# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/1a81e03b-d300-4f89-92ee-8f1000af83fc/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 K4CdP2 / R-3m (166) / materials id 28302](https://mdr.nims.go.jp/datasets/c93b1ceb-fc18-4278-a75d-2d32cad3dc97) ## 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: "R-3m" number: 166 Hall_symbol: "-R 3 2\""primitive_matrix:- [ 0.666666666666667, -0.333333333333333, -0.333333333333333 ]- [ 0.333333333333333, 0.333333333333333, -0.666666666666667 ]- [ 0.333333333333333, 0.333333333333333, 0.333333333333333 ]supercell_matrix:- [ 2, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 2.822774046666670, 1.629729353333332, 8.972323806666656 ] # a - [ -2.822774043333330, 1.629729353333332, 8.972323806666656 ] # b - [ -0.000000003333330, -3.259458706666668, 8.972323806666656 ] # c points: - symbol: P # 1 coordinates: [ 0.588753140000000, 0.588753140000002, 0.588753140000000 ] mass: 30.973762 - symbol: P # 2 coordinates: [ 0.411246860000000, 0.411246860000001, 0.411246860000000 ] mass: 30.973762 - symbol: K # 3 coordinates: [ 0.107494980000000, 0.107494970000001, 0.107494980000000 ] mass: 39.098300 - symbol: K # 4 coordinates: [ 0.291951540000000, 0.291951530000002, 0.291951540000000 ] mass: 39.098300 - symbol: K # 5 coordinates: [ 0.708048460000000, 0.708048470000001, 0.708048460000000 ] mass: 39.098300 - symbol: K # 6 coordinates: [ 0.892505020000000, 0.892505030000002, 0.892505020000000 ] mass: 39.098300 - symbol: Cd # 7 coordinates: [ 0.500000000000000, 0.500000000000001, 0.500000000000000 ] mass: 112.411000 reciprocal_lattice: # without 2pi - [ 0.177130720358455, 0.102266468987971, 0.037151282155650 ] # a* - [ -0.177130720358455, 0.102266469350261, 0.037151282155651 ] # b* - [ 0.000000000000000, -0.204532938338232, 0.037151282155650 ] # c*unit_cell: lattice: - [ 5.645548090000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.822774040000000, 4.889188060000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 26.916971419999999 ] # c points: - symbol: P # 1 coordinates: [ 0.000000000000000, 0.000000000000000, 0.588753140000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 2 coordinates: [ 0.000000000000000, 0.000000000000000, 0.411246860000000 ] mass: 30.973762 reduced_to: 2 - symbol: P # 3 coordinates: [ 0.666666670000000, 0.333333330000000, 0.922086470000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 4 coordinates: [ 0.666666670000000, 0.333333330000000, 0.744580190000000 ] mass: 30.973762 reduced_to: 2 - symbol: P # 5 coordinates: [ 0.333333330000000, 0.666666670000000, 0.255419810000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 6 coordinates: [ 0.333333330000000, 0.666666670000000, 0.077913530000000 ] mass: 30.973762 reduced_to: 2 - symbol: K # 7 coordinates: [ 0.666666670000000, 0.333333330000000, 0.440828310000000 ] mass: 39.098300 reduced_to: 7 - symbol: K # 8 coordinates: [ 0.666666670000000, 0.333333330000000, 0.625284870000000 ] mass: 39.098300 reduced_to: 8 - symbol: K # 9 coordinates: [ 0.333333330000000, 0.666666670000000, 0.374715130000000 ] mass: 39.098300 reduced_to: 9 - symbol: K # 10 coordinates: [ 0.333333330000000, 0.666666670000000, 0.559171690000000 ] mass: 39.098300 reduced_to: 10 - symbol: K # 11 coordinates: [ 0.333333330000000, 0.666666670000000, 0.774161640000000 ] mass: 39.098300 reduced_to: 7 - symbol: K # 12 coordinates: [ 0.333333330000000, 0.666666670000000, 0.958618200000000 ] mass: 39.098300 reduced_to: 8 - symbol: K # 13 coordinates: [ 0.000000000000000, 0.000000000000000, 0.708048460000000 ] mass: 39.098300 reduced_to: 9 - symbol: K # 14 coordinates: [ 0.000000000000000, 0.000000000000000, 0.892505030000000 ] mass: 39.098300 reduced_to: 10 - symbol: K # 15 coordinates: [ 0.000000000000000, 0.000000000000000, 0.107494970000000 ] mass: 39.098300 reduced_to: 7 - symbol: K # 16 coordinates: [ 0.000000000000000, 0.000000000000000, 0.291951540000000 ] mass: 39.098300 reduced_to: 8 - symbol: K # 17 coordinates: [ 0.666666670000000, 0.333333330000000, 0.041381800000000 ] mass: 39.098300 reduced_to: 9 - symbol: K # 18 coordinates: [ 0.666666670000000, 0.333333330000000, 0.225838360000000 ] mass: 39.098300 reduced_to: 10 - symbol: Cd # 19 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 112.411000 reduced_to: 19 - symbol: Cd # 20 coordinates: [ 0.666666670000000, 0.333333330000000, 0.833333330000000 ] mass: 112.411000 reduced_to: 19 - symbol: Cd # 21 coordinates: [ 0.333333330000000, 0.666666670000000, 0.166666670000000 ] mass: 112.411000 reduced_to: 19supercell: lattice: - [ 11.291096180000000, 0.000000000000000, 0.000000000000000 ] # a - [ -5.645548080000000, 9.778376120000001, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 26.916971419999999 ] # c points: - symbol: P # 1 coordinates: [ 0.000000000000000, 0.000000000000000, 0.588753140000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 2 coordinates: [ 0.500000000000000, 0.000000000000000, 0.588753140000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 3 coordinates: [ 0.000000000000000, 0.500000000000000, 0.588753140000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 4 coordinates: [ 0.500000000000000, 0.500000000000000, 0.588753140000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 5 coordinates: [ 0.000000000000000, 0.000000000000000, 0.411246860000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 6 coordinates: [ 0.500000000000000, 0.000000000000000, 0.411246860000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 7 coordinates: [ 0.000000000000000, 0.500000000000000, 0.411246860000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 8 coordinates: [ 0.500000000000000, 0.500000000000000, 0.411246860000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 9 coordinates: [ 0.333333335000000, 0.166666665000000, 0.922086470000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 10 coordinates: [ 0.833333335000000, 0.166666665000000, 0.922086470000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 11 coordinates: [ 0.333333335000000, 0.666666665000000, 0.922086470000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 12 coordinates: [ 0.833333335000000, 0.666666665000000, 0.922086470000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 13 coordinates: [ 0.333333335000000, 0.166666665000000, 0.744580190000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 14 coordinates: [ 0.833333335000000, 0.166666665000000, 0.744580190000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 15 coordinates: [ 0.333333335000000, 0.666666665000000, 0.744580190000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 16 coordinates: [ 0.833333335000000, 0.666666665000000, 0.744580190000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 17 coordinates: [ 0.166666665000000, 0.333333335000000, 0.255419810000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 18 coordinates: [ 0.666666665000000, 0.333333335000000, 0.255419810000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 19 coordinates: [ 0.166666665000000, 0.833333335000000, 0.255419810000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 20 coordinates: [ 0.666666665000000, 0.833333335000000, 0.255419810000000 ] mass: 30.973762 reduced_to: 1 - symbol: P # 21 coordinates: [ 0.166666665000000, 0.333333335000000, 0.077913530000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 22 coordinates: [ 0.666666665000000, 0.333333335000000, 0.077913530000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 23 coordinates: [ 0.166666665000000, 0.833333335000000, 0.077913530000000 ] mass: 30.973762 reduced_to: 5 - symbol: P # 24 coordinates: [ 0.666666665000000, 0.833333335000000, 0.077913530000000 ] mass: 30.973762 reduced_to: 5 - symbol: K # 25 coordinates: [ 0.333333335000000, 0.166666665000000, 0.440828310000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 26 coordinates: [ 0.833333335000000, 0.166666665000000, 0.440828310000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 27 coordinates: [ 0.333333335000000, 0.666666665000000, 0.440828310000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 28 coordinates: [ 0.833333335000000, 0.666666665000000, 0.440828310000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 29 coordinates: [ 0.333333335000000, 0.166666665000000, 0.625284870000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 30 coordinates: [ 0.833333335000000, 0.166666665000000, 0.625284870000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 31 coordinates: [ 0.333333335000000, 0.666666665000000, 0.625284870000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 32 coordinates: [ 0.833333335000000, 0.666666665000000, 0.625284870000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 33 coordinates: [ 0.166666665000000, 0.333333335000000, 0.374715130000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 34 coordinates: [ 0.666666665000000, 0.333333335000000, 0.374715130000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 35 coordinates: [ 0.166666665000000, 0.833333335000000, 0.374715130000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 36 coordinates: [ 0.666666665000000, 0.833333335000000, 0.374715130000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 37 coordinates: [ 0.166666665000000, 0.333333335000000, 0.559171690000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 38 coordinates: [ 0.666666665000000, 0.333333335000000, 0.559171690000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 39 coordinates: [ 0.166666665000000, 0.833333335000000, 0.559171690000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 40 coordinates: [ 0.666666665000000, 0.833333335000000, 0.559171690000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 41 