# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/ec6b4015-ed70-4ad4-909d-1e9820470c68/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 YI3 / R-3 (148) / materials id 571442](https://mdr.nims.go.jp/datasets/072df8c0-54a7-44bc-8919-299c8a5c61c0) ## 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-3" number: 148 Hall_symbol: "-R 3"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: - [ 3.729661836666670, 2.153321179999998, 6.969988416666659 ] # a - [ -3.729661763333330, 2.153321309999998, 6.969988416666659 ] # b - [ -0.000000073333330, -4.306642490000002, 6.969988416666659 ] # c points: - symbol: Y # 1 coordinates: [ 0.166402280000000, 0.166402270000001, 0.166402280000000 ] mass: 88.905850 - symbol: Y # 2 coordinates: [ 0.833597720000000, 0.833597730000002, 0.833597720000000 ] mass: 88.905850 - symbol: I # 3 coordinates: [ 0.237573620000000, 0.583045920000002, 0.930405640000000 ] mass: 126.904470 - symbol: I # 4 coordinates: [ 0.069594360000000, 0.762426380000001, 0.416954080000000 ] mass: 126.904470 - symbol: I # 5 coordinates: [ 0.416954080000000, 0.069594360000001, 0.762426380000000 ] mass: 126.904470 - symbol: I # 6 coordinates: [ 0.762426380000000, 0.416954080000001, 0.069594360000000 ] mass: 126.904470 - symbol: I # 7 coordinates: [ 0.583045920000000, 0.930405640000002, 0.237573620000000 ] mass: 126.904470 - symbol: I # 8 coordinates: [ 0.930405640000000, 0.237573620000002, 0.583045920000000 ] mass: 126.904470 reciprocal_lattice: # without 2pi - [ 0.134060414011530, 0.077399813027488, 0.047824087129939 ] # a* - [ -0.134060411313705, 0.077399817593039, 0.047824087129939 ] # b* - [ -0.000000002697825, -0.154799630620527, 0.047824087129939 ] # c*unit_cell: lattice: - [ 7.459323600000000, -0.000000130000000, 0.000000000000000 ] # a - [ -3.729661690000000, 6.459963800000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 20.909965249999999 ] # c points: - symbol: Y # 1 coordinates: [ 0.666666670000000, 0.333333330000000, 0.499735610000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 2 coordinates: [ 0.333333330000000, 0.666666670000000, 0.500264390000000 ] mass: 88.905850 reduced_to: 2 - symbol: Y # 3 coordinates: [ 0.333333330000000, 0.666666670000000, 0.833068950000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 4 coordinates: [ 0.000000000000000, 0.000000000000000, 0.833597720000000 ] mass: 88.905850 reduced_to: 2 - symbol: Y # 5 coordinates: [ 0.000000000000000, 0.000000000000000, 0.166402280000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 6 coordinates: [ 0.666666670000000, 0.333333330000000, 0.166931050000000 ] mass: 88.905850 reduced_to: 2 - symbol: I # 7 coordinates: [ 0.653898560000000, 0.653269420000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 7 - symbol: I # 8 coordinates: [ 0.653269420000000, 0.999370860000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 8 - symbol: I # 9 coordinates: [ 0.000629140000000, 0.653898560000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 9 - symbol: I # 10 coordinates: [ 0.346101440000000, 0.346730580000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 10 - symbol: I # 11 coordinates: [ 0.999370860000000, 0.346101440000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 11 - symbol: I # 12 coordinates: [ 0.346730580000000, 0.000629140000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 12 - symbol: I # 13 coordinates: [ 0.320565220000000, 0.986602750000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 7 - symbol: I # 14 coordinates: [ 0.319936080000000, 0.332704190000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 8 - symbol: I # 15 coordinates: [ 0.667295810000000, 0.987231890000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 9 - symbol: I # 16 coordinates: [ 0.012768110000000, 0.680063920000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 10 - symbol: I # 17 coordinates: [ 0.666037520000000, 0.679434780000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 11 - symbol: I # 18 coordinates: [ 0.013397250000000, 0.333962480000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 12 - symbol: I # 19 coordinates: [ 0.987231890000000, 0.319936080000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 7 - symbol: I # 20 coordinates: [ 0.986602750000000, 0.666037520000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 8 - symbol: I # 21 coordinates: [ 0.333962480000000, 0.320565220000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 9 - symbol: I # 22 coordinates: [ 0.679434780000000, 0.013397250000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 10 - symbol: I # 23 coordinates: [ 0.332704190000000, 0.012768110000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 11 - symbol: I # 24 coordinates: [ 0.680063920000000, 0.667295810000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 12supercell: lattice: - [ 14.918647200000001, -0.000000260000000, 0.000000000000000 ] # a - [ -7.459323380000000, 12.919927599999999, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 20.909965249999999 ] # c points: - symbol: Y # 1 coordinates: [ 0.333333335000000, 0.166666665000000, 0.499735610000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 2 coordinates: [ 0.833333335000000, 0.166666665000000, 0.499735610000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 3 coordinates: [ 0.333333335000000, 0.666666665000000, 0.499735610000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 4 coordinates: [ 0.833333335000000, 0.666666665000000, 0.499735610000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 5 coordinates: [ 0.166666665000000, 0.333333335000000, 0.500264390000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 6 coordinates: [ 0.666666665000000, 0.333333335000000, 0.500264390000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 7 coordinates: [ 0.166666665000000, 0.833333335000000, 0.500264390000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 8 coordinates: [ 0.666666665000000, 0.833333335000000, 0.500264390000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 9 coordinates: [ 0.166666665000000, 0.333333335000000, 0.833068950000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 10 coordinates: [ 0.666666665000000, 0.333333335000000, 0.833068950000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 11 coordinates: [ 0.166666665000000, 0.833333335000000, 0.833068950000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 12 coordinates: [ 0.666666665000000, 0.833333335000000, 0.833068950000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 13 coordinates: [ 0.000000000000000, 0.000000000000000, 0.833597720000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 14 coordinates: [ 0.500000000000000, 0.000000000000000, 0.833597720000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 15 coordinates: [ 0.000000000000000, 0.500000000000000, 0.833597720000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 16 coordinates: [ 0.500000000000000, 0.500000000000000, 0.833597720000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 17 coordinates: [ 0.000000000000000, 0.000000000000000, 0.166402280000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 18 coordinates: [ 0.500000000000000, 0.000000000000000, 0.166402280000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 19 coordinates: [ 0.000000000000000, 0.500000000000000, 0.166402280000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 20 coordinates: [ 0.500000000000000, 0.500000000000000, 0.166402280000000 ] mass: 88.905850 reduced_to: 1 - symbol: Y # 21 coordinates: [ 0.333333335000000, 0.166666665000000, 0.166931050000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 22 coordinates: [ 0.833333335000000, 0.166666665000000, 0.166931050000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 23 coordinates: [ 0.333333335000000, 0.666666665000000, 0.166931050000000 ] mass: 88.905850 reduced_to: 5 - symbol: Y # 24 coordinates: [ 0.833333335000000, 0.666666665000000, 0.166931050000000 ] mass: 88.905850 reduced_to: 5 - symbol: I # 25 coordinates: [ 0.326949280000000, 0.326634710000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 26 coordinates: [ 0.826949280000000, 0.326634710000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 27 coordinates: [ 0.326949280000000, 0.826634710000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 28 coordinates: [ 0.826949280000000, 0.826634710000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 29 coordinates: [ 0.326634710000000, 0.499685430000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 30 coordinates: [ 0.826634710000000, 0.499685430000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 31 coordinates: [ 0.326634710000000, 0.999685430000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 32 coordinates: [ 0.826634710000000, 0.999685430000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 33 coordinates: [ 0.000314570000000, 0.326949280000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 34 coordinates: [ 0.500314570000000, 0.326949280000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 35 coordinates: [ 0.000314570000000, 0.826949280000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 36 coordinates: [ 0.500314570000000, 0.826949280000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 37 coordinates: [ 0.173050720000000, 0.173365290000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 38 coordinates: [ 0.673050720000000, 0.173365290000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 39 coordinates: [ 0.173050720000000, 0.673365290000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 40 coordinates: [ 0.673050720000000, 0.673365290000000, 0.416324940000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 41 coordinates: [ 0.499685430000000, 0.173050720000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 42 coordinates: [ 0.999685430000000, 0.173050720000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 43 coordinates: [ 0.499685430000000, 0.673050720000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 44 coordinates: [ 0.999685430000000, 0.673050720000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 45 coordinates: [ 0.173365290000000, 0.000314570000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 46 coordinates: [ 0.673365290000000, 