000000000 ] - [ 0.0000097100000000, -0.0000319200000000, 0.0000890400000000 ] - [ 0.0004485600000000, 0.0001806200000000, 0.0004157300000000 ] - [ -0.0001387900000000, -0.0000582300000000, -0.0000745700000000 ] - [ 0.0003082700000000, 0.0004059900000000, -0.0001281400000000 ] - [ 0.0000485300000000, -0.0000087900000000, 0.0002614600000000 ] - [ -0.0028151900000000, 0.0007711300000000, 0.0003346700000000 ] - [ -0.0030475300000000, -0.0011069200000000, 0.0000386600000000 ] - [ 0.0006023300000000, -0.0001774200000000, 0.0001999800000000 ] - [ 0.0002666600000000, -0.0001768500000000, 0.0002002900000000 ] - [ -0.0002708900000000, -0.0000772600000000, -0.0004915200000000 ] - [ -0.0002720100000000, -0.0002790400000000, 0.0008887400000000 ] - [ -0.0000385300000000, -0.0001769100000000, 0.0001997500000000 ] - [ 0.0000658900000000, -0.0001775300000000, 0.0002001000000000 ] - [ -0.0001292800000000, -0.0001853200000000, 0.0007455200000000 ] - [ -0.0001292300000000, -0.0001698600000000, -0.0003425100000000 ] - [ -0.0000364800000000, -0.0001771200000000, 0.0002001200000000 ] - [ 0.0000651800000000, -0.0001772600000000, 0.0001998500000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0632708400000000 ] - [ 0.0000000000000000, -0.0000701500000000, -0.0012465300000000 ] - [ 0.0000607500000000, 0.0000350800000000, -0.0012465300000000 ] - [ -0.0000607500000000, 0.0000350800000000, -0.0012465300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0081226500000000 ] - [ 0.0000000000000000, 0.0001235800000000, 0.0003735100000000 ] - [ -0.0001070200000000, -0.0000617900000000, 0.0003735100000000 ] - [ 0.0001070200000000, -0.0000617900000000, 0.0003735100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0080420200000000 ] - [ 0.0000000000000000, -0.0001156400000000, 0.0003719900000000 ] - [ 0.0001001500000000, 0.0000578200000000, 0.0003719900000000 ] - [ -0.0001001500000000, 0.0000578200000000, 0.0003719900000000 ] - [ 0.0064710500000000, -0.0037360600000000, 0.0006838200000000 ] - [ -0.0064710500000000, -0.0037360600000000, 0.0006838200000000 ] - [ 0.0000000000000000, 0.0074721300000000, 0.0006838200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005261900000000 ] - [ 0.0000476400000000, -0.0000275100000000, 0.0021705200000000 ] - [ -0.0000476400000000, -0.0000275100000000, 0.0021705200000000 ] - [ 0.0000000000000000, 0.0000550200000000, 0.0021705200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009703800000000 ] - [ -0.0056032400000000, 0.0032350300000000, 0.0020524800000000 ] - [ 0.0056032400000000, 0.0032350300000000, 0.0020524800000000 ] - [ 0.0000000000000000, -0.0064700700000000, 0.0020524800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003073000000000 ] - [ 0.0000000000000000, 0.0059231000000000, -0.0020221100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005619500000000 ] - [ 0.0051295600000000, -0.0029615500000000, -0.0020221100000000 ] - [ -0.0051295600000000, -0.0029615500000000, -0.0020221100000000 ] - [ 0.0000000000000000, -0.0029526500000000, 0.0012360800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000926000000000 ] - [ -0.0025570700000000, 0.0014763200000000, 0.0012360800000000 ] - [ 0.0025570700000000, 0.0014763200000000, 0.0012360800000000 ] - [ 0.0000000000000000, 0.0003483200000000, 0.0011996400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0006897200000000 ] - [ 0.0003016500000000, -0.0001741600000000, 0.0011996400000000 ] - [ -0.0003016500000000, -0.0001741600000000, 0.0011996400000000 ] - [ -0.0002685000000000, 0.0001550200000000, 0.0038673200000000 ] - [ -0.0003818200000000, -0.0000271500000000, 0.0002479800000000 ] - [ -0.0001674000000000, 0.0003442400000000, 0.0002479800000000 ] - [ 0.0001216800000000, -0.0000702500000000, 0.0000314700000000 ] - [ 0.0002136600000000, -0.0001233600000000, -0.0014710300000000 ] - [ 0.0002120300000000, -0.0000997500000000, -0.0007308500000000 ] - [ 0.0001924000000000, -0.0001337500000000, -0.0007308500000000 ] - [ 0.0001990500000000, -0.0001149200000000, -0.0006330300000000 ] - [ 0.0003098000000000, -0.0001788600000000, 0.0037057900000000 ] - [ 0.0005076900000000, -0.0002043300000000, 0.0001558200000000 ] - [ 0.0004308000000000, -0.0003375000000000, 0.0001558200000000 ] - [ 0.0001609800000000, -0.0000929400000000, -0.0000599000000000 ] - [ 0.0002685000000000, 0.0001550200000000, 0.0038673200000000 ] - [ 0.0003818200000000, -0.0000271500000000, 0.0002479800000000 ] - [ -0.0001216800000000, -0.0000702500000000, 0.0000314700000000 ] - [ 0.0001674000000000, 0.0003442400000000, 0.0002479800000000 ] - [ -0.0002136600000000, -0.0001233600000000, -0.0014710300000000 ] - [ -0.0002120300000000, -0.0000997500000000, -0.0007308500000000 ] - [ -0.0001990500000000, -0.0001149200000000, -0.0006330300000000 ] - [ -0.0001924000000000, -0.0001337500000000, -0.0007308500000000 ] - [ -0.0003098000000000, -0.0001788600000000, 0.0037057900000000 ] - [ -0.0005076900000000, -0.0002043300000000, 0.0001558200000000 ] - [ -0.0001609800000000, -0.0000929400000000, -0.0000599000000000 ] - [ -0.0004308000000000, -0.0003375000000000, 0.0001558200000000 ] - [ 0.0000000000000000, -0.0003100300000000, 0.0038673200000000 ] - [ 0.0000000000000000, 0.0001405100000000, 0.0000314700000000 ] - [ 0.0002144200000000, -0.0003170900000000, 0.0002479800000000 ] - [ -0.0002144200000000, -0.0003170900000000, 0.0002479800000000 ] - [ 0.0000000000000000, 0.0002467200000000, -0.0014710300000000 ] - [ 0.0000000000000000, 0.0002298400000000, -0.0006330300000000 ] - [ -0.0000196300000000, 0.0002335000000000, -0.0007308500000000 ] - [ 0.0000196300000000, 0.0002335000000000, -0.0007308500000000 ] - [ 0.0000000000000000, 0.0003577300000000, 0.0037057900000000 ] - [ 0.0000000000000000, 0.0001858900000000, -0.0000599000000000 ] - [ -0.0000768900000000, 0.0005418300000000, 0.0001558200000000 ] - [ 0.0000768900000000, 0.0005418300000000, 0.0001558200000000 ] - [ -0.0001188600000000, 0.0000686300000000, 0.0007934700000000 ] - [ -0.0009862000000000, -0.0003832500000000, 0.0040227800000000 ] - [ -0.0001611900000000, 0.0010457000000000, 0.0040227800000000 ] - [ -0.0003265600000000, 0.0001885400000000, 0.0007054600000000 ] - [ -0.0002845300000000, 0.0001642800000000, -0.0000369500000000 ] - [ 0.0007350300000000, 0.0007623000000000, -0.0009217700000000 ] - [ -0.0002926500000000, -0.0010177000000000, -0.0009217700000000 ] - [ 0.0000426900000000, -0.0000246500000000, 0.0000262300000000 ] - [ -0.0000284800000000, 0.0000164400000000, -0.0002217500000000 ] - [ -0.0005403800000000, -0.0003349200000000, -0.0007920000000000 ] - [ 0.0000198600000000, 0.0006354400000000, -0.0007920000000000 ] - [ -0.0002259400000000, 0.0001304500000000, -0.0000506000000000 ] - [ 0.0009862000000000, -0.0003832500000000, 0.0040227800000000 ] - [ 0.0001188600000000, 0.0000686300000000, 0.0007934700000000 ] - [ 0.0001611900000000, 0.0010457000000000, 0.0040227800000000 ] - [ 0.0003265600000000, 0.0001885400000000, 0.0007054600000000 ] - [ -0.0007350300000000, 0.0007623000000000, -0.0009217700000000 ] - [ 0.0002845300000000, 0.0001642800000000, -0.0000369500000000 ] - [ 0.0002926500000000, -0.0010177000000000, -0.0009217700000000 ] - [ -0.0000426900000000, -0.0000246500000000, 0.0000262300000000 ] - [ 0.0005403800000000, -0.0003349200000000, -0.0007920000000000 ] - [ 0.0000284800000000, 0.0000164400000000, -0.0002217500000000 ] - [ -0.0000198600000000, 0.0006354400000000, -0.0007920000000000 ] - [ 0.0002259400000000, 0.0001304500000000, -0.0000506000000000 ] - [ 0.0008250100000000, -0.0006624500000000, 0.0040227800000000 ] - [ -0.0008250100000000, -0.0006624500000000, 0.0040227800000000 ] - [ 0.0000000000000000, -0.0001372500000000, 0.0007934700000000 ] - [ 0.0000000000000000, -0.0003770800000000, 0.0007054600000000 ] - [ -0.0010276800000000, 0.0002554100000000, -0.0009217700000000 ] - [ 0.0010276800000000, 0.0002554100000000, -0.0009217700000000 ] - [ 0.0000000000000000, -0.0003285500000000, -0.0000369500000000 ] - [ 0.0000000000000000, 0.0000492900000000, 0.0000262300000000 ] - [ 0.0005602300000000, -0.0003005200000000, -0.0007920000000000 ] - [ -0.0005602300000000, -0.0003005200000000, -0.0007920000000000 ] - [ 0.0000000000000000, -0.0000328800000000, -0.0002217500000000 ] - [ 0.0000000000000000, -0.0002608900000000, -0.0000506000000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0629182700000000 ] - [ 0.0000000000000000, 0.0000730600000000, 0.0008328800000000 ] - [ -0.0000632800000000, -0.0000365300000000, 0.0008328800000000 ] - [ 0.0000632800000000, -0.0000365300000000, 0.0008328800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0084427500000000 ] - [ 0.0000000000000000, -0.0001235300000000, -0.0007787300000000 ] - [ 0.0001069800000000, 0.0000617700000000, -0.0007787300000000 ] - [ -0.0001069800000000, 0.0000617700000000, -0.0007787300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0085243100000000 ] - [ 0.0000000000000000, 0.0001163500000000, -0.0007806900000000 ] - [ -0.0001007600000000, -0.0000581800000000, -0.0007806900000000 ] - [ 0.0001007600000000, -0.0000581800000000, -0.0007806900000000 ] - [ -0.0064393400000000, 0.0037177600000000, -0.0002657400000000 ] - [ 0.0064393400000000, 0.0037177600000000, -0.0002657400000000 ] - [ 0.0000000000000000, -0.0074355100000000, -0.0002657400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009347800000000 ] - [ -0.0000480100000000, 0.0000277200000000, -0.0017586700000000 ] - [ 0.0000480100000000, 0.0000277200000000, -0.0017586700000000 ] - [ 0.0000000000000000, -0.0000554300000000, -0.0017586700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005591100000000 ] - [ 0.0056294800000000, -0.0032501800000000, -0.0016635000000000 ] - [ -0.0056294800000000, -0.0032501800000000, -0.0016635000000000 ] - [ 0.0000000000000000, 0.0065003600000000, -0.0016635000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000982100000000 ] - [ 0.0000000000000000, -0.0059243900000000, 0.0020312000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005592600000000 ] - [ -0.0051306700000000, 0.0029621900000000, 0.0020312000000000 ] - [ 0.0051306700000000, 0.0029621900000000, 0.0020312000000000 ] - [ 0.0000000000000000, 0.0029581200000000, -0.0012314000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000963300000000 ] - [ 0.0025618000000000, -0.0014790600000000, -0.0012314000000000 ] - [ -0.0025618000000000, -0.0014790600000000, -0.0012314000000000 ] - [ 0.0000000000000000, -0.0003471400000000, -0.0011972500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0006891200000000 ] - [ -0.0003006300000000, 0.0001735700000000, -0.0011972500000000 ] - [ 0.0003006300000000, 0.0001735700000000, -0.0011972500000000 ] - [ 0.0004385700000000, -0.0002532100000000, -0.0040178500000000 ] - [ 0.0006893500000000, -0.0001517200000000, -0.0006491900000000 ] - [ 0.0004760700000000, -0.0005211400000000, -0.0006491900000000 ] - [ 0.0001859600000000, -0.0001073600000000, -0.0004345700000000 ] - [ 0.0000946400000000, -0.0000546400000000, 0.0010674600000000 ] - [ 0.0000964000000000, -0.0000779500000000, 0.0003282100000000 ] - [ 0.0001157100000000, -0.0000445100000000, 0.0003282100000000 ] - [ 0.0001089800000000, -0.0000629200000000, 0.0002305900000000 ] - [ -0.0001491600000000, 0.0000861100000000, -0.0043677500000000 ] - [ -0.0001951300000000, 0.0000267000000000, -0.0005592800000000 ] - [ -0.0001206900000000, 0.0001556400000000, -0.0005592800000000 ] - [ 0.0001460400000000, -0.0000843100000000, -0.0003398600000000 ] - [ -0.0004385700000000, -0.0002532100000000, -0.0040178500000000 ] - [ -0.0006893500000000, -0.0001517200000000, -0.0006491900000000 ] - [ -0.0001859600000000, -0.0001073600000000, -0.0004345700000000 ] - [ -0.0004760700000000, -0.0005211400000000, -0.0006491900000000 ] - [ -0.0000946400000000, -0.0000546400000000, 0.0010674600000000 ] - [ -0.0000964000000000, -0.0000779500000000, 0.0003282100000000 ] - [ -0.0001089800000000, -0.0000629200000000, 0.0002305900000000 ] - [ -0.0001157100000000, -0.0000445100000000, 0.0003282100000000 ] - [ 0.0001491600000000, 0.0000861100000000, -0.0043677500000000 ] - [ 0.0001951300000000, 0.0000267000000000, -0.0005592800000000 ] - [ -0.0001460400000000, -0.0000843100000000, -0.0003398600000000 ] - [ 0.0001206900000000, 0.0001556400000000, -0.0005592800000000 ] - [ 0.0000000000000000, 0.0005064200000000, -0.0040178500000000 ] - [ 0.0000000000000000, 0.0002147300000000, -0.0004345700000000 ] - [ -0.0002132900000000, 0.0006728600000000, -0.0006491900000000 ] - [ 0.0002132900000000, 0.0006728600000000, -0.0006491900000000 ] - [ 0.0000000000000000, 0.0001092800000000, 0.0010674600000000 ] - [ 0.0000000000000000, 0.0001258400000000, 0.0002305900000000 ] - [ 0.0000193100000000, 0.0001224600000000, 0.0003282100000000 ] - [ -0.0000193100000000, 0.0001224600000000, 0.0003282100000000 ] - [ 0.0000000000000000, -0.0001722300000000, -0.0043677500000000 ] - [ 0.0000000000000000, 0.0001686300000000, -0.0003398600000000 ] - [ 0.0000744400000000, -0.0001823400000000, -0.0005592800000000 ] - [ -0.0000744400000000, -0.0001823400000000, -0.0005592800000000 ] - [ -0.0001907300000000, 0.0001101200000000, -0.0003903200000000 ] - [ 0.0006919700000000, 0.0005739900000000, -0.0036263700000000 ] - [ -0.0001511100000000, -0.0008862500000000, -0.0036263700000000 ] - [ 0.0000199200000000, -0.0000115000000000, -0.0003024300000000 ] - [ -0.0000225100000000, 0.0000130000000000, 0.0004363600000000 ] - [ -0.0010445200000000, -0.0005838900000000, 0.0013220500000000 ] - [ -0.0000166000000000, 0.0011965200000000, 0.0013220500000000 ] - [ -0.0003507700000000, 0.0002025200000000, 0.0003741100000000 ] - [ -0.0002790100000000, 0.0001610900000000, 0.0006241000000000 ] - [ 0.0002303000000000, 0.0005121400000000, 0.0011928000000000 ] - [ -0.0003283800000000, -0.0004555200000000, 0.0011928000000000 ] - [ -0.0000825100000000, 0.0000476400000000, 0.0004517600000000 ] - [ -0.0006919700000000, 0.0005739900000000, -0.0036263700000000 ] - [ 0.0001907300000000, 0.0001101200000000, -0.0003903200000000 ] - [ 0.0001511100000000, -0.0008862500000000, -0.0036263700000000 ] - [ -0.0000199200000000, -0.0000115000000000, -0.0003024300000000 ] - [ 0.0010445200000000, -0.0005838900000000, 0.0013220500000000 ] - [ 0.0000225100000000, 0.0000130000000000, 0.0004363600000000 ] - [ 0.0000166000000000, 0.0011965200000000, 0.0013220500000000 ] - [ 0.0003507700000000, 0.0002025200000000, 0.0003741100000000 ] - [ -0.0002303000000000, 0.0005121400000000, 0.0011928000000000 ] - [ 0.0002790100000000, 0.0001610900000000, 0.0006241000000000 ] - [ 0.0003283800000000, -0.0004555200000000, 0.0011928000000000 ] - [ 0.0000825100000000, 0.0000476400000000, 0.0004517600000000 ] - [ -0.0008430700000000, 0.0003122700000000, -0.0036263700000000 ] - [ 0.0008430700000000, 0.0003122700000000, -0.0036263700000000 ] - [ 0.0000000000000000, -0.0002202300000000, -0.0003903200000000 ] - [ 0.0000000000000000, 0.0000230000000000, -0.0003024300000000 ] - [ 0.0010279200000000, -0.0006126400000000, 0.0013220500000000 ] - [ -0.0010279200000000, -0.0006126400000000, 0.0013220500000000 ] - [ 0.0000000000000000, -0.0000260000000000, 0.0004363600000000 ] - [ 0.0000000000000000, -0.0004050300000000, 0.0003741100000000 ] - [ -0.0005586800000000, -0.0000566200000000, 0.0011928000000000 ] - [ 0.0005586800000000, -0.0000566200000000, 0.0011928000000000 ] - [ 0.0000000000000000, -0.0003221700000000, 0.0006241000000000 ] - [ 0.0000000000000000, -0.0000952800000000, 0.0004517600000000 ]- atom: 25 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0038926200000000, -0.0000113200000000, -0.0002070800000000 ] - [ 0.0011818700000000, -0.0000006800000000, -0.0002039200000000 ] - [ 0.0088599800000000, -0.0073771200000000, 0.0049572500000000 ] - [ 0.0087289800000000, 0.0072735700000000, -0.0053031000000000 ] - [ -0.0002658000000000, -0.0000004600000000, -0.0002046600000000 ] - [ 0.0003297400000000, -0.0000007800000000, -0.0002049000000000 ] - [ 0.0001127600000000, -0.0002191300000000, 0.0000968400000000 ] - [ 0.0001123400000000, 0.0002179600000000, -0.0005053100000000 ] - [ -0.0002865600000000, 0.0000006900000000, -0.0002048400000000 ] - [ 0.0004879900000000, -0.0000002700000000, -0.0002051100000000 ] - [ 0.0009718200000000, -0.0007270600000000, -0.0027609200000000 ] - [ 0.0009703300000000, 0.0007250100000000, 0.0023585900000000 ] - [ 0.0009718200000000, 0.0007270600000000, 0.0027609200000000 ] - [ 0.0009703300000000, -0.0007250100000000, -0.0023585900000000 ] - [ 0.0004879900000000, 0.0000002700000000, 0.0002051100000000 ] - [ -0.0002865600000000, -0.0000006900000000, 0.0002048400000000 ] - [ 0.0001127600000000, 0.0002191300000000, -0.0000968400000000 ] - [ 0.0001123400000000, -0.0002179600000000, 0.0005053100000000 ] - [ 0.0003297400000000, 0.0000007800000000, 0.0002049000000000 ] - [ -0.0002658000000000, 0.0000004600000000, 0.0002046600000000 ] - [ 0.0088599800000000, 0.0073771200000000, -0.0049572500000000 ] - [ 0.0087289800000000, -0.0072735700000000, 0.0053031000000000 ] - [ 0.0011818700000000, 0.0000006800000000, 0.0002039200000000 ] - [ -0.0038926200000000, 0.0000113200000000, 0.0002070800000000 ] - [ -0.0965511400000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0018974000000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0004642200000000, -0.0013648700000000, 0.0005703300000000 ] - [ -0.0004642200000000, 0.0013648700000000, -0.0005703300000000 ] - [ -0.0013188300000000, 0.0000008800000000, -0.0000020100000000 ] - [ 0.0007049400000000, 0.0000005600000000, 0.0000003200000000 ] - [ -0.0000189000000000, -0.0004184200000000, 0.0000469800000000 ] - [ -0.0000187300000000, 0.0004173000000000, -0.0000465900000000 ] - [ -0.0013188300000000, -0.0000008800000000, 0.0000020100000000 ] - [ 0.0007049400000000, -0.0000005600000000, -0.0000003200000000 ] - [ -0.0000187300000000, -0.0004173000000000, 0.0000465900000000 ] - [ -0.0000189000000000, 0.0004184200000000, -0.0000469800000000 ] - [ 0.0003324600000000, 0.0001302400000000, -0.0001262000000000 ] - [ -0.0000189100000000, -0.0002667700000000, -0.0002941100000000 ] - [ 0.0005905200000000, 0.0005273100000000, -0.0011368600000000 ] - [ -0.0002846300000000, -0.0001742300000000, 0.0001557800000000 ] - [ 0.0002273800000000, 0.0000345100000000, -0.0002061100000000 ] - [ 0.0000620400000000, -0.0001809500000000, -0.0001804000000000 ] - [ 0.0003573300000000, 0.0000311100000000, -0.0000112700000000 ] - [ -0.0001205500000000, -0.0000681200000000, -0.0003812600000000 ] - [ 0.0004706000000000, 0.0000584400000000, -0.0003137300000000 ] - [ -0.0001427200000000, -0.0004073700000000, -0.0000787700000000 ] - [ 0.0146654800000000, -0.0049985700000000, -0.0064323500000000 ] - [ -0.0010992700000000, -0.0003852300000000, -0.0002539300000000 ] - [ 0.0000243700000000, -0.0003090900000000, -0.0002762400000000 ] - [ -0.0003269500000000, 0.0000877200000000, -0.0001085300000000 ] - [ -0.0005938700000000, -0.0000060000000000, -0.0005598500000000 ] - [ 0.0002802600000000, -0.0007060000000000, 0.0007282400000000 ] - [ -0.0000805400000000, -0.0002140300000000, -0.0001964100000000 ] - [ -0.0002459500000000, 0.0000014500000000, -0.0002218900000000 ] - [ -0.0004285200000000, -0.0001106200000000, -0.0000217600000000 ] - [ 0.0000494000000000, -0.0002097400000000, -0.0003911300000000 ] - [ 0.0001632900000000, -0.0002391900000000, -0.0000886200000000 ] - [ -0.0004499800000000, 0.0002252100000000, -0.0003241100000000 ] - [ -0.0014058000000000, 0.0002059900000000, -0.0001453700000000 ] - [ 0.0138836100000000, 0.0045050600000000, 0.0056595000000000 ] - [ 0.0015034600000000, 0.0001763500000000, -0.0002009500000000 ] - [ -0.0004799400000000, 0.0001768700000000, -0.0002000000000000 ] - [ -0.0000130100000000, 0.0005607500000000, -0.0004836900000000 ] - [ -0.0000130300000000, -0.0002052600000000, 0.0000819200000000 ] - [ 0.0004119500000000, 0.0001766200000000, -0.0001997600000000 ] - [ -0.0002499400000000, 0.0001768400000000, -0.0001998700000000 ] - [ 0.0000253600000000, 0.0004264900000000, -0.0000254600000000 ] - [ 0.0000255900000000, -0.0000731200000000, -0.0003752600000000 ] - [ 0.0060462900000000, 0.0001104100000000, -0.0001594700000000 ] - [ -0.0008441800000000, 0.0001774700000000, -0.0002006700000000 ] - [ -0.0005947200000000, 0.0013145500000000, -0.0002572000000000 ] - [ -0.0005951000000000, -0.0009594500000000, -0.0001406200000000 ] - [ -0.0014058000000000, -0.0002059900000000, 0.0001453700000000 ] - [ 0.0138836100000000, -0.0045050600000000, -0.0056595000000000 ] - [ -0.0004499800000000, -0.0002252100000000, 0.0003241100000000 ] - [ 0.0001632900000000, 0.0002391900000000, 0.0000886200000000 ] - [ -0.0004285200000000, 0.0001106200000000, 0.0000217600000000 ] - [ 0.0000494000000000, 0.0002097400000000, 0.0003911300000000 ] - [ -0.0002459500000000, -0.0000014500000000, 0.0002218900000000 ] - [ -0.0000805400000000, 0.0002140300000000, 0.0001964100000000 ] - [ -0.0005938700000000, 0.0000060000000000, 0.0005598500000000 ] - [ 0.0002802600000000, 0.0007060000000000, -0.0007282400000000 ] - [ -0.0003269500000000, -0.0000877200000000, 0.0001085300000000 ] - [ 0.0000243700000000, 0.0003090900000000, 0.0002762400000000 ] - [ 0.0146654800000000, 0.0049985700000000, 0.0064323500000000 ] - [ -0.0010992700000000, 0.0003852300000000, 0.0002539300000000 ] - [ -0.0001427200000000, 0.0004073700000000, 0.0000787700000000 ] - [ 0.0004706000000000, -0.0000584400000000, 0.0003137300000000 ] - [ 0.0003573300000000, -0.0000311100000000, 0.0000112700000000 ] - [ -0.0001205500000000, 0.0000681200000000, 0.0003812600000000 ] - [ 0.0000620400000000, 0.0001809500000000, 0.0001804000000000 ] - [ 0.0002273800000000, -0.0000345100000000, 0.0002061100000000 ] - [ 0.0005905200000000, -0.0005273100000000, 0.0011368600000000 ] - [ -0.0002846300000000, 0.0001742300000000, -0.0001557800000000 ] - [ -0.0000189100000000, 0.0002667700000000, 0.0002941100000000 ] - [ 0.0003324600000000, -0.0001302400000000, 0.0001262000000000 ] - [ -0.0005947200000000, -0.0013145500000000, 0.0002572000000000 ] - [ -0.0005951000000000, 0.0009594500000000, 0.0001406200000000 ] - [ -0.0008441800000000, -0.0001774700000000, 