# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/c81310ae-ee14-4b36-a58d-6ddc8721fd07/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 RbYTe2 / P6_3/mmc (194) / materials id 16764](https://mdr.nims.go.jp/datasets/bbd114db-0b1f-4bf0-a09a-b416522d12c6) ## 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: "P6_3/mmc" number: 194 Hall_symbol: "-P 6c 2c"supercell_matrix:- [ 4, 0, 0 ]- [ 0, 4, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 4.447163980000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.223581980000000, 3.851356980000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 16.881999789999998 ] # c points: - symbol: Rb # 1 coordinates: [ 0.333333330000000, 0.666666670000000, 0.250000000000000 ] mass: 85.467800 - symbol: Rb # 2 coordinates: [ 0.666666670000000, 0.333333330000000, 0.750000000000000 ] mass: 85.467800 - symbol: Y # 3 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 88.905850 - symbol: Y # 4 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 88.905850 - symbol: Te # 5 coordinates: [ 0.333333330000000, 0.666666670000000, 0.600246640000000 ] mass: 127.600000 - symbol: Te # 6 coordinates: [ 0.666666670000000, 0.333333330000000, 0.100246640000000 ] mass: 127.600000 - symbol: Te # 7 coordinates: [ 0.666666670000000, 0.333333330000000, 0.399753360000000 ] mass: 127.600000 - symbol: Te # 8 coordinates: [ 0.333333330000000, 0.666666670000000, 0.899753360000000 ] mass: 127.600000 reciprocal_lattice: # without 2pi - [ 0.224862407704606, 0.129824371084754, 0.000000000000000 ] # a* - [ 0.000000000000000, 0.259648743337212, 0.000000000000000 ] # b* - [ 0.000000000000000, 0.000000000000000, 0.059234688570032 ] # c*unit_cell: lattice: - [ 4.447163980000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.223581980000000, 3.851356980000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 16.881999789999998 ] # c points: - symbol: Rb # 1 coordinates: [ 0.333333330000000, 0.666666670000000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 2 coordinates: [ 0.666666670000000, 0.333333330000000, 0.750000000000000 ] mass: 85.467800 reduced_to: 2 - symbol: Y # 3 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 3 - symbol: Y # 4 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 4 - symbol: Te # 5 coordinates: [ 0.333333330000000, 0.666666670000000, 0.600246640000000 ] mass: 127.600000 reduced_to: 5 - symbol: Te # 6 coordinates: [ 0.666666670000000, 0.333333330000000, 0.100246640000000 ] mass: 127.600000 reduced_to: 6 - symbol: Te # 7 coordinates: [ 0.666666670000000, 0.333333330000000, 0.399753360000000 ] mass: 127.600000 reduced_to: 7 - symbol: Te # 8 coordinates: [ 0.333333330000000, 0.666666670000000, 0.899753360000000 ] mass: 127.600000 reduced_to: 8supercell: lattice: - [ 17.788655920000000, 0.000000000000000, 0.000000000000000 ] # a - [ -8.894327920000000, 15.405427919999999, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 16.881999789999998 ] # c points: - symbol: Rb # 1 coordinates: [ 0.083333332500000, 0.166666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 2 coordinates: [ 0.333333332500000, 0.166666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 3 coordinates: [ 0.583333332500000, 0.166666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 4 coordinates: [ 0.833333332500000, 0.166666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 5 coordinates: [ 0.083333332500000, 0.416666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 6 coordinates: [ 0.333333332500000, 0.416666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 7 coordinates: [ 0.583333332500000, 0.416666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 8 coordinates: [ 0.833333332500000, 0.416666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 9 coordinates: [ 0.083333332500000, 0.666666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 10 coordinates: [ 0.333333332500000, 0.666666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 11 coordinates: [ 0.583333332500000, 0.666666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 12 coordinates: [ 0.833333332500000, 0.666666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 13 coordinates: [ 0.083333332500000, 0.916666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 14 coordinates: [ 0.333333332500000, 0.916666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 15 coordinates: [ 0.583333332500000, 0.916666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 16 coordinates: [ 0.833333332500000, 0.916666667500000, 0.250000000000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 17 coordinates: [ 0.166666667500000, 0.083333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 18 coordinates: [ 0.416666667500000, 0.083333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 19 coordinates: [ 0.666666667500000, 0.083333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 20 coordinates: [ 0.916666667500000, 0.083333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 21 coordinates: [ 0.166666667500000, 0.333333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 22 coordinates: [ 0.416666667500000, 0.333333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 23 coordinates: [ 0.666666667500000, 0.333333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 24 coordinates: [ 0.916666667500000, 0.333333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 25 coordinates: [ 0.166666667500000, 0.583333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 26 coordinates: [ 0.416666667500000, 0.583333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 27 coordinates: [ 0.666666667500000, 0.583333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 28 coordinates: [ 0.916666667500000, 0.583333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 29 coordinates: [ 0.166666667500000, 0.833333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 30 coordinates: [ 0.416666667500000, 0.833333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 31 coordinates: [ 0.666666667500000, 0.833333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Rb # 32 coordinates: [ 0.916666667500000, 0.833333332500000, 0.750000000000000 ] mass: 85.467800 reduced_to: 17 - symbol: Y # 33 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 34 coordinates: [ 0.250000000000000, 0.000000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 35 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 36 coordinates: [ 0.750000000000000, 0.000000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 37 coordinates: [ 0.000000000000000, 0.250000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 38 coordinates: [ 0.250000000000000, 0.250000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 39 coordinates: [ 0.500000000000000, 0.250000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 40 coordinates: [ 0.750000000000000, 0.250000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 41 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 42 coordinates: [ 0.250000000000000, 0.500000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 43 coordinates: [ 0.500000000000000, 0.500000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 44 coordinates: [ 0.750000000000000, 0.500000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 45 coordinates: [ 0.000000000000000, 0.750000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 46 coordinates: [ 0.250000000000000, 0.750000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 47 coordinates: [ 0.500000000000000, 0.750000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 48 coordinates: [ 0.750000000000000, 0.750000000000000, 0.000000000000000 ] mass: 88.905850 reduced_to: 33 - symbol: Y # 49 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 50 coordinates: [ 0.250000000000000, 0.000000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 