coordinates: [ 0.166666665000000, 0.333333335000000, 0.774161640000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 42 coordinates: [ 0.666666665000000, 0.333333335000000, 0.774161640000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 43 coordinates: [ 0.166666665000000, 0.833333335000000, 0.774161640000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 44 coordinates: [ 0.666666665000000, 0.833333335000000, 0.774161640000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 45 coordinates: [ 0.166666665000000, 0.333333335000000, 0.958618200000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 46 coordinates: [ 0.666666665000000, 0.333333335000000, 0.958618200000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 47 coordinates: [ 0.166666665000000, 0.833333335000000, 0.958618200000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 48 coordinates: [ 0.666666665000000, 0.833333335000000, 0.958618200000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 49 coordinates: [ 0.000000000000000, 0.000000000000000, 0.708048460000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 50 coordinates: [ 0.500000000000000, 0.000000000000000, 0.708048460000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 51 coordinates: [ 0.000000000000000, 0.500000000000000, 0.708048460000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 52 coordinates: [ 0.500000000000000, 0.500000000000000, 0.708048460000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 53 coordinates: [ 0.000000000000000, 0.000000000000000, 0.892505030000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 54 coordinates: [ 0.500000000000000, 0.000000000000000, 0.892505030000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 55 coordinates: [ 0.000000000000000, 0.500000000000000, 0.892505030000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 56 coordinates: [ 0.500000000000000, 0.500000000000000, 0.892505030000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 57 coordinates: [ 0.000000000000000, 0.000000000000000, 0.107494970000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 58 coordinates: [ 0.500000000000000, 0.000000000000000, 0.107494970000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 59 coordinates: [ 0.000000000000000, 0.500000000000000, 0.107494970000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 60 coordinates: [ 0.500000000000000, 0.500000000000000, 0.107494970000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 61 coordinates: [ 0.000000000000000, 0.000000000000000, 0.291951540000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 62 coordinates: [ 0.500000000000000, 0.000000000000000, 0.291951540000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 63 coordinates: [ 0.000000000000000, 0.500000000000000, 0.291951540000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 64 coordinates: [ 0.500000000000000, 0.500000000000000, 0.291951540000000 ] mass: 39.098300 reduced_to: 29 - symbol: K # 65 coordinates: [ 0.333333335000000, 0.166666665000000, 0.041381800000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 66 coordinates: [ 0.833333335000000, 0.166666665000000, 0.041381800000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 67 coordinates: [ 0.333333335000000, 0.666666665000000, 0.041381800000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 68 coordinates: [ 0.833333335000000, 0.666666665000000, 0.041381800000000 ] mass: 39.098300 reduced_to: 33 - symbol: K # 69 coordinates: [ 0.333333335000000, 0.166666665000000, 0.225838360000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 70 coordinates: [ 0.833333335000000, 0.166666665000000, 0.225838360000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 71 coordinates: [ 0.333333335000000, 0.666666665000000, 0.225838360000000 ] mass: 39.098300 reduced_to: 37 - symbol: K # 72 coordinates: [ 0.833333335000000, 0.666666665000000, 0.225838360000000 ] mass: 39.098300 reduced_to: 37 - symbol: Cd # 73 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 74 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 75 coordinates: [ 0.000000000000000, 0.500000000000000, 0.500000000000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 76 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 77 coordinates: [ 0.333333335000000, 0.166666665000000, 0.833333330000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 78 coordinates: [ 0.833333335000000, 0.166666665000000, 0.833333330000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 79 coordinates: [ 0.333333335000000, 0.666666665000000, 0.833333330000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 80 coordinates: [ 0.833333335000000, 0.666666665000000, 0.833333330000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 81 coordinates: [ 0.166666665000000, 0.333333335000000, 0.166666670000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 82 coordinates: [ 0.666666665000000, 0.333333335000000, 0.166666670000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 83 coordinates: [ 0.166666665000000, 0.833333335000000, 0.166666670000000 ] mass: 112.411000 reduced_to: 73 - symbol: Cd # 84 coordinates: [ 0.666666665000000, 0.833333335000000, 0.166666670000000 ] mass: 112.411000 reduced_to: 73born_effective_charge:- # 1 (P) - [ -1.668074870000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -1.668074870000000, 0.000000000000000 ] - [ 0.000000000000000, -0.000000000000000, -3.128504570000000 ]- # 2 (P) - [ -1.668074870000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -1.668074870000000, 0.000000000000000 ] - [ 0.000000000000000, -0.000000000000000, -3.128504570000000 ]- # 3 (K) - [ 1.071182200000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 1.071182200000000, 0.000000000000000 ] - [ 0.000000000000000, -0.000000000000000, 0.699041110000000 ]- # 4 (K) - [ 0.900931700000000, -0.000000000000000, -0.000000000000000 ] - [ 0.000000000000000, 0.900931700000000, -0.000000000000000 ] - [ -0.000000000000000, 0.000000000000000, 1.371914430000000 ]- # 5 (K) - [ 0.900931700000000, -0.000000000000000, -0.000000000000000 ] - [ 0.000000000000000, 0.900931700000000, -0.000000000000000 ] - [ -0.000000000000000, 0.000000000000000, 1.371914430000000 ]- # 6 (K) - [ 1.071182200000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 1.071182200000000, 0.000000000000000 ] - [ 0.000000000000000, -0.000000000000000, 0.699041110000000 ]- # 7 (Cd) - [ -0.608078060000000, -0.000000000000000, -0.000000000000000 ] - [ 0.000000000000000, -0.608078060000000, -0.000000000000000 ] - [ -0.000000000000000, 0.000000000000000, 2.115098040000000 ]dielectric_constant: - [ 4.543224590000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 4.543224580000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 6.365416650000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0217670400000000, 0.0000348000000000, -0.0001876500000000 ] - [ 0.0032393500000000, -0.0000004500000000, -0.0000143600000000 ] - [ 0.0001181700000000, -0.0018027400000000, 0.0002208800000000 ] - [ 0.0001190000000000, 0.0018013800000000, -0.0002499200000000 ] - [ -0.0026142200000000, 0.0000023100000000, 0.0000196100000000 ] - [ -0.0000327000000000, 0.0000004500000000, 0.0000129100000000 ] - [ 0.0000117900000000, 0.0000263600000000, -0.0000303700000000 ] - [ 0.0000119000000000, -0.0000251400000000, 0.0000621500000000 ] - [ 0.0000024000000000, -0.0000146400000000, 0.0002379000000000 ] - [ 0.0000024100000000, 0.0000139700000000, -0.0002666800000000 ] - [ -0.0000078500000000, -0.0000005200000000, -0.0000145700000000 ] - [ 0.0000271200000000, -0.0000004200000000, -0.0000142600000000 ] - [ 0.0000695900000000, 0.0001167100000000, 0.0008283000000000 ] - [ 0.0000692900000000, -0.0001155400000000, -0.0008038300000000 ] - [ 0.0000405200000000, 0.0000003300000000, 0.0000113800000000 ] - [ -0.0001316800000000, 0.0000003400000000, 0.0000105800000000 ] - [ 0.0000273700000000, -0.0000010500000000, -0.0000124000000000 ] - [ -0.0000078000000000, -0.0000004200000000, -0.0000133500000000 ] - [ 0.0000019800000000, 0.0000140200000000, 0.0000756400000000 ] - [ 0.0000030600000000, -0.0000146600000000, -0.0000988600000000 ] - [ -0.0000246500000000, 0.0000005600000000, 0.0000152000000000 ] - [ 0.0000182600000000, 0.0000004700000000, 0.0000150700000000 ] - [ 0.0000020800000000, -0.0000150900000000, 0.0000641400000000 ] - [ 0.0000019000000000, 0.0000157800000000, -0.0000333400000000 ] - [ -0.0002311200000000, -0.0001913300000000, 0.0007098900000000 ] - [ -0.0002354300000000, 0.0001914500000000, -0.0006647600000000 ] - [ -0.0000579500000000, 0.0000014200000000, 0.0000205700000000 ] - [ 0.0000981100000000, -0.0000020800000000, 0.0000197700000000 ] - [ 0.0031094200000000, 0.0011518400000000, 0.0003537000000000 ] - [ 0.0029951100000000, -0.0010731500000000, -0.0004498600000000 ] - [ -0.0003376000000000, 0.0000017700000000, -0.0000725700000000 ] - [ 0.0011255800000000, 0.0000036500000000, -0.0000716500000000 ] - [ -0.0000714700000000, 0.0000016900000000, 0.0000712700000000 ] - [ 0.0000087500000000, -0.0000006500000000, 0.0000716800000000 ] - [ 0.0000331600000000, -0.0000598900000000, 0.0001579600000000 ] - [ 0.0000290400000000, 0.0000585300000000, -0.0000143100000000 ] - [ 0.0012720600000000, -0.0000089100000000, -0.0000170800000000 ] - [ -0.0002668000000000, -0.0000026400000000, -0.0000198500000000 ] - [ 0.0041702500000000, -0.0016786900000000, -0.0010390600000000 ] - [ 0.0040142100000000, 0.0015780400000000, 0.0009431300000000 ] - [ 0.0001452400000000, 0.0000000700000000, 0.0000205000000000 ] - [ -0.0001410100000000, -0.0000000800000000, 0.0000206200000000 ] - [ -0.0000354700000000, 0.0001049500000000, -0.0001221800000000 ] - [ -0.0000358500000000, -0.0001039800000000, 