0.0002006700000000 ] - [ 0.0060462900000000, -0.0001104100000000, 0.0001594700000000 ] - [ 0.0000253600000000, -0.0004264900000000, 0.0000254600000000 ] - [ 0.0000255900000000, 0.0000731200000000, 0.0003752600000000 ] - [ -0.0002499400000000, -0.0001768400000000, 0.0001998700000000 ] - [ 0.0004119500000000, -0.0001766200000000, 0.0001997600000000 ] - [ -0.0000130100000000, -0.0005607500000000, 0.0004836900000000 ] - [ -0.0000130300000000, 0.0002052600000000, -0.0000819200000000 ] - [ -0.0004799400000000, -0.0001768700000000, 0.0002000000000000 ] - [ 0.0015034600000000, -0.0001763500000000, 0.0002009500000000 ]- atom: 25 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0065736600000000, -0.0022492200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0007685400000000 ] - [ 0.0056929500000000, -0.0032868300000000, -0.0022492200000000 ] - [ -0.0056929500000000, -0.0032868300000000, -0.0022492200000000 ] - [ 0.0000000000000000, 0.0003740700000000, 0.0009952800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004835300000000 ] - [ 0.0003239500000000, -0.0001870300000000, 0.0009952800000000 ] - [ -0.0003239500000000, -0.0001870300000000, 0.0009952800000000 ] - [ 0.0000000000000000, -0.0011148300000000, 0.0010362500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002967900000000 ] - [ -0.0009654700000000, 0.0005574100000000, 0.0010362500000000 ] - [ 0.0009654700000000, 0.0005574100000000, 0.0010362500000000 ] - [ 0.0009763800000000, 0.0005637100000000, 0.0014303200000000 ] - [ -0.0009763800000000, 0.0005637100000000, 0.0014303200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001060400000000 ] - [ 0.0000000000000000, -0.0011274300000000, 0.0014303200000000 ] - [ -0.0003168500000000, -0.0001829300000000, 0.0013996000000000 ] - [ 0.0003168500000000, -0.0001829300000000, 0.0013996000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0008941900000000 ] - [ 0.0000000000000000, 0.0003658600000000, 0.0013996000000000 ] - [ -0.0056848400000000, -0.0032821400000000, -0.0018056300000000 ] - [ 0.0056848400000000, -0.0032821400000000, -0.0018056300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003560100000000 ] - [ 0.0000000000000000, 0.0065642900000000, -0.0018056300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0508990100000000 ] - [ 0.0000000000000000, -0.0006592700000000, -0.0012969000000000 ] - [ 0.0005709400000000, 0.0003296400000000, -0.0012969000000000 ] - [ -0.0005709400000000, 0.0003296400000000, -0.0012969000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0030738500000000 ] - [ 0.0000000000000000, -0.0000532300000000, 0.0003633300000000 ] - [ 0.0000461000000000, 0.0000266100000000, 0.0003633300000000 ] - [ -0.0000461000000000, 0.0000266100000000, 0.0003633300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0030371500000000 ] - [ 0.0000000000000000, -0.0000547300000000, 0.0003649200000000 ] - [ 0.0000473900000000, 0.0000273600000000, 0.0003649200000000 ] - [ -0.0000473900000000, 0.0000273600000000, 0.0003649200000000 ] - [ 0.0001092500000000, -0.0003662800000000, -0.0002534600000000 ] - [ 0.0001352600000000, -0.0000780900000000, -0.0003410900000000 ] - [ -0.0005689100000000, 0.0003284600000000, -0.0013344200000000 ] - [ 0.0003718300000000, 0.0000885300000000, -0.0002534600000000 ] - [ 0.0001125100000000, -0.0000673300000000, -0.0005591500000000 ] - [ 0.0002268300000000, -0.0001309600000000, -0.0004501900000000 ] - [ 0.0003351800000000, -0.0001935200000000, -0.0009470800000000 ] - [ 0.0001145600000000, -0.0000637700000000, -0.0005591500000000 ] - [ -0.0001189000000000, 0.0004709400000000, 0.0003301300000000 ] - [ 0.0001701500000000, -0.0000982300000000, 0.0002814400000000 ] - [ -0.0068435600000000, 0.0039511300000000, 0.0086456800000000 ] - [ -0.0004672900000000, -0.0001325000000000, 0.0003301300000000 ] - [ -0.0001092500000000, -0.0003662800000000, -0.0002534600000000 ] - [ -0.0001352600000000, -0.0000780900000000, -0.0003410900000000 ] - [ -0.0003718300000000, 0.0000885300000000, -0.0002534600000000 ] - [ 0.0005689100000000, 0.0003284600000000, -0.0013344200000000 ] - [ -0.0001125100000000, -0.0000673300000000, -0.0005591500000000 ] - [ -0.0002268300000000, -0.0001309600000000, -0.0004501900000000 ] - [ -0.0001145600000000, -0.0000637700000000, -0.0005591500000000 ] - [ -0.0003351800000000, -0.0001935200000000, -0.0009470800000000 ] - [ 0.0001189000000000, 0.0004709400000000, 0.0003301300000000 ] - [ -0.0001701500000000, -0.0000982300000000, 0.0002814400000000 ] - [ 0.0004672900000000, -0.0001325000000000, 0.0003301300000000 ] - [ 0.0068435600000000, 0.0039511300000000, 0.0086456800000000 ] - [ 0.0000000000000000, -0.0006569300000000, -0.0013344200000000 ] - [ 0.0000000000000000, 0.0001561900000000, -0.0003410900000000 ] - [ -0.0002625900000000, 0.0002777500000000, -0.0002534600000000 ] - [ 0.0002625900000000, 0.0002777500000000, -0.0002534600000000 ] - [ 0.0000000000000000, 0.0003870300000000, -0.0009470800000000 ] - [ 0.0000000000000000, 0.0002619200000000, -0.0004501900000000 ] - [ -0.0000020500000000, 0.0001311000000000, -0.0005591500000000 ] - [ 0.0000020500000000, 0.0001311000000000, -0.0005591500000000 ] - [ 0.0000000000000000, -0.0079022600000000, 0.0086456800000000 ] - [ 0.0000000000000000, 0.0001964700000000, 0.0002814400000000 ] - [ 0.0003483900000000, -0.0003384400000000, 0.0003301300000000 ] - [ -0.0003483900000000, -0.0003384400000000, 0.0003301300000000 ] - [ -0.0007731300000000, 0.0000462300000000, 0.0007324500000000 ] - [ -0.0073743400000000, 0.0042575700000000, 0.0091080700000000 ] - [ -0.0001388500000000, 0.0000801600000000, 0.0006852800000000 ] - [ -0.0004266000000000, 0.0006464300000000, 0.0007324500000000 ] - [ -0.0001943700000000, 0.0001131800000000, -0.0001553200000000 ] - [ 0.0000305900000000, -0.0000176600000000, -0.0005484100000000 ] - [ -0.0000808500000000, 0.0000466800000000, -0.0000483800000000 ] - [ -0.0001952000000000, 0.0001117400000000, -0.0001553200000000 ] - [ 0.0000612700000000, 0.0002658800000000, 0.0001455100000000 ] - [ -0.0008627000000000, 0.0004980800000000, -0.0009185400000000 ] - [ -0.0001721500000000, 0.0000993900000000, 0.0000579100000000 ] - [ -0.0001996200000000, -0.0001860100000000, 0.0001455100000000 ] - [ 0.0073743400000000, 0.0042575700000000, 0.0091080700000000 ] - [ 0.0007731300000000, 0.0000462300000000, 0.0007324500000000 ] - [ 0.0001388500000000, 0.0000801600000000, 0.0006852800000000 ] - [ 0.0004266000000000, 0.0006464300000000, 0.0007324500000000 ] - [ -0.0000305900000000, -0.0000176600000000, -0.0005484100000000 ] - [ 0.0001943700000000, 0.0001131800000000, -0.0001553200000000 ] - [ 0.0000808500000000, 0.0000466800000000, -0.0000483800000000 ] - [ 0.0001952000000000, 0.0001117400000000, -0.0001553200000000 ] - [ 0.0008627000000000, 0.0004980800000000, -0.0009185400000000 ] - [ -0.0000612700000000, 0.0002658800000000, 0.0001455100000000 ] - [ 0.0001721500000000, 0.0000993900000000, 0.0000579100000000 ] - [ 0.0001996200000000, -0.0001860100000000, 0.0001455100000000 ] - [ -0.0003465300000000, -0.0006926600000000, 0.0007324500000000 ] - [ 0.0003465300000000, -0.0006926600000000, 0.0007324500000000 ] - [ 0.0000000000000000, -0.0001603300000000, 0.0006852800000000 ] - [ 0.0000000000000000, -0.0085151500000000, 0.0091080700000000 ] - [ 0.0000008400000000, -0.0002249200000000, -0.0001553200000000 ] - [ -0.0000008400000000, -0.0002249200000000, -0.0001553200000000 ] - [ 0.0000000000000000, -0.0000933500000000, -0.0000483800000000 ] - [ 0.0000000000000000, 0.0000353300000000, -0.0005484100000000 ] - [ 0.0002609000000000, -0.0000798700000000, 0.0001455100000000 ] - [ -0.0002609000000000, -0.0000798700000000, 0.0001455100000000 ] - [ 0.0000000000000000, -0.0001987900000000, 0.0000579100000000 ] - [ 0.0000000000000000, -0.0009961600000000, -0.0009185400000000 ]- atom: 37 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0036261700000000, -0.0003538900000000, -0.0005954800000000 ] - [ -0.0006910500000000, -0.0001020000000000, -0.0007373700000000 ] - [ 0.0001557600000000, 0.0002206500000000, -0.0005262600000000 ] - [ -0.0000882800000000, -0.0002944600000000, -0.0002364800000000 ] - [ 0.0045087800000000, -0.0004736400000000, 0.0000671200000000 ] - [ -0.0010595700000000, -0.0000685400000000, 0.0001452800000000 ] - [ 0.0001602100000000, 0.0003384400000000, 0.0000701300000000 ] - [ -0.0000669300000000, -0.0003513200000000, -0.0001974200000000 ] - [ 0.0001995700000000, -0.0000178100000000, -0.0001448100000000 ] - [ -0.0001967300000000, -0.0000353300000000, -0.0001464800000000 ] - [ 0.0000144400000000, 0.0000727800000000, -0.0001660200000000 ] - [ -0.0000200600000000, -0.0001126500000000, -0.0001594200000000 ] - [ -0.0004965500000000, 0.0006398500000000, 0.0002408000000000 ] - [ 0.0015922600000000, -0.0035775800000000, -0.0006339900000000 ] - [ 0.0018587200000000, -0.0017930600000000, 0.0001948000000000 ] - [ -0.0007124700000000, 0.0005628700000000, 0.0000313200000000 ] - [ -0.0003478900000000, 0.0001800000000000, 0.0000732200000000 ] - [ 0.0003590000000000, -0.0004656900000000, 0.0010950800000000 ] - [ 0.0001904000000000, -0.0001625800000000, 0.0000688500000000 ] - [ -0.0001448500000000, 0.0001218200000000, 0.0004009700000000 ] - [ -0.0002932100000000, 0.0001490300000000, 0.0003301200000000 ] - [ 0.0002929900000000, -0.0002363500000000, -0.0001811900000000 ] - [ 0.0001550700000000, -0.0001701000000000, 0.0003783700000000 ] - [ -0.0001052900000000, 0.0000988700000000, 0.0001333800000000 ] - [ 0.0001798300000000, 0.0002725500000000, -0.0000453800000000 ] - [ -0.0001718300000000, -0.0001768100000000, -0.0000182200000000 ] - [ 0.0004348400000000, 0.0006165600000000, -0.0007154500000000 ] - [ -0.0004376700000000, -0.0001375500000000, 0.0002174900000000 ] - [ 0.0003179200000000, 0.0006080600000000, -0.0002713900000000 ] - [ -0.0002953000000000, -0.0003150000000000, 0.0000145500000000 ] - [ 0.0140502600000000, -0.0045821200000000, -0.0069101400000000 ] - [ -0.0012483800000000, -0.0007596700000000, -0.0006220400000000 ] - [ 0.0000744700000000, 0.0002222500000000, -0.0000411000000000 ] - [ -0.0000906000000000, -0.0000907400000000, 0.0000727500000000 ] - [ 0.0002036700000000, 0.0001202800000000, 0.0001833400000000 ] - [ -0.0002728400000000, -0.0000767800000000, -0.0000400700000000 ] - [ -0.0330317800000000, 0.0102239700000000, 0.0100470500000000 ] - [ 0.0011030300000000, -0.0000492700000000, -0.0002101500000000 ] - [ 0.0002397300000000, -0.0005476800000000, -0.0002076200000000 ] - [ 0.0005587900000000, 0.0010142400000000, -0.0001294800000000 ] - [ -0.0002283600000000, -0.0001506000000000, -0.0002326900000000 ] - [ 0.0003322600000000, -0.0000954200000000, -0.0002644000000000 ] - [ 0.0001637600000000, -0.0001801600000000, -0.0002291000000000 ] - [ 0.0001599200000000, 0.0000207800000000, -0.0002457800000000 ] - [ -0.0002285200000000, -0.0001509100000000, -0.0001993200000000 ] - [ 0.0003322700000000, -0.0000824200000000, -0.0002159500000000 ] - [ 0.0001637200000000, -0.0001932200000000, -0.0002087700000000 ] - [ 0.0001600500000000, 0.0000208200000000, -0.0001799900000000 ] - [ 0.0038395400000000, -0.0011185400000000, 0.0001579100000000 ] - [ 0.0026083100000000, 0.0002283700000000, -0.0003373000000000 ] - [ -0.0002463200000000, -0.0001670900000000, -0.0001813600000000 ] - [ -0.0002459800000000, -0.0000403600000000, -0.0001787300000000 ] - [ -0.0000115500000000, 0.0001020700000000, 0.0002140500000000 ] - [ -0.0000452100000000, -0.0002112500000000, -0.0004626400000000 ] - [ -0.0001667000000000, -0.0000975100000000, -0.0002209700000000 ] - [ -0.0001789900000000, -0.0000786800000000, -0.0002272600000000 ] - [ -0.0000113900000000, 0.0000718700000000, -0.0005886800000000 ] - [ -0.0000452900000000, -0.0001771000000000, -0.0000012400000000 ] - [ -0.0001790400000000, -0.0000882900000000, -0.0002058300000000 ] - [ -0.0001667700000000, -0.0000923500000000, -0.0001898800000000 ] - [ 0.0003688200000000, -0.0008717300000000, -0.0000317600000000 ] - [ 0.0004088400000000, 0.0004166500000000, -0.0001955900000000 ] - [ 0.0001471300000000, -0.0016614800000000, -0.0002009100000000 ] - [ 0.0002999500000000, 0.0004812700000000, -0.0001868500000000 ] - [ -0.0001657100000000, -0.0001622200000000, 0.0002186400000000 ] - [ 0.0001163000000000, 0.0002540600000000, -0.0003052700000000 ] - [ -0.0000998300000000, 0.0001436400000000, -0.0002133800000000 ] - [ 0.0000853600000000, 0.0002394500000000, -0.0001792200000000 ] - [ -0.0001395900000000, -0.0001776400000000, -0.0005829600000000 ] - [ 0.0000938300000000, 0.0002345700000000, -0.0001488300000000 ] - [ -0.0001298500000000, 0.0001608700000000, -0.0002142000000000 ] - [ 0.0001119300000000, 0.0002567100000000, -0.0002589700000000 ] - [ 0.0000224000000000, 0.0000694600000000, 0.0001974600000000 ] - [ -0.0005303600000000, 0.0001033300000000, 0.0003433900000000 ] - [ 0.0000174600000000, 0.0004200200000000, -0.0001075000000000 ] - [ -0.0001464300000000, -0.0000898800000000, 0.0004294600000000 ] - [ 0.0001253000000000, 0.0000434500000000, 0.0001570100000000 ] - [ -0.0006452600000000, 0.0001931400000000, 0.0001787400000000 ] - [ -0.0000370500000000, 0.0005449800000000, 0.0005407500000000 ] - [ 0.0000857700000000, -0.0004083800000000, -0.0002428000000000 ] - [ -0.0000388600000000, 0.0000791000000000, 0.0001825000000000 ] - [ -0.0003473100000000, 0.0000667000000000, 0.0001847600000000 ] - [ -0.0001174800000000, 0.0001996400000000, 0.0002156600000000 ] - [ -0.0001705000000000, 0.0000150300000000, 0.0001617800000000 ] - [ 0.0002452000000000, -0.0001442400000000, 0.0001094200000000 ] - [ 0.0002460100000000, 0.0003490900000000, 0.0003587000000000 ] - [ -0.0005491100000000, 0.0001731400000000, 0.0000370800000000 ] - [ 0.0003150700000000, 0.0000849200000000, 0.0002345100000000 ] - [ 0.0003016000000000, -0.0001588600000000, 0.0003192600000000 ] - [ 0.0003030400000000, 0.0005903900000000, 0.0001717500000000 ] - [ -0.0011296100000000, 0.0001338500000000, 0.0003085100000000 ] - [ 0.0003876800000000, 0.0000808300000000, 0.0002407000000000 ] - [ 0.0002044300000000, 0.0000248400000000, 0.0002000600000000 ] - [ 0.0002045400000000, 0.0001417300000000, 0.0001563300000000 ] - [ 0.0001008800000000, 0.0000740000000000, 0.0001760700000000 ] - [ 0.0002202200000000, 0.0000823000000000, 0.0001805000000000 ] - [ 0.0003864600000000, -0.0002667000000000, -0.0000329300000000 ] - [ 0.0004573900000000, 0.0004026500000000, 0.0017783400000000 ] - [ -0.0000407800000000, -0.0000200400000000, 0.0000951300000000 ] - [ 0.0000135400000000, -0.0002572000000000, 0.0002485800000000 ] - [ 0.0005985700000000, -0.0004192300000000, 0.0006368200000000 ] - [ 0.0019211000000000, 0.0016094000000000, -0.0031547000000000 ] - [ -0.0000514200000000, -0.0000447900000000, 0.0002568000000000 ] - [ 0.0000336500000000, -0.0002831800000000, 0.0002035300000000 ] - [ 0.0001120000000000, -0.0001935600000000, 0.0002022900000000 ] - [ -0.0001043900000000, -0.0001911900000000, 0.0001443900000000 ] - [ 0.0000109100000000, -0.0001355400000000, 0.0001752200000000 ] - [ -0.0000122000000000, -0.0002149800000000, 0.0001810200000000 ]- atom: 37 displacement: [ -0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0035906400000000, 0.0003284500000000, 0.0001106600000000 ] - [ 0.0006902600000000, 0.0001010400000000, 0.0003347400000000 ] - [ -0.0001549600000000, -0.0002199600000000, 0.0001177200000000 ] - [ 0.0000902700000000, 0.0002930800000000, -0.0001712000000000 ] - [ -0.0044554200000000, 0.0004383700000000, -0.0003891800000000 ] - [ 0.0010538400000000, 0.0000658300000000, -0.0005569000000000 ] - [ -0.0001618900000000, -0.0003350900000000, -0.0004808800000000 ] - [ 0.0000694500000000, 0.0003503700000000, -0.0002118000000000 ] - [ -0.0001967800000000, 0.0000154900000000, -0.0002630100000000 ] - [ 0.0001978200000000, 0.0000335900000000, -0.0002616100000000 ] - [ -0.0000132600000000, -0.0000728900000000, -0.0002417200000000 ] - [ 0.0000225000000000, 0.0001121100000000, -0.0002488500000000 ] - [ 0.0005050900000000, -0.0006355500000000, 0.0001682400000000 ] - [ -0.0016370600000000, 0.0035504800000000, 0.0010432900000000 ] - [ -0.0018211100000000, 0.0018391300000000, 0.0002043300000000 ] - [ 0.0007088100000000, -0.0005671000000000, 0.0003767000000000 ] - [ 0.0003469900000000, -0.0001780600000000, 0.0003346100000000 ] - [ -0.0003614800000000, 0.0004645600000000, -0.0006851200000000 ] - [ -0.0001873500000000, 0.0001655200000000, 0.0003442300000000 ] - [ 0.0001420200000000, -0.0001212500000000, 0.0000067100000000 ] - [ 0.0002912300000000, -0.0001475600000000, 0.0000789800000000 ] - [ -0.0002952100000000, 0.0002357000000000, 0.0005889000000000 ] - [ -0.0001550500000000, 0.0001720900000000, 0.0000295600000000 ] - [ 0.0001033000000000, -0.0000983000000000, 0.0002759300000000 ] - [ -0.0001795300000000, -0.0002724200000000, 0.0000449300000000 ] - [ 0.0001715200000000, 0.0001777200000000, 0.0000187000000000 ] - [ -0.0004384700000000, -0.0006167300000000, 0.0007159900000000 ] - [ 0.0004382000000000, 0.0001362900000000, -0.0002155700000000 ] - [ -0.0003185800000000, -0.0006129500000000, 0.0002740800000000 ] - [ 0.0002950600000000, 0.0003175500000000, -0.0000167800000000 ] - [ -0.0145011100000000, 0.0049215700000000, 0.0073112100000000 ] - [ 0.0012539600000000, 0.0007549200000000, 0.0006182800000000 ] - [ -0.0000746700000000, -0.0002221100000000, 0.0000415500000000 ] - [ 0.0000905800000000, 0.0000918200000000, -0.0000730700000000 ] - [ -0.0002054000000000, -0.0001209400000000, -0.0001822500000000 ] - [ 0.0002738500000000, 0.0000764500000000, 0.0000398400000000 ] - [ 0.0337067500000000, -0.0106512700000000, -0.0108536100000000 ] - [ -0.0007925100000000, -0.0001307800000000, -0.0001941100000000 ] - [ 0.0000713300000000, 0.0003680300000000, -0.0001970200000000 ] - [ -0.0002489300000000, -0.0011952400000000, -0.0002745900000000 ] - [ 0.0005403000000000, -0.0000277700000000, -0.0001756600000000 ] - [ -0.0000212400000000, -0.0000836900000000, -0.0001395800000000 ] - [ 0.0001476900000000, 0.0000001600000000, -0.0001760400000000 ] - [ 0.0001508900000000, -0.0002008500000000, -0.0001591600000000 ] - [ 0.0005401200000000, -0.0000280800000000, -0.0002036600000000 ] - [ -0.0000212300000000, -0.0000969200000000, -0.0001896400000000 ] - [ 0.0001476500000000, 0.0000133200000000, -0.0001961500000000 ] - [ 0.0001510400000000, -0.0002007900000000, -0.0002250800000000 ] - [ -0.0041093700000000, 0.0009299500000000, -0.0005555700000000 ] - [ -0.0029499900000000, -0.0004105800000000, -0.0000599900000000 ] - [ -0.0000587800000000, -0.0000129200000000, -0.0002181300000000 ] - [ -0.0000584200000000, -0.0001379300000000, -0.0002210000000000 ] - [ -0.0002947000000000, -0.0002800200000000, -0.0006144000000000 ] - [ -0.0002588200000000, 0.0000326300000000, 0.0000628800000000 ] - [ -0.0001381900000000, -0.0000821900000000, -0.0001790500000000 ] - [ -0.0001259500000000, -0.0001001400000000, -0.0001727800000000 ] - [ -0.0002945500000000, -0.0002498500000000, 0.0001885500000000 ] - [ -0.0002588800000000, -0.0000018500000000, -0.0003986900000000 ] - [ -0.0001259900000000, -0.0000910700000000, -0.0001944000000000 ] - [ -0.0001382700000000, -0.0000863900000000, -0.0002099800000000 ] - [ -0.0003789200000000, 0.0012373400000000, -0.0003692100000000 ] - [ -0.0004070500000000, -0.0000650800000000, -0.0002039200000000 ] - [ -0.0001422400000000, 0.0020193200000000, -0.0001996900000000 ] - [ -0.0002979300000000, -0.0001262900000000, -0.0002127600000000 ] - [ 0.0001678100000000, 0.0005155100000000, -0.0006180100000000 ] - [ -0.0001136300000000, 0.0000989100000000, -0.0000938800000000 ] - [ 0.0001040100000000, 0.0002094500000000, -0.0001880600000000 ] - [ -0.0000835200000000, 0.0001141600000000, -0.0002206900000000 ] - [ 0.0001416300000000, 0.0005303100000000, 0.0001816500000000 ] - [ -0.0000912000000000, 0.0001185800000000, -0.0002517600000000 ] - [ 0.0001334200000000, 0.0001923500000000, -0.0001853400000000 ] - [ -0.0001098800000000, 0.0000969200000000, -0.0001412000000000 ] - [ -0.0003338300000000, 0.0001095800000000, 0.0002067600000000 ] - [ 0.0002196700000000, 0.0000769200000000, 0.0000620600000000 ] - [ -0.0003304300000000, -0.0002402400000000, 0.0005125900000000 ] - [ -0.0001632500000000, 0.0002701500000000, -0.0000251200000000 ] - [ -0.0004369300000000, 0.0001350200000000, 0.0002486100000000 ] - [ 0.0003353600000000, -0.0000124600000000, 0.0002254900000000 ] - [ -0.0002776700000000, -0.0003656900000000, -0.0001358000000000 ] - [ -0.0003930000000000, 0.0005894500000000, 0.0006489300000000 ] - [ -0.0002722000000000, 0.0001001400000000, 0.0002223000000000 ] - [ 0.0000360200000000, 0.0001130800000000, 0.0002199400000000 ] - [ -0.0001943800000000, -0.0000196400000000, 0.0001888300000000 ] - [ -0.0001401300000000, 0.0001649000000000, 0.0002426900000000 ] - [ 0.0000587800000000, 0.0003228400000000, 0.0002910900000000 ] - [ 0.0000595800000000, -0.0001703000000000, 0.0000405000000000 ] - [ 0.0008538700000000, -0.0000012300000000, 0.0003712500000000 ] - [ -0.0000103500000000, 0.0000945400000000, 0.0001647100000000 ] - [ 0.0000014500000000, 0.0003379400000000, 0.0000792300000000 ] - [ 0.0000028500000000, -0.0004112500000000, 0.0002291200000000 ] - [ 0.0014352500000000, 0.0000193200000000, 0.0000660900000000 ] - [ -0.0000826800000000, 0.0000990000000000, 0.0001601500000000 ] - [ 0.0001004000000000, 0.0001538600000000, 0.0001996100000000 ] - [ 0.0001004900000000, 0.0000371100000000, 0.0002434800000000 ] - [ 0.0002040300000000, 0.0001045400000000, 0.0002230800000000 ] - [ 0.0000845500000000, 0.0000968000000000, 0.0002193600000000 ] - [ -0.0003896600000000, -0.0000878400000000, 0.0004311700000000 ] - [ -0.0004530900000000, -0.0007586900000000, -0.0013788100000000 ] - [ 0.0000373900000000, -0.0003343800000000, 0.0003042400000000 ] - [ -0.0000158900000000, -0.0000959300000000, 0.0001512600000000 ] - [ -0.0006009700000000, 0.0000631000000000, -0.0002330000000000 ] - [ -0.0019097300000000, -0.0019687800000000, 0.0035620700000000 ] - [ 0.0000467100000000, -0.0003116800000000, 0.0001443500000000 ] - [ -0.0000357100000000, -0.0000698500000000, 0.0001964300000000 ] - [ -0.0001147400000000, -0.0001598400000000, 0.0001976000000000 ] - [ 0.0001025500000000, -0.0001618400000000, 0.0002551000000000 ] - [ -0.0000134700000000, -0.0002186400000000, 0.0002243500000000 ] - [ 0.0000098900000000, -0.0001384200000000, 0.0002188000000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ -0.0017304100000000, 0.0009990600000000, 0.0036215600000000 ] - [ -0.0003807600000000, 0.0000389700000000, 0.0002414100000000 ] - [ -0.0002241300000000, 0.0003102600000000, 0.0002414100000000 ] - [ 0.0001172100000000, -0.0000676700000000, 0.0000285700000000 ] - [ 0.0004625400000000, -0.0002670500000000, 0.0039443500000000 ] - [ 0.0008595000000000, -0.0000307800000000, 0.0001580500000000 ] - [ 0.0004564000000000, -0.0007289600000000, 0.0001580500000000 ] - [ -0.0001377900000000, 0.0000795600000000, -0.0000629600000000 ] - [ -0.0000308000000000, 0.0000177800000000, -0.0014720400000000 ] - [ 0.0000317500000000, -0.0000029900000000, -0.0007336300000000 ] - [ 0.0000184600000000, -0.0000260000000000, -0.0007336300000000 ] - [ -0.0000142900000000, 0.0000082500000000, -0.0006358000000000 ] - [ 0.0001375300000000, -0.0000794000000000, 0.0007945300000000 ] - [ -0.0003566100000000, 0.0000296200000000, 0.0040256000000000 ] - [ -0.0002039600000000, 0.0002940200000000, 0.0040256000000000 ] - [ 0.0000476200000000, -0.0000275000000000, 0.0007062500000000 ] - [ -0.0002538300000000, 0.0001465500000000, -0.0000317700000000 ] - [ 0.0001159700000000, 0.0007301300000000, -0.0009167600000000 ] - [ -0.0005743200000000, -0.0004655000000000, -0.0009167600000000 ] - [ 0.0001101600000000, -0.0000636000000000, 0.0000309900000000 ] - [ 0.0002721300000000, -0.0001571100000000, -0.0002188200000000 ] - [ -0.0002157100000000, -0.0005026200000000, -0.0007890400000000 ] - [ 0.0003274300000000, 0.0004381200000000, -0.0007890400000000 ] - [ -0.0000628800000000, 0.0000363100000000, -0.0000489100000000 ] - [ 0.0000751100000000, -0.0003681200000000, -0.0000538100000000 ] - [ -0.0000926600000000, 0.0000535000000000, -0.0001411200000000 ] - [ -0.0009304600000000, 0.0005372000000000, -0.0011262400000000 ] - [ 0.0003563600000000, 0.0001190200000000, -0.0000538100000000 ] - [ -0.0001128200000000, -0.0000021400000000, 0.0005334000000000 ] - [ 0.0001225800000000, -0.0000707700000000, 0.0004853700000000 ] - [ -0.0061577300000000, 0.0035551700000000, 0.0089058900000000 ] - [ -0.0000545600000000, 0.0000987800000000, 0.0005334000000000 ] - [ -0.0000051300000000, 0.0002058500000000, -0.0003560400000000 ] - [ 0.0000206200000000, -0.0000119100000000, -0.0002478400000000 ] - [ 0.0001903600000000, -0.0001099000000000, -0.0007468600000000 ] - [ -0.0001808400000000, -0.0000984800000000, -0.0003560400000000 ] - [ 0.0105793100000000, -0.0061079700000000, -0.0319377400000000 ] - [ 0.0001519700000000, -0.0000897100000000, -0.0004765300000000 ] - [ 0.0001536800000000, -0.0000867500000000, -0.0004765300000000 ] - [ 0.0002317200000000, -0.0001337800000000, -0.0006614400000000 ] - [ 0.0001602200000000, -0.0000925000000000, 0.0008180700000000 ] - [ 0.0001459700000000, -0.0000920600000000, -0.0000852900000000 ] - [ 0.0001527100000000, -0.0000803800000000, -0.0000852900000000 ] - [ 0.0001813600000000, -0.0001047100000000, -0.0000327000000000 ] - [ 0.0001295200000000, -0.0000747800000000, 0.0008167400000000 ] - [ 0.0000969900000000, -0.0000970400000000, -0.0000845100000000 ] - [ 0.0001325300000000, -0.0000354800000000, -0.0000845100000000 ] - [ 0.0001155300000000, -0.0000667000000000, -0.0000319700000000 ] - [ -0.0005220800000000, -0.0000779400000000, -0.0009340900000000 ] - [ -0.0000069200000000, -0.0001702700000000, -0.0006768700000000 ] - [ -0.0001770900000000, -0.0000950200000000, -0.0004496700000000 ] - [ -0.0001742000000000, -0.0000854200000000, -0.0004494000000000 ] - [ 0.0002335600000000, 0.0001270100000000, 0.0004276100000000 ] - [ -0.0003548200000000, 0.0000402300000000, 0.0001572100000000 ] - [ -0.0001659100000000, -0.0000175500000000, -0.0000700200000000 ] - [ -0.0001501500000000, -0.0001544600000000, -0.0000860500000000 ] - [ -0.0005685900000000, -0.0003335700000000, 0.0004251200000000 ] - [ 0.0001064900000000, -0.0002279200000000, 0.0001575600000000 ] - [ -0.0001286200000000, -0.0001309100000000, -0.0000850000000000 ] - [ -0.0001347700000000, 0.0000180700000000, -0.0000692000000000 ] - [ -0.0001935400000000, 0.0004911000000000, -0.0009340900000000 ] - [ -0.0000062600000000, 0.0002008700000000, -0.0004496700000000 ] - [ 0.0001439900000000, 0.0000911300000000, -0.0006768700000000 ] - [ -0.0000131300000000, 0.0001935700000000, -0.0004494000000000 ] - [ 0.0000067900000000, -0.0002657700000000, 0.0004276100000000 ] - [ -0.0000677500000000, 0.0001524600000000, -0.0000700200000000 ] - [ -0.0002122400000000, 0.0002871700000000, 0.0001572100000000 ] - [ 0.0000586900000000, 0.0002072700000000, -0.0000860500000000 ] - [ 0.0000045900000000, 0.0006592000000000, 0.0004251200000000 ] - [ 0.0000490600000000, 0.0001768400000000, -0.0000850000000000 ] - [ 0.0002506300000000, 0.0000217300000000, 0.0001575600000000 ] - [ -0.0000830300000000, 0.0001076800000000, -0.0000692000000000 ] - [ -0.0001633800000000, 0.0000943300000000, 0.0001555200000000 ] - [ -0.0000192500000000, 0.0005302900000000, 0.0001771900000000 ] - [ -0.0004688700000000, -0.0002484800000000, 0.0001771900000000 ] - [ 0.0000686800000000, -0.0000396500000000, 0.0001155700000000 ] - [ -0.0002045400000000, 0.0001180900000000, 0.0001010500000000 ] - [ -0.0001830300000000, -0.0003123500000000, -0.0001090600000000 ] - [ 0.0001789900000000, 0.0003146800000000, -0.0001090600000000 ] - [ -0.0006033000000000, 0.0003483200000000, 0.0000534100000000 ] - [ -0.0001787400000000, 0.0001032000000000, 0.0003739800000000 ] - [ -0.0001768300000000, 0.0000655900000000, 0.0006157500000000 ] - [ -0.0001452100000000, 0.0001203500000000, 0.0006157500000000 ] - [ -0.0001995500000000, 0.0001152100000000, 0.0005094700000000 ] - [ -0.0000028000000000, 0.0003027000000000, 0.0001338100000000 ] - [ 0.0002465600000000, 0.0003066000000000, 0.0001337300000000 ] - [ 0.0003227500000000, -0.0018205300000000, 0.0019094800000000 ] - [ 0.0001213900000000, 0.0000554400000000, 0.0001300800000000 ] - [ 0.0001841700000000, 0.0000093300000000, -0.0000454200000000 ] - [ 0.0000357200000000, -0.0003418800000000, -0.0000446800000000 ] - [ 0.0000347300000000, 0.0040519300000000, 0.0031813100000000 ] - [ 0.0001157800000000, 0.0001104800000000, 0.0000872400000000 ] - [ 0.0001998300000000, 0.0000942800000000, 0.0004594900000000 ] - [ 0.0001554100000000, 0.0000887100000000, 0.0004593900000000 ] - [ 0.0001792900000000, 0.0001421100000000, 0.0006993700000000 ] - [ 0.0001755600000000, 0.0001021100000000, 0.0003697400000000 ] - [ -0.0002635400000000, -0.0001489300000000, 0.0001338100000000 ] - [ 0.0017380000000000, 0.0006307600000000, 0.0019094800000000 ] - [ -0.0001422400000000, -0.0003668300000000, 0.0001337300000000 ] - [ 0.0000126800000000, -0.0001328400000000, 0.0001300800000000 ] - [ 0.0000840000000000, -0.0001641600000000, -0.0000454200000000 ] - [ -0.0034917100000000, -0.0020560400000000, 0.0031813100000000 ] - [ 0.0003139300000000, 0.0001400100000000, -0.0000446800000000 ] - [ -0.0000377900000000, -0.0001555100000000, 0.0000872400000000 ] - [ 0.0000182700000000, -0.0002202000000000, 0.0004594900000000 ] - [ -0.0000334300000000, -0.0002263200000000, 0.0006993700000000 ] - [ 