0.000314570000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 47 coordinates: [ 0.173365290000000, 0.500314570000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 48 coordinates: [ 0.673365290000000, 0.500314570000000, 0.583675060000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 49 coordinates: [ 0.160282610000000, 0.493301375000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 50 coordinates: [ 0.660282610000000, 0.493301375000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 51 coordinates: [ 0.160282610000000, 0.993301375000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 52 coordinates: [ 0.660282610000000, 0.993301375000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 53 coordinates: [ 0.159968040000000, 0.166352095000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 54 coordinates: [ 0.659968040000000, 0.166352095000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 55 coordinates: [ 0.159968040000000, 0.666352095000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 56 coordinates: [ 0.659968040000000, 0.666352095000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 57 coordinates: [ 0.333647905000000, 0.493615945000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 58 coordinates: [ 0.833647905000000, 0.493615945000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 59 coordinates: [ 0.333647905000000, 0.993615945000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 60 coordinates: [ 0.833647905000000, 0.993615945000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 61 coordinates: [ 0.006384055000000, 0.340031960000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 62 coordinates: [ 0.506384055000000, 0.340031960000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 63 coordinates: [ 0.006384055000000, 0.840031960000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 64 coordinates: [ 0.506384055000000, 0.840031960000000, 0.749658280000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 65 coordinates: [ 0.333018760000000, 0.339717390000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 66 coordinates: [ 0.833018760000000, 0.339717390000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 67 coordinates: [ 0.333018760000000, 0.839717390000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 68 coordinates: [ 0.833018760000000, 0.839717390000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 69 coordinates: [ 0.006698625000000, 0.166981240000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 70 coordinates: [ 0.506698625000000, 0.166981240000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 71 coordinates: [ 0.006698625000000, 0.666981240000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 72 coordinates: [ 0.506698625000000, 0.666981240000000, 0.917008390000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 73 coordinates: [ 0.493615945000000, 0.159968040000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 74 coordinates: [ 0.993615945000000, 0.159968040000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 75 coordinates: [ 0.493615945000000, 0.659968040000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 76 coordinates: [ 0.993615945000000, 0.659968040000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 25 - symbol: I # 77 coordinates: [ 0.493301375000000, 0.333018760000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 78 coordinates: [ 0.993301375000000, 0.333018760000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 79 coordinates: [ 0.493301375000000, 0.833018760000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 80 coordinates: [ 0.993301375000000, 0.833018760000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 29 - symbol: I # 81 coordinates: [ 0.166981240000000, 0.160282610000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 82 coordinates: [ 0.666981240000000, 0.160282610000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 83 coordinates: [ 0.166981240000000, 0.660282610000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 84 coordinates: [ 0.666981240000000, 0.660282610000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 33 - symbol: I # 85 coordinates: [ 0.339717390000000, 0.006698625000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 86 coordinates: [ 0.839717390000000, 0.006698625000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 87 coordinates: [ 0.339717390000000, 0.506698625000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 88 coordinates: [ 0.839717390000000, 0.506698625000000, 0.082991610000000 ] mass: 126.904470 reduced_to: 37 - symbol: I # 89 coordinates: [ 0.166352095000000, 0.006384055000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 90 coordinates: [ 0.666352095000000, 0.006384055000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 91 coordinates: [ 0.166352095000000, 0.506384055000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 92 coordinates: [ 0.666352095000000, 0.506384055000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 41 - symbol: I # 93 coordinates: [ 0.340031960000000, 0.333647905000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 94 coordinates: [ 0.840031960000000, 0.333647905000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 95 coordinates: [ 0.340031960000000, 0.833647905000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 45 - symbol: I # 96 coordinates: [ 0.840031960000000, 0.833647905000000, 0.250341720000000 ] mass: 126.904470 reduced_to: 45born_effective_charge:- # 1 (Y) - [ 3.904127110000000, -0.005930320000000, 0.000000000000000 ] - [ 0.005930320000000, 3.904127110000000, -0.000000000000000 ] - [ -0.000000000000000, -0.000000000000000, 2.378651190000000 ]- # 2 (Y) - [ 3.904127110000000, -0.005930320000000, 0.000000000000000 ] - [ 0.005930320000000, 3.904127110000000, -0.000000000000000 ] - [ -0.000000000000000, -0.000000000000000, 2.378651190000000 ]- # 3 (I) - [ -1.617392730000000, 0.542303610000000, -0.161327300000000 ] - [ 0.538350060000000, -0.985358670000000, -0.281549430000000 ] - [ -0.193999410000000, -0.296714740000000, -0.792883730000000 ]- # 4 (I) - [ -0.675430419545366, 0.005492132936837, 0.324492608833903 ] - [ 0.001538584080970, -1.927320980454634, 0.001061175024403 ] - [ 0.353962207490955, -0.019651047543101, -0.792883730000000 ]- # 5 (I) - [ -1.611303950457005, -0.541865418903781, -0.163165308833903 ] - [ -0.545818968109709, -0.991447449542995, 0.280488254975597 ] - [ -0.159962797490954, 0.316365787543101, -0.792883730000000 ]- # 6 (I) - [ -1.617392730000000, 0.542303610000000, -0.161327300000000 ] - [ 0.538350060000000, -0.985358670000000, -0.281549430000000 ] - [ -0.193999410000000, -0.296714740000000, -0.792883730000000 ]- # 7 (I) - [ -1.611303950457005, -0.541865418903781, -0.163165308833903 ] - [ -0.545818968109709, -0.991447449542995, 0.280488254975597 ] - [ -0.159962797490954, 0.316365787543101, -0.792883730000000 ]- # 8 (I) - [ -0.675430419545366, 0.005492132936837, 0.324492608833903 ] - [ 0.001538584080970, -1.927320980454634, 0.001061175024403 ] - [ 0.353962207490955, -0.019651047543101, -0.792883730000000 ]dielectric_constant: - [ 4.679825570000000, 0.000003050000000, 0.000000000000000 ] - [ -0.000003050000000, 4.679825560000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 4.139666600000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, -0.0000000001742785, 0.0000000000000000 ] forces: - [ -0.0698565700000000, -0.0000995900000000, 0.0000166200000000 ] - [ 0.0042660700000000, 0.0000047200000000, 0.0000078400000000 ] - [ 0.0005638600000000, -0.0021399500000000, 0.0000302200000000 ] - [ 0.0005553000000000, 0.0021398800000000, 0.0000311800000000 ] - [ 0.0092129000000000, -0.0076717800000000, -0.0027021200000000 ] - [ 0.0093326000000000, 0.0077083100000000, -0.0026354600000000 ] - [ -0.0040465100000000, 0.0000467300000000, 0.0052691700000000 ] - [ 0.0000051700000000, -0.0000021800000000, -0.0000228600000000 ] - [ 0.0002996300000000, -0.0002436200000000, -0.0005556900000000 ] - [ -0.0000447300000000, 0.0004474000000000, 0.0006173100000000 ] - [ -0.0004729400000000, -0.0001968600000000, -0.0000514400000000 ] - [ 0.0002747500000000, 0.0000499600000000, 0.0000035500000000 ] - [ 0.0002549800000000, 0.0003971300000000, -0.0004335600000000 ] - [ -0.0000686100000000, -0.0005839200000000, 0.0004771000000000 ] - [ 0.0004828200000000, 0.0000004400000000, -0.0000136600000000 ] - [ -0.0007584100000000, 0.0001875800000000, -0.0000854500000000 ] - [ -0.0000466200000000, 0.0004423300000000, 0.0005080800000000 ] - [ 0.0002984600000000, -0.0002492300000000, -0.0004059200000000 ] - [ 0.0002747800000000, -0.0000498300000000, 0.0000136100000000 ] - [ -0.0004711600000000, -0.0002011600000000, -0.0000607000000000 ] - [ -0.0009262700000000, -0.0000003700000000, -0.0000039500000000 ] - [ 0.0007692100000000, -0.0000578800000000, 0.0001800900000000 ] - [ 0.0000045000000000, -0.0003826000000000, 0.0000274800000000 ] - [ 0.0001045400000000, 0.0004410100000000, -0.0002176000000000 ] - [ 0.0057045700000000, -0.0074180000000000, -0.0068066100000000 ] - [ -0.0023200800000000, 0.0004929900000000, -0.0001700800000000 ] - [ 0.0001292400000000, 0.0006669200000000, 0.0000415000000000 ] - [ 0.0001894900000000, -0.0000933000000000, -0.0002219200000000 ] - [ 0.0001015500000000, 0.0018210200000000, -0.0001833800000000 ] - [ -0.0005106700000000, -0.0018127800000000, 0.0005415400000000 ] - [ 0.0072367400000000, -0.0057874100000000, -0.0086863900000000 ] - [ -0.0001375800000000, 0.0000268600000000, 0.0003666600000000 ] - [ -0.0025697600000000, -0.0000160000000000, -0.0001244200000000 ] - [ 0.0053469100000000, 0.0080201900000000, -0.0069195600000000 ] - [ -0.0001435000000000, -0.0001829600000000, 0.0000769500000000 ] - [ -0.0000840800000000, 0.0005736400000000, -0.0001893200000000 ] - [ 0.0175620200000000, 0.0019623800000000, 0.0152945300000000 ] - [ -0.0020297500000000, 0.0002276500000000, 0.0001531100000000 ] - [ -0.0002564500000000, 0.0000706800000000, -0.0003684200000000 ] - [ 0.0000919700000000, -0.0005509000000000, -0.0001284700000000 ] - [ 0.0184934400000000, -0.0023722500000000, 0.0157990600000000 ] - [ -0.0017551000000000, -0.0007212500000000, 0.0001390100000000 ] - [ 0.0003693800000000, 0.0000761200000000, -0.0001674000000000 ] - [ 0.0000248600000000, -0.0005547600000000, -0.0003910300000000 ] - [ 0.0067013500000000, 0.0056481700000000, -0.0086779300000000 ] - [ -0.0006997000000000, -0.0000175500000000, 0.0003406700000000 ] - [ -0.0010675200000000, 0.0018304200000000, 0.0005124900000000 ] - [ -0.0004432300000000, -0.0018265500000000, -0.0002270600000000 ] - [ -0.0000650700000000, 0.0003645800000000, 0.0000448100000000 ] - [ 0.0002237000000000, 0.0001560900000000, -0.0001072200000000 ] - [ 0.0002392500000000, 0.0002101200000000, 0.0000222500000000 ] - [ -0.0000139400000000, 0.0003665800000000, -0.0000764100000000 ] - [ 0.0000258600000000, 0.0000532300000000, 0.0003208500000000 ] - [ 0.0006008400000000, 0.0000827100000000, -0.0004447600000000 ] - [ 0.0002509200000000, 0.0000735500000000, 0.0000597100000000 ] - [ 0.0003132800000000, 0.0000529600000000, 0.0000162600000000 ] - [ 0.0000404500000000, 0.0001178900000000, 0.0003354100000000 ] - [ -0.0003697800000000, 0.0001940100000000, -0.0000906000000000 ] - [ -0.0001528000000000, 0.0003716500000000, -0.0001274200000000 ] - [ -0.0003163100000000, 0.0001284300000000, 0.0000321400000000 ] - [ -0.0002237900000000, -0.0001728300000000, 0.0000813200000000 ] - [ -0.0000567300000000, -0.0004782500000000, -0.0001457300000000 ] - [ 0.0000833600000000, -0.0002571400000000, 0.0001613800000000 ] - [ -0.0002042300000000, -0.0002084000000000, 0.0000021000000000 ] - [ 0.0003608700000000, -0.0001704500000000, 0.0000350000000000 ] - [ 0.0000383600000000, -0.0003121300000000, -0.0000904100000000 ] - [ 0.0002853500000000, -0.0001112600000000, -0.0000958800000000 ] - [ 0.0000445600000000, -0.0003192000000000, 0.0000376300000000 ] - [ -0.0003727300000000, -0.0000711500000000, 0.0001249600000000 ] - [ -0.0002292800000000, -0.0000217700000000, -0.0001354600000000 ] - [ -0.0002860600000000, -0.0000313600000000, -0.0000325200000000 ] - [ -0.0002494800000000, -0.0000724600000000, -0.0000393000000000 ] - [ 0.0003422300000000, 0.0004638300000000, 0.0003475900000000 ] - [ -0.0000654000000000, 0.0000849900000000, -0.0002741100000000 ] - [ 0.0000912100000000, 0.0002996000000000, -0.0000609900000000 ] - [ 0.0000539000000000, 0.0002943400000000, 0.0000467500000000 ] - [ 0.0003995100000000, 0.0000475200000000, -0.0000335100000000 ] - [ 0.0002186500000000, 0.0001107400000000, 0.0000260200000000 ] - [ 0.0002498100000000, 0.0001692200000000, 0.0000940700000000 ] - [ 0.0002732500000000, -0.0001524100000000, 0.0000033600000000 ] - [ -0.0000523100000000, 0.0002664900000000, 0.0000327900000000 ] - [ -0.0003924900000000, 0.0001654700000000, 0.0000171500000000 ] - [ -0.0001924300000000, 0.0002603800000000, 0.0000221900000000 ] - [ -0.0001098300000000, 0.0002135200000000, 0.0000533200000000 ] - [ 0.0000609100000000, -0.0002688500000000, 0.0000791000000000 ] - [ -0.0001937500000000, -0.0003145400000000, -0.0000692900000000 ] - [ -0.0000863300000000, -0.0002344400000000, 0.0000576300000000 ] - [ -0.0001591300000000, -0.0002757600000000, 0.0000300300000000 ] - [ 0.0002402800000000, -0.0000575200000000, -0.0004017100000000 ] - [ 0.0000444700000000, -0.0003039400000000, 0.0000537800000000 ] - [ 0.0001665900000000, -0.0001237300000000, -0.0001303700000000 ] - [ 0.0003398900000000, -0.0003535200000000, 0.0001885400000000 ] - [ -0.0001221400000000, -0.0000759500000000, 0.0000072000000000 ] - [ -0.0003930100000000, -0.0000063600000000, 0.0000333100000000 ] - [ -0.0003478300000000, 0.0000277400000000, 0.0000349700000000 ] - [ -0.0002745000000000, -0.0002320500000000, -0.0000433000000000 ]- atom: 1 displacement: [ -0.0100000000000000, 0.0000000001742785, 0.0000000000000000 ] forces: - [ 0.0698637700000000, -0.0000992000000000, 0.0000286800000000 ] - [ -0.0042671600000000, -0.0000075300000000, 0.0000381900000000 ] - [ -0.0005661400000000, 0.0021463600000000, 0.0000144200000000 ] - [ -0.0005538000000000, -0.0021342900000000, 0.0000162700000000 ] - [ -0.0092819400000000, 0.0077374600000000, 0.0026732100000000 ] - [ -0.0092626100000000, -0.0076430300000000, 0.0025741800000000 ] - [ 0.0040473900000000, -0.0000111000000000, -0.0053147000000000 ] - [ -0.0000052100000000, -0.0000022400000000, -0.0000225800000000 ] - [ -0.0002983500000000, 0.0002428900000000, 0.0005618700000000 ] - [ 0.0000471400000000, -0.0004483000000000, -0.0006100700000000 ] - [ 0.0004710400000000, 0.0001958600000000, 0.0000574500000000 ] - [ -0.0002744400000000, -0.0000498500000000, 0.0000032700000000 ] - [ -0.0002539000000000, -0.0003979200000000, 0.0004045300000000 ] - [ 0.0000693400000000, 0.0005843200000000, -0.0005044500000000 ] - [ -0.0004828800000000, 0.0000002800000000, -0.0000135500000000 ] - [ 0.0007561800000000, -0.0001860100000000, 0.0000584600000000 ] - [ 0.0000452000000000, -0.0004422900000000, -0.0004813600000000 ] - [ -0.0002996200000000, 0.0002484300000000, 0.0004346600000000 ] - [ -0.0002744200000000, 0.0000502200000000, 0.0000132900000000 ] - [ 0.0004728400000000, 0.0002027900000000, 0.0000874600000000 ] - [ 0.0009288000000000, -0.0000004200000000, -0.0000037800000000 ] - [ -0.0007689300000000, 0.0000572100000000, -0.0001871200000000 ] - [ -0.0000053900000000, 0.0003844400000000, -0.0000334700000000 ] - [ -0.0001048900000000, -0.0004412600000000, 0.0002112400000000 ] - [ -0.0055216800000000, 0.0080593000000000, 0.0068477300000000 ] - [ 0.0024953600000000, 0.0000399400000000, 0.0001353400000000 ] - [ 0.0000552600000000, -0.0001323800000000, -0.0000736100000000 ] - [ -0.0000088200000000, 0.0006285100000000, 0.0001864600000000 ] - [ 0.0004546000000000, -0.0017159600000000, 0.0002157800000000 ] - [ 0.0010584400000000, 0.0019148300000000, -0.0005059700000000 ] - [ -0.0066974400000000, 0.0058123800000000, 0.0086579500000000 ] - [ 0.0006932700000000, 0.0000876000000000, -0.0003323400000000 ] - [ 0.0022003900000000, 0.0004373800000000, 0.0001590300000000 ] - [ -0.0057211100000000, -0.0074875000000000, 0.0068753800000000 ] - [ -0.0002339500000000, 0.0006050900000000, -0.0000451000000000 ] - [ -0.0002895900000000, -0.0001496900000000, 0.0002249100000000 ] - [ -0.0184184300000000, -0.0024747900000000, -0.0158433100000000 ] - [ 0.0018487800000000, -0.0007640900000000, -0.0001165900000000 ] - [ 0.0000793600000000, -0.0006123300000000, 0.0004031200000000 ] - [ -0.0002725900000000, 0.0000139400000000, 0.0001638500000000 ] - [ -0.0174512600000000, 0.0019711600000000, -0.0152538200000000 ] - [ 0.0021285700000000, 0.0002965900000000, -0.0001749700000000 ] - [ 0.0000044600000000, -0.0005007400000000, 0.0001321900000000 ] - [ 0.0003448500000000, 0.0001244900000000, 0.0003568500000000 ] - [ -0.0072399100000000, -0.0058459200000000, 0.0087072700000000 ] - [ 0.0001431000000000, -0.0000914300000000, -0.0003748600000000 ] - [ 0.0005194000000000, -0.0019517500000000, -0.0005482000000000 ] - [ -0.0001125300000000, 0.0017077100000000, 0.0001945600000000 ] - [ 0.0002660700000000, 0.0001809700000000, -0.0000990700000000 ] - [ -0.0000225900000000, 0.0003890800000000, 0.0000523500000000 ] - [ -0.0000376100000000, 0.0003351400000000, -0.0000766000000000 ] - [ 0.0002152800000000, 0.0001783500000000, 0.0000218800000000 ] - [ 0.0005511600000000, 0.0000742700000000, -0.0002845200000000 ] - [ -0.0000247000000000, 0.0000445500000000, 0.0004816700000000 ] - [ 0.0003257900000000, 0.0000535100000000, -0.0000229500000000 ] - [ 0.0002637700000000, 0.0000739300000000, 0.0000202800000000 ] - [ -0.0004377700000000, 0.0003171400000000, -0.0002983200000000 ] - [ -0.0000287600000000, 0.0002415900000000, 0.0001264700000000 ] - [ -0.0002451300000000, 0.0000654100000000, 0.0001614400000000 ] - [ -0.0000828100000000, 0.0003069100000000, 0.0000038900000000 ] - [ 0.0000445300000000, -0.0003909100000000, -0.0000454600000000 ] - [ -0.0001220000000000, -0.0000874100000000, 0.0001781000000000 ] - [ -0.0002612200000000, -0.0003054700000000, -0.0001239800000000 ] - [ 0.0000258600000000, -0.0003550900000000, 0.0000338800000000 ] - [ 0.0000112300000000, -0.0002760700000000, -0.0000894800000000 ] - [ 0.0003334800000000, -0.0001344800000000, 0.0000356500000000 ] - [ 0.0000865800000000, -0.0003354800000000, 0.0000413100000000 ] - [ 0.0003268300000000, -0.0001276200000000, -0.0000920700000000 ] - [ -0.0001998100000000, -0.0000277600000000, -0.0001792700000000 ] - [ -0.0003431700000000, -0.0000771900000000, 0.0000804200000000 ] - [ -0.0002860200000000, -0.0000678000000000, -0.0000223800000000 ] - [ -0.0003228100000000, -0.0000268700000000, -0.0000154100000000 ] - [ -0.0001646400000000, 0.0000994200000000, -0.0003842600000000 ] - [ 0.0002444000000000, 0.0004780800000000, 0.0002381400000000 ] - [ 0.0000878100000000, 0.0002630800000000, 0.0000247500000000 ] - [ 0.0001247000000000, 0.0002685600000000, -0.0000826900000000 ] - [ 0.0001723500000000, 0.0000514900000000, 0.0000886500000000 ] - [ 0.0003537300000000, -0.0000116700000000, 0.0000288400000000 ] - [ 0.0003226400000000, -0.0000706900000000, -0.0000396200000000 ] - [ 0.0002991800000000, 0.0002514900000000, 0.0000514200000000 ] - [ -0.0003195300000000, 0.0001800400000000, 0.0000218400000000 ] - [ 0.0000209600000000, 0.0002809200000000, 0.0000373600000000 ] - [ -0.0001794000000000, 0.0001857900000000, 0.0000322500000000 ] - [ -0.0002622800000000, 0.0002326800000000, 0.0000014700000000 ] - [ -0.0002627800000000, -0.0002765900000000, -0.0000245500000000 ] - [ -0.0000073900000000, -0.0002311500000000, 0.0001237800000000 ] - [ -0.0001145800000000, -0.0003114300000000, -0.0000030600000000 ] - [ -0.0000420500000000, -0.0002697800000000, 0.0000245000000000 ] - [ 0.0001578900000000, -0.0003774000000000, 0.0003695600000000 ] - [ 0.0003538500000000, -0.0001318800000000, -0.0000897900000000 ] - [ 0.0002315000000000, -0.0003123500000000, 0.0000940100000000 ] - [ 0.0000577400000000, -0.0000825700000000, -0.0002244200000000 ] - [ -0.0004556500000000, -0.0000524800000000, -0.0000395800000000 ] - [ -0.0001844700000000, -0.0001209400000000, -0.0000689300000000 ] - [ -0.0002283100000000, -0.0001550000000000, -0.0000720600000000 ] - [ -0.0003024600000000, 0.0001045100000000, 0.0000068100000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0678816200000000 ] - [ -0.0000152400000000, 0.0000006300000000, -0.0015596300000000 ] - [ 0.0000070800000000, -0.0000135100000000, -0.0015596300000000 ] - [ 0.0000081600000000, 0.0000128900000000, -0.0015596300000000 ] - [ -0.0026831000000000, -0.0045621000000000, -0.0095302800000000 ] - [ -0.0026093500000000, 0.0046046900000000, -0.0095302800000000 ] - [ 0.0052924500000000, -0.0000425800000000, -0.0095302800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0016366600000000 ] - [ -0.0004207300000000, 0.0003291600000000, 0.0007366200000000 ] - [ 0.0004954200000000, 0.0001997800000000, 0.0007366200000000 ] - [ -0.0000747000000000, -0.0005289400000000, 0.0007366200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002863900000000 ] - [ -0.0004191400000000, -0.0003257100000000, 0.0007321300000000 ] - [ 0.0004916400000000, -0.0002001300000000, 0.0007321300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002402000000000 ] - [ -0.0000725000000000, 0.0005258400000000, 0.0007321300000000 ] - [ 0.0006129000000000, 0.0002914700000000, 0.0007467300000000 ] - [ -0.0005588700000000, 0.0003850500000000, 0.0007467300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002971900000000 ] - [ -0.0000540300000000, -0.0006765200000000, 0.0007467300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0013074200000000 ] - [ 0.0001840400000000, -0.0001413100000000, 0.0003907900000000 ] - [ 0.0000303600000000, 0.0002300300000000, 0.0003907900000000 ] - [ -0.0002143900000000, -0.0000887300000000, 0.0003907900000000 ] - [ -0.0033403300000000, 0.0126655400000000, 0.0147532900000000 ] - [ 0.0000168600000000, 0.0001437100000000, 0.0007770300000000 ] - [ -0.0000340100000000, 0.0004092000000000, 0.0010134900000000 ] - [ 0.0002214600000000, 0.0003801200000000, 0.0004970600000000 ] - [ 0.0002173300000000, 0.0002531800000000, 0.0010585900000000 ] - [ 0.0004281300000000, 0.0000708600000000, 0.0008132500000000 ] - [ -0.0085049600000000, 0.0088757700000000, 0.0145253200000000 ] - [ 0.0001164100000000, 0.0000108600000000, 0.0005284300000000 ] - [ -0.0002754300000000, 0.0003353400000000, 0.0008132500000000 ] - [ -0.0034341700000000, -0.0118034000000000, 0.0145253200000000 ] - [ -0.0003279200000000, 0.0000616200000000, 0.0010585900000000 ] - [ -0.0000676100000000, 0.0000953800000000, 0.0005284300000000 ] - [ 0.0119391300000000, 0.0029276200000000, 0.0145253200000000 ] - [ 0.0001105900000000, -0.0003148000000000, 0.0010585900000000 ] - [ -0.0001527000000000, -0.0004062000000000, 0.0008132500000000 ] - [ -0.0000488000000000, -0.0001062400000000, 0.0005284300000000 ] - [ 0.0126388500000000, -0.0034399600000000, 0.0147532900000000 ] - [ 0.0003713900000000, -0.0001751500000000, 0.0010134900000000 ] - [ 0.0002184600000000, -0.0003818500000000, 0.0004970600000000 ] - [ 0.0001160300000000, -0.0000864600000000, 0.0007770300000000 ] - [ -0.0092985200000000, -0.0092255800000000, 0.0147532900000000 ] - [ -0.0004399200000000, 0.0000017400000000, 0.0004970600000000 ] - [ -0.0001328900000000, -0.0000572500000000, 0.0007770300000000 ] - [ -0.0003373700000000, -0.0002340600000000, 0.0010134900000000 ] - [ 0.0001682600000000, 0.0001542400000000, -0.0001933400000000 ] - [ 0.0000076900000000, 0.0001262800000000, -0.0002971300000000 ] - [ 0.0000691800000000, 0.0002327100000000, -0.0002343800000000 ] - [ -0.0000483500000000, 0.0002699500000000, -0.0002106300000000 ] - [ 0.0005778400000000, 0.0000456500000000, -0.0003600900000000 ] - [ 0.0003910500000000, 0.0000554500000000, -0.0001824300000000 ] - [ 0.0002848700000000, 0.0001652200000000, -0.0000294100000000 ] - [ 0.0002927300000000, -0.0000425500000000, -0.0000465100000000 ] - [ -0.0002435400000000, 0.0003109300000000, -0.0001824300000000 ] - [ -0.0002855200000000, 0.0001640900000000, -0.0000294100000000 ] - [ -0.0003284500000000, 0.0004776000000000, -0.0003600900000000 ] - [ -0.0001095200000000, 0.0002747900000000, -0.0000465100000000 ] - [ 0.0000006500000000, -0.0003293100000000, -0.0000294100000000 ] - [ -0.0002493900000000, -0.0005232400000000, -0.0003600900000000 ] - [ -0.0001475000000000, -0.0003663800000000, -0.0001824300000000 ] - [ -0.0001832100000000, -0.0002322400000000, -0.0000465100000000 ] - [ 0.0001669400000000, -0.0001762700000000, -0.0002343800000000 ] - [ 0.0000494500000000, -0.0002228400000000, -0.0001933400000000 ] - [ 0.0001055200000000, -0.0000698000000000, -0.0002971300000000 ] - [ 0.0002579600000000, -0.0000931000000000, -0.0002106300000000 ] - [ -0.0001132100000000, -0.0000564800000000, -0.0002971300000000 ] - [ -0.0002361200000000, -0.0000564400000000, -0.0002343800000000 ] - [ -0.0002177100000000, 0.0000685900000000, -0.0001933400000000 ] - [ -0.0002096100000000, -0.0001768500000000, -0.0002106300000000 ] - [ 0.0000418200000000, -0.0000304900000000, -0.0004522100000000 ] - [ -0.0000442400000000, 0.0002371500000000, -0.0001568400000000 ] - [ 0.0000163600000000, 0.0003512700000000, -0.0000681800000000 ] - [ 0.0001387000000000, 0.0002584600000000, -0.0000768300000000 ] - [ 0.0004172300000000, 0.0001884200000000, -0.0002698500000000 ] - [ 0.0003434100000000, 0.0001094400000000, -0.0000934700000000 ] - [ 0.0004157600000000, -0.0000672200000000, -0.0001886800000000 ] - [ 0.0003389900000000, -0.0000571600000000, -0.0001604600000000 ] - [ -0.0003717900000000, 0.0002671200000000, -0.0002698500000000 ] - [ -0.0001199900000000, 0.0003221500000000, -0.0001604600000000 ] - [ -0.0002664800000000, 0.0002426800000000, -0.0000934700000000 ] - [ -0.0001496600000000, 0.0003936700000000, -0.0001886800000000 ] - [ -0.0000454400000000, -0.0004555400000000, -0.0002698500000000 ] - [ -0.0002661000000000, -0.0003264500000000, -0.0001886800000000 ] - [ -0.0002189900000000, -0.0002649900000000, -0.0001604600000000 ] - [ -0.0000769300000000, -0.0003521200000000, -0.0000934700000000 ] - [ -0.0000473100000000, -0.0000209700000000, -0.0004522100000000 ] - [ 0.0002960200000000, -0.0001898100000000, -0.0000681800000000 ] - [ 0.0001544800000000, -0.0002493400000000, -0.0000768300000000 ] - [ 0.0002275000000000, -0.0000802600000000, -0.0001568400000000 ] - [ 0.0000054900000000, 0.0000514600000000, -0.0004522100000000 ] - [ -0.0002931800000000, -0.0000091100000000, -0.0000768300000000 ] - [ -0.0001832600000000, -0.0001568900000000, -0.0001568400000000 ] - [ -0.0003123900000000, -0.0001614600000000, -0.0000681800000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0679095700000000 ] - [ 0.0000152300000000, 0.0000011300000000, 0.0016052200000000 ] - [ -0.0000086000000000, 0.0000126300000000, 0.0016052200000000 ] - [ -0.0000066400000000, -0.0000137600000000, 0.0016052200000000 ] - [ 0.0026919800000000, 0.0045563800000000, 0.0094839400000000 ] - [ 0.0025999500000000, -0.0046095100000000, 0.0094839400000000 ] - [ -0.0052919300000000, 0.0000531300000000, 0.0094839400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0015904000000000 ] - [ 0.0004202100000000, -0.0003277100000000, -0.0007293500000000 ] - [ -0.0004939100000000, -0.0002000600000000, -0.0007293500000000 ] - [ 0.0000737000000000, 0.0005277700000000, -0.0007293500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002799800000000 ] - [ 0.0004189100000000, 0.0003242100000000, -0.0007596000000000 ] - [ -0.0004902300000000, 0.0002006800000000, -0.0007596000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002683500000000 ] - [ 0.0000713200000000, -0.0005248900000000, -0.0007596000000000 ] - [ -0.0006142000000000, -0.0002909200000000, -0.0007191900000000 ] - [ 0.0005590400000000, -0.0003864500000000, -0.0007191900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002690900000000 ] - [ 0.0000551600000000, 0.0006773700000000, -0.0007191900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0013162600000000 ] - [ -0.0001835100000000, 0.0001415300000000, -0.0003970800000000 ] - [ -0.0000308100000000, -0.0002296900000000, -0.0003970800000000 ] - [ 0.0002143200000000, 0.0000881600000000, -0.0003970800000000 ] - [ 0.0033318300000000, -0.0118145400000000, -0.0146208700000000 ] - [ 0.0001651600000000, 0.0003923600000000, -0.0008124400000000 ] - [ 0.0002127500000000, 0.0001298800000000, -0.0010481000000000 ] - [ -0.0000400800000000, 0.0001553700000000, -0.0005309100000000 ] - [ 0.0003389300000000, -0.0001455900000000, -0.0010236800000000 ] - [ 0.0001271200000000, 0.0000410100000000, -0.0007775000000000 ] - [ 0.0092355500000000, -0.0090852800000000, -0.0146527800000000 ] - [ 0.0004379900000000, 0.0001007500000000, -0.0004943200000000 ] - [ -0.0000990700000000, 0.0000895800000000, -0.0007775000000000 ] - [ 0.0032503000000000, 0.0125408600000000, -0.0146527800000000 ] - [ -0.0000433800000000, 0.0003663200000000, -0.0010236800000000 ] - [ -0.0003062500000000, 0.0003289400000000, -0.0004943200000000 ] - [ -0.0124858500000000, -0.0034555800000000, -0.0146527800000000 ] - [ -0.0002955500000000, -0.0002207200000000, -0.0010236800000000 ] - [ -0.0000280400000000, -0.0001305900000000, -0.0007775000000000 ] - [ -0.0001317400000000, -0.0004296900000000, -0.0004943200000000 ] - [ -0.0118976000000000, 0.0030218200000000, -0.0146208700000000 ] - [ 0.0000061100000000, -0.0002491900000000, -0.0010481000000000 ] - [ 0.0001545900000000, -0.0000429800000000, -0.0005309100000000 ] - [ 0.0002572100000000, -0.0003392200000000, -0.0008124400000000 ] - [ 0.0085657700000000, 0.0087927100000000, -0.0146208700000000 ] - [ -0.0001145100000000, -0.0001123900000000, -0.0005309100000000 ] - [ -0.0004223800000000, -0.0000531400000000, -0.0008124400000000 ] - [ -0.0002188600000000, 0.0001193000000000, -0.0010481000000000 ] - [ 0.0000327700000000, 0.0003903200000000, 0.0001396000000000 ] - [ 0.0001931000000000, 0.0004183200000000, 0.0002434300000000 ] - [ 0.0001318200000000, 0.0003121400000000, 0.0001807900000000 ] - [ 0.0002492100000000, 0.0002746600000000, 0.0001569500000000 ] - [ -0.0000018800000000, 0.0000808300000000, 0.0003961900000000 ] - [ 0.0001842600000000, 0.0000710800000000, 0.0002181000000000 ] - [ 0.0002914800000000, -0.0000385400000000, 0.0000650100000000 ] - [ 0.0002836300000000, 0.0001690700000000, 0.0000821800000000 ] - [ -0.0001536800000000, 0.0001240300000000, 0.0002181000000000 ] - [ -0.0001123600000000, 0.0002717000000000, 0.0000650100000000 ] - [ -0.0000690600000000, -0.0000420500000000, 0.0003961900000000 ] - [ -0.0002882300000000, 0.0001611000000000, 0.0000821800000000 ] - [ -0.0001791200000000, -0.0002331600000000, 0.0000650100000000 ] - [ 0.0000709400000000, -0.0000387900000000, 0.0003961900000000 ] - [ -0.0000305700000000, -0.0001951100000000, 0.0002181000000000 ] - [ 0.0000046000000000, -0.0003301700000000, 0.0000821800000000 ] - [ 0.0002044100000000, -0.0002702300000000, 0.0001807900000000 ] - [ 0.0003216500000000, -0.0002235400000000, 0.0001396000000000 ] - [ 0.0002657200000000, -0.0003763900000000, 0.0002434300000000 ] - [ 0.0001132600000000, -0.0003531600000000, 0.0001569500000000 ] - [ -0.0004588300000000, -0.0000419300000000, 0.0002434300000000 ] - [ -0.0003362300000000, -0.0000419100000000, 0.0001807900000000 ] - [ -0.0003544100000000, -0.0001667800000000, 0.0001396000000000 ] - [ -0.0003624700000000, 0.0000784900000000, 0.0001569500000000 ] - [ 0.0001372600000000, 0.0005933400000000, 0.0004152900000000 ] - [ 0.0002232600000000, 0.0003248800000000, 0.0001215200000000 ] - [ 0.0001622200000000, 0.0002109300000000, 0.0000326700000000 ] - [ 0.0000398000000000, 0.0003039000000000, 0.0000414300000000 ] - [ 0.0001546000000000, -0.0000904200000000, 0.0003242100000000 ] - [ 0.0002287400000000, -0.0000111800000000, 0.0001472500000000 ] - [ 0.0001564200000000, 0.0001657300000000, 0.0002424200000000 ] - [ 0.0002332100000000, 0.0001555900000000, 0.0002141900000000 ] - [ 0.0000010100000000, 0.0001791000000000, 0.0003242100000000 ] - [ -0.0002513500000000, 0.0001241800000000, 0.0002141900000000 ] - [ -0.0001046900000000, 0.0002036800000000, 0.0001472500000000 ] - [ -0.0002217300000000, 0.0000526000000000, 0.0002424200000000 ] - [ -0.0001556100000000, -0.0000886800000000, 0.0003242100000000 ] - [ 0.0000653200000000, -0.0002183200000000, 0.0002424200000000 ] - [ 0.0000181400000000, -0.0002797600000000, 0.0002141900000000 ] - [ -0.0001240500000000, -0.0001925000000000, 0.0001472500000000 ] - [ 0.0004452200000000, -0.0004155400000000, 0.0004152900000000 ] - [ 0.0001015600000000, -0.0002459600000000, 0.0000326700000000 ] - [ 0.0002432900000000, -0.0001864200000000, 0.0000414300000000 ] - [ 0.0001697300000000, -0.0003557900000000, 0.0001215200000000 ] - [ -0.0005824800000000, -0.0001778000000000, 0.0004152900000000 ] - [ -0.0002830900000000, -0.0001174800000000, 0.0000414300000000 ] - [ -0.0003929900000000, 0.0000309100000000, 0.0001215200000000 ] - [ -0.0002637900000000, 0.0000350200000000, 0.0000326700000000 ]- atom: 25 displacement: [ 0.0100000000000000, -0.0000000001742785, 0.0000000000000000 ] forces: - [ 0.0056205100000000, -0.0050302900000000, -0.0033694600000000 ] - [ -0.0024038200000000, -0.0009554100000000, -0.0000514500000000 ] - [ 0.0000347300000000, 0.0016491200000000, -0.0000991100000000 ] - [ 0.0000982400000000, -0.0003376400000000, 0.0001534200000000 ] - [ 0.0176634400000000, -0.0005471600000000, 0.0118991300000000 ] - [ -0.0019359200000000, -0.0007558500000000, 0.0001806800000000 ] - [ -0.0001657000000000, 0.0015022500000000, -0.0000870100000000 ] - [ 0.0001824500000000, -0.0003128100000000, 0.0000181100000000 ] - [ 0.0002515000000000, -0.0000363600000000, -0.0000423900000000 ] - [ -0.0001552500000000, -0.0000362600000000, -0.0001304900000000 ] - [ 0.0000019700000000, 0.0001757800000000, -0.0000693400000000 ] - [ -0.0000361600000000, -0.0000968300000000, 0.0000528800000000 ] - [ 0.0001711000000000, 0.0000595500000000, -0.0000716700000000 ] - [ -0.0001141400000000, 0.0000914100000000, -0.0001084100000000 ] - [ -0.0001351200000000, 0.0000453900000000, 0.0000755900000000 ] - [ 0.0000344000000000, -0.0001604600000000, -0.0001737600000000 ] - [ 0.0001219600000000, -0.0000984900000000, -0.0000784800000000 ] - [ -0.0001655400000000, 0.0000779400000000, 0.0000818500000000 ] - [ -0.0001148900000000, 0.0001101500000000, -0.0001344600000000 ] - [ 0.0001381000000000, -0.0000740200000000, -0.0000168900000000 ] - [ 0.0001622000000000, -0.0000262500000000, 0.0000517000000000 ] - [ -0.0000931700000000, -0.0000874000000000, -0.0001687100000000 ] - [ 0.0000137000000000, 0.0001853600000000, -0.0001218200000000 ] - [ -0.0000581200000000, -0.0000670600000000, 0.0000201200000000 ] - [ -0.0350862600000000, 0.0095439100000000, -0.0089191700000000 ] - [ 0.0007739700000000, 0.0000872000000000, 0.0000082300000000 ] - [ 0.0004057500000000, -0.0001225900000000, -0.0000614800000000 ] - [ -0.0000393600000000, 0.0003649000000000, -0.0000105300000000 ] - [ 0.0001827800000000, -0.0015105100000000, 0.0010432100000000 ] - [ 0.0004301000000000, 0.0002666500000000, -0.0001142500000000 ] - [ 0.0011896100000000, -0.0022397300000000, -0.0011444500000000 ] - [ 0.0003267700000000, 0.0003286500000000, 0.0000541200000000 ] - [ 0.0032717900000000, 0.0010316400000000, 0.0015842200000000 ] - [ 0.0017820600000000, 0.0005870800000000, -0.0016563600000000 ] - [ -0.0002784600000000, 0.0001439600000000, -0.0000596900000000 ] - [ -0.0002838000000000, 0.0000229200000000, 0.0000959800000000 ] - [ -0.0019016300000000, 0.0012165800000000, 0.0011222000000000 ] - [ 0.0009362400000000, -0.0004004300000000, 0.0000296900000000 ] - [ 0.0002873800000000, -0.0007746500000000, 0.0000043800000000 ] - [ -0.0002373800000000, -0.0001565700000000, 0.0000164600000000 ] - [ 0.0036913800000000, -0.0011057400000000, -0.0003261400000000 ] - [ 0.0035695000000000, 0.0015373600000000, 0.0001873300000000 ] - [ 0.0000573400000000, -0.0002515900000000, -0.0001023600000000 ] - [ 0.0001476000000000, -0.0004012200000000, 0.0000610400000000 ] - [ -0.0005532600000000, -0.0013346700000000, 0.0000499600000000 ] - [ 0.0000293100000000, 0.0003326600000000, -0.0001345800000000 ] - [ 0.0016749700000000, -0.0026319400000000, -0.0000549100000000 ] - [ 0.0000713300000000, 0.0002589000000000, -0.0001550200000000 ] - [ 0.0000714800000000, 0.0002800500000000, -0.0000277800000000 ] - [ 0.0001184300000000, 0.0003050400000000, 0.0000266100000000 ] - [ 0.0000925800000000, 0.0002696600000000, -0.0000190000000000 ] - [ 0.0001377000000000, 0.0002609600000000, -0.0000129300000000 ] - [ 0.0003532700000000, 0.0001948200000000, -0.0001381200000000 ] - [ 0.0002735300000000, 0.0000495800000000, 0.0000615200000000 ] - [ 0.0003207900000000, 0.0000277300000000, -0.0000070900000000 ] - [ 0.0002902600000000, 0.0001063100000000, 0.0000111400000000 ] - [ -0.0000937900000000, 0.0000624100000000, -0.0000457200000000 ] - [ -0.0001420900000000, 0.0002398200000000, 0.0000181100000000 ] - [ -0.0001831000000000, 0.0001668900000000, 0.0000751800000000 ] - [ -0.0002399000000000, 0.0002473700000000, -0.0000273000000000 ] - [ -0.0001662900000000, -0.0003259400000000, -0.0000629200000000 ] - [ 0.0001188700000000, -0.0002340600000000, 0.0002699600000000 ] - [ -0.0000903000000000, -0.0002778000000000, 0.0000643700000000 ] - [ -0.0000664900000000, -0.0003061600000000, -0.0000024400000000 ] - [ 0.0001568800000000, -0.0002346100000000, -0.0000100900000000 ] - [ 0.0002660500000000, -0.0001986500000000, 0.0000019300000000 ] - [ 0.0001907400000000, -0.0002554400000000, 0.0000032700000000 ] - [ 0.0001652800000000, -0.0002254000000000, -0.0000279400000000 ] - [ -0.0003235100000000, -0.0000430000000000, 0.0000029300000000 ] - [ -0.0002805400000000, -0.0000660900000000, -0.0000037500000000 ] - [ -0.0002783300000000, -0.0000913700000000, -0.0000280400000000 ] - [ -0.0002884300000000, 0.0000126900000000, -0.0000053600000000 ] - [ 0.0000596600000000, 0.0002205900000000, -0.0001178600000000 ] - [ 0.0001075600000000, 0.0003478200000000, 0.0000645800000000 ] - [ 0.0000815200000000, 0.0003166100000000, 0.0000611400000000 ] - [ 0.0001263100000000, 0.0002564500000000, -0.0000241000000000 ] - [ 0.0002607400000000, 0.0000730700000000, 0.0000373800000000 ] - [ 0.0002847900000000, 0.0000493000000000, 0.0000596300000000 ] - [ 0.0002951100000000, -0.0000047300000000, 0.0000290100000000 ] - [ 0.0002774000000000, 0.0000821900000000, 0.0000391700000000 ] - [ -0.0002281600000000, 0.0002094700000000, 0.0000251400000000 ] - [ -0.0001200200000000, 0.0002446300000000, 0.0000465100000000 ] - [ -0.0001824300000000, 0.0001837300000000, 0.0000697700000000 ] - [ -0.0001967100000000, 0.0002288600000000, 0.0000288900000000 ] - [ -0.0001057800000000, -0.0002817300000000, 0.0000154900000000 ] - [ -0.0001077500000000, -0.0002391500000000, 0.0000641400000000 ] - [ -0.0001209300000000, -0.0002590100000000, 0.0000387100000000 ] - [ -0.0000511400000000, -0.0002920400000000, 0.0000513700000000 ] - [ 0.0001552100000000, -0.0002209000000000, 0.0000149600000000 ] - [ 0.0002593600000000, -0.0002061200000000, 0.0000045400000000 ] - [ 0.0002266300000000, -0.0002972500000000, 0.0000745700000000 ] - [ 0.0001755800000000, -0.0001845200000000, -0.0000534100000000 ] - [ -0.0002994700000000, -0.0000421000000000, -0.0000203000000000 ] - [ -0.0003122000000000, -0.0000628500000000, 0.0000934400000000 ] - [ -0.0002567700000000, -0.0001159500000000, -0.0000392500000000 ] - [ -0.0002958100000000, -0.0000385700000000, -0.0000080000000000 ]- atom: 25 displacement: [ -0.0100000000000000, 0.0000000001742785, 0.0000000000000000 ] forces: - [ -0.0056040400000000, 0.0048954800000000, 0.0033006900000000 ] - [ 0.0024117300000000, 0.0009617700000000, 0.0000962600000000 ] - [ -0.0000382800000000, -0.0016532200000000, 0.0001473900000000 ] - [ -0.0000994100000000, 0.0003361300000000, -0.0001087400000000 ] - [ -0.0183172400000000, 0.0005795500000000, -0.0125276700000000 ] - [ 0.0019430800000000, 0.0007464400000000, -0.0002252100000000 ] - [ 0.0001695800000000, -0.0015117600000000, 0.0000386200000000 ] - [ -0.0001831200000000, 0.0003171400000000, -0.0000637900000000 ] - [ -0.0002545900000000, 0.0000391500000000, 0.0000522000000000 ] - [ 0.0001559500000000, 0.0000355800000000, 0.0001361400000000 ] - [ -0.0000011000000000, -0.0001772300000000, 0.0000754900000000 ] - [ 0.0000354200000000, 0.0000970700000000, -0.0000472200000000 ] - [ -0.0001740600000000, -0.0000636500000000, 0.0000455200000000 ] - [ 0.0001149500000000, -0.0000906800000000, 0.0000802100000000 ] - [ 0.0001339700000000, -0.0000448600000000, -0.0001037700000000 ] - [ -0.0000316200000000, 0.0001606100000000, 0.0001471700000000 ] - [ -0.0001228100000000, 0.0000982900000000, 0.0001064000000000 ] - [ 0.0001658100000000, -0.0000781100000000, -0.0000538500000000 ] - [ 0.0001147400000000, -0.0001112200000000, 0.0001630600000000 ] - [ -0.0001380000000000, 0.0000739900000000, 0.0000451000000000 ] - [ -0.0001616800000000, 0.0000267500000000, -0.0000579600000000 ] - [ 0.0000925200000000, 0.0000880300000000, 0.0001639800000000 ] - [ -0.0000140400000000, -0.0001856100000000, 0.0001162500000000 ] - [ 0.0000580800000000, 0.0000671300000000, -0.0000259700000000 ] - [ 0.0359246800000000, -0.0088831300000000, 0.0096003400000000 ] - [ -0.0005943600000000, 0.0004508800000000, -0.0000414900000000 ] - [ -0.0002264000000000, 0.0006607700000000, 0.0000273900000000 ] - [ 0.0002207500000000, 0.0001717300000000, -0.0000229700000000 ] - [ 0.0003791900000000, 0.0016251200000000, -0.0010108200000000 ] - [ 0.0001245600000000, -0.0001538500000000, 0.0001483800000000 ] - [ -0.0006306900000000, 0.0023605100000000, 0.0011848100000000 ] - [ 0.0002288300000000, -0.0002187900000000, -0.0000210700000000 ] - [ -0.0036716100000000, -0.0006110900000000, -0.0015572800000000 ] - [ -0.0021508400000000, -0.0001644100000000, 0.0016725500000000 ] - [ -0.0000953400000000, 0.0002817200000000, 0.0000936500000000 ] - [ -0.0000906300000000, 0.0004018900000000, -0.0000623400000000 ] - [ 0.0017306000000000, -0.0017530400000000, -0.0010843200000000 ] - [ -0.0011211500000000, -0.0001362100000000, 0.0000033200000000 ] - [ -0.0004700700000000, 0.0002402300000000, 0.0000299000000000 ] - [ 0.0000562000000000, -0.0003810200000000, 0.0000176300000000 ] - [ -0.0032579600000000, 0.0006478900000000, 0.0002864000000000 ] - [ -0.0032460600000000, -0.0019901400000000, -0.0002267000000000 ] - [ 0.0003170500000000, -0.0001758400000000, 0.0000701900000000 ] - [ 0.0002278100000000, -0.0000219300000000, -0.0000946900000000 ] - [ -0.0000077800000000, 0.0012384700000000, -0.0000793900000000 ] - [ -0.0005863200000000, -0.0004489000000000, 0.0001008500000000 ] - [ -0.0022676900000000, 0.0025536500000000, 0.0000190100000000 ] - [ -0.0006165400000000, -0.0003640400000000, 0.0001218600000000 ] - [ 0.0001308600000000, 0.0002659200000000, -0.0000260800000000 ] - [ 0.0000823500000000, 0.0002416400000000, -0.0000800100000000 ] - [ 0.0001084300000000, 0.0002770800000000, -0.0000349700000000 ] - [ 0.0000637800000000, 0.0002849500000000, -0.0000405900000000 ] - [ 0.0002278800000000, -0.0000676800000000, 0.0001714100000000 ] - [ 0.0003037700000000, 0.0000776900000000, -0.0000258700000000 ] - [ 0.0002566700000000, 0.0000998500000000, 0.0000426400000000 ] - [ 0.0002874700000000, 0.0000208100000000, 0.0000243400000000 ] - [ -0.0003061200000000, 0.0003747300000000, 0.0000795300000000 ] - [ -0.0002566100000000, 0.0001967600000000, 0.0000172300000000 ] - [ -0.0002162900000000, 0.0002692900000000, -0.0000398600000000 ] - [ -0.0001583700000000, 0.0001892100000000, 0.0000627300000000 ] - [ -0.0000116600000000, -0.0002390100000000, 0.0000975900000000 ] - [ -0.0002927000000000, -0.0003298600000000, -0.0002265800000000 ] - [ -0.0000893000000000, -0.0002860600000000, -0.0000292400000000 ] - [ -0.0001123000000000, -0.0002582000000000, 0.0000377800000000 ] - [ 0.0002152000000000, -0.0002130400000000, -0.0000438800000000 ] - [ 0.0001067600000000, -0.0002485700000000, -0.0000553200000000 ] - [ 0.0001813500000000, -0.0001921100000000, -0.0000568500000000 ] - [ 0.0002080300000000, -0.0002214700000000, -0.0000260200000000 ] - [ -0.0002491600000000, -0.0000563700000000, -0.0000577300000000 ] - [ -0.0002931400000000, -0.0000334200000000, -0.0000498000000000 ] - [ -0.0002950200000000, -0.0000077700000000, -0.0000258500000000 ] - [ -0.0002851400000000, -0.0001123400000000, -0.0000484000000000 ] - [ 0.0001190000000000, 0.0003436600000000, 0.0000823400000000 ] - [ 0.0000714600000000, 0.0002161500000000, -0.0000998200000000 ] - [ 0.0000973200000000, 0.0002473000000000, -0.0000966200000000 ] - [ 0.0000523700000000, 0.0003075600000000, -0.0000110500000000 ] - [ 0.0003125500000000, 0.0000260100000000, 0.0000162500000000 ] - [ 0.0002886500000000, 0.0000499100000000, -0.0000062500000000 ] - [ 0.0002780700000000, 0.0001038100000000, 0.0000244400000000 ] - [ 0.0002960100000000, 0.0000170000000000, 0.0000140500000000 ] - [ -0.0001445000000000, 0.0002377200000000, 0.0000281000000000 ] - [ -0.0002528800000000, 0.0002024300000000, 0.0000067900000000 ] - [ -0.0001900500000000, 0.0002638400000000, -0.0000167100000000 ] - [ -0.0001761600000000, 0.0002184100000000, 0.0000244900000000 ] - [ -0.0000960000000000, -0.0002648300000000, 0.0000376400000000 ] - [ -0.0000937500000000, -0.0003078000000000, -0.0000110300000000 ] - [ -0.0000806500000000, -0.0002874500000000, 0.0000146100000000 ] - [ -0.0001509000000000, -0.0002544200000000, 0.0000017700000000 ] - [ 0.0002435100000000, -0.0002158900000000, -0.0000499500000000 ] - [ 0.0001392300000000, -0.0002305600000000, -0.0000402100000000 ] - [ 0.0001721500000000, -0.0001391000000000, -0.0001101500000000 ] - [ 0.0002230400000000, -0.0002520900000000, 0.0000180100000000 ] - [ -0.0002786000000000, -0.0000853300000000, -0.0000151500000000 ] - [ -0.0002652600000000, -0.0000647200000000, -0.0001294500000000 ] - [ -0.0003210600000000, -0.0000117800000000, 0.0000036600000000 ] - [ -0.0002823900000000, -0.0000890700000000, -0.0000274700000000 ]- atom: 25 displacement: [ -0.0049999998503029, 0.0086602541242721, 0.0000000000000000 ] forces: - [ -0.0093345500000000, 0.0149909900000000, 0.0120004500000000 ] - [ 0.0013952500000000, 0.0006231600000000, -0.0000494500000000 ] - [ 0.0003227800000000, -0.0020522400000000, 0.0002064400000000 ] - [ -0.0003597200000000, 0.0000032800000000, 0.0000545500000000 ] - [ -0.0071357100000000, 0.0022796700000000, -0.0034213600000000 ] - [ 0.0013984600000000, 0.0008569700000000, -0.0001641900000000 ] - [ 0.0003800300000000, -0.0025301400000000, -0.0001112400000000 ] - [ -0.0003364200000000, -0.0000763100000000, 0.0000960800000000 ] - [ 0.0000310400000000, 0.0000687000000000, -0.0002419600000000 ] - [ -0.0000910000000000, 0.0001096000000000, 0.0000324100000000 ] - [ 0.0000161800000000, -0.0001704900000000, 0.0001000100000000 ] - [ 0.0000285900000000, -0.0000201500000000, -0.0000412000000000 ] - [ -0.0000661400000000, 0.0002355500000000, -0.0000580600000000 ] - [ 0.0001209400000000, -0.0000661400000000, 0.0000753500000000 ] - [ 0.0001611200000000, -0.0001032400000000, -0.0001007400000000 ] - [ -0.0001868200000000, -0.0000536800000000, -0.0001432800000000 ] - [ -0.0001610200000000, 0.0000211700000000, -0.0000661100000000 ] - [ 0.0001624300000000, -0.0000763100000000, -0.0001220100000000 ] - [ 0.0001393400000000, -0.0000818700000000, 0.0000862600000000 ] - [ -0.0001225800000000, 0.0001313700000000, -0.0000045200000000 ] - [ -0.0000776800000000, 0.0001088300000000, -0.0001894700000000 ] - [ 0.0000095500000000, 0.0000937000000000, 0.0000333700000000 ] - [ 0.0000257100000000, -0.0002236600000000, 0.0000631100000000 ] - [ 0.0000263300000000, 0.0000077500000000, -0.0000834700000000 ] - [ 0.0257111800000000, -0.0256873300000000, -0.0092475800000000 ] - [ -0.0004079800000000, 0.0003452000000000, -0.0000653500000000 ] - [ -0.0004059300000000, 0.0007640300000000, 0.0000043400000000 ] - [ 0.0002391600000000, 0.0002051300000000, -0.0000081300000000 ] - [ -0.0004000500000000, 0.0019386800000000, -0.0016417900000000 ] - [ 0.0001598100000000, -0.0001181400000000, 0.0001015000000000 ] - [ -0.0007537400000000, 0.0034548400000000, 0.0015683000000000 ] - [ 0.0002634100000000, -0.0000633600000000, -0.0000547200000000 ] - [ -0.0026204100000000, -0.0001519900000000, -0.0011469500000000 ] - [ -0.0014788200000000, -0.0006629700000000, 0.0010417400000000 ] - [ 0.0000215600000000, 0.0003896700000000, 0.0000579600000000 ] - [ -0.0000754000000000, 0.0004503300000000, -0.0001076200000000 ] - [ 0.0021014900000000, -0.0011343100000000, 0.0010688000000000 ] - [ -0.0007178600000000, -0.0001945800000000, 0.0000042500000000 ] - [ -0.0007184700000000, 0.0005575300000000, 0.0000299100000000 ] - [ 0.0000795000000000, -0.0003363800000000, 0.0000248600000000 ] - [ -0.0030799100000000, 0.0002355800000000, -0.0000261300000000 ] - [ -0.0007913400000000, -0.0010964200000000, 0.0000621500000000 ] - [ 0.0002806900000000, 0.0002498600000000, -0.0001506400000000 ] - [ 0.0003735300000000, 0.0002457300000000, -0.0001327900000000 ] - [ -0.0004596800000000, 0.0038210900000000, 0.0002003800000000 ] - [ -0.0004245800000000, -0.0001863100000000, 0.0000623600000000 ] - [ -0.0027270800000000, 0.0024984000000000, -0.0002985700000000 ] - [ -0.0002419400000000, -0.0001852000000000, -0.0000999500000000 ] - [ 0.0000627800000000, 0.0003018800000000, 0.0000077000000000 ] - [ 0.0001487500000000, 0.0002632000000000, 0.0000003300000000 ] - [ 0.0001346300000000, 0.0002486300000000, -0.0000210600000000 ] - [ 0.0000604400000000, 0.0002999700000000, -0.0000344400000000 ] - [ 0.0003040800000000, 0.0001947900000000, -0.0001017300000000 ] - [ 0.0003225400000000, 0.0000360400000000, -0.0000398600000000 ] - [ 0.0002633700000000, 0.0001149400000000, 0.0000368400000000 ] - [ 0.0002936200000000, 0.0000851900000000, 0.0000196600000000 ] - [ -0.0003212300000000, 0.0004579400000000, 0.0005837200000000 ] - [ -0.0002310800000000, 0.0002190000000000, 0.0000047900000000 ] - [ -0.0002203200000000, 0.0002740500000000, -0.0000316200000000 ] - [ -0.0001919300000000, 0.0001916900000000, 0.0000441000000000 ] - [ -0.0000882300000000, -0.0002116200000000, 0.0000986400000000 ] - [ -0.0001510200000000, -0.0002562500000000, -0.0000123900000000 ] - [ -0.0000860600000000, -0.0003448200000000, -0.0000636500000000 ] - [ -0.0001217100000000, -0.0002534500000000, 0.0000359100000000 ] - [ 0.0002206500000000, -0.0002283100000000, 0.0000142600000000 ] - [ 0.0001552200000000, -0.0002396100000000, -0.0000223500000000 ] - [ 0.0001782700000000, -0.0001979700000000, -0.0000569700000000 ] - [ 0.0001966700000000, -0.0002419500000000, -0.0000118800000000 ] - [ -0.0002918800000000, -0.0001037100000000, 0.0000042500000000 ] - [ -0.0002875600000000, -0.0000772200000000, -0.0000339900000000 ] - [ -0.0003035200000000, 0.0000100800000000, -0.0000239200000000 ] - [ -0.0002783200000000, -0.0000131000000000, -0.0000042600000000 ] - [ 0.0001105400000000, 0.0003454000000000, 0.0000973900000000 ] - [ 0.0001081900000000, 0.0002552600000000, -0.0000251500000000 ] - [ 0.0000903600000000, 0.0002378200000000, -0.0000980500000000 ] - [ 0.0000606700000000, 0.0003157300000000, 0.0000121100000000 ] - [ 0.0002893800000000, 0.0000026700000000, 0.0000533000000000 ] - [ 0.0002750300000000, 0.0000306100000000, 0.0000265000000000 ] - [ 0.0002624300000000, 0.0001119300000000, 