0.0001636500000000 ] - [ 0.0000597000000000, 0.0000001100000000, -0.0000717300000000 ] - [ -0.0000602800000000, 0.0000000500000000, -0.0000717400000000 ] - [ -0.0000004800000000, 0.0000349200000000, -0.0000827500000000 ] - [ -0.0000004800000000, -0.0000345700000000, -0.0000606900000000 ] - [ 0.0006870300000000, 0.0000006900000000, 0.0000618400000000 ] - [ -0.0003255000000000, 0.0000000800000000, 0.0000619500000000 ] - [ -0.0000133300000000, 0.0001792800000000, 0.0000444800000000 ] - [ -0.0000137800000000, -0.0001808700000000, 0.0000810400000000 ] - [ 0.0000957600000000, -0.0000004100000000, -0.0000295000000000 ] - [ -0.0000955300000000, -0.0000004100000000, -0.0000295200000000 ] - [ 0.0000033000000000, 0.0000565000000000, -0.0000028100000000 ] - [ 0.0000032800000000, -0.0000576300000000, -0.0000558800000000 ] - [ -0.0000013900000000, 0.0000004600000000, 0.0000290200000000 ] - [ 0.0000007500000000, 0.0000006600000000, 0.0000290000000000 ] - [ -0.0000016800000000, -0.0000010300000000, 0.0000298800000000 ] - [ -0.0000014900000000, 0.0000017500000000, 0.0000284200000000 ] - [ -0.0001699300000000, 0.0000003000000000, -0.0000656500000000 ] - [ 0.0000288700000000, 0.0000003900000000, -0.0000626900000000 ] - [ 0.0000012700000000, -0.0000156300000000, -0.0000554700000000 ] - [ 0.0000015800000000, 0.0000160600000000, -0.0000708400000000 ] - [ 0.0000002500000000, 0.0000007700000000, 0.0000369100000000 ] - [ 0.0000001500000000, -0.0000009800000000, 0.0001057700000000 ] - [ 0.0000027000000000, -0.0000001600000000, 0.0000712700000000 ] - [ -0.0000013600000000, -0.0000001800000000, 0.0000714500000000 ] - [ 0.0000064000000000, 0.0000110400000000, -0.0000443200000000 ] - [ 0.0000058000000000, -0.0000114200000000, 0.0000032700000000 ] - [ 0.0000104900000000, -0.0000002300000000, -0.0000202400000000 ] - [ -0.0000134300000000, -0.0000006100000000, -0.0000204300000000 ] - [ 0.0046695000000000, -0.0000069700000000, 0.0001735100000000 ] - [ 0.0003985200000000, -0.0000001400000000, 0.0000037300000000 ] - [ 0.0000172000000000, -0.0002199500000000, 0.0000574800000000 ] - [ 0.0000172000000000, 0.0002203300000000, -0.0000546800000000 ] - [ 0.0000062600000000, 0.0000522500000000, -0.0002214100000000 ] - [ 0.0000063700000000, -0.0000539500000000, 0.0002198900000000 ] - [ 0.0000216200000000, -0.0000005800000000, -0.0000018200000000 ] - [ -0.0000857200000000, -0.0000009500000000, 0.0000000200000000 ] - [ 0.0000067900000000, 0.0000003800000000, -0.0000006700000000 ] - [ 0.0000023900000000, 0.0000006000000000, -0.0000001500000000 ] - [ -0.0000188900000000, 0.0000153400000000, -0.0000302400000000 ] - [ -0.0000184000000000, -0.0000140900000000, 0.0000287500000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.1035733200000000 ] - [ 0.0000000000000000, -0.0002722400000000, -0.0022348200000000 ] - [ 0.0002357700000000, 0.0001361200000000, -0.0022348200000000 ] - [ -0.0002357700000000, 0.0001361200000000, -0.0022348200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0059883000000000 ] - [ 0.0000000000000000, 0.0000533700000000, -0.0008296100000000 ] - [ -0.0000462200000000, -0.0000266800000000, -0.0008296100000000 ] - [ 0.0000462200000000, -0.0000266800000000, -0.0008296100000000 ] - [ -0.0000877200000000, -0.0000506500000000, 0.0011045400000000 ] - [ 0.0000877200000000, -0.0000506500000000, 0.0011045400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005467700000000 ] - [ 0.0000000000000000, 0.0001013000000000, 0.0011045400000000 ] - [ 0.0008177700000000, 0.0004721400000000, 0.0012569400000000 ] - [ -0.0008177700000000, 0.0004721400000000, 0.0012569400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001418600000000 ] - [ 0.0000000000000000, -0.0009442800000000, 0.0012569400000000 ] - [ 0.0000000000000000, -0.0002905100000000, 0.0011035400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005479000000000 ] - [ -0.0002515900000000, 0.0001452500000000, 0.0011035400000000 ] - [ 0.0002515900000000, 0.0001452500000000, 0.0011035400000000 ] - [ 0.0000000000000000, 0.0000568600000000, 0.0010115700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0008109600000000 ] - [ 0.0000492400000000, -0.0000284300000000, 0.0010115700000000 ] - [ -0.0000492400000000, -0.0000284300000000, 0.0010115700000000 ] - [ 0.0014064600000000, 0.0008120200000000, -0.0000831600000000 ] - [ -0.0014064600000000, 0.0008120200000000, -0.0000831600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002835500000000 ] - [ 0.0000000000000000, -0.0016240400000000, -0.0000831600000000 ] - [ 0.0002652300000000, 0.0001531300000000, 0.0017478500000000 ] - [ -0.0002652300000000, 0.0001531300000000, 0.0017478500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003917700000000 ] - [ 0.0000000000000000, -0.0003062600000000, 0.0017478500000000 ] - [ 0.0000000000000000, 0.0010704000000000, -0.0003081200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001490900000000 ] - [ 0.0009270000000000, -0.0005352000000000, -0.0003081200000000 ] - [ -0.0009270000000000, -0.0005352000000000, -0.0003081200000000 ] - [ 0.0000000000000000, -0.0013586700000000, 0.0020309600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005131700000000 ] - [ -0.0011766400000000, 0.0006793300000000, 0.0020309600000000 ] - [ 0.0011766400000000, 0.0006793300000000, 0.0020309600000000 ] - [ 0.0000000000000000, -0.0004960400000000, -0.0003742300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001008800000000 ] - [ -0.0004295900000000, 0.0002480200000000, -0.0003742300000000 ] - [ 0.0004295900000000, 0.0002480200000000, -0.0003742300000000 ] - [ 0.0000000000000000, -0.0000828900000000, -0.0004974400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005046200000000 ] - [ -0.0000717900000000, 0.0000414500000000, -0.0004974400000000 ] - [ 0.0000717900000000, 0.0000414500000000, -0.0004974400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0079395900000000 ] - [ 0.0000000000000000, 0.0001450100000000, 0.0005220400000000 ] - [ -0.0001255800000000, -0.0000725000000000, 0.0005220400000000 ] - [ 0.0001255800000000, -0.0000725000000000, 0.0005220400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002515700000000 ] - [ 0.0000000000000000, 0.0001472500000000, -0.0002451300000000 ] - [ -0.0001275200000000, -0.0000736200000000, -0.0002451300000000 ] - [ 0.0001275200000000, -0.0000736200000000, -0.0002451300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002091100000000 ] - [ 0.0000000000000000, 0.0000657200000000, -0.0001927200000000 ] - [ -0.0000569100000000, -0.0000328600000000, -0.0001927200000000 ] - [ 0.0000569100000000, -0.0000328600000000, -0.0001927200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0015233200000000 ] - [ 0.0000000000000000, 0.0000682200000000, -0.0002097200000000 ] - [ -0.0000590800000000, -0.0000341100000000, -0.0002097200000000 ] - [ 0.0000590800000000, -0.0000341100000000, -0.0002097200000000 ] - [ 0.0000246100000000, 0.0000142100000000, -0.0003624900000000 ] - [ -0.0000246100000000, 0.0000142100000000, -0.0003624900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003002400000000 ] - [ 0.0000000000000000, -0.0000284100000000, -0.0003624900000000 ] - [ 0.0001404300000000, 0.0000810800000000, -0.0002662200000000 ] - [ -0.0001404300000000, 0.0000810800000000, -0.0002662200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001142100000000 ] - [ 0.0000000000000000, -0.0001621500000000, -0.0002662200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0815886600000000 ] - [ 0.0000000000000000, -0.0000402300000000, 0.0012905500000000 ] - [ 0.0000348400000000, 0.0000201100000000, 0.0012905500000000 ] - [ -0.0000348400000000, 0.0000201100000000, 0.0012905500000000 ] - [ 0.0002921900000000, 0.0001687000000000, -0.0008299500000000 ] - [ -0.0002921900000000, 0.0001687000000000, -0.0008299500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002535600000000 ] - [ 0.0000000000000000, -0.0003373900000000, -0.0008299500000000 ] - [ 0.0000000000000000, -0.0001127700000000, -0.0006993200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004957900000000 ] - [ -0.0000976600000000, 0.0000563800000000, -0.0006993200000000 ] - [ 0.0000976600000000, 0.0000563800000000, -0.0006993200000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.1069038700000000 ] - [ 0.0000000000000000, 0.0002711600000000, 0.0022341800000000 ] - [ -0.0002348300000000, -0.0001355800000000, 0.0022341800000000 ] - [ 0.0002348300000000, -0.0001355800000000, 0.0022341800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0061270000000000 ] - [ 0.0000000000000000, -0.0000535600000000, 0.0008418900000000 ] - [ 0.0000463800000000, 0.0000267800000000, 0.0008418900000000 ] - [ -0.0000463800000000, 0.0000267800000000, 0.0008418900000000 ] - [ 0.0000875600000000, 0.0000505500000000, -0.0011014700000000 ] - [ -0.0000875600000000, 0.0000505500000000, -0.0011014700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005444400000000 ] - [ 0.0000000000000000, -0.0001011100000000, -0.0011014700000000 ] - [ -0.0008145000000000, -0.0004702500000000, -0.0012629500000000 ] - [ 0.0008145000000000, -0.0004702500000000, -0.0012629500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001362200000000 ] - [ 0.0000000000000000, 0.0009405000000000, -0.0012629500000000 ] - [ 0.0000000000000000, 0.0002929600000000, -0.0011027900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005435500000000 ] - [ 0.0002537100000000, -0.0001464800000000, -0.0011027900000000 ] - [ -0.0002537100000000, -0.0001464800000000, -0.0011027900000000 ] - [ 0.0000000000000000, -0.0000570200000000, -0.0010171000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0008150200000000 ] - [ -0.0000493800000000, 0.0000285100000000, -0.0010171000000000 ] - [ 0.0000493800000000, 