51 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 52 coordinates: [ 0.750000000000000, 0.000000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 53 coordinates: [ 0.000000000000000, 0.250000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 54 coordinates: [ 0.250000000000000, 0.250000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 55 coordinates: [ 0.500000000000000, 0.250000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 56 coordinates: [ 0.750000000000000, 0.250000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 57 coordinates: [ 0.000000000000000, 0.500000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 58 coordinates: [ 0.250000000000000, 0.500000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 59 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 60 coordinates: [ 0.750000000000000, 0.500000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 61 coordinates: [ 0.000000000000000, 0.750000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 62 coordinates: [ 0.250000000000000, 0.750000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 63 coordinates: [ 0.500000000000000, 0.750000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Y # 64 coordinates: [ 0.750000000000000, 0.750000000000000, 0.500000000000000 ] mass: 88.905850 reduced_to: 49 - symbol: Te # 65 coordinates: [ 0.083333332500000, 0.166666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 66 coordinates: [ 0.333333332500000, 0.166666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 67 coordinates: [ 0.583333332500000, 0.166666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 68 coordinates: [ 0.833333332500000, 0.166666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 69 coordinates: [ 0.083333332500000, 0.416666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 70 coordinates: [ 0.333333332500000, 0.416666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 71 coordinates: [ 0.583333332500000, 0.416666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 72 coordinates: [ 0.833333332500000, 0.416666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 73 coordinates: [ 0.083333332500000, 0.666666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 74 coordinates: [ 0.333333332500000, 0.666666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 75 coordinates: [ 0.583333332500000, 0.666666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 76 coordinates: [ 0.833333332500000, 0.666666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 77 coordinates: [ 0.083333332500000, 0.916666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 78 coordinates: [ 0.333333332500000, 0.916666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 79 coordinates: [ 0.583333332500000, 0.916666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 80 coordinates: [ 0.833333332500000, 0.916666667500000, 0.600246640000000 ] mass: 127.600000 reduced_to: 65 - symbol: Te # 81 coordinates: [ 0.166666667500000, 0.083333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 82 coordinates: [ 0.416666667500000, 0.083333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 83 coordinates: [ 0.666666667500000, 0.083333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 84 coordinates: [ 0.916666667500000, 0.083333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 85 coordinates: [ 0.166666667500000, 0.333333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 86 coordinates: [ 0.416666667500000, 0.333333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 87 coordinates: [ 0.666666667500000, 0.333333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 88 coordinates: [ 0.916666667500000, 0.333333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 89 coordinates: [ 0.166666667500000, 0.583333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 90 coordinates: [ 0.416666667500000, 0.583333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 91 coordinates: [ 0.666666667500000, 0.583333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 92 coordinates: [ 0.916666667500000, 0.583333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 93 coordinates: [ 0.166666667500000, 0.833333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 94 coordinates: [ 0.416666667500000, 0.833333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 95 coordinates: [ 0.666666667500000, 0.833333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 96 coordinates: [ 0.916666667500000, 0.833333332500000, 0.100246640000000 ] mass: 127.600000 reduced_to: 81 - symbol: Te # 97 coordinates: [ 0.166666667500000, 0.083333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 98 coordinates: [ 0.416666667500000, 0.083333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 99 coordinates: [ 0.666666667500000, 0.083333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 100 coordinates: [ 0.916666667500000, 0.083333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 101 coordinates: [ 0.166666667500000, 0.333333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 102 coordinates: [ 0.416666667500000, 0.333333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 103 coordinates: [ 0.666666667500000, 0.333333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 104 coordinates: [ 0.916666667500000, 0.333333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 105 coordinates: [ 0.166666667500000, 0.583333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 106 coordinates: [ 0.416666667500000, 0.583333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 107 coordinates: [ 0.666666667500000, 0.583333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 108 coordinates: [ 0.916666667500000, 0.583333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 109 coordinates: [ 0.166666667500000, 0.833333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 110 coordinates: [ 0.416666667500000, 0.833333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 111 coordinates: [ 0.666666667500000, 0.833333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 112 coordinates: [ 0.916666667500000, 0.833333332500000, 0.399753360000000 ] mass: 127.600000 reduced_to: 97 - symbol: Te # 113 coordinates: [ 0.083333332500000, 0.166666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 114 coordinates: [ 0.333333332500000, 0.166666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 115 coordinates: [ 0.583333332500000, 0.166666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 116 coordinates: [ 0.833333332500000, 0.166666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 117 coordinates: [ 0.083333332500000, 0.416666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 118 coordinates: [ 0.333333332500000, 0.416666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 119 coordinates: [ 0.583333332500000, 0.416666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 120 coordinates: [ 0.833333332500000, 0.416666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 121 coordinates: [ 0.083333332500000, 0.666666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 122 coordinates: [ 0.333333332500000, 0.666666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 123 coordinates: [ 0.583333332500000, 0.666666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 124 coordinates: [ 0.833333332500000, 0.666666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 125 coordinates: [ 0.083333332500000, 0.916666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 126 coordinates: [ 0.333333332500000, 0.916666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 127 coordinates: [ 0.583333332500000, 0.916666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113 - symbol: Te # 128 coordinates: [ 0.833333332500000, 0.916666667500000, 0.899753360000000 ] mass: 