0.0000457000000000 ] - [ 0.0002877200000000, 0.0000545100000000, 0.0000475300000000 ] - [ -0.0001469900000000, 0.0002096600000000, 0.0000710600000000 ] - [ -0.0002278700000000, 0.0001987000000000, 0.0000407600000000 ] - [ -0.0001909000000000, 0.0002537500000000, 0.0000029000000000 ] - [ -0.0001639800000000, 0.0002096300000000, 0.0000495800000000 ] - [ -0.0001058900000000, -0.0002544100000000, 0.0000634600000000 ] - [ -0.0000678200000000, -0.0002872700000000, 0.0000416300000000 ] - [ -0.0000784300000000, -0.0002753000000000, 0.0000385200000000 ] - [ -0.0001422600000000, -0.0002418100000000, 0.0000250300000000 ] - [ 0.0002491200000000, -0.0002619300000000, 0.0000596200000000 ] - [ 0.0001563700000000, -0.0002305100000000, -0.0000197200000000 ] - [ 0.0001638800000000, -0.0001362600000000, -0.0000990100000000 ] - [ 0.0002240300000000, -0.0002452600000000, 0.0000235500000000 ] - [ -0.0002943800000000, -0.0001001200000000, 0.0000130300000000 ] - [ -0.0002776000000000, -0.0000818700000000, -0.0000876600000000 ] - [ -0.0003373500000000, 0.0000002900000000, 0.0000327100000000 ] - [ -0.0002856000000000, -0.0000561900000000, -0.0000041400000000 ]- atom: 25 displacement: [ 0.0049999998503029, -0.0086602541242721, 0.0000000000000000 ] forces: - [ 0.0096841400000000, -0.0155344000000000, -0.0125389400000000 ] - [ -0.0014052600000000, -0.0006250700000000, 0.0000918500000000 ] - [ -0.0003341200000000, 0.0020531100000000, -0.0001594100000000 ] - [ 0.0003635000000000, -0.0000016700000000, -0.0000090800000000 ] - [ 0.0070092400000000, -0.0023318100000000, 0.0032612100000000 ] - [ -0.0013996700000000, -0.0008618600000000, 0.0001205100000000 ] - [ -0.0003783100000000, 0.0025403600000000, 0.0000647400000000 ] - [ 0.0003357400000000, 0.0000753500000000, -0.0001427800000000 ] - [ -0.0000322700000000, -0.0000639900000000, 0.0002506400000000 ] - [ 0.0000933200000000, -0.0001102800000000, -0.0000254700000000 ] - [ -0.0000155000000000, 0.0001691600000000, -0.0000943000000000 ] - [ -0.0000293700000000, 0.0000197400000000, 0.0000478900000000 ] - [ 0.0000650400000000, -0.0002402200000000, 0.0000318900000000 ] - [ -0.0001208600000000, 0.0000661200000000, -0.0001034600000000 ] - [ -0.0001615800000000, 0.0001045100000000, 0.0000726100000000 ] - [ 0.0001854900000000, 0.0000553000000000, 0.0001164000000000 ] - [ 0.0001618400000000, -0.0000217500000000, 0.0000942100000000 ] - [ -0.0001629900000000, 0.0000755500000000, 0.0001506900000000 ] - [ -0.0001389100000000, 0.0000823500000000, -0.0000580100000000 ] - [ 0.0001227500000000, -0.0001312100000000, 0.0000329100000000 ] - [ 0.0000780100000000, -0.0001089600000000, 0.0001836500000000 ] - [ -0.0000103300000000, -0.0000938200000000, -0.0000397100000000 ] - [ -0.0000262200000000, 0.0002243500000000, -0.0000686500000000 ] - [ -0.0000262400000000, -0.0000077700000000, 0.0000775500000000 ] - [ -0.0257525200000000, 0.0268396000000000, 0.0099235200000000 ] - [ 0.0005903600000000, 0.0001893500000000, 0.0000302700000000 ] - [ 0.0005881600000000, -0.0002292300000000, -0.0000385000000000 ] - [ -0.0000590400000000, 0.0003303600000000, -0.0000262700000000 ] - [ 0.0009486400000000, -0.0018232100000000, 0.0016590400000000 ] - [ 0.0003937400000000, 0.0002293800000000, -0.0000669500000000 ] - [ 0.0013159200000000, -0.0033668300000000, -0.0015393100000000 ] - [ 0.0002904400000000, 0.0001760000000000, 0.0000893800000000 ] - [ 0.0022523100000000, 0.0005830700000000, 0.0011874300000000 ] - [ 0.0011045900000000, 0.0010936900000000, -0.0010081100000000 ] - [ -0.0003965900000000, 0.0000334500000000, -0.0000238400000000 ] - [ -0.0002965500000000, -0.0000266100000000, 0.0001426800000000 ] - [ -0.0022859100000000, 0.0006075300000000, -0.0010297800000000 ] - [ 0.0005403600000000, -0.0003407100000000, 0.0000308700000000 ] - [ 0.0005400300000000, -0.0010958600000000, 0.0000041100000000 ] - [ -0.0002609600000000, -0.0001989800000000, 0.0000101300000000 ] - [ 0.0035023000000000, -0.0006756500000000, -0.0000105500000000 ] - [ 0.0011803500000000, 0.0006752300000000, -0.0000927200000000 ] - [ 0.0000933400000000, -0.0006613200000000, 0.0001165900000000 ] - [ -0.0000030700000000, -0.0006729600000000, 0.0000980500000000 ] - [ -0.0000923600000000, -0.0039921400000000, -0.0002406800000000 ] - [ -0.0001278300000000, 0.0000766900000000, -0.0000970900000000 ] - [ 0.0021173400000000, -0.0025756700000000, 0.0002577700000000 ] - [ -0.0003138600000000, 0.0000724900000000, 0.0000669100000000 ] - [ 0.0001388400000000, 0.0002420600000000, -0.0000623800000000 ] - [ 0.0000521600000000, 0.0002812300000000, -0.0000550600000000 ] - [ 0.0000659800000000, 0.0002965900000000, -0.0000335100000000 ] - [ 0.0001409300000000, 0.0002443100000000, -0.0000199700000000 ] - [ 0.0002737200000000, -0.0000671000000000, 0.0001355600000000 ] - [ 0.0002531900000000, 0.0000909600000000, 0.0000764100000000 ] - [ 0.0003124000000000, 0.0000117900000000, -0.0000001400000000 ] - [ 0.0002825600000000, 0.0000414700000000, 0.0000167200000000 ] - [ -0.0000796800000000, -0.0000171200000000, -0.0005342000000000 ] - [ -0.0001665000000000, 0.0002160100000000, 0.0000316600000000 ] - [ -0.0001772300000000, 0.0001612500000000, 0.0000675600000000 ] - [ -0.0002051000000000, 0.0002439200000000, -0.0000079000000000 ] - [ -0.0000895700000000, -0.0003512800000000, -0.0000626500000000 ] - [ -0.0000274600000000, -0.0003065000000000, 0.0000477800000000 ] - [ -0.0000930200000000, -0.0002167900000000, 0.0001001100000000 ] - [ -0.0000566300000000, -0.0003091100000000, 0.0000002600000000 ] - [ 0.0001502700000000, -0.0002182000000000, -0.0000691700000000 ] - [ 0.0002157200000000, -0.0002066900000000, -0.0000321400000000 ] - [ 0.0001929600000000, -0.0002481700000000, 0.0000026400000000 ] - [ 0.0001751600000000, -0.0002035100000000, -0.0000431000000000 ] - [ -0.0002790000000000, 0.0000049500000000, -0.0000598000000000 ] - [ -0.0002841100000000, -0.0000212800000000, -0.0000206800000000 ] - [ -0.0002679900000000, -0.0001088800000000, -0.0000306600000000 ] - [ -0.0002929800000000, -0.0000854900000000, -0.0000504900000000 ] - [ 0.0000678800000000, 0.0002168800000000, -0.0001339900000000 ] - [ 0.0000705900000000, 0.0003073600000000, -0.0000107200000000 ] - [ 0.0000883200000000, 0.0003242700000000, 0.0000617100000000 ] - [ 0.0001178300000000, 0.0002464000000000, -0.0000484800000000 ] - [ 0.0002822900000000, 0.0000959400000000, 0.0000011100000000 ] - [ 0.0002966900000000, 0.0000678000000000, 0.0000279600000000 ] - [ 0.0003093100000000, -0.0000133400000000, 0.0000085500000000 ] - [ 0.0002838500000000, 0.0000441600000000, 0.0000069600000000 ] - [ -0.0002244200000000, 0.0002364400000000, -0.0000169300000000 ] - [ -0.0001430600000000, 0.0002475600000000, 0.0000134700000000 ] - [ -0.0001803100000000, 0.0001923000000000, 0.0000512000000000 ] - [ -0.0002072600000000, 0.0002365000000000, 0.0000047200000000 ] - [ -0.0000953900000000, -0.0002902800000000, -0.0000094000000000 ] - [ -0.0001334400000000, -0.0002574800000000, 0.0000126100000000 ] - [ -0.0001225800000000, -0.0002696500000000, 0.0000153200000000 ] - [ -0.0000591000000000, -0.0003029600000000, 0.0000291400000000 ] - [ 0.0001482400000000, -0.0001733600000000, -0.0000958300000000 ] - [ 0.0002413400000000, -0.0002047400000000, -0.0000166600000000 ] - [ 0.0002335200000000, -0.0002989800000000, 0.0000624200000000 ] - [ 0.0001734800000000, -0.0001899300000000, -0.0000600100000000 ] - [ -0.0002818000000000, -0.0000266700000000, -0.0000493700000000 ] - [ -0.0002984600000000, -0.0000452900000000, 0.0000515800000000 ] - [ -0.0002382700000000, -0.0001272600000000, -0.0000695800000000 ] - [ -0.0002905400000000, -0.0000708400000000, -0.0000324900000000 ]- atom: 25 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ -0.0067178900000000, 0.0137984700000000, 0.0146364000000000 ] - [ -0.0001563300000000, -0.0005230800000000, 0.0008179900000000 ] - [ 0.0000551800000000, 0.0002152200000000, 0.0010570600000000 ] - [ -0.0002058000000000, -0.0002935600000000, 0.0005384200000000 ] - [ 0.0153557200000000, 0.0010290800000000, 0.0144936700000000 ] - [ 0.0001389000000000, 0.0001507500000000, 0.0010201400000000 ] - [ -0.0003841800000000, -0.0003861400000000, 0.0007715800000000 ] - [ -0.0001450900000000, -0.0003217200000000, 0.0004886700000000 ] - [ 0.0003671900000000, -0.0002378100000000, -0.0004308200000000 ] - [ -0.0002594600000000, 0.0000890800000000, -0.0001358200000000 ] - [ -0.0000443800000000, 0.0000561300000000, -0.0000461000000000 ] - [ 0.0000643300000000, -0.0000952300000000, -0.0000546400000000 ] - [ 0.0001446200000000, 0.0004537100000000, -0.0002154200000000 ] - [ -0.0000148000000000, 0.0000094900000000, -0.0000785600000000 ] - [ 0.0000650200000000, -0.0000872000000000, -0.0000612900000000 ] - [ -0.0001620700000000, -0.0002600700000000, -0.0003940000000000 ] - [ -0.0000811000000000, -0.0001274700000000, -0.0002565400000000 ] - [ 0.0000707000000000, -0.0000341000000000, -0.0001530500000000 ] - [ -0.0000508700000000, 0.0000438000000000, -0.0001704700000000 ] - [ 0.0000485300000000, 0.0000985300000000, -0.0001941500000000 ] - [ 0.0000530700000000, 0.0000380800000000, -0.0003018000000000 ] - [ -0.0000954300000000, -0.0000231700000000, -0.0002205100000000 ] - [ 0.0000312800000000, 0.0000085100000000, -0.0001925800000000 ] - [ 0.0000038700000000, -0.0000013700000000, -0.0001254700000000 ] - [ -0.0090593100000000, -0.0159623700000000, -0.0362420600000000 ] - [ 0.0001144000000000, 0.0002273600000000, -0.0001546300000000 ] - [ 0.0000451600000000, 0.0002672800000000, -0.0001531100000000 ] - [ 0.0000958500000000, 0.0002822400000000, -0.0000910700000000 ] - [ 0.0009128300000000, -0.0014911200000000, 0.0009655300000000 ] - [ 0.0003128600000000, -0.0000117600000000, -0.0001445100000000 ] - [ -0.0001277300000000, 0.0016404600000000, 0.0009096400000000 ] - [ 0.0003231600000000, 0.0001750000000000, -0.0001412900000000 ] - [ 0.0013702300000000, 0.0006600500000000, 0.0009098700000000 ] - [ -0.0018316400000000, -0.0000221100000000, 0.0009654300000000 ] - [ -0.0001030300000000, 0.0003148900000000, -0.0001441000000000 ] - [ -0.0002599300000000, 0.0002096700000000, -0.0001415400000000 ] - [ 0.0010041200000000, 0.0015644900000000, 0.0026706900000000 ] - [ -0.0000761500000000, -0.0002760300000000, -0.0001721300000000 ] - [ -0.0001025100000000, -0.0002604200000000, -0.0001706500000000 ] - [ -0.0000906000000000, -0.0002604600000000, -0.0001031600000000 ] - [ 0.0004052500000000, -0.0004119100000000, -0.0007781900000000 ] - [ -0.0000835700000000, -0.0000053000000000, -0.0007679200000000 ] - [ 0.0001037100000000, -0.0000047800000000, -0.0003966800000000 ] - [ 0.0002674200000000, -0.0001213300000000, -0.0001507000000000 ] - [ 0.0000359000000000, -0.0002213400000000, -0.0007758200000000 ] - [ -0.0002393200000000, 0.0000554900000000, -0.0001506700000000 ] - [ -0.0005587800000000, 0.0000167900000000, -0.0007703000000000 ] - [ -0.0000580300000000, -0.0000303900000000, -0.0003966100000000 ] - [ -0.0000010200000000, 0.0003494200000000, 0.0000548300000000 ] - [ 0.0001827000000000, 0.0003125600000000, 0.0000897000000000 ] - [ 0.0001795500000000, 0.0002259000000000, 0.0000245900000000 ] - [ 0.0000933200000000, 0.0003044800000000, 0.0000047000000000 ] - [ -0.0002143700000000, -0.0003014300000000, 0.0008997500000000 ] - [ 0.0003076300000000, 0.0000229400000000, 0.0000041300000000 ] - [ 0.0003016400000000, 0.0000725700000000, 0.0000155900000000 ] - [ 0.0002805500000000, 0.0001268100000000, 0.0000348600000000 ] - [ -0.0003210700000000, 0.0004700800000000, 0.0008989100000000 ] - [ -0.0001811700000000, 0.0002358600000000, 0.0000153800000000 ] - [ -0.0001983300000000, 0.0002243400000000, 0.0000348800000000 ] - [ -0.0002584300000000, 0.0002005800000000, 0.0000039600000000 ] - [ -0.0001698500000000, -0.0002351500000000, 0.0000134700000000 ] - [ 0.0001646300000000, -0.0001720600000000, 0.0004029900000000 ] - [ -0.0000415300000000, -0.0003501000000000, -0.0000048900000000 ] - [ -0.0001092000000000, -0.0002731100000000, 0.0000260600000000 ] - [ 0.0002179800000000, -0.0002381000000000, 0.0000507300000000 ] - [ 0.0002381400000000, -0.0002276100000000, 0.0000307100000000 ] - [ 0.0002008200000000, -0.0002425300000000, 0.0000017300000000 ] - [ 0.0001162800000000, -0.0003121700000000, 0.0000632100000000 ] - [ -0.0003970800000000, -0.0000766000000000, 0.0001346100000000 ] - [ -0.0002922500000000, -0.0000955100000000, 0.0000123100000000 ] - [ -0.0003071100000000, -0.0000363200000000, 0.0000004800000000 ] - [ -0.0002978700000000, 0.0000505100000000, 0.0000496700000000 ] - [ 0.0000878800000000, 0.0003222300000000, 0.0000638600000000 ] - [ 0.0001420300000000, 0.0003447700000000, 0.0000982900000000 ] - [ 0.0000967300000000, 0.0002938500000000, 0.0000340300000000 ] - [ 0.0001025700000000, 0.0002815700000000, 0.0000139900000000 ] - [ 0.0002434200000000, 0.0000240000000000, 0.0001096500000000 ] - [ 0.0002614100000000, 0.0000386400000000, 0.0000916500000000 ] - [ 0.0002526400000000, 0.0000537900000000, 0.0000893300000000 ] - [ 0.0002670300000000, 0.0000891400000000, 0.0000888700000000 ] - [ -0.0001603400000000, 0.0001957000000000, 0.0001094300000000 ] - [ -0.0001680400000000, 0.0002094500000000, 0.0000892800000000 ] - [ -0.0001662300000000, 0.0001967000000000, 0.0000888900000000 ] - [ -0.0001873700000000, 0.0001850700000000, 0.0000916000000000 ] - [ -0.0001110500000000, -0.0002372800000000, 0.0000979600000000 ] - [ -0.0000623800000000, -0.0002345900000000, 0.0001165200000000 ] - [ -0.0000878100000000, -0.0002528100000000, 0.0000907300000000 ] - [ -0.0000751700000000, -0.0002611700000000, 0.0000788900000000 ] - [ 0.0002318200000000, -0.0002709200000000, 0.0001429200000000 ] - [ 0.0002029900000000, -0.0002182000000000, 0.0000098800000000 ] - [ 0.0002230100000000, -0.0002558300000000, 0.0000587400000000 ] - [ 0.0001930600000000, -0.0002405700000000, 0.0000218700000000 ] - [ -0.0003474500000000, -0.0000787400000000, 0.0000598400000000 ] - [ -0.0003032100000000, -0.0000739400000000, 0.0000720100000000 ] - [ -0.0003219700000000, -0.0000507700000000, 0.0000395700000000 ] - [ -0.0002887500000000, -0.0000297800000000, 0.0000111000000000 ]- atom: 25 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0069394500000000, -0.0141640600000000, -0.0147382400000000 ] - [ 0.0001510700000000, 0.0005207300000000, -0.0007728700000000 ] - [ -0.0000572300000000, -0.0002099200000000, -0.0010064600000000 ] - [ 0.0002050000000000, 0.0002929100000000, -0.0004911600000000 ] - [ -0.0157793200000000, -0.0010201500000000, -0.0146818900000000 ] - [ -0.0001335600000000, -0.0001498900000000, -0.0010610100000000 ] - [ 0.0003850400000000, 0.0003819600000000, -0.0008174000000000 ] - [ 0.0001450000000000, 0.0003212700000000, -0.0005324800000000 ] - [ -0.0003625100000000, 0.0002346200000000, 0.0004349300000000 ] - [ 0.0002554800000000, -0.0000877400000000, 0.0001414600000000 ] - [ 0.0000435600000000, -0.0000558600000000, 0.0000530100000000 ] - [ -0.0000630500000000, 0.0000936700000000, 0.0000617000000000 ] - [ -0.0001432800000000, -0.0004476200000000, 0.0001869700000000 ] - [ 0.0000145500000000, -0.0000087100000000, 0.0000518000000000 ] - [ -0.0000643600000000, 0.0000862800000000, 0.0000346200000000 ] - [ 0.0001597400000000, 0.0002565600000000, 0.0003637500000000 ] - [ 0.0000811600000000, 0.0001275900000000, 0.0002824500000000 ] - [ -0.0000704100000000, 0.0000335500000000, 0.0001785300000000 ] - [ 0.0000505600000000, -0.0000441600000000, 0.0001958700000000 ] - [ -0.0000479800000000, -0.0000984000000000, 0.0002188500000000 ] - [ -0.0000535900000000, -0.0000385400000000, 0.0002933600000000 ] - [ 0.0000957500000000, 0.0000232200000000, 0.0002126600000000 ] - [ -0.0000316900000000, -0.0000081200000000, 0.0001840200000000 ] - [ -0.0000038500000000, 0.0000021400000000, 0.0001171900000000 ] - [ 0.0094565000000000, 0.0168568800000000, 0.0365145700000000 ] - [ 0.0000654000000000, 0.0003082900000000, 0.0001173200000000 ] - [ 0.0001348000000000, 0.0002685200000000, 0.0001159500000000 ] - [ 0.0000842700000000, 0.0002535400000000, 0.0000542200000000 ] - [ -0.0003665400000000, 0.0016130600000000, -0.0009468600000000 ] - [ 0.0002408100000000, 0.0001230200000000, 0.0001802300000000 ] - [ 0.0006790700000000, -0.0015220400000000, -0.0008759100000000 ] - [ 0.0002309000000000, -0.0000620300000000, 0.0001775900000000 ] - [ -0.0017362900000000, -0.0002351300000000, -0.0008759200000000 ] - [ 0.0014701800000000, 0.0004442800000000, -0.0009468600000000 ] - [ -0.0002704400000000, 0.0001093500000000, 0.0001805800000000 ] - [ -0.0001145400000000, 0.0002134600000000, 0.0001774700000000 ] - [ -0.0012035400000000, -0.0021327000000000, -0.0026736900000000 ] - [ -0.0001032500000000, -0.0002597100000000, 0.0002084000000000 ] - [ -0.0000778900000000, -0.0002747400000000, 0.0002070500000000 ] - [ -0.0000902300000000, -0.0002761300000000, 0.0001389700000000 ] - [ -0.0000368200000000, -0.0000083600000000, 0.0007372200000000 ] - [ 0.0004716100000000, -0.0004126200000000, 0.0007315200000000 ] - [ 0.0002692900000000, -0.0004210500000000, 0.0003586900000000 ] - [ 0.0001068900000000, -0.0003013200000000, 0.0001142200000000 ] - [ -0.0005916800000000, 0.0001242400000000, 0.0007396600000000 ] - [ -0.0003140800000000, -0.0001666500000000, 0.0001140900000000 ] - [ 0.0000101600000000, -0.0001316500000000, 0.0007290300000000 ] - [ -0.0004975300000000, -0.0000838700000000, 0.0003588000000000 ] - [ 0.0002000900000000, 0.0001973000000000, -0.0001101800000000 ] - [ 0.0000191000000000, 0.0002334700000000, -0.0001445200000000 ] - [ 0.0000226000000000, 0.0003184900000000, -0.0000805600000000 ] - [ 0.0001071200000000, 0.0002410000000000, -0.0000609100000000 ] - [ 0.0007778200000000, 0.0004149900000000, -0.0008344400000000 ] - [ 0.0002695000000000, 0.0001037500000000, 0.0000335100000000 ] - [ 0.0002751300000000, 0.0000554300000000, 0.0000224700000000 ] - [ 0.0002963800000000, 0.0000019600000000, 0.0000031700000000 ] - [ -0.0000827100000000, -0.0000240900000000, -0.0008351300000000 ] - [ -0.0002169500000000, 0.0002002900000000, 0.0000222100000000 ] - [ -0.0002002100000000, 0.0002110400000000, 0.0000031000000000 ] - [ -0.0001412800000000, 0.0002346200000000, 0.0000334300000000 ] - [ -0.0000099500000000, -0.0003278200000000, 0.0000238100000000 ] - [ -0.0003326500000000, -0.0003883600000000, -0.0003510500000000 ] - [ -0.0001360800000000, -0.0002145500000000, 0.0000420300000000 ] - [ -0.0000696000000000, -0.0002902500000000, 0.0000116100000000 ] - [ 0.0001544400000000, -0.0002082900000000, -0.0001061300000000 ] - [ 0.0001349200000000, -0.0002183400000000, -0.0000864900000000 ] - [ 0.0001713500000000, -0.0002039900000000, -0.0000580200000000 ] - [ 0.0002542600000000, -0.0001355100000000, -0.0001184300000000 ] - [ -0.0001765900000000, -0.0000232100000000, -0.0001891500000000 ] - [ -0.0002798500000000, -0.0000048800000000, -0.0000685300000000 ] - [ -0.0002650600000000, -0.0000628100000000, -0.0000571600000000 ] - [ -0.0002744100000000, -0.0001480900000000, -0.0001052300000000 ] - [ 0.0000904700000000, 0.0002415600000000, -0.0001009100000000 ] - [ 0.0000363500000000, 0.0002184600000000, -0.0001358800000000 ] - [ 0.0000815900000000, 0.0002694300000000, -0.0000709900000000 ] - [ 0.0000756600000000, 0.0002816000000000, -0.0000512100000000 ] - [ 0.0003282000000000, 0.0000754600000000, -0.0000523300000000 ] - [ 0.0003103100000000, 0.0000610200000000, -0.0000345600000000 ] - [ 0.0003189100000000, 0.0000454700000000, -0.0000326900000000 ] - [ 0.0003046700000000, 0.0000100900000000, -0.0000320400000000 ] - [ -0.0002115100000000, 0.0002502400000000, -0.0000525100000000 ] - [ -0.0002041000000000, 0.0002363600000000, -0.0000327800000000 ] - [ -0.0002054800000000, 0.0002492200000000, -0.0000322300000000 ] - [ -0.0001848400000000, 0.0002605700000000, -0.0000344900000000 ] - [ -0.0000895100000000, -0.0003079100000000, -0.0000413500000000 ] - [ -0.0001383400000000, -0.0003108200000000, -0.0000598300000000 ] - [ -0.0001127100000000, -0.0002923500000000, -0.0000339800000000 ] - [ -0.0001256200000000, -0.0002841200000000, -0.0000222700000000 ] - [ 0.0001665300000000, -0.0001642900000000, -0.0001806100000000 ] - [ 0.0001951400000000, -0.0002174800000000, -0.0000474300000000 ] - [ 0.0001757000000000, -0.0001798800000000, -0.0000960900000000 ] - [ 0.0002052300000000, -0.0001953000000000, -0.0000590700000000 ] - [ -0.0002298700000000, -0.0000487900000000, -0.0000965900000000 ] - [ -0.0002738400000000, -0.0000535700000000, -0.0001093300000000 ] - [ -0.0002546300000000, -0.0000769900000000, -0.0000774500000000 ] - [ -0.0002882400000000, -0.0000981000000000, -0.0000487500000000 ]