0.0000285100000000, -0.0010171000000000 ] - [ -0.0014138600000000, -0.0008163000000000, 0.0001053900000000 ] - [ 0.0014138600000000, -0.0008163000000000, 0.0001053900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002620100000000 ] - [ 0.0000000000000000, 0.0016325900000000, 0.0001053900000000 ] - [ -0.0002537500000000, -0.0001465000000000, -0.0018956800000000 ] - [ 0.0002537500000000, -0.0001465000000000, -0.0018956800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005390900000000 ] - [ 0.0000000000000000, 0.0002930100000000, -0.0018956800000000 ] - [ 0.0000000000000000, -0.0010759800000000, 0.0004582700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002998000000000 ] - [ -0.0009318300000000, 0.0005379900000000, 0.0004582700000000 ] - [ 0.0009318300000000, 0.0005379900000000, 0.0004582700000000 ] - [ 0.0000000000000000, 0.0013613000000000, -0.0020486000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005395800000000 ] - [ 0.0011789200000000, -0.0006806500000000, -0.0020486000000000 ] - [ -0.0011789200000000, -0.0006806500000000, -0.0020486000000000 ] - [ 0.0000000000000000, 0.0004933600000000, 0.0003971800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000745800000000 ] - [ 0.0004272600000000, -0.0002466800000000, 0.0003971800000000 ] - [ -0.0004272600000000, -0.0002466800000000, 0.0003971800000000 ] - [ 0.0000000000000000, 0.0000828900000000, 0.0003469500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003538000000000 ] - [ 0.0000717900000000, -0.0000414500000000, 0.0003469500000000 ] - [ -0.0000717900000000, -0.0000414500000000, 0.0003469500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0074473400000000 ] - [ 0.0000000000000000, -0.0001456800000000, -0.0003841200000000 ] - [ 0.0001261600000000, 0.0000728400000000, -0.0003841200000000 ] - [ -0.0001261600000000, 0.0000728400000000, -0.0003841200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002084400000000 ] - [ 0.0000000000000000, -0.0001470800000000, 0.0002020500000000 ] - [ 0.0001273700000000, 0.0000735400000000, 0.0002020500000000 ] - [ -0.0001273700000000, 0.0000735400000000, 0.0002020500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002528700000000 ] - [ 0.0000000000000000, -0.0000661100000000, 0.0002364900000000 ] - [ 0.0000572500000000, 0.0000330500000000, 0.0002364900000000 ] - [ -0.0000572500000000, 0.0000330500000000, 0.0002364900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0013921500000000 ] - [ 0.0000000000000000, -0.0000685100000000, 0.0000742700000000 ] - [ 0.0000593300000000, 0.0000342600000000, 0.0000742700000000 ] - [ -0.0000593300000000, 0.0000342600000000, 0.0000742700000000 ] - [ -0.0000248200000000, -0.0000143300000000, 0.0005142600000000 ] - [ 0.0000248200000000, -0.0000143300000000, 0.0005142600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004520600000000 ] - [ 0.0000000000000000, 0.0000286600000000, 0.0005142600000000 ] - [ -0.0001415400000000, -0.0000817200000000, 0.0002421100000000 ] - [ 0.0001415400000000, -0.0000817200000000, 0.0002421100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000886000000000 ] - [ 0.0000000000000000, 0.0001634300000000, 0.0002421100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0851563700000000 ] - [ 0.0000000000000000, 0.0000405000000000, -0.0013013200000000 ] - [ -0.0000350800000000, -0.0000202500000000, -0.0013013200000000 ] - [ 0.0000350800000000, -0.0000202500000000, -0.0013013200000000 ] - [ -0.0002913200000000, -0.0001681900000000, 0.0008304600000000 ] - [ 0.0002913200000000, -0.0001681900000000, 0.0008304600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002544200000000 ] - [ 0.0000000000000000, 0.0003363900000000, 0.0008304600000000 ] - [ 0.0000000000000000, 0.0001137000000000, 0.0007007900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004960000000000 ] - [ 0.0000984700000000, -0.0000568500000000, 0.0007007900000000 ] - [ -0.0000984700000000, -0.0000568500000000, 0.0007007900000000 ]- atom: 25 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0002330600000000, -0.0001916500000000, 0.0013939000000000 ] - [ -0.0002322100000000, 0.0001913300000000, -0.0014266500000000 ] - [ -0.0000572400000000, -0.0000007200000000, -0.0000139500000000 ] - [ 0.0000990700000000, 0.0000002500000000, -0.0000098000000000 ] - [ 0.0040127200000000, 0.0015782300000000, 0.0011706300000000 ] - [ 0.0041702200000000, -0.0016783300000000, -0.0011866400000000 ] - [ -0.0002678200000000, -0.0000014900000000, 0.0000170600000000 ] - [ 0.0012715700000000, -0.0000035800000000, 0.0000182600000000 ] - [ -0.0000010800000000, -0.0000004100000000, -0.0000149900000000 ] - [ 0.0000015600000000, -0.0000004300000000, -0.0000147200000000 ] - [ -0.0000009300000000, -0.0000020500000000, -0.0000715000000000 ] - [ -0.0000010700000000, 0.0000008600000000, 0.0000429700000000 ] - [ 0.0000951100000000, 0.0000003000000000, 0.0000104600000000 ] - [ -0.0000958800000000, 0.0000005200000000, 0.0000103500000000 ] - [ 0.0000023300000000, 0.0000574300000000, -0.0001172900000000 ] - [ 0.0000028000000000, -0.0000562300000000, 0.0001382700000000 ] - [ -0.0000357200000000, 0.0001038800000000, -0.0004410900000000 ] - [ -0.0000350200000000, -0.0001051700000000, 0.0004165300000000 ] - [ 0.0001456600000000, -0.0000007400000000, -0.0000132700000000 ] - [ -0.0001404600000000, -0.0000003500000000, -0.0000143000000000 ] - [ 0.0000059500000000, -0.0000106200000000, -0.0001274700000000 ] - [ 0.0000058900000000, 0.0000114900000000, 0.0001544200000000 ] - [ -0.0000133200000000, 0.0000003900000000, 0.0000128300000000 ] - [ 0.0000104600000000, 0.0000003500000000, 0.0000131800000000 ] - [ -0.0196909700000000, 0.0001294700000000, 0.0000585100000000 ] - [ 0.0008236700000000, -0.0000022800000000, 0.0000184300000000 ] - [ 0.0000568500000000, -0.0004422100000000, -0.0000182900000000 ] - [ 0.0000528500000000, 0.0004458100000000, 0.0000557300000000 ] - [ -0.0004364500000000, 0.0000007200000000, -0.0000734800000000 ] - [ 0.0003879500000000, 0.0000002400000000, -0.0000718600000000 ] - [ -0.0000188500000000, -0.0002356100000000, -0.0000251000000000 ] - [ -0.0000201800000000, 0.0002348200000000, -0.0001193300000000 ] - [ 0.0023436800000000, -0.0019950200000000, 0.0021290500000000 ] - [ 0.0023548500000000, 0.0020124900000000, -0.0020072700000000 ] - [ -0.0011212600000000, 0.0000055900000000, 0.0000746100000000 ] - [ 0.0006027200000000, -0.0000014900000000, 0.0000721800000000 ] - [ 0.0005112600000000, -0.0006524000000000, -0.0007435700000000 ] - [ 0.0005108000000000, 0.0006552600000000, 0.0007090900000000 ] - [ -0.0006214200000000, 0.0000008500000000, -0.0000211700000000 ] - [ 0.0006873000000000, -0.0000020800000000, -0.0000206200000000 ] - [ -0.0000000300000000, -0.0000303500000000, -0.0000113300000000 ] - [ -0.0000002900000000, 0.0000310400000000, 0.0000521200000000 ] - [ -0.0000533800000000, 0.0000002700000000, 0.0000205000000000 ] - [ 0.0000570900000000, 0.0000001100000000, 0.0000204400000000 ] - [ 0.0000001300000000, -0.0000073700000000, -0.0000504300000000 ] - [ 0.0000001300000000, 0.0000076200000000, -0.0000929800000000 ] - [ -0.0000128600000000, 0.0000000300000000, -0.0000717300000000 ] - [ 0.0000126200000000, 0.0000000600000000, -0.0000715700000000 ] - [ -0.0000155100000000, -0.0000250600000000, -0.0001790800000000 ] - [ -0.0000156400000000, 0.0000245200000000, 0.0003064500000000 ] - [ -0.0000212300000000, -0.0000002900000000, 0.0000633600000000 ] - [ 0.0000273600000000, -0.0000002500000000, 0.0000627100000000 ] - [ 0.0000009400000000, -0.0000096500000000, -0.0000251200000000 ] - [ 0.0000008700000000, 0.0000084500000000, -0.0000324300000000 ] - [ -0.0000156400000000, -0.0000004200000000, -0.0000287700000000 ] - [ 0.0000165800000000, -0.0000005000000000, -0.0000288500000000 ] - [ -0.0000005700000000, 0.0000310300000000, 0.0000307000000000 ] - [ -0.0000003800000000, -0.0000304000000000, 0.0000270300000000 ] - [ 0.0000568600000000, 0.0000004600000000, 0.0000288400000000 ] - [ -0.0000536700000000, 0.0000005900000000, 0.0000289700000000 ] - [ 0.0001201200000000, 0.0001215700000000, 0.0003442200000000 ] - [ 0.0001215000000000, -0.0001227300000000, -0.0004708500000000 ] - [ 0.0000835200000000, 0.0000004100000000, -0.0000642900000000 ] - [ -0.0000907700000000, 0.0000003600000000, -0.0000624500000000 ] - [ -0.0000352200000000, -0.0000002200000000, 0.0000722300000000 ] - [ 0.0000352400000000, -0.0000003200000000, 0.0000722700000000 ] - [ 0.0000001200000000, -0.0000204000000000, 0.0000847600000000 ] - [ 0.0000000000000000, 0.0000201800000000, 0.0000596500000000 ] - [ -0.0001337800000000, -0.0000003100000000, -0.0000194000000000 ] - [ 0.0001095200000000, -0.0000006800000000, -0.0000196400000000 ] - [ -0.0000015400000000, -0.0000644500000000, -0.0000800700000000 ] - [ -0.0000022100000000, 0.0000640900000000, 0.0000408300000000 ] - [ 0.0025129600000000, 0.0016034600000000, -0.0026721200000000 ] - [ 0.0025581700000000, -0.0016408900000000, 0.0027074500000000 ] - [ -0.0000844300000000, -0.0000005200000000, 0.0000005900000000 ] - [ -0.0002740600000000, -0.0000062400000000, -0.0000059700000000 ] - [ 0.0000477600000000, -0.0000007400000000, -0.0000003100000000 ] - [ -0.0000454000000000, -0.0000006100000000, 0.0000005200000000 ] - [ 0.0000043200000000, 0.0000282500000000, 0.0000458100000000 ] - [ 0.0000044600000000, -0.0000293700000000, -0.0000468600000000 ] - [ -0.0000266700000000, 0.0000535900000000, 0.0001249100000000 ] - [ -0.0000263000000000, -0.0000526500000000, -0.0001246600000000 ] - [ 0.0000655300000000, 0.0000004100000000, -0.0000004900000000 ] - [ -0.0000585700000000, 0.0000005600000000, 0.0000009600000000 ]- atom: 25 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0006903700000000, 0.0003985900000000, -0.0001075900000000 ] - [ -0.0006903700000000, 0.0003985900000000, -0.0001075900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002583900000000 ] - [ 0.0000000000000000, -0.0007971700000000, -0.0001075900000000 ] - [ 0.0009882300000000, 0.0005705500000000, 0.0020612700000000 ] - [ -0.0009882300000000, 0.0005705500000000, 0.0020612700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005421000000000 ] - [ 0.0000000000000000, -0.0011411100000000, 0.0020612700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002479200000000 ] - [ 0.0000000000000000, -0.0000009300000000, -0.0002305800000000 ] - [ 0.0000008100000000, 0.0000004700000000, -0.0002305800000000 ] - [ -0.0000008100000000, 0.0000004700000000, -0.0002305800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002191400000000 ] - [ 0.0000000000000000, -0.0000305900000000, -0.0002124100000000 ] - [ 0.0000265000000000, 0.0000153000000000, -0.0002124100000000 ] - [ -0.0000265000000000, 0.0000153000000000, -0.0002124100000000 ] - [ -0.0001421600000000, 0.0000820700000000, -0.0003967400000000 ] - [ 0.0001421600000000, 0.0000820700000000, -0.0003967400000000 ] - [ 0.0000000000000000, -0.0001641500000000, -0.0003967400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000753200000000 ] - [ 0.0000234700000000, -0.0000135500000000, -0.0002377400000000 ] - [ -0.0000234700000000, -0.0000135500000000, -0.0002377400000000 ] - [ 0.0000000000000000, 0.0000271000000000, -0.0002377400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000839300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0074183600000000 ] - [ 0.0000000000000000, 0.0000421000000000, -0.0000937400000000 ] - [ -0.0000364600000000, -0.0000210500000000, -0.0000937400000000 ] - [ 0.0000364600000000, -0.0000210500000000, -0.0000937400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0008629600000000 ] - [ 0.0000000000000000, 0.0001448400000000, 0.0000040600000000 ] - [ -0.0001254300000000, -0.0000724200000000, 0.0000040600000000 ] - [ 0.0001254300000000, -0.0000724200000000, 0.0000040600000000 ] - [ 0.0019645200000000, -0.0011342200000000, 0.0003150100000000 ] - [ -0.0019645200000000, -0.0011342200000000, 0.0003150100000000 ] - [ 0.0000000000000000, 0.0022684300000000, 0.0003150100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001284900000000 ] - [ -0.0007294000000000, 0.0004211200000000, 0.0003569900000000 ] - [ 0.0007294000000000, 0.0004211200000000, 0.0003569900000000 ] - [ 0.0000000000000000, -0.0008422400000000, 0.0003569900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002980700000000 ] - [ -0.0000018000000000, 0.0000010400000000, 0.0000589600000000 ] - [ 0.0000018000000000, 0.0000010400000000, 0.0000589600000000 ] - [ 0.0000000000000000, -0.0000020800000000, 0.0000589600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001005300000000 ] - [ 0.0000039100000000, -0.0000022600000000, 0.0000303100000000 ] - [ -0.0000039100000000, -0.0000022600000000, 0.0000303100000000 ] - [ 0.0000000000000000, 0.0000045200000000, 0.0000303100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000071200000000 ] - [ 0.0000391700000000, 0.0000226100000000, 0.0002107600000000 ] - [ -0.0000391700000000, 0.0000226100000000, 0.0002107600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000919300000000 ] - [ 0.0000000000000000, -0.0000452200000000, 0.0002107600000000 ] - [ 0.0000036100000000, 0.0000020800000000, 0.0000192100000000 ] - [ -0.0000036100000000, 0.0000020800000000, 0.0000192100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000249900000000 ] - [ 0.0000000000000000, -0.0000041600000000, 0.0000192100000000 ] - [ 0.0000316800000000, 0.0000182900000000, 0.0000666800000000 ] - [ -0.0000316800000000, 0.0000182900000000, 0.0000666800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001081400000000 ] - [ 0.0000000000000000, -0.0000365800000000, 0.0000666800000000 ] - [ 0.0003682600000000, 0.0002126100000000, 0.0000564100000000 ] - [ -0.0003682600000000, 0.0002126100000000, 0.0000564100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001716900000000 ] - [ 0.0000000000000000, -0.0004252300000000, 0.0000564100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001678100000000 ] - [ 0.0000000000000000, 0.0000229900000000, 0.0001660200000000 ] - [ -0.0000199100000000, -0.0000114900000000, 0.0001660200000000 ] - [ 0.0000199100000000, -0.0000114900000000, 0.0001660200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003192500000000 ] - [ 0.0000000000000000, 0.0000692700000000, -0.0000375800000000 ] - [ -0.0000599900000000, -0.0000346300000000, -0.0000375800000000 ] - [ 0.0000599900000000, -0.0000346300000000, -0.0000375800000000 ] - [ -0.0020062200000000, -0.0011582900000000, -0.0003725600000000 ] - [ 0.0020062200000000, -0.0011582900000000, -0.0003725600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004351300000000 ] - [ 0.0000000000000000, 0.0023165800000000, -0.0003725600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001493700000000 ] - [ 0.0000000000000000, -0.0000208700000000, 0.0001439200000000 ] - [ 0.0000180700000000, 0.0000104300000000, 0.0001439200000000 ] - [ -0.0000180700000000, 0.0000104300000000, 0.0001439200000000 ] - [ -0.0000979900000000, 0.0000565800000000, 0.0002012900000000 ] - [ 0.0000979900000000, 0.0000565800000000, 0.0002012900000000 ] - [ 0.0000000000000000, -0.0001131500000000, 0.0002012900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000319200000000 ]- atom: 25 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ -0.0006843700000000, -0.0003951200000000, 0.0000929200000000 ] - [ 0.0006843700000000, -0.0003951200000000, 0.0000929200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002746900000000 ] - [ 0.0000000000000000, 0.0007902500000000, 0.0000929200000000 ] - [ -0.0009930100000000, -0.0005733200000000, -0.0020342300000000 ] - [ 0.0009930100000000, -0.0005733200000000, -0.0020342300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005259000000000 ] - [ 0.0000000000000000, 0.0011466300000000, -0.0020342300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002338100000000 ] - [ 0.0000000000000000, 0.0000010400000000, 0.0002166000000000 ] - [ -0.0000009000000000, -0.0000005200000000, 0.0002166000000000 ] - [ 0.0000009000000000, -0.0000005200000000, 0.0002166000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002296600000000 ] - [ 0.0000000000000000, 0.0000306000000000, 0.0002234700000000 ] - [ -0.0000265000000000, -0.0000153000000000, 0.0002234700000000 ] - [ 0.0000265000000000, -0.0000153000000000, 0.0002234700000000 ] - [ 0.0001439400000000, -0.0000831000000000, 0.0003877800000000 ] - [ -0.0001439400000000, -0.0000831000000000, 0.0003877800000000 ] - [ 0.0000000000000000, 0.0001662100000000, 0.0003877800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000878800000000 ] - [ -0.0000237900000000, 0.0000137400000000, 0.0002531000000000 ] - [ 0.0000237900000000, 0.0000137400000000, 0.0002531000000000 ] - [ 0.0000000000000000, -0.0000274800000000, 0.0002531000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000995000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0074350800000000 ] - [ 0.0000000000000000, -0.0000433600000000, 0.0001271300000000 ] - [ 0.0000375500000000, 0.0000216800000000, 0.0001271300000000 ] - [ -0.0000375500000000, 0.0000216800000000, 0.0001271300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0010004100000000 ] - [ 0.0000000000000000, -0.0001449300000000, -0.0001524800000000 ] - [ 0.0001255100000000, 0.0000724600000000, -0.0001524800000000 ] - [ -0.0001255100000000, 0.0000724600000000, -0.0001524800000000 ] - [ -0.0019711100000000, 0.0011380200000000, -0.0001567300000000 ] - [ 0.0019711100000000, 0.0011380200000000, -0.0001567300000000 ] - [ 0.0000000000000000, -0.0022760400000000, -0.0001567300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000211200000000 ] - [ 0.0007234600000000, -0.0004176900000000, -0.0003903400000000 ] - [ -0.0007234600000000, -0.0004176900000000, -0.0003903400000000 ] - [ 0.0000000000000000, 0.0008353800000000, -0.0003903400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002611000000000 ] - [ 0.0000018100000000, -0.0000010400000000, -0.0000244300000000 ] - [ -0.0000018100000000, -0.0000010400000000, -0.0000244300000000 ] - [ 0.0000000000000000, 0.0000020900000000, -0.0000244300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000659600000000 ] - [ -0.0000039900000000, 0.0000023000000000, -0.0001778200000000 ] - [ 0.0000039900000000, 0.0000023000000000, -0.0001778200000000 ] - [ 0.0000000000000000, -0.0000046000000000, -0.0001778200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001545200000000 ] - [ -0.0000391200000000, -0.0000225900000000, -0.0000813200000000 ] - [ 0.0000391200000000, -0.0000225900000000, -0.0000813200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000377600000000 ] - [ 0.0000000000000000, 0.0000451700000000, -0.0000813200000000 ] - [ -0.0000036500000000, -0.0000021100000000, -0.0000713500000000 ] - [ 0.0000036500000000, -0.0000021100000000, -0.0000713500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000771400000000 ] - [ 0.0000000000000000, 0.0000042100000000, -0.0000713500000000 ] - [ -0.0000319700000000, -0.0000184600000000, -0.0000151500000000 ] - [ 0.0000319700000000, -0.0000184600000000, -0.0000151500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000569500000000 ] - [ 0.0000000000000000, 0.0000369100000000, -0.0000151500000000 ] - [ -0.0003729300000000, -0.0002153100000000, -0.0001874900000000 ] - [ 0.0003729300000000, -0.0002153100000000, -0.0001874900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000433100000000 ] - [ 0.0000000000000000, 0.0004306300000000, -0.0001874900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000215300000000 ] - [ 0.0000000000000000, -0.0000231100000000, -0.0000196800000000 ] - [ 0.0000200100000000, 0.0000115500000000, -0.0000196800000000 ] - [ -0.0000200100000000, 0.0000115500000000, -0.0000196800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003585400000000 ] - [ 0.0000000000000000, -0.0000701300000000, 0.0000031600000000 ] - [ 0.0000607300000000, 0.0000350600000000, 0.0000031600000000 ] - [ -0.0000607300000000, 0.0000350600000000, 0.0000031600000000 ] - [ 0.0019940800000000, 0.0011512800000000, 0.0003577200000000 ] - [ -0.0019940800000000, 0.0011512800000000, 0.0003577200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004343600000000 ] - [ 0.0000000000000000, -0.0023025600000000, 0.0003577200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001506600000000 ] - [ 0.0000000000000000, 0.0000208900000000, -0.0001452200000000 ] - [ -0.0000180900000000, -0.0000104400000000, -0.0001452200000000 ] - [ 0.0000180900000000, -0.0000104400000000, -0.0001452200000000 ] - [ 0.0000992000000000, -0.0000572700000000, -0.0002022500000000 ] - [ -0.0000992000000000, -0.0000572700000000, -0.0002022500000000 ] - [ 0.0000000000000000, 0.0001145500000000, -0.0002022500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000316500000000 ]- atom: 29 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0029915000000000, 0.0010733300000000, 0.0002182600000000 ] - [ 0.0031130300000000, -0.0011516600000000, -0.0002999000000000 ] - [ -0.0003378700000000, -0.0000023400000000, -0.0000126800000000 ] - [ 0.0011256900000000, -0.0000069500000000, -0.0000143200000000 ] - [ 0.0000318700000000, 0.0000600700000000, -0.0009128900000000 ] - [ 0.0000301300000000, -0.0000584200000000, 0.0009465300000000 ] - [ 0.0000092700000000, 0.0000004800000000, 0.0000184900000000 ] - [ -0.0000715800000000, 0.0000000500000000, 0.0000152700000000 ] - [ -0.0001697700000000, -0.0000001200000000, -0.0000120900000000 ] - [ 0.0000293100000000, -0.0000005100000000, -0.0000152600000000 ] - [ 0.0000015800000000, -0.0000165800000000, -0.0000734100000000 ] - [ 0.0000014000000000, 0.0000155100000000, 0.0000453900000000 ] - [ 0.0006866900000000, 0.0000001700000000, -0.0000009300000000 ] - [ -0.0003259500000000, 0.0000004900000000, 0.0000081900000000 ] - [ -0.0000141400000000, 0.0001809900000000, -0.0001162000000000 ] - [ -0.0000136900000000, -0.0001792800000000, 0.0001363700000000 ] - [ -0.0000005000000000, 0.0000342800000000, -0.0000855000000000 ] - [ -0.0000002500000000, -0.0000354500000000, 0.0000587300000000 ] - [ 0.0000600000000000, -0.0000006000000000, -0.0000130300000000 ] - [ -0.0000599800000000, -0.0000004700000000, -0.0000124800000000 ] - [ -0.0000000600000000, -0.0000003500000000, -0.0000115600000000 ] - [ 0.0000001200000000, 0.0000012400000000, 0.0000377100000000 ] - [ -0.0000014300000000, 0.0000003000000000, 0.0000128800000000 ] - [ 0.0000025200000000, 0.0000003900000000, 0.0000135800000000 ] - [ -0.0004370400000000, 0.0000008000000000, 0.0000198700000000 ] - [ 0.0003872900000000, -0.0000001600000000, 0.0000193800000000 ] - [ -0.0000192300000000, -0.0002347000000000, -0.0001059100000000 ] - [ -0.0000210300000000, 0.0002356900000000, 0.0001449700000000 ] - [ -0.0151091000000000, 0.0000844500000000, 0.0000022300000000 ] - [ 0.0007488100000000, -0.0000015800000000, -0.0000730700000000 ] - [ 0.0000644300000000, -0.0003949100000000, 0.0000378400000000 ] - [ 0.0000622800000000, 0.0003967500000000, -0.0001833800000000 ] - [ 0.0000000200000000, -0.0001318700000000, 0.0001068200000000 ] - [ -0.0000011500000000, 0.0001315200000000, 0.0000376300000000 ] - [ -0.0002286600000000, 0.0000002600000000, 0.0000721100000000 ] - [ 0.0002292200000000, -0.0000004500000000, 0.0000726000000000 ] - [ 0.0023438600000000, -0.0019951600000000, 0.0019367800000000 ] - [ 0.0023557400000000, 0.0020122300000000, -0.0019990100000000 ] - [ -0.0011206100000000, 0.0000048300000000, -0.0000178500000000 ] - [ 0.0006034000000000, -0.0000021900000000, -0.0000209100000000 ] - [ 0.0001213800000000, -0.0001212700000000, -0.0003483200000000 ] - [ 0.0001201400000000, 0.0001230000000000, 0.0003928900000000 ] - [ -0.0000908400000000, 0.0000008400000000, 0.0000204700000000 ] - [ 0.0000835400000000, -0.0000003500000000, 0.0000205300000000 ] - [ 0.0000012700000000, -0.0000108700000000, -0.0000581200000000 ] - [ 0.0000005100000000, 0.0000109500000000, -0.0000858400000000 ] - [ -0.0000180200000000, 0.0000003400000000, -0.0000721000000000 ] - [ 0.0000142500000000, -0.0000000500000000, -0.0000718900000000 ] - [ 0.0013758600000000, 0.0011246200000000, -0.0015204100000000 ] - [ 0.0013819900000000, -0.0011376200000000, 0.0016613000000000 ] - [ 0.0000026700000000, 0.0000002000000000, 0.0000638000000000 ] - [ -0.0005801900000000, -0.0000048800000000, 0.0000603900000000 ] - [ -0.0000145900000000, -0.0000252700000000, 0.0000100600000000 ] - [ -0.0000159500000000, 0.0000244100000000, -0.0000683000000000 ] - [ -0.0000210200000000, -0.0000002500000000, -0.0000289800000000 ] - [ 0.0000277600000000, -0.0000010400000000, -0.0000292400000000 ] - [ -0.0000003600000000, 0.0000079200000000, 0.0000251700000000 ] - [ -0.0000005100000000, -0.0000069700000000, 0.0000330500000000 ] - [ 0.0000120300000000, 0.0000004200000000, 0.0000291800000000 ] - [ -0.0000133200000000, 0.0000003200000000, 0.0000291700000000 ] - [ 0.0000007200000000, 0.0000110800000000, 0.0000665200000000 ] - [ 0.0000006000000000, -0.0000106400000000, -0.0001941800000000 ] - [ 0.0000139600000000, 0.0000002400000000, -0.0000641300000000 ] - [ -0.0000181600000000, 0.0000002100000000, -0.0000636000000000 ] - [ -0.0000202600000000, -0.0000001500000000, 0.0000720600000000 ] - [ 0.0000133700000000, -0.0000001700000000, 0.0000725100000000 ] - [ 0.0000004900000000, -0.0000076100000000, 0.0000809600000000 ] - [ 0.0000005300000000, 0.0000072100000000, 0.0000637000000000 ] - [ -0.0000349600000000, -0.0000002900000000, -0.0000199300000000 ] - [ 0.0000355000000000, -0.0000003800000000, -0.0000198700000000 ] - [ 0.0000004600000000, -0.0000206100000000, -0.0000399100000000 ] - [ 0.0000002300000000, 0.0000199200000000, 0.0000000700000000 ] - [ -0.0000617000000000, -0.0002439300000000, 0.0009874200000000 ] - [ -0.0000550100000000, 0.0002414400000000, -0.0009857700000000 ] - [ -0.0000706600000000, -0.0000004400000000, -0.0000013200000000 ] - [ 0.0003619100000000, 0.0000010000000000, 0.0000027200000000 ] - [ 0.0006353200000000, -0.0000017100000000, -0.0000019400000000 ] - [ -0.0001186300000000, -0.0000003900000000, 0.0000015600000000 ] - [ -0.0000060200000000, 0.0000644400000000, 0.0000456700000000 ] - [ -0.0000058900000000, -0.0000658200000000, -0.0000466200000000 ] - [ -0.0000025400000000, 0.0000190400000000, 0.0000253300000000 ] - [ -0.0000022800000000, -0.0000179700000000, -0.0000251200000000 ] - [ 0.0000296500000000, 0.0000004300000000, -0.0000008400000000 ] - [ -0.0000293900000000, 0.0000005700000000, 0.0000006200000000 ]- atom: 29 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0003947100000000, 0.0002278900000000, 0.0018205700000000 ] - [ -0.0003947100000000, 0.0002278900000000, 0.0018205700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004635300000000 ] - [ 0.0000000000000000, -0.0004557700000000, 0.0018205700000000 ] - [ -0.0000857700000000, -0.0000495200000000, -0.0003821900000000 ] - [ 0.0000857700000000, -0.0000495200000000, -0.0003821900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002224900000000 ] - [ 0.0000000000000000, 0.0000990300000000, -0.0003821900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0014544600000000 ] - [ 0.0000000000000000, -0.0000088300000000, -0.0001410900000000 ] - [ 0.0000076500000000, 0.0000044100000000, -0.0001410900000000 ] - [ -0.0000076500000000, 0.0000044100000000, -0.0001410900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0078770900000000 ] - [ 0.0000000000000000, 0.0000210400000000, 0.0004527400000000 ] - [ -0.0000182200000000, -0.0000105200000000, 0.0004527400000000 ] - [ 0.0000182200000000, -0.0000105200000000, 0.0004527400000000 ] - [ -0.0000111000000000, 0.0000064100000000, -0.0004217600000000 ] - [ 0.0000111000000000, 0.0000064100000000, -0.0004217600000000 ] - [ 0.0000000000000000, -0.0000128200000000, -0.0004217600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004287000000000 ] - [ 0.0000343400000000, -0.0000198200000000, -0.0004404300000000 ] - [ -0.0000343400000000, -0.0000198200000000, -0.0004404300000000 ] - [ 0.0000000000000000, 0.0000396500000000, -0.0004404300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003784400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009369000000000 ] - [ 0.0000000000000000, -0.0000547100000000, 0.0000895200000000 ] - [ 0.0000473800000000, 0.0000273600000000, 0.0000895200000000 ] - [ -0.0000473800000000, 0.0000273600000000, 0.0000895200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0174401800000000 ] - [ 0.0000000000000000, -0.0001284400000000, -0.0005910400000000 ] - [ 0.0001112300000000, 0.0000642200000000, -0.0005910400000000 ] - [ -0.0001112300000000, 0.0000642200000000, -0.0005910400000000 ] - [ 0.0000345200000000, -0.0000199300000000, 0.0002862600000000 ] - [ -0.0000345200000000, -0.0000199300000000, 0.0002862600000000 ] - [ 0.0000000000000000, 0.0000398600000000, 0.0002862600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002743000000000 ] - [ 0.0020652000000000, -0.0011923400000000, 0.0002293400000000 ] - [ -0.0020652000000000, -0.0011923400000000, 0.0002293400000000 ] - [ 0.0000000000000000, 0.0023846800000000, 0.0002293400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000428700000000 ] - [ -0.0004079000000000, 0.0002355000000000, 0.0001348700000000 ] - [ 0.0004079000000000, 0.0002355000000000, 0.0001348700000000 ] - [ 