127.600000 reduced_to: 113born_effective_charge:- # 1 (Rb) - [ 1.105230080000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 1.105230080000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 2.132383810000000 ]- # 2 (Rb) - [ 1.105230080000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 1.105230080000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 2.132383810000000 ]- # 3 (Y) - [ 4.855316910000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 4.855316910000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.807758780000000 ]- # 4 (Y) - [ 4.855316910000000, -0.000000000000000, 0.000000000000000 ] - [ -0.000000000000000, 4.855316910000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.807758780000000 ]- # 5 (Te) - [ -2.980273490000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -2.980273490000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -1.970071290000000 ]- # 6 (Te) - [ -2.980273490000000, -0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -2.980273490000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -1.970071290000000 ]- # 7 (Te) - [ -2.980273490000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -2.980273490000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -1.970071290000000 ]- # 8 (Te) - [ -2.980273490000000, -0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -2.980273490000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -1.970071290000000 ]dielectric_constant: - [ 8.503097560000000, -0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 8.503097560000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 6.000793460000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0163482300000000, 0.0001036400000000, 0.0000000000000000 ] - [ 0.0019152200000000, -0.0000544700000000, 0.0000000000000000 ] - [ 0.0001210900000000, -0.0000000500000000, 0.0000000000000000 ] - [ 0.0018927300000000, 0.0000537200000000, 0.0000000000000000 ] - [ 0.0001631400000000, -0.0010582200000000, 0.0000000000000000 ] - [ 0.0001593900000000, 0.0010623500000000, 0.0000000000000000 ] - [ 0.0000767400000000, 0.0000476900000000, 0.0000000000000000 ] - [ 0.0000763800000000, -0.0000471800000000, 0.0000000000000000 ] - [ 0.0000068700000000, -0.0000660200000000, 0.0000000000000000 ] - [ -0.0000055800000000, -0.0000000500000000, 0.0000000000000000 ] - [ 0.0000066700000000, 0.0000661000000000, 0.0000000000000000 ] - [ -0.0000056000000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0001605800000000, -0.0009546800000000, 0.0000000000000000 ] - [ 0.0000766700000000, -0.0000476000000000, 0.0000000000000000 ] - [ 0.0000764200000000, 0.0000472300000000, 0.0000000000000000 ] - [ 0.0001619400000000, 0.0009494400000000, 0.0000000000000000 ] - [ -0.0000392000000000, 0.0000065300000000, 0.0000000000000000 ] - [ 0.0000441000000000, -0.0000149300000000, 0.0000000000000000 ] - [ 0.0000442200000000, 0.0000146400000000, 0.0000000000000000 ] - [ -0.0000393100000000, -0.0000067900000000, 0.0000000000000000 ] - [ -0.0000277200000000, 0.0000000800000000, 0.0000000000000000 ] - [ -0.0000084000000000, 0.0000316800000000, 0.0000000000000000 ] - [ 0.0000429200000000, -0.0000000700000000, 0.0000000000000000 ] - [ -0.0000081700000000, -0.0000318300000000, 0.0000000000000000 ] - [ -0.0000012600000000, -0.0000115200000000, 0.0000000000000000 ] - [ -0.0000013700000000, 0.0000114100000000, 0.0000000000000000 ] - [ 0.0000032900000000, 0.0000229400000000, 0.0000000000000000 ] - [ 0.0000033400000000, -0.0000227900000000, 0.0000000000000000 ] - [ 0.0000243300000000, -0.0000261900000000, 0.0000000000000000 ] - [ 0.0000571000000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0000242900000000, 0.0000263200000000, 0.0000000000000000 ] - [ -0.0000633000000000, 0.0000000600000000, 0.0000000000000000 ] - [ -0.0016101500000000, 0.0000006500000000, 0.0000009300000000 ] - [ 0.0005904300000000, -0.0003462000000000, -0.0004353100000000 ] - [ 0.0003178300000000, -0.0000005600000000, -0.0000005900000000 ] - [ 0.0005925200000000, 0.0003463600000000, 0.0004341000000000 ] - [ -0.0002075600000000, -0.0008078800000000, 0.0007880900000000 ] - [ -0.0002110100000000, 0.0008095300000000, -0.0007900900000000 ] - [ 0.0002938500000000, 0.0000021100000000, -0.0000941400000000 ] - [ 0.0002933300000000, -0.0000029500000000, 0.0000926900000000 ] - [ -0.0000178200000000, -0.0002681600000000, 0.0001140400000000 ] - [ -0.0000085000000000, -0.0000016400000000, 0.0000008500000000 ] - [ -0.0000187700000000, 0.0002699100000000, -0.0001150900000000 ] - [ 0.0001071000000000, 0.0000002400000000, -0.0000000500000000 ] - [ -0.0000975400000000, -0.0001365900000000, 0.0000207700000000 ] - [ 0.0001052400000000, -0.0001230100000000, -0.0000339100000000 ] - [ 0.0001048600000000, 0.0001228400000000, 0.0000336800000000 ] - [ -0.0000976000000000, 0.0001370800000000, -0.0000213700000000 ] - [ -0.0016101500000000, 0.0000006500000000, -0.0000009300000000 ] - [ 0.0005904300000000, -0.0003462000000000, 0.0004353100000000 ] - [ 0.0003178300000000, -0.0000005600000000, 0.0000005900000000 ] - [ 0.0005925200000000, 0.0003463600000000, -0.0004341000000000 ] - [ -0.0002075600000000, -0.0008078800000000, -0.0007880900000000 ] - [ -0.0002110100000000, 0.0008095300000000, 0.0007900900000000 ] - [ 0.0002938500000000, 0.0000021100000000, 0.0000941400000000 ] - [ 0.0002933300000000, -0.0000029500000000, -0.0000926900000000 ] - [ -0.0000178200000000, -0.0002681600000000, -0.0001140400000000 ] - [ -0.0000085000000000, -0.0000016400000000, -0.0000008500000000 ] - [ -0.0000187700000000, 0.0002699100000000, 0.0001150900000000 ] - [ 0.0001071000000000, 0.0000002400000000, 0.0000000500000000 ] - [ -0.0000975400000000, -0.0001365900000000, -0.0000207700000000 ] - [ 0.0001052400000000, -0.0001230100000000, 0.0000339100000000 ] - [ 0.0001048600000000, 0.0001228400000000, -0.0000336800000000 ] - [ -0.0000976000000000, 0.0001370800000000, 0.0000213700000000 ] - [ 0.0003862900000000, -0.0000008700000000, -0.0014816700000000 ] - [ -0.0001088100000000, -0.0000724900000000, -0.0016195700000000 ] - [ -0.0001676800000000, 0.0000001100000000, -0.0014812500000000 ] - [ -0.0001096900000000, 0.0000733400000000, -0.0013417600000000 ] - [ 0.0000898100000000, 0.0001004500000000, -0.0014293200000000 ] - [ 0.0000909000000000, -0.0001004400000000, -0.0015323300000000 ] - [ -0.0000839700000000, -0.0000644300000000, -0.0015309500000000 ] - [ -0.0000839400000000, 0.0000640300000000, -0.0014314400000000 ] - [ -0.0000051700000000, 0.0000937900000000, -0.0014725600000000 ] - [ -0.0000252400000000, 0.0000002200000000, -0.0014807300000000 ] - [ -0.0000049800000000, -0.0000941000000000, -0.0014895800000000 ] - [ 0.0000273400000000, -0.0000001800000000, -0.0014809900000000 ] - [ 0.0001403200000000, 0.0001585500000000, -0.0015680800000000 ] - [ -0.0001461300000000, 0.0000698600000000, -0.0015412900000000 ] - [ -0.0001469600000000, -0.0000702200000000, -0.0014199800000000 ] - [ 0.0001411400000000, -0.0001594900000000, -0.0013931600000000 ] - [ 0.0031573200000000, -0.0016074200000000, -0.0039560700000000 ] - [ -0.0002608700000000, 0.0000402600000000, -0.0013562600000000 ] - [ -0.0002604000000000, -0.0000391700000000, -0.0016038000000000 ] - [ 0.0031073600000000, 0.0015650400000000, 0.0009137100000000 ] - [ 0.0003851200000000, -0.0000076500000000, -0.0014759800000000 ] - [ -0.0001975600000000, -0.0002353200000000, -0.0011501500000000 ] - [ -0.0001428000000000, -0.0000000900000000, -0.0014807900000000 ] - [ -0.0001965000000000, 0.0002333200000000, -0.0018079300000000 ] - [ 0.0000325900000000, 0.0000768500000000, -0.0015270400000000 ] - [ 0.0000332600000000, -0.0000766000000000, -0.0014344800000000 ] - [ -0.0000298800000000, -0.0000653900000000, -0.0014743800000000 ] - [ -0.0000298800000000, 0.0000651400000000, -0.0014872900000000 ] - [ -0.0000820100000000, 