0.0000008800000000, -0.0001789400000000, 0.0004593900000000 ] - [ -0.0000006500000000, -0.0002031000000000, 0.0003697400000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0019022700000000, -0.0010982800000000, -0.0042633100000000 ] - [ 0.0003805500000000, -0.0000419900000000, -0.0006568600000000 ] - [ 0.0002266400000000, -0.0003085700000000, -0.0006568600000000 ] - [ -0.0001156300000000, 0.0000667600000000, -0.0004389800000000 ] - [ -0.0003107900000000, 0.0001794300000000, -0.0041298900000000 ] - [ -0.0008590600000000, 0.0000277000000000, -0.0005583700000000 ] - [ -0.0004535200000000, 0.0007301200000000, -0.0005583700000000 ] - [ 0.0001395100000000, -0.0000805400000000, -0.0003429400000000 ] - [ 0.0000332400000000, -0.0000191900000000, 0.0010659700000000 ] - [ -0.0000294600000000, 0.0000024100000000, 0.0003255400000000 ] - [ -0.0000168200000000, 0.0000243100000000, 0.0003255400000000 ] - [ 0.0000159900000000, -0.0000092300000000, 0.0002280800000000 ] - [ -0.0001413000000000, 0.0000815800000000, -0.0003889600000000 ] - [ 0.0003554300000000, -0.0000389700000000, -0.0036231600000000 ] - [ 0.0002114600000000, -0.0002883200000000, -0.0036231600000000 ] - [ -0.0000547300000000, 0.0000316000000000, -0.0003011800000000 ] - [ 0.0002475900000000, -0.0001429500000000, 0.0004412300000000 ] - [ -0.0001167900000000, -0.0007289400000000, 0.0013276200000000 ] - [ 0.0005728900000000, 0.0004656200000000, 0.0013276200000000 ] - [ -0.0001118600000000, 0.0000645800000000, 0.0003795900000000 ] - [ -0.0002789900000000, 0.0001610800000000, 0.0006278900000000 ] - [ 0.0002156200000000, 0.0005052800000000, 0.0011968400000000 ] - [ -0.0003297700000000, -0.0004393700000000, 0.0011968400000000 ] - [ 0.0000607200000000, -0.0000350600000000, 0.0004545600000000 ] - [ -0.0000750100000000, 0.0003716500000000, 0.0000522300000000 ] - [ 0.0000929200000000, -0.0000536500000000, 0.0001401700000000 ] - [ 0.0009348200000000, -0.0005397200000000, 0.0011248400000000 ] - [ -0.0003593600000000, -0.0001208700000000, 0.0000522300000000 ] - [ 0.0001121400000000, 0.0000023300000000, -0.0005304000000000 ] - [ -0.0001228000000000, 0.0000709000000000, -0.0004829600000000 ] - [ 0.0059312900000000, -0.0034244300000000, -0.0088495700000000 ] - [ 0.0000540500000000, -0.0000982900000000, -0.0005304000000000 ] - [ 0.0000046300000000, -0.0002036900000000, 0.0003567000000000 ] - [ -0.0000205700000000, 0.0000118800000000, 0.0002488400000000 ] - [ -0.0001893600000000, 0.0001093300000000, 0.0007472500000000 ] - [ 0.0001787100000000, 0.0000978400000000, 0.0003567000000000 ] - [ -0.0103217100000000, 0.0059592400000000, 0.0315070000000000 ] - [ 0.0001648200000000, -0.0000907300000000, 0.0000708200000000 ] - [ 0.0001609800000000, -0.0000973700000000, 0.0000708200000000 ] - [ 0.0000832600000000, -0.0000480700000000, 0.0002554300000000 ] - [ 0.0001524900000000, -0.0000880400000000, -0.0012235900000000 ] - [ 0.0001690800000000, -0.0000895100000000, -0.0003211600000000 ] - [ 0.0001620600000000, -0.0001016700000000, -0.0003211600000000 ] - [ 0.0001330600000000, -0.0000768200000000, -0.0003737000000000 ] - [ 0.0001831800000000, -0.0001057600000000, -0.0012251000000000 ] - [ 0.0002185200000000, -0.0000843200000000, -0.0003205100000000 ] - [ 0.0001822800000000, -0.0001470800000000, -0.0003205100000000 ] - [ 0.0001988800000000, -0.0001148200000000, -0.0003731500000000 ] - [ 0.0001947900000000, -0.0000980900000000, 0.0005337500000000 ] - [ -0.0002808400000000, -0.0000095200000000, 0.0002761400000000 ] - [ -0.0001314200000000, -0.0000875600000000, 0.0000488200000000 ] - [ -0.0001340600000000, -0.0000950400000000, 0.0000489600000000 ] - [ -0.0005402800000000, -0.0003051000000000, -0.0008263700000000 ] - [ 0.0000459100000000, -0.0002205200000000, -0.0005584600000000 ] - [ -0.0001425300000000, -0.0001631800000000, -0.0003315600000000 ] - [ -0.0001582200000000, -0.0000270200000000, -0.0003156200000000 ] - [ 0.0002632000000000, 0.0001563400000000, -0.0008291200000000 ] - [ -0.0004156600000000, 0.0000482100000000, -0.0005582200000000 ] - [ -0.0001797300000000, -0.0000497300000000, -0.0003148200000000 ] - [ -0.0001734600000000, -0.0001997700000000, -0.0003309000000000 ] - [ 0.0001823400000000, -0.0001196400000000, 0.0005337500000000 ] - [ 0.0000101200000000, 0.0001576000000000, 0.0000488200000000 ] - [ -0.0001321800000000, 0.0002479800000000, 0.0002761400000000 ] - [ 0.0000152800000000, 0.0001636200000000, 0.0000489600000000 ] - [ -0.0000059100000000, 0.0006204400000000, -0.0008263700000000 ] - [ 0.0000700600000000, 0.0002050300000000, -0.0003315600000000 ] - [ 0.0002139300000000, 0.0000705000000000, -0.0005584600000000 ] - [ -0.0000557000000000, 0.0001505300000000, -0.0003156200000000 ] - [ -0.0000037900000000, -0.0003061100000000, -0.0008291200000000 ] - [ -0.0000468000000000, 0.0001805200000000, -0.0003148200000000 ] - [ -0.0002495800000000, 0.0003358700000000, -0.0005582200000000 ] - [ 0.0000862800000000, 0.0002501100000000, -0.0003309000000000 ] - [ -0.0001507500000000, 0.0000870300000000, 0.0002510000000000 ] - [ -0.0002973100000000, -0.0003500900000000, 0.0002305300000000 ] - [ 0.0001545400000000, 0.0004325200000000, 0.0002305300000000 ] - [ -0.0003825400000000, 0.0002208600000000, 0.0002931200000000 ] - [ -0.0001096100000000, 0.0000632800000000, 0.0003030800000000 ] - [ -0.0001330000000000, 0.0004940100000000, 0.0005119800000000 ] - [ -0.0004943300000000, -0.0001318200000000, 0.0005119800000000 ] - [ 0.0002917300000000, -0.0001684300000000, 0.0003469400000000 ] - [ -0.0001355900000000, 0.0000782800000000, 0.0000312100000000 ] - [ -0.0001383100000000, 0.0001150000000000, -0.0002105100000000 ] - [ -0.0001687500000000, 0.0000622800000000, -0.0002105100000000 ] - [ -0.0001153100000000, 0.0000665800000000, -0.0001041800000000 ] - [ 0.0003120200000000, -0.0001245500000000, 0.0002691000000000 ] - [ 0.0000616000000000, -0.0001263500000000, 0.0002690500000000 ] - [ -0.0000147600000000, 0.0020160800000000, -0.0015172200000000 ] - [ 0.0001877700000000, 0.0001254600000000, 0.0002716300000000 ] - [ 0.0001234300000000, 0.0001702300000000, 0.0004428000000000 ] - [ 0.0002723500000000, 0.0005220100000000, 0.0004434600000000 ] - [ 0.0002735700000000, -0.0038459400000000, -0.0027724700000000 ] - [ 0.0001930400000000, 0.0000701400000000, 0.0003123700000000 ] - [ 0.0001092400000000, 0.0000859000000000, -0.0000591300000000 ] - [ 0.0001524900000000, 0.0000919100000000, -0.0000591700000000 ] - [ 0.0001288400000000, 0.0000394300000000, -0.0002993100000000 ] - [ 0.0001332600000000, 0.0000789000000000, 0.0000306600000000 ] - [ 0.0002638800000000, -0.0002079500000000, 0.0002691000000000 ] - [ -0.0017533600000000, -0.0009952500000000, -0.0015172200000000 ] - [ 0.0001402300000000, 0.0000098300000000, 0.0002690500000000 ] - [ -0.0000147700000000, -0.0002253400000000, 0.0002716300000000 ] - [ -0.0000857100000000, -0.0001920100000000, 0.0004428000000000 ] - [ 0.0034674700000000, 0.0016860500000000, -0.0027724700000000 ] - [ -0.0003159000000000, -0.0004968700000000, 0.0004434600000000 ] - [ 0.0000357800000000, -0.0002022500000000, 0.0003123700000000 ] - [ -0.0000197700000000, -0.0001375500000000, -0.0000591300000000 ] - [ 0.0000302700000000, -0.0001312900000000, -0.0002993100000000 ] - [ -0.0000033500000000, -0.0001780200000000, -0.0000591700000000 ] - [ -0.0000017000000000, -0.0001548500000000, 0.0000306600000000 ]