0.0000000000000000, -0.0004710100000000, 0.0001348700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000959500000000 ] - [ -0.0001300200000000, 0.0000750700000000, 0.0001344600000000 ] - [ 0.0001300200000000, 0.0000750700000000, 0.0001344600000000 ] - [ 0.0000000000000000, -0.0001501400000000, 0.0001344600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000921600000000 ] - [ -0.0015952300000000, -0.0009210100000000, 0.0000596500000000 ] - [ 0.0015952300000000, -0.0009210100000000, 0.0000596500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003773100000000 ] - [ 0.0000000000000000, 0.0018420100000000, 0.0000596500000000 ] - [ -0.0002424900000000, -0.0001400000000000, 0.0001260700000000 ] - [ 0.0002424900000000, -0.0001400000000000, 0.0001260700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000068100000000 ] - [ 0.0000000000000000, 0.0002800100000000, 0.0001260700000000 ] - [ -0.0000211800000000, -0.0000122300000000, 0.0001244900000000 ] - [ 0.0000211800000000, -0.0000122300000000, 0.0001244900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001013000000000 ] - [ 0.0000000000000000, 0.0000244500000000, 0.0001244900000000 ] - [ -0.0000138000000000, -0.0000079700000000, 0.0001427300000000 ] - [ 0.0000138000000000, -0.0000079700000000, 0.0001427300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001005200000000 ] - [ 0.0000000000000000, 0.0000159400000000, 0.0001427300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003996500000000 ] - [ 0.0000000000000000, -0.0000100100000000, 0.0002301900000000 ] - [ 0.0000086700000000, 0.0000050100000000, 0.0002301900000000 ] - [ -0.0000086700000000, 0.0000050100000000, 0.0002301900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000835400000000 ] - [ 0.0000000000000000, -0.0000145300000000, 0.0000817000000000 ] - [ 0.0000125800000000, 0.0000072600000000, 0.0000817000000000 ] - [ -0.0000125800000000, 0.0000072600000000, 0.0000817000000000 ] - [ 0.0001578600000000, 0.0000911400000000, 0.0004562000000000 ] - [ -0.0001578600000000, 0.0000911400000000, 0.0004562000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000915800000000 ] - [ 0.0000000000000000, -0.0001822800000000, 0.0004562000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0015404500000000 ] - [ 0.0000000000000000, 0.0000208600000000, 0.0000275400000000 ] - [ -0.0000180600000000, -0.0000104300000000, 0.0000275400000000 ] - [ 0.0000180600000000, -0.0000104300000000, 0.0000275400000000 ] - [ 0.0000119000000000, -0.0000068700000000, 0.0002860000000000 ] - [ -0.0000119000000000, -0.0000068700000000, 0.0002860000000000 ] - [ 0.0000000000000000, 0.0000137400000000, 0.0002860000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002693300000000 ]- atom: 29 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ -0.0004081100000000, -0.0002356200000000, -0.0018234400000000 ] - [ 0.0004081100000000, -0.0002356200000000, -0.0018234400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004677000000000 ] - [ 0.0000000000000000, 0.0004712500000000, -0.0018234400000000 ] - [ 0.0000867500000000, 0.0000500900000000, 0.0003834200000000 ] - [ -0.0000867500000000, 0.0000500900000000, 0.0003834200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002253000000000 ] - [ 0.0000000000000000, -0.0001001700000000, 0.0003834200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0014602300000000 ] - [ 0.0000000000000000, 0.0000088800000000, 0.0001429000000000 ] - [ -0.0000076900000000, -0.0000044400000000, 0.0001429000000000 ] - [ 0.0000076900000000, -0.0000044400000000, 0.0001429000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0075093700000000 ] - [ 0.0000000000000000, -0.0000210800000000, -0.0004538200000000 ] - [ 0.0000182600000000, 0.0000105400000000, -0.0004538200000000 ] - [ -0.0000182600000000, 0.0000105400000000, -0.0004538200000000 ] - [ 0.0000110900000000, -0.0000064000000000, 0.0004227600000000 ] - [ -0.0000110900000000, -0.0000064000000000, 0.0004227600000000 ] - [ 0.0000000000000000, 0.0000128100000000, 0.0004227600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004301600000000 ] - [ -0.0000346000000000, 0.0000199800000000, 0.0004364700000000 ] - [ 0.0000346000000000, 0.0000199800000000, 0.0004364700000000 ] - [ 0.0000000000000000, -0.0000399500000000, 0.0004364700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003739300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0009213700000000 ] - [ 0.0000000000000000, 0.0000544000000000, -0.0000619400000000 ] - [ -0.0000471100000000, -0.0000272000000000, -0.0000619400000000 ] - [ 0.0000471100000000, -0.0000272000000000, -0.0000619400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0168907700000000 ] - [ 0.0000000000000000, 0.0001273300000000, 0.0004357800000000 ] - [ -0.0001102700000000, -0.0000636700000000, 0.0004357800000000 ] - [ 0.0001102700000000, -0.0000636700000000, 0.0004357800000000 ] - [ -0.0000346500000000, 0.0000200000000000, -0.0001342500000000 ] - [ 0.0000346500000000, 0.0000200000000000, -0.0001342500000000 ] - [ 0.0000000000000000, -0.0000400100000000, -0.0001342500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001217800000000 ] - [ -0.0020711200000000, 0.0011957600000000, -0.0002477800000000 ] - [ 0.0020711200000000, 0.0011957600000000, -0.0002477800000000 ] - [ 0.0000000000000000, -0.0023915200000000, -0.0002477800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000700700000000 ] - [ 0.0004071600000000, -0.0002350700000000, -0.0001054500000000 ] - [ -0.0004071600000000, -0.0002350700000000, -0.0001054500000000 ] - [ 0.0000000000000000, 0.0004701500000000, -0.0001054500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001227800000000 ] - [ 0.0001306100000000, -0.0000754100000000, -0.0002850400000000 ] - [ -0.0001306100000000, -0.0000754100000000, -0.0002850400000000 ] - [ 0.0000000000000000, 0.0001508100000000, -0.0002850400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002428900000000 ] - [ 0.0015863900000000, 0.0009159100000000, 0.0000717900000000 ] - [ -0.0015863900000000, 0.0009159100000000, 0.0000717900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005100300000000 ] - [ 0.0000000000000000, -0.0018318100000000, 0.0000717900000000 ] - [ 0.0002428500000000, 0.0001402100000000, -0.0001708800000000 ] - [ -0.0002428500000000, 0.0001402100000000, -0.0001708800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000520400000000 ] - [ 0.0000000000000000, -0.0002804200000000, -0.0001708800000000 ] - [ 0.0000213500000000, 0.0000123300000000, -0.0000792500000000 ] - [ -0.0000213500000000, 0.0000123300000000, -0.0000792500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000559700000000 ] - [ 0.0000000000000000, -0.0000246500000000, -0.0000792500000000 ] - [ 0.0000139300000000, 0.0000080400000000, -0.0002766300000000 ] - [ -0.0000139300000000, 0.0000080400000000, -0.0002766300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002344500000000 ] - [ 0.0000000000000000, -0.0000160900000000, -0.0002766300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002482300000000 ] - [ 0.0000000000000000, 0.0000100900000000, -0.0000788800000000 ] - [ -0.0000087400000000, -0.0000050400000000, -0.0000788800000000 ] - [ 0.0000087400000000, -0.0000050400000000, -0.0000788800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001105000000000 ] - [ 0.0000000000000000, 0.0000146200000000, -0.0001087100000000 ] - [ -0.0000126600000000, -0.0000073100000000, -0.0001087100000000 ] - [ 0.0000126600000000, -0.0000073100000000, -0.0001087100000000 ] - [ -0.0001589200000000, -0.0000917600000000, -0.0004532300000000 ] - [ 0.0001589200000000, -0.0000917600000000, -0.0004532300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000916800000000 ] - [ 0.0000000000000000, 0.0001835100000000, -0.0004532300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0015231500000000 ] - [ 0.0000000000000000, -0.0000208500000000, -0.0000264800000000 ] - [ 0.0000180600000000, 0.0000104300000000, -0.0000264800000000 ] - [ -0.0000180600000000, 0.0000104300000000, -0.0000264800000000 ] - [ -0.0000119900000000, 0.0000069200000000, -0.0002856900000000 ] - [ 0.0000119900000000, 0.0000069200000000, -0.0002856900000000 ] - [ 0.0000000000000000, -0.0000138400000000, -0.0002856900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002689700000000 ]- atom: 73 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0046670700000000, 0.0000014400000000, -0.0001581000000000 ] - [ 0.0003978900000000, -0.0000005600000000, -0.0000146500000000 ] - [ 0.0000159900000000, -0.0002207200000000, 0.0000195500000000 ] - [ 0.0000161200000000, 0.0002200900000000, -0.0000498800000000 ] - [ 0.0046670700000000, -0.0000014400000000, 0.0001581000000000 ] - [ 0.0003978900000000, 0.0000005600000000, 0.0000146500000000 ] - [ 0.0000161200000000, -0.0002200900000000, 0.0000498800000000 ] - [ 0.0000159900000000, 0.0002207200000000, -0.0000195500000000 ] - [ -0.0000193000000000, -0.0000152200000000, 0.0000827700000000 ] - [ -0.0000191900000000, 0.0000144000000000, -0.0001137800000000 ] - [ 0.0000022100000000, -0.0000004300000000, -0.0000159400000000 ] - [ 0.0000064300000000, -0.0000004000000000, -0.0000144100000000 ] - [ 0.0000049800000000, 0.0000539700000000, 0.0003025600000000 ] - [ 0.0000033800000000, -0.0000523200000000, -0.0002808600000000 ] - [ 0.0000197600000000, 0.0000006000000000, 0.0000109100000000 ] - [ -0.0000878900000000, -0.0000001700000000, 0.0000119000000000 ] - [ -0.0000878900000000, 0.0000001700000000, -0.0000119000000000 ] - [ 0.0000197600000000, -0.0000006000000000, -0.0000109100000000 ] - [ 0.0000049800000000, -0.0000539700000000, -0.0003025600000000 ] - [ 0.0000033800000000, 0.0000523200000000, 0.0002808600000000 ] - [ 0.0000064300000000, 0.0000004000000000, 