0.0001960400000000, -0.0014031200000000 ] - [ -0.0000670700000000, 0.0000001400000000, -0.0014807500000000 ] - [ -0.0000816600000000, -0.0001959400000000, -0.0015579900000000 ] - [ 0.0002089100000000, 0.0000002200000000, -0.0014808100000000 ] - [ 0.0031573200000000, -0.0016074200000000, 0.0039560700000000 ] - [ -0.0002608700000000, 0.0000402600000000, 0.0013562600000000 ] - [ -0.0002604000000000, -0.0000391700000000, 0.0016038000000000 ] - [ 0.0031073600000000, 0.0015650400000000, -0.0009137100000000 ] - [ 0.0003851200000000, -0.0000076500000000, 0.0014759800000000 ] - [ -0.0001975600000000, -0.0002353200000000, 0.0011501500000000 ] - [ -0.0001428000000000, -0.0000000900000000, 0.0014807900000000 ] - [ -0.0001965000000000, 0.0002333200000000, 0.0018079300000000 ] - [ 0.0000325900000000, 0.0000768500000000, 0.0015270400000000 ] - [ 0.0000332600000000, -0.0000766000000000, 0.0014344800000000 ] - [ -0.0000298800000000, -0.0000653900000000, 0.0014743800000000 ] - [ -0.0000298800000000, 0.0000651400000000, 0.0014872900000000 ] - [ -0.0000820100000000, 0.0001960400000000, 0.0014031200000000 ] - [ -0.0000670700000000, 0.0000001400000000, 0.0014807500000000 ] - [ -0.0000816600000000, -0.0001959400000000, 0.0015579900000000 ] - [ 0.0002089100000000, 0.0000002200000000, 0.0014808100000000 ] - [ 0.0003862900000000, -0.0000008700000000, 0.0014816700000000 ] - [ -0.0001088100000000, -0.0000724900000000, 0.0016195700000000 ] - [ -0.0001676800000000, 0.0000001100000000, 0.0014812500000000 ] - [ -0.0001096900000000, 0.0000733400000000, 0.0013417600000000 ] - [ 0.0000898100000000, 0.0001004500000000, 0.0014293200000000 ] - [ 0.0000909000000000, -0.0001004400000000, 0.0015323300000000 ] - [ -0.0000839700000000, -0.0000644300000000, 0.0015309500000000 ] - [ -0.0000839400000000, 0.0000640300000000, 0.0014314400000000 ] - [ -0.0000051700000000, 0.0000937900000000, 0.0014725600000000 ] - [ -0.0000252400000000, 0.0000002200000000, 0.0014807300000000 ] - [ -0.0000049800000000, -0.0000941000000000, 0.0014895800000000 ] - [ 0.0000273400000000, -0.0000001800000000, 0.0014809900000000 ] - [ 0.0001403200000000, 0.0001585500000000, 0.0015680800000000 ] - [ -0.0001461300000000, 0.0000698600000000, 0.0015412900000000 ] - [ -0.0001469600000000, -0.0000702200000000, 0.0014199800000000 ] - [ 0.0001411400000000, -0.0001594900000000, 0.0013931600000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0207897000000000 ] - [ -0.0000030300000000, 0.0000004500000000, -0.0007989300000000 ] - [ 0.0000000000000000, 0.0000000400000000, -0.0002653500000000 ] - [ 0.0000030300000000, 0.0000004500000000, -0.0007989300000000 ] - [ 0.0000011200000000, -0.0000028500000000, -0.0007989300000000 ] - [ -0.0000011200000000, -0.0000028500000000, -0.0007989300000000 ] - [ 0.0000000600000000, 0.0000000300000000, -0.0002649000000000 ] - [ -0.0000000600000000, 0.0000000300000000, -0.0002649000000000 ] - [ -0.0000000400000000, -0.0000000200000000, -0.0002653500000000 ] - [ 0.0000000000000000, 0.0000000900000000, -0.0002648200000000 ] - [ 0.0000000400000000, -0.0000000200000000, -0.0002653500000000 ] - [ 0.0000000000000000, -0.0000000600000000, -0.0002649000000000 ] - [ -0.0000019100000000, 0.0000024000000000, -0.0007989300000000 ] - [ 0.0000000800000000, -0.0000000500000000, -0.0002648200000000 ] - [ -0.0000000800000000, -0.0000000500000000, -0.0002648200000000 ] - [ 0.0000019100000000, 0.0000024000000000, -0.0007989300000000 ] - [ 0.0000000600000000, -0.0000000300000000, 0.0003839600000000 ] - [ 0.0000000500000000, -0.0000001500000000, 0.0002835500000000 ] - [ -0.0000000500000000, -0.0000001500000000, 0.0002835500000000 ] - [ -0.0000000600000000, -0.0000000300000000, 0.0003839600000000 ] - [ 0.0000000000000000, 0.0000000700000000, 0.0003839600000000 ] - [ 0.0000000100000000, 0.0000000000000000, 0.0003229000000000 ] - [ 0.0000000000000000, -0.0000000100000000, 0.0002153100000000 ] - [ -0.0000000100000000, 0.0000000000000000, 0.0003229000000000 ] - [ 0.0000001100000000, 0.0000001200000000, 0.0002835500000000 ] - [ -0.0000001100000000, 0.0000001200000000, 0.0002835500000000 ] - [ -0.0000000100000000, 0.0000000100000000, 0.0002153100000000 ] - [ 0.0000000100000000, 0.0000000100000000, 0.0002153100000000 ] - [ 0.0000001600000000, 0.0000000400000000, 0.0002835500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002775600000000 ] - [ -0.0000001600000000, 0.0000000400000000, 0.0002835500000000 ] - [ 0.0000000000000000, -0.0000000100000000, 0.0003229000000000 ] - [ 0.0000000000000000, 0.0012335200000000, 0.0015483700000000 ] - [ -0.0008468600000000, 0.0004889400000000, 0.0005863300000000 ] - [ 0.0000000000000000, 0.0000668800000000, 0.0000444500000000 ] - [ 0.0008468600000000, 0.0004889400000000, 0.0005863300000000 ] - [ 0.0010682600000000, -0.0006167600000000, 0.0015483700000000 ] - [ -0.0010682600000000, -0.0006167600000000, 0.0015483700000000 ] - [ -0.0002245100000000, -0.0000650400000000, 0.0000247000000000 ] - [ 0.0002245100000000, -0.0000650400000000, 0.0000247000000000 ] - [ 0.0001685800000000, -0.0001619100000000, 0.0000247000000000 ] - [ 0.0000000000000000, -0.0009778700000000, 0.0005863300000000 ] - [ -0.0001685800000000, -0.0001619100000000, 0.0000247000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000050300000000 ] - [ -0.0000559300000000, 0.0002269500000000, 0.0000247000000000 ] - [ -0.0000579200000000, -0.0000334400000000, 0.0000444500000000 ] - [ 0.0000579200000000, -0.0000334400000000, 0.0000444500000000 ] - [ 0.0000559300000000, 0.0002269500000000, 0.0000247000000000 ] - [ 0.0000000000000000, -0.0012440000000000, 0.0015629800000000 ] - [ 0.0008477200000000, -0.0004894300000000, 0.0005886600000000 ] - [ 0.0000000000000000, -0.0000675100000000, 0.0000452100000000 ] - [ -0.0008477200000000, -0.0004894300000000, 0.0005886600000000 ] - [ -0.0010773400000000, 0.0006220000000000, 0.0015629800000000 ] - [ 0.0010773400000000, 0.0006220000000000, 0.0015629800000000 ] - [ 0.0002245300000000, 0.0000649300000000, 0.0000248800000000 ] - [ -0.0002245300000000, 0.0000649300000000, 0.0000248800000000 ] - [ -0.0001684900000000, 0.0001619800000000, 0.0000248800000000 ] - [ 0.0000000000000000, 0.0009788600000000, 0.0005886600000000 ] - [ 0.0001684900000000, 0.0001619800000000, 0.0000248800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000049700000000 ] - [ 0.0000560300000000, -0.0002269100000000, 0.0000248800000000 ] - [ 0.0000584700000000, 0.0000337600000000, 0.0000452100000000 ] - [ -0.0000584700000000, 0.0000337600000000, 0.0000452100000000 ] - [ -0.0000560300000000, -0.0002269100000000, 0.0000248800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0019767300000000 ] - [ -0.0003549000000000, -0.0000574200000000, -0.0019176000000000 ] - [ 0.0000000000000000, 0.0000058900000000, -0.0016068400000000 ] - [ 0.0003549000000000, -0.0000574200000000, -0.0019176000000000 ] - [ 0.0002271800000000, -0.0002786400000000, -0.0019176000000000 ] - [ -0.0002271800000000, -0.0002786400000000, -0.0019176000000000 ] - [ -0.0000655700000000, -0.0000378600000000, -0.0016056100000000 ] - [ 0.0000655700000000, -0.0000378600000000, -0.0016056100000000 ] - [ -0.0000051000000000, -0.0000029500000000, -0.0016068400000000 ] - [ 0.0000000000000000, -0.0001851300000000, -0.0016877200000000 ] - [ 0.0000051000000000, -0.0000029500000000, -0.0016068400000000 ] - [ 0.0000000000000000, 0.0000757100000000, -0.0016056100000000 ] - [ -0.0001277200000000, 0.0003360600000000, -0.0019176000000000 ] - [ -0.0001603200000000, 0.0000925600000000, -0.0016877200000000 ] - [ 0.0001603200000000, 0.0000925600000000, -0.0016877200000000 ] - [ 0.0001277200000000, 0.0003360600000000, -0.0019176000000000 ] - [ -0.0025141200000000, 0.0014515300000000, 0.0011941500000000 ] - [ 0.0002274300000000, 0.0000217200000000, -0.0013794300000000 ] - [ -0.0002274300000000, 0.0000217200000000, -0.0013794300000000 ] - [ 0.0025141200000000, 0.0014515300000000, 0.0011941500000000 ] - [ 0.0000000000000000, -0.0029030500000000, 0.0011941500000000 ] - [ 0.0003109300000000, 0.0001795100000000, -0.0014087900000000 ] - [ 0.0000000000000000, 0.0000446100000000, -0.0013796600000000 ] - [ -0.0003109300000000, 0.0001795100000000, -0.0014087900000000 ] - [ -0.0001325200000000, 0.0001861000000000, -0.0013794300000000 ] - [ 0.0001325200000000, 0.0001861000000000, -0.0013794300000000 ] - [ 0.0000386300000000, -0.0000223000000000, -0.0013796600000000 ] - [ -0.0000386300000000, -0.0000223000000000, -0.0013796600000000 ] - [ 0.0000949100000000, -0.0002078200000000, -0.0013794300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0013717000000000 ] - [ -0.0000949100000000, -0.0002078200000000, -0.0013794300000000 ] - [ 0.0000000000000000, -0.0003590300000000, -0.0014087900000000 ] - [ 0.0025940300000000, -0.0014976600000000, 0.0042321600000000 ] - [ -0.0002279800000000, -0.0000211100000000, 0.0015827800000000 ] - [ 0.0002279800000000, -0.0000211100000000, 0.0015827800000000 ] - [ -0.0025940300000000, -0.0014976600000000, 0.0042321600000000 ] - [ 0.0000000000000000, 0.0029953300000000, 0.0042321600000000 ] - [ -0.0003109300000000, -0.0001795100000000, 0.0015542600000000 ] - [ 0.0000000000000000, -0.0000436900000000, 0.0015836300000000 ] - [ 0.0003109300000000, -0.0001795100000000, 0.0015542600000000 ] - [ 0.0001322700000000, -0.0001868800000000, 0.0015827800000000 ] - [ -0.0001322700000000, -0.0001868800000000, 0.0015827800000000 ] - [ -0.0000378400000000, 0.0000218500000000, 0.0015836300000000 ] - [ 0.0000378400000000, 0.0000218500000000, 0.0015836300000000 ] - [ -0.0000957100000000, 0.0002080000000000, 0.0015827800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0015906500000000 ] - [ 0.0000957100000000, 0.0002080000000000, 0.0015827800000000 ] - [ 0.0000000000000000, 0.0003590300000000, 0.0015542600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009842800000000 ] - [ 0.0003542600000000, 0.0000578500000000, 0.0010459800000000 ] - [ 0.0000000000000000, -0.0000059400000000, 0.0013559000000000 ] - [ -0.0003542600000000, 0.0000578500000000, 0.0010459800000000 ] - [ -0.0002272300000000, 0.0002778700000000, 0.0010459800000000 ] - [ 0.0002272300000000, 0.0002778700000000, 0.0010459800000000 ] - [ 0.0000664000000000, 0.0000383400000000, 0.0013576700000000 ] - [ -0.0000664000000000, 0.0000383400000000, 0.0013576700000000 ] - [ 0.0000051500000000, 0.0000029700000000, 0.0013559000000000 ] - [ 0.0000000000000000, 0.0001856300000000, 0.0012744500000000 ] - [ -0.0000051500000000, 0.0000029700000000, 0.0013559000000000 ] - [ 0.0000000000000000, -0.0000766700000000, 0.0013576700000000 ] - [ 0.0001270300000000, -0.0003357200000000, 0.0010459800000000 ] - [ 0.0001607600000000, -0.0000928100000000, 0.0012744500000000 ] - [ -0.0001607600000000, -0.0000928100000000, 0.0012744500000000 ] - [ -0.0001270300000000, -0.0003357200000000, 0.0010459800000000 ]- atom: 33 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0016104000000000, -0.0000004200000000, 0.0000002900000000 ] - [ 0.0005926700000000, 0.0003478000000000, 0.0008487200000000 ] - [ 0.0003178900000000, 0.0000004600000000, 0.0000007700000000 ] - [ 0.0005896900000000, -0.0003449300000000, -0.0008460300000000 ] - [ -0.0000980100000000, -0.0002233500000000, -0.0000560500000000 ] - [ -0.0000975700000000, 0.0002232100000000, 0.0000561400000000 ] - [ 0.0001048400000000, 0.0001230300000000, 0.0000581200000000 ] - [ 0.0001049700000000, -0.0001228800000000, -0.0000581300000000 ] - [ -0.0000188500000000, -0.0001826200000000, 0.0001685600000000 ] - [ 0.0001068800000000, -0.0000001000000000, 0.0000001000000000 ] - [ -0.0000183100000000, 0.0001824900000000, -0.0001684500000000 ] - [ -0.0000087100000000, 0.0000011300000000, -0.0000009000000000 ] - [ -0.0002106500000000, -0.0008104400000000, 0.0010738300000000 ] - [ 0.0002932000000000, -0.0000890600000000, 0.0002249600000000 ] - [ 0.0002933500000000, 0.0000888700000000, -0.0002242600000000 ] - [ -0.0002087600000000, 0.0008069500000000, -0.0010714200000000 ] - [ -0.0002106500000000, 0.0008104400000000, -0.0010738300000000 ] - [ 0.0002932000000000, 0.0000890600000000, -0.0002249600000000 ] - [ 0.0002933500000000, -0.0000888700000000, 0.0002242600000000 ] - [ -0.0002087600000000, -0.0008069500000000, 0.0010714200000000 ] - [ -0.0000087100000000, -0.0000011300000000, 0.0000009000000000 ] - [ -0.0000188500000000, 0.0001826200000000, -0.0001685600000000 ] - [ 0.0001068800000000, 0.0000001000000000, -0.0000001000000000 ] - [ -0.0000183100000000, -0.0001824900000000, 0.0001684500000000 ] - [ 0.0001048400000000, -0.0001230300000000, -0.0000581200000000 ] - [ 0.0001049700000000, 0.0001228800000000, 0.0000581300000000 ] - [ -0.0000980100000000, 0.0002233500000000, 0.0000560500000000 ] - [ -0.0000975700000000, -0.0002232100000000, -0.0000561400000000 ] - [ 0.0005926700000000, -0.0003478000000000, -0.0008487200000000 ] - [ 0.0003178900000000, -0.0000004600000000, -0.0000007700000000 ] - [ 0.0005896900000000, 0.0003449300000000, 0.0008460300000000 ] - [ -0.0016104000000000, 0.0000004200000000, -0.0000002900000000 ] - [ -0.0562860000000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0091195200000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0030398700000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0090188700000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0010044100000000, -0.0058079600000000, 0.0033792800000000 ] - [ -0.0010122400000000, 0.0058281900000000, -0.0033958700000000 ] - [ 0.0011736600000000, 0.0007305000000000, -0.0000638000000000 ] - [ 0.0011754900000000, -0.0007261000000000, 0.0000628700000000 ] - [ 0.0001750400000000, -0.0016540200000000, 0.0003816500000000 ] - [ -0.0000868800000000, 0.0000015900000000, -0.0000005700000000 ] - [ 0.0001750400000000, 0.0016540200000000, -0.0003816500000000 ] - [ -0.0000868800000000, -0.0000015900000000, 0.0000005700000000 ] - [ -0.0010122400000000, -0.0058281900000000, 0.0033958700000000 ] - [ 0.0011736600000000, -0.0007305000000000, 0.0000638000000000 ] - [ 0.0011754900000000, 0.0007261000000000, -0.0000628700000000 ] - [ -0.0010044100000000, 0.0058079600000000, -0.0033792800000000 ] - [ -0.0012124400000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0002864200000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0006320200000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0002851700000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0003008000000000, -0.0003382600000000, -0.0001419000000000 ] - [ -0.0003009600000000, 0.0003390500000000, 0.0001425500000000 ] - [ 0.0002974400000000, 0.0001799300000000, 0.0000276600000000 ] - [ 0.0002974700000000, -0.0001795500000000, -0.0000278000000000 ] - [ 0.0000121600000000, -0.0003579100000000, -0.0000736200000000 ] - [ -0.0000138100000000, 0.0000001000000000, 0.0000001300000000 ] - [ 0.0000121600000000, 0.0003579100000000, 0.0000736200000000 ] - [ -0.0000138100000000, -0.0000001000000000, -0.0000001300000000 ] - [ -0.0003009600000000, -0.0003390500000000, -0.0001425500000000 ] - [ 0.0002974400000000, -0.0001799300000000, -0.0000276600000000 ] - [ 0.0002974700000000, 0.0001795500000000, 0.0000278000000000 ] - [ -0.0003008000000000, 0.0003382600000000, 0.0001419000000000 ] - [ 0.0004477300000000, -0.0000005200000000, -0.0014819100000000 ] - [ -0.0000889000000000, -0.0001476400000000, -0.0012922700000000 ] - [ -0.0002417400000000, -0.0000000800000000, -0.0014809800000000 ] - [ -0.0000889300000000, 0.0001472000000000, -0.0016701700000000 ] - [ 0.0000483500000000, 0.0001295900000000, -0.0014852700000000 ] - [ 0.0000487900000000, -0.0001294300000000, -0.0014774900000000 ] - [ -0.0000497900000000, -0.0001109100000000, -0.0014730300000000 ] - [ -0.0000498600000000, 0.0001107000000000, -0.0014892100000000 ] - [ -0.0000157600000000, 0.0002223400000000, -0.0012951000000000 ] - [ -0.0001381400000000, 0.0000001000000000, -0.0014811700000000 ] - [ -0.0000158000000000, -0.0002224600000000, -0.0016675600000000 ] - [ 0.0001664100000000, 0.0000002900000000, -0.0014807900000000 ] - [ 0.0002952400000000, 0.0000879600000000, -0.0008484900000000 ] - [ -0.0002882500000000, 0.0000094100000000, -0.0012910400000000 ] - [ -0.0002885200000000, -0.0000091200000000, -0.0016712400000000 ] - [ 0.0002959100000000, -0.0000877500000000, -0.0021120400000000 ] - [ 0.0105176400000000, 0.0041814000000000, 0.0073201900000000 ] - [ -0.0024679100000000, -0.0004157400000000, -0.0016326300000000 ] - [ -0.0024598200000000, 0.0004127200000000, -0.0013305900000000 ] - [ 0.0101829000000000, -0.0039542300000000, -0.0099807100000000 ] - [ 0.0015328400000000, -0.0000045200000000, -0.0014777600000000 ] - [ -0.0006101100000000, -0.0013752300000000, -0.0012796600000000 ] - [ -0.0004511500000000, 0.0000001200000000, -0.0014810700000000 ] - [ -0.0006131700000000, 0.0013769500000000, -0.0016829400000000 ] - [ -0.0001392300000000, 0.0003552100000000, -0.0015405600000000 ] - [ -0.0001401000000000, -0.0003550100000000, -0.0014216000000000 ] - [ 0.0000121400000000, -0.0011217900000000, -0.0011297600000000 ] - [ 0.0000133600000000, 0.0011244300000000, -0.0018351200000000 ] - [ -0.0004733100000000, 0.0011609200000000, -0.0020430700000000 ] - [ -0.0007546900000000, 0.0000009600000000, -0.0014815000000000 ] - [ -0.0004778200000000, -0.0011581600000000, -0.0009209200000000 ] - [ 0.0033055500000000, 0.0000426400000000, -0.0015188300000000 ] - [ 0.0002952400000000, -0.0000879600000000, 0.0008484900000000 ] - [ -0.0002882500000000, -0.0000094100000000, 0.0012910400000000 ] - [ -0.0002885200000000, 0.0000091200000000, 0.0016712400000000 ] - [ 0.0002959100000000, 0.0000877500000000, 0.0021120400000000 ] - [ 0.0001664100000000, -0.0000002900000000, 0.0014807900000000 ] - [ -0.0000157600000000, -0.0002223400000000, 0.0012951000000000 ] - [ -0.0001381400000000, -0.0000001000000000, 0.0014811700000000 ] - [ -0.0000158000000000, 0.0002224600000000, 0.0016675600000000 ] - [ -0.0000497900000000, 0.0001109100000000, 0.0014730300000000 ] - [ -0.0000498600000000, -0.0001107000000000, 0.0014892100000000 ] - [ 0.0000483500000000, -0.0001295900000000, 0.0014852700000000 ] - [ 0.0000487900000000, 0.0001294300000000, 0.0014774900000000 ] - [ -0.0000889000000000, 0.0001476400000000, 0.0012922700000000 ] - [ -0.0002417400000000, 0.0000000800000000, 0.0014809800000000 ] - [ -0.0000889300000000, -0.0001472000000000, 0.0016701700000000 ] - [ 0.0004477300000000, 0.0000005200000000, 0.0014819100000000 ] - [ 0.0033055500000000, -0.0000426400000000, 0.0015188300000000 ] - [ -0.0004733100000000, -0.0011609200000000, 0.0020430700000000 ] - [ -0.0007546900000000, -0.0000009600000000, 0.0014815000000000 ] - [ -0.0004778200000000, 0.0011581600000000, 0.0009209200000000 ] - [ 0.0000121400000000, 0.0011217900000000, 0.0011297600000000 ] - [ 0.0000133600000000, -0.0011244300000000, 0.0018351200000000 ] - [ -0.0001392300000000, -0.0003552100000000, 0.0015405600000000 ] - [ -0.0001401000000000, 0.0003550100000000, 0.0014216000000000 ] - [ -0.0006101100000000, 0.0013752300000000, 0.0012796600000000 ] - [ -0.0004511500000000, -0.0000001200000000, 0.0014810700000000 ] - [ -0.0006131700000000, -0.0013769500000000, 0.0016829400000000 ] - [ 0.0015328400000000, 0.0000045200000000, 0.0014777600000000 ] - [ 0.0105176400000000, -0.0041814000000000, -0.0073201900000000 ] - [ -0.0024679100000000, 0.0004157400000000, 0.0016326300000000 ] - [ -0.0024598200000000, -0.0004127200000000, 0.0013305900000000 ] - [ 0.0101829000000000, 0.0039542300000000, 0.0099807100000000 ]- atom: 33 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0009166000000000, 0.0015632600000000 ] - [ 0.0004354100000000, 0.0002513900000000, 0.0005873900000000 ] - [ 0.0000000000000000, 0.0000387100000000, 0.0000449000000000 ] - [ -0.0004354100000000, 0.0002513900000000, 0.0005873900000000 ] - [ 0.0000208800000000, 0.0001200500000000, 0.0000248800000000 ] - [ -0.0000208800000000, 0.0001200500000000, 0.0000248800000000 ] - [ 0.0000335300000000, -0.0000193600000000, 0.0000449000000000 ] - [ -0.0000335300000000, -0.0000193600000000, 0.0000449000000000 ] - [ 0.0001144100000000, -0.0000419400000000, 0.0000248800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000049000000000 ] - [ -0.0001144100000000, -0.0000419400000000, 0.0000248800000000 ] - [ 0.0000000000000000, -0.0005027700000000, 0.0005873900000000 ] - [ 0.0007938000000000, -0.0004583000000000, 0.0015632600000000 ] - [ 0.0000935200000000, -0.0000781100000000, 0.0000248800000000 ] - [ -0.0000935200000000, -0.0000781100000000, 0.0000248800000000 ] - [ -0.0007938000000000, -0.0004583000000000, 0.0015632600000000 ] - [ -0.0007841900000000, -0.0004527500000000, 0.0015476000000000 ] - [ -0.0000934000000000, -0.0000786000000000, 0.0000247000000000 ] - [ 0.0000934000000000, -0.0000786000000000, 0.0000247000000000 ] - [ 0.0007841900000000, -0.0004527500000000, 0.0015476000000000 ] - [ 0.0000000000000000, -0.0005011900000000, 0.0005874600000000 ] - [ -0.0001147700000000, -0.0000415800000000, 0.0000247000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000048500000000 ] - [ 0.0001147700000000, -0.0000415800000000, 0.0000247000000000 ] - [ -0.0000338100000000, -0.0000195200000000, 0.0000450700000000 ] - [ 0.0000338100000000, -0.0000195200000000, 0.0000450700000000 ] - [ -0.0000213700000000, 0.0001201800000000, 0.0000247000000000 ] - [ 0.0000213700000000, 0.0001201800000000, 0.0000247000000000 ] - [ -0.0004340400000000, 0.0002506000000000, 0.0005874600000000 ] - [ 0.0000000000000000, 0.0000390400000000, 0.0000450700000000 ] - [ 0.0004340400000000, 0.0002506000000000, 0.0005874600000000 ] - [ 0.0000000000000000, 0.0009055100000000, 0.0015476000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0523248700000000 ] - [ -0.0000011400000000, -0.0039115700000000, -0.0049106300000000 ] - [ 0.0000000000000000, -0.0004405200000000, -0.0004703300000000 ] - [ 0.0000011400000000, -0.0039115700000000, -0.0049106300000000 ] - [ 0.0033880900000000, 0.0019548000000000, -0.0049106300000000 ] - [ -0.0033880900000000, 0.0019548000000000, -0.0049106300000000 ] - [ -0.0000627500000000, -0.0000362300000000, -0.0002260400000000 ] - [ 0.0000627500000000, -0.0000362300000000, -0.0002260400000000 ] - [ 0.0003815000000000, 0.0002202600000000, -0.0004703300000000 ] - [ 0.0000000000000000, 0.0000738700000000, -0.0002280000000000 ] - [ -0.0003815000000000, 0.0002202600000000, -0.0004703300000000 ] - [ 0.0000000000000000, 0.0000724600000000, -0.0002260400000000 ] - [ 0.0033869500000000, 0.0019567700000000, -0.0049106300000000 ] - [ 0.0000639700000000, -0.0000369300000000, -0.0002280000000000 ] - [ -0.0000639700000000, -0.0000369300000000, -0.0002280000000000 ] - [ -0.0033869500000000, 0.0019567700000000, -0.0049106300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0007618800000000 ] - [ 0.0000003900000000, -0.0001642700000000, 0.0003092500000000 ] - [ 0.0000000000000000, -0.0000850700000000, 0.0000758400000000 ] - [ -0.0000003900000000, -0.0001642700000000, 0.0003092500000000 ] - [ 0.0001420700000000, 0.0000824700000000, 0.0003092500000000 ] - [ -0.0001420700000000, 0.0000824700000000, 0.0003092500000000 ] - [ -0.0000276700000000, -0.0000159700000000, 0.0000535800000000 ] - [ 0.0000276700000000, -0.0000159700000000, 0.0000535800000000 ] - [ 0.0000736800000000, 0.0000425400000000, 0.0000758400000000 ] - [ 0.0000000000000000, 0.0000321400000000, 0.0000536000000000 ] - [ -0.0000736800000000, 0.0000425400000000, 0.0000758400000000 ] - [ 0.0000000000000000, 0.0000319400000000, 0.0000535800000000 ] - [ 0.0001424600000000, 0.0000818000000000, 0.0003092500000000 ] - [ 0.0000278300000000, -0.0000160700000000, 0.0000536000000000 ] - [ -0.0000278300000000, -0.0000160700000000, 0.0000536000000000 ] - [ -0.0001424600000000, 0.0000818000000000, 0.0003092500000000 ] - [ 0.0000000000000000, 0.0000153400000000, -0.0021980500000000 ] - [ 0.0000633500000000, 0.0000365800000000, -0.0016654200000000 ] - [ 0.0000000000000000, 0.0000061900000000, -0.0015014900000000 ] - [ -0.0000633500000000, 0.0000365800000000, -0.0016654200000000 ] - [ -0.0000555700000000, 0.0000124200000000, -0.0016155500000000 ] - [ 0.0000555700000000, 0.0000124200000000, -0.0016155500000000 ] - [ 0.0000053600000000, -0.0000031000000000, -0.0015014900000000 ] - [ -0.0000053600000000, -0.0000031000000000, -0.0015014900000000 ] - [ -0.0000170300000000, -0.0000543400000000, -0.0016155500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0015118700000000 ] - [ 0.0000170300000000, -0.0000543400000000, -0.0016155500000000 ] - [ 0.0000000000000000, -0.0000731600000000, -0.0016654200000000 ] - [ 0.0000132800000000, -0.0000076700000000, -0.0021980500000000 ] - [ 0.0000385500000000, 0.0000419200000000, -0.0016155500000000 ] - [ -0.0000385500000000, 0.0000419200000000, -0.0016155500000000 ] - [ -0.0000132800000000, -0.0000076700000000, -0.0021980500000000 ] - [ 0.0069735300000000, 0.0040261700000000, 0.0087822800000000 ] - [ -0.0001750700000000, 0.0001600500000000, -0.0009456500000000 ] - [ 0.0001750700000000, 0.0001600500000000, -0.0009456500000000 ] - [ -0.0069735300000000, 0.0040261700000000, 0.0087822800000000 ] - [ 0.0000000000000000, -0.0002154200000000, -0.0003636500000000 ] - [ 0.0000510700000000, -0.0002316400000000, -0.0009456500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0013839600000000 ] - [ -0.0000510700000000, -0.0002316400000000, -0.0009456500000000 ] - [ -0.0000247400000000, -0.0000142900000000, -0.0013871900000000 ] - [ 0.0000247400000000, -0.0000142900000000, -0.0013871900000000 ] - [ 0.0002261400000000, 0.0000715900000000, -0.0009456500000000 ] - [ -0.0002261400000000, 0.0000715900000000, -0.0009456500000000 ] - [ -0.0001865600000000, 0.0001077100000000, -0.0003636500000000 ] - [ 0.0000000000000000, 0.0000285700000000, -0.0013871900000000 ] - [ 0.0001865600000000, 0.0001077100000000, -0.0003636500000000 ] - [ 0.0000000000000000, -0.0080523400000000, 0.0087822800000000 ] - [ -0.0000139900000000, -0.0000080800000000, 0.0007635500000000 ] - [ -0.0000386000000000, 0.0000418600000000, 0.0013471100000000 ] - [ 0.0000386000000000, 0.0000418600000000, 0.0013471100000000 ] - [ 0.0000139900000000, -0.0000080800000000, 0.0007635500000000 ] - [ 0.0000000000000000, -0.0000732600000000, 0.0012968700000000 ] - [ 0.0000169500000000, -0.0000543600000000, 0.0013471100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0014507200000000 ] - [ -0.0000169500000000, -0.0000543600000000, 0.0013471100000000 ] - [ -0.0000052800000000, -0.0000030500000000, 0.0014608100000000 ] - [ 0.0000052800000000, -0.0000030500000000, 0.0014608100000000 ] - [ 0.0000555500000000, 0.0000125000000000, 0.0013471100000000 ] - [ -0.0000555500000000, 0.0000125000000000, 0.0013471100000000 ] - [ -0.0000634400000000, 0.0000366300000000, 0.0012968700000000 ] - [ 0.0000000000000000, 0.0000061000000000, 0.0014608100000000 ] - [ 0.0000634400000000, 0.0000366300000000, 0.0012968700000000 ] - [ 0.0000000000000000, 0.0000161500000000, 0.0007635500000000 ] - [ 0.0000000000000000, -0.0078038500000000, 0.0116403500000000 ] - [ 0.0001806900000000, 0.0001043200000000, 0.0026027500000000 ] - [ 0.0000000000000000, 0.0000290500000000, 0.0015746900000000 ] - [ -0.0001806900000000, 0.0001043200000000, 0.0026027500000000 ] - [ -0.0002273600000000, 0.0000714300000000, 0.0020192100000000 ] - [ 0.0002273600000000, 0.0000714300000000, 0.0020192100000000 ] - [ 0.0000251600000000, -0.0000145300000000, 0.0015746900000000 ] - [ -0.0000251600000000, -0.0000145300000000, 0.0015746900000000 ] - [ -0.0000518200000000, -0.0002326200000000, 0.0020192100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0015784400000000 ] - [ 0.0000518200000000, -0.0002326200000000, 0.0020192100000000 ] - [ 0.0000000000000000, -0.0002086500000000, 0.0026027500000000 ] - [ -0.0067583300000000, 0.0039019300000000, 0.0116403500000000 ] - [ 0.0001755400000000, 0.0001611800000000, 0.0020192100000000 ] - [ -0.0001755400000000, 0.0001611800000000, 0.0020192100000000 ] - [ 0.0067583300000000, 0.0039019300000000, 0.0116403500000000 ]- atom: 65 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0003860100000000, 0.0000003800000000, 0.0000002300000000 ] - [ -0.0001089300000000, -0.0000143400000000, 0.0003552400000000 ] - [ -0.0001674800000000, 0.0000002100000000, 0.0000003400000000 ] - [ -0.0001091800000000, 0.0000151400000000, -0.0003546400000000 ] - [ 0.0001408300000000, 0.0000711800000000, -0.0001272500000000 ] - [ 0.0001411400000000, -0.0000715900000000, 0.0001284300000000 ] - [ -0.0001471000000000, -0.0000706000000000, 0.0001609200000000 ] - [ -0.0001471300000000, 0.0000698900000000, -0.0001601500000000 ] - [ -0.0000041500000000, 0.0000940000000000, -0.0000053500000000 ] - [ 0.0000270800000000, -0.0000001100000000, 0.0000002000000000 ] - [ -0.0000045000000000, -0.0000943800000000, 0.0000053600000000 ] - [ -0.0000254500000000, -0.0000004500000000, -0.0000006900000000 ] - [ 0.0000908700000000, 0.0001884800000000, 0.0002265000000000 ] - [ -0.0000843500000000, 0.0000645800000000, 0.0000660600000000 ] - [ -0.0000845600000000, -0.0000642100000000, -0.0000659500000000 ] - [ 0.0000902300000000, -0.0001879700000000, -0.0002277100000000 ] - [ 0.0031569500000000, -0.0016068800000000, 0.0025933500000000 ] - [ -0.0002601100000000, 0.0000933100000000, -0.0002286700000000 ] - [ -0.0002599200000000, -0.0000924200000000, 0.0002269600000000 ] - [ 0.0031077800000000, 0.0015653900000000, -0.0025137100000000 ] - [ 0.0003852900000000, -0.0000047900000000, -0.0000049600000000 ] - [ -0.0001970800000000, -0.0002347100000000, -0.0003117800000000 ] - [ -0.0001423800000000, -0.0000002800000000, -0.0000004400000000 ] - [ -0.0001974500000000, 0.0002342600000000, 0.0003108500000000 ] - [ 0.0000331400000000, 0.0001293800000000, 0.0001319600000000 ] - [ 0.0000331200000000, -0.0001295100000000, -0.0001324000000000 ] - [ -0.0000294600000000, -0.0000655100000000, -0.0000386500000000 ] - [ -0.0000293400000000, 0.0000649500000000, 0.0000385000000000 ] - [ -0.0000814400000000, 0.0001426400000000, -0.0000953800000000 ] - [ -0.0000666800000000, -0.0000000100000000, -0.0000001100000000 ] - [ -0.0000820900000000, -0.0001427900000000, 0.0000958900000000 ] - [ 0.0002088700000000, -0.0000011100000000, 0.0000007600000000 ] - [ 0.0004489800000000, -0.0000006400000000, 0.0000006800000000 ] - [ -0.0000882600000000, 0.0001475400000000, -0.0000630100000000 ] - [ -0.0002412100000000, 0.0000002500000000, -0.0000000300000000 ] - [ -0.0000891300000000, -0.0001470800000000, 0.0000632400000000 ] - [ 0.0002945500000000, 0.0000890000000000, 0.0000144900000000 ] - [ 0.0002969300000000, -0.0000880200000000, -0.0000131500000000 ] - [ -0.0002884500000000, -0.0000651800000000, -0.0000383900000000 ] - [ -0.0002893300000000, 0.0000650800000000, 0.0000383500000000 ] - [ -0.0000159800000000, 0.0001670700000000, -0.0000165600000000 ] - [ 0.0001664600000000, 0.0000002900000000, 0.0000001700000000 ] - [ -0.0000155900000000, -0.0001671100000000, 0.0000168900000000 ] - [ -0.0001381200000000, -0.0000004300000000, -0.0000000400000000 ] - [ 0.0000491000000000, 0.0001850100000000, -0.0000551000000000 ] - [ -0.0000496000000000, 0.0001105000000000, -0.0000052300000000 ] - [ -0.0000499500000000, -0.0001105600000000, 0.0000053200000000 ] - [ 0.0000484000000000, -0.0001860100000000, 0.0000550900000000 ] - [ 0.0033051700000000, 0.0000252500000000, 