0.0000144100000000 ] - [ 0.0000022100000000, 0.0000004300000000, 0.0000159400000000 ] - [ -0.0000193000000000, 0.0000152200000000, -0.0000827700000000 ] - [ -0.0000191900000000, -0.0000144000000000, 0.0001137800000000 ] - [ 0.0025567400000000, 0.0016413400000000, -0.0019966000000000 ] - [ 0.0025126200000000, -0.0016033600000000, 0.0020045500000000 ] - [ -0.0000845800000000, 0.0000004600000000, 0.0000202500000000 ] - [ -0.0002752300000000, 0.0000068700000000, 0.0000230000000000 ] - [ -0.0000605700000000, -0.0002418900000000, 0.0000868400000000 ] - [ -0.0000579700000000, 0.0002434600000000, -0.0002290000000000 ] - [ -0.0000716200000000, -0.0000001200000000, -0.0000710700000000 ] - [ 0.0003610000000000, -0.0000004900000000, -0.0000704700000000 ] - [ 0.0003610000000000, 0.0000004900000000, 0.0000704700000000 ] - [ -0.0000716200000000, 0.0000001200000000, 0.0000710700000000 ] - [ -0.0000605700000000, 0.0002418900000000, -0.0000868400000000 ] - [ -0.0000579700000000, -0.0002434600000000, 0.0002290000000000 ] - [ -0.0002752300000000, -0.0000068700000000, -0.0000230000000000 ] - [ -0.0000845800000000, -0.0000004600000000, -0.0000202500000000 ] - [ 0.0025567400000000, -0.0016413400000000, 0.0019966000000000 ] - [ 0.0025126200000000, 0.0016033600000000, -0.0020045500000000 ] - [ 0.0000658000000000, 0.0000000100000000, 0.0000203000000000 ] - [ -0.0000574000000000, 0.0000003000000000, 0.0000207300000000 ] - [ -0.0000265300000000, 0.0000536200000000, -0.0000783100000000 ] - [ -0.0000260300000000, -0.0000528100000000, 0.0001196100000000 ] - [ 0.0000285000000000, 0.0000000900000000, -0.0000712600000000 ] - [ -0.0000293700000000, 0.0000002400000000, -0.0000714500000000 ] - [ -0.0000030200000000, 0.0000182800000000, -0.0000590200000000 ] - [ -0.0000027300000000, -0.0000180000000000, -0.0000835900000000 ] - [ 0.0006332200000000, 0.0000001000000000, 0.0000697500000000 ] - [ -0.0001209900000000, -0.0000001900000000, 0.0000637200000000 ] - [ -0.0000080700000000, 0.0000648700000000, 0.0000453100000000 ] - [ -0.0000080200000000, -0.0000654900000000, 0.0000814200000000 ] - [ 0.0000438000000000, -0.0000005700000000, -0.0000289400000000 ] - [ -0.0000478800000000, -0.0000004500000000, -0.0000289500000000 ] - [ 0.0000023700000000, 0.0000285500000000, -0.0000109100000000 ] - [ 0.0000025500000000, -0.0000294300000000, -0.0000470700000000 ] - [ 0.0000438000000000, 0.0000005700000000, 0.0000289400000000 ] - [ -0.0000478800000000, 0.0000004500000000, 0.0000289500000000 ] - [ 0.0000025500000000, 0.0000294300000000, 0.0000470700000000 ] - [ 0.0000023700000000, -0.0000285500000000, 0.0000109100000000 ] - [ 0.0006332200000000, -0.0000001000000000, -0.0000697500000000 ] - [ -0.0001209900000000, 0.0000001900000000, -0.0000637200000000 ] - [ -0.0000080200000000, 0.0000654900000000, -0.0000814200000000 ] - [ -0.0000080700000000, -0.0000648700000000, -0.0000453100000000 ] - [ -0.0000030200000000, -0.0000182800000000, 0.0000590200000000 ] - [ -0.0000027300000000, 0.0000180000000000, 0.0000835900000000 ] - [ -0.0000293700000000, -0.0000002400000000, 0.0000714500000000 ] - [ 0.0000285000000000, -0.0000000900000000, 0.0000712600000000 ] - [ -0.0000265300000000, -0.0000536200000000, 0.0000783100000000 ] - [ -0.0000260300000000, 0.0000528100000000, -0.0001196100000000 ] - [ -0.0000574000000000, -0.0000003000000000, -0.0000207300000000 ] - [ 0.0000658000000000, -0.0000000100000000, -0.0000203000000000 ] - [ -0.0207994000000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0000886100000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0000445500000000, -0.0000752100000000, -0.0000337900000000 ] - [ -0.0000445500000000, 0.0000752100000000, 0.0000337900000000 ] - [ 0.0000588300000000, 0.0000694400000000, -0.0000779900000000 ] - [ 0.0000582700000000, -0.0000706400000000, 0.0000778000000000 ] - [ 0.0000115800000000, -0.0000004800000000, -0.0000004700000000 ] - [ -0.0000628100000000, -0.0000009200000000, 0.0000001000000000 ] - [ -0.0000628100000000, 0.0000009200000000, -0.0000001000000000 ] - [ 0.0000115800000000, 0.0000004800000000, 0.0000004700000000 ] - [ 0.0000588300000000, -0.0000694400000000, 0.0000779900000000 ] - [ 0.0000582700000000, 0.0000706400000000, -0.0000778000000000 ]- atom: 73 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0851504400000000 ] - [ 0.0000000000000000, -0.0000647500000000, 0.0012923800000000 ] - [ 0.0000560800000000, 0.0000323800000000, 0.0012923800000000 ] - [ -0.0000560800000000, 0.0000323800000000, 0.0012923800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0815900200000000 ] - [ 0.0000000000000000, -0.0000650100000000, 0.0012959500000000 ] - [ 0.0000563000000000, 0.0000325000000000, 0.0012959500000000 ] - [ -0.0000563000000000, 0.0000325000000000, 0.0012959500000000 ] - [ 0.0000290400000000, 0.0000167700000000, -0.0007004000000000 ] - [ -0.0000290400000000, 0.0000167700000000, -0.0007004000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004967500000000 ] - [ 0.0000000000000000, -0.0000335400000000, -0.0007004000000000 ] - [ -0.0002198300000000, -0.0001269200000000, -0.0008326500000000 ] - [ 0.0002198300000000, -0.0001269200000000, -0.0008326500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002563600000000 ] - [ 0.0000000000000000, 0.0002538400000000, -0.0008326500000000 ] - [ 0.0000000000000000, 0.0002548000000000, -0.0008308700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002552600000000 ] - [ 0.0002206600000000, -0.0001274000000000, -0.0008308700000000 ] - [ -0.0002206600000000, -0.0001274000000000, -0.0008308700000000 ] - [ 0.0000000000000000, -0.0000335600000000, -0.0007029600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004994200000000 ] - [ -0.0000290700000000, 0.0000167800000000, -0.0007029600000000 ] - [ 0.0000290700000000, 0.0000167800000000, -0.0007029600000000 ] - [ -0.0026837600000000, -0.0015494700000000, -0.0003472000000000 ] - [ 0.0026837600000000, -0.0015494700000000, -0.0003472000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004219600000000 ] - [ 0.0000000000000000, 0.0030989400000000, -0.0003472000000000 ] - [ 0.0009882800000000, 0.0005705800000000, 0.0003780800000000 ] - [ -0.0009882800000000, 0.0005705800000000, 0.0003780800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000135600000000 ] - [ 0.0000000000000000, -0.0011411700000000, 0.0003780800000000 ] - [ 0.0000000000000000, -0.0011379600000000, 0.0005277100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001653500000000 ] - [ -0.0009855100000000, 0.0005689800000000, 0.0005277100000000 ] - [ 0.0009855100000000, 0.0005689800000000, 0.0005277100000000 ] - [ 0.0000000000000000, 0.0031119800000000, -0.0003850500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004505700000000 ] - [ 0.0026950600000000, -0.0015559900000000, -0.0003850500000000 ] - [ -0.0026950600000000, -0.0015559900000000, -0.0003850500000000 ] - [ 0.0000000000000000, 0.0001436000000000, 0.0002136700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000453100000000 ] - [ 0.0001243600000000, -0.0000718000000000, 0.0002136700000000 ] - [ -0.0001243600000000, -0.0000718000000000, 0.0002136700000000 ] - [ 0.0000000000000000, 0.0000294800000000, 0.0002079100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001916900000000 ] - [ 0.0000255300000000, -0.0000147400000000, 0.0002079100000000 ] - [ -0.0000255300000000, -0.0000147400000000, 0.0002079100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0016026200000000 ] - [ 0.0000000000000000, -0.0000543400000000, 0.0000932300000000 ] - [ 0.0000470600000000, 0.0000271700000000, 0.0000932300000000 ] - [ -0.0000470600000000, 0.0000271700000000, 0.0000932300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001231500000000 ] - [ 0.0000000000000000, -0.0000542900000000, 0.0001190500000000 ] - [ 0.0000470200000000, 0.0000271500000000, 0.0001190500000000 ] - [ -0.0000470200000000, 0.0000271500000000, 0.0001190500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001702100000000 ] - [ 0.0000000000000000, -0.0000543500000000, 0.0001660000000000 ] - [ 0.0000470600000000, 0.0000271700000000, 0.0001660000000000 ] - [ -0.0000470600000000, 0.0000271700000000, 0.0001660000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0014559600000000 ] - [ 0.0000000000000000, -0.0000541700000000, -0.0000416000000000 ] - [ 0.0000469100000000, 0.0000270800000000, -0.0000416000000000 ] - [ -0.0000469100000000, 0.0000270800000000, -0.0000416000000000 ] - [ -0.0000255400000000, -0.0000147500000000, 0.0003593700000000 ] - [ 0.0000255400000000, -0.0000147500000000, 0.0003593700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003432000000000 ] - [ 0.0000000000000000, 0.0000294900000000, 0.0003593700000000 ] - [ -0.0001246700000000, -0.0000719800000000, 0.0001856400000000 ] - [ 0.0001246700000000, -0.0000719800000000, 0.0001856400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000168500000000 ] - [ 0.0000000000000000, 0.0001439600000000, 0.0001856400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.1697230900000000 ] - [ 0.0000000000000000, 0.0000385400000000, -0.0017058200000000 ] - [ -0.0000333800000000, -0.0000192700000000, -0.0017058200000000 ] - [ 0.0000333800000000, -0.0000192700000000, -0.0017058200000000 ] - [ -0.0000775500000000, -0.0000447700000000, 0.0004628100000000 ] - [ 0.0000775500000000, -0.0000447700000000, 0.0004628100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002901900000000 ] - [ 0.0000000000000000, 0.0000895400000000, 0.0004628100000000 ] - [ 0.0000000000000000, 0.0000897700000000, 0.0004629100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002903600000000 ] - [ 0.0000777400000000, -0.0000448800000000, 0.0004629100000000 ] - [ -0.0000777400000000, -0.0000448800000000, 0.0004629100000000 ]