0.0000142000000000 ] - [ -0.0004697300000000, 0.0011616800000000, 0.0001833000000000 ] - [ -0.0007541700000000, 0.0000019400000000, 0.0000004500000000 ] - [ -0.0004810600000000, -0.0011575700000000, -0.0001840200000000 ] - [ 0.0101923000000000, -0.0039385400000000, 0.0066943500000000 ] - [ 0.0105074400000000, 0.0041973500000000, -0.0070377500000000 ] - [ -0.0024666000000000, -0.0003073600000000, 0.0001763100000000 ] - [ -0.0024604100000000, 0.0003066600000000, -0.0001749800000000 ] - [ -0.0006122400000000, 0.0014801600000000, 0.0000501400000000 ] - [ 0.0015331000000000, -0.0000016600000000, 0.0000003500000000 ] - [ -0.0006124500000000, -0.0014864600000000, -0.0000525900000000 ] - [ -0.0004507500000000, -0.0000026300000000, 0.0000003500000000 ] - [ 0.0000149800000000, 0.0010111100000000, 0.0002270300000000 ] - [ -0.0001380800000000, 0.0003544400000000, 0.0000252300000000 ] - [ -0.0001400700000000, -0.0003557500000000, -0.0000248900000000 ] - [ 0.0000102000000000, -0.0010188500000000, -0.0002269300000000 ] - [ -0.0414853200000000, -0.0002439100000000, -0.0012202900000000 ] - [ 0.0035435100000000, -0.0004937700000000, -0.0017602400000000 ] - [ 0.0013623300000000, -0.0000007500000000, -0.0014812300000000 ] - [ 0.0035070000000000, 0.0004900400000000, -0.0012033500000000 ] - [ 0.0001181800000000, -0.0024555800000000, -0.0014341800000000 ] - [ 0.0001169300000000, 0.0024628800000000, -0.0015253400000000 ] - [ 0.0003158800000000, 0.0002467500000000, -0.0014435100000000 ] - [ 0.0003160000000000, -0.0002449800000000, -0.0015183500000000 ] - [ 0.0002422200000000, -0.0006451600000000, -0.0014801100000000 ] - [ -0.0001099800000000, 0.0000008900000000, -0.0014809500000000 ] - [ 0.0002434700000000, 0.0006474200000000, -0.0014816200000000 ] - [ -0.0001099300000000, 0.0000011300000000, -0.0014812200000000 ] - [ 0.0001137700000000, -0.0014754600000000, -0.0017126600000000 ] - [ 0.0003149900000000, -0.0002461900000000, -0.0014890400000000 ] - [ 0.0003167700000000, 0.0002455300000000, -0.0014731300000000 ] - [ 0.0001213500000000, 0.0014753700000000, -0.0012469300000000 ] - [ -0.0001357800000000, -0.0000013000000000, -0.0017023800000000 ] - [ 0.0001345500000000, -0.0000329600000000, -0.0015342000000000 ] - [ 0.0001348400000000, 0.0000327700000000, -0.0014283400000000 ] - [ -0.0001350900000000, 0.0000012500000000, -0.0012607200000000 ] - [ -0.0001376200000000, -0.0000004900000000, -0.0014814800000000 ] - [ -0.0000091200000000, 0.0000922800000000, -0.0016165700000000 ] - [ 0.0001641200000000, 0.0000001300000000, -0.0014813400000000 ] - [ -0.0000081900000000, -0.0000922600000000, -0.0013464400000000 ] - [ -0.0000269200000000, -0.0000603600000000, -0.0014602600000000 ] - [ -0.0000269000000000, 0.0000605200000000, -0.0015024300000000 ] - [ 0.0000312600000000, 0.0000770200000000, -0.0015209900000000 ] - [ 0.0000311600000000, -0.0000764600000000, -0.0014412200000000 ] - [ 0.0000298200000000, -0.0000932300000000, -0.0015130100000000 ] - [ 0.0000653000000000, 0.0000000000000000, -0.0014811500000000 ] - [ 0.0000302100000000, 0.0000933600000000, -0.0014492400000000 ] - [ -0.0001684800000000, 0.0000002500000000, -0.0014807800000000 ] - [ 0.0007375000000000, -0.0015503900000000, -0.0011452400000000 ] - [ 0.0004763900000000, -0.0001920800000000, 0.0013211600000000 ] - [ 0.0004781900000000, 0.0001900700000000, 0.0016404000000000 ] - [ 0.0007446600000000, 0.0015428900000000, 0.0040956300000000 ] - [ -0.0019377800000000, -0.0000003300000000, 0.0014805100000000 ] - [ 0.0029523900000000, 0.0014502500000000, 0.0002297300000000 ] - [ 0.0013404300000000, 0.0000008900000000, 0.0014809600000000 ] - [ 0.0029395500000000, -0.0014456300000000, 0.0027315800000000 ] - [ -0.0002452300000000, -0.0002251600000000, 0.0015888700000000 ] - [ -0.0002446900000000, 0.0002267300000000, 0.0013732400000000 ] - [ 0.0002972000000000, 0.0006049500000000, 0.0014775800000000 ] - [ 0.0002969500000000, -0.0005998100000000, 0.0014851100000000 ] - [ 0.0000844700000000, -0.0004164600000000, 0.0014299300000000 ] - [ 0.0001536400000000, -0.0000001800000000, 0.0014809900000000 ] - [ 0.0000874700000000, 0.0004175000000000, 0.0015335500000000 ] - [ 0.0004380200000000, 0.0000109100000000, 0.0014874600000000 ] - [ -0.0004777000000000, 0.0000000700000000, 0.0014784400000000 ] - [ 0.0001083200000000, 0.0000487100000000, 0.0017909100000000 ] - [ 0.0001779700000000, -0.0000000300000000, 0.0014814400000000 ] - [ 0.0001091900000000, -0.0000489600000000, 0.0011713100000000 ] - [ -0.0000884300000000, -0.0000656400000000, 0.0014015400000000 ] - [ -0.0000892500000000, 0.0000649100000000, 0.0015599400000000 ] - [ 0.0000888900000000, 0.0000589300000000, 0.0015359300000000 ] - [ 0.0000889800000000, -0.0000587000000000, 0.0014266300000000 ] - [ 0.0000095800000000, -0.0000970500000000, 0.0014742500000000 ] - [ -0.0000130100000000, -0.0000000900000000, 0.0014811700000000 ] - [ 0.0000098100000000, 0.0000972000000000, 0.0014880300000000 ] - [ -0.0000129500000000, 0.0000002300000000, 0.0014810800000000 ] - [ -0.0000891800000000, -0.0001627900000000, 0.0017112800000000 ] - [ 0.0000887400000000, -0.0000590000000000, 0.0015294200000000 ] - [ 0.0000890700000000, 0.0000587000000000, 0.0014329000000000 ] - [ -0.0000884900000000, 0.0001630500000000, 0.0012500100000000 ]- atom: 65 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0004992900000000 ] - [ 0.0001394000000000, 0.0000207400000000, -0.0004366700000000 ] - [ 0.0000000000000000, -0.0000101000000000, -0.0001255500000000 ] - [ -0.0001394000000000, 0.0000207400000000, -0.0004366700000000 ] - [ -0.0000876700000000, 0.0001103500000000, -0.0004366700000000 ] - [ 0.0000876700000000, 0.0001103500000000, -0.0004366700000000 ] - [ 0.0000605700000000, 0.0000349700000000, -0.0002071200000000 ] - [ -0.0000605700000000, 0.0000349700000000, -0.0002071200000000 ] - [ 0.0000087400000000, 0.0000050500000000, -0.0001255500000000 ] - [ 0.0000000000000000, 0.0000573600000000, -0.0001242900000000 ] - [ -0.0000087400000000, 0.0000050500000000, -0.0001255500000000 ] - [ 0.0000000000000000, -0.0000699400000000, -0.0002071200000000 ] - [ 0.0000517400000000, -0.0001311000000000, -0.0004366700000000 ] - [ 0.0000496700000000, -0.0000286800000000, -0.0001242900000000 ] - [ -0.0000496700000000, -0.0000286800000000, -0.0001242900000000 ] - [ -0.0000517400000000, -0.0001311000000000, -0.0004366700000000 ] - [ 0.0024813600000000, -0.0014326100000000, 0.0027512100000000 ] - [ -0.0001241700000000, 0.0000181100000000, 0.0001023200000000 ] - [ 0.0001241700000000, 0.0000181100000000, 0.0001023200000000 ] - [ -0.0024813600000000, -0.0014326100000000, 0.0027512100000000 ] - [ 0.0000000000000000, 0.0028652200000000, 0.0027512100000000 ] - [ -0.0003302600000000, -0.0001906800000000, 0.0000730700000000 ] - [ 0.0000000000000000, -0.0000077900000000, 0.0001020900000000 ] - [ 0.0003302600000000, -0.0001906800000000, 0.0000730700000000 ] - [ 0.0000464000000000, -0.0001165900000000, 0.0001023200000000 ] - [ -0.0000464000000000, -0.0001165900000000, 0.0001023200000000 ] - [ -0.0000067500000000, 0.0000039000000000, 0.0001020900000000 ] - [ 0.0000067500000000, 0.0000039000000000, 0.0001020900000000 ] - [ -0.0000777600000000, 0.0000984800000000, 0.0001023200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001093300000000 ] - [ 0.0000777600000000, 0.0000984800000000, 0.0001023200000000 ] - [ 0.0000000000000000, 0.0003813600000000, 0.0000730700000000 ] - [ 0.0000000000000000, 0.0007312000000000, -0.0007188100000000 ] - [ -0.0001891700000000, 0.0001092200000000, -0.0001856500000000 ] - [ 0.0000000000000000, 0.0000092200000000, -0.0000207900000000 ] - [ 0.0001891700000000, 0.0001092200000000, -0.0001856500000000 ] - [ 0.0006332400000000, -0.0003656000000000, -0.0007188100000000 ] - [ -0.0006332400000000, -0.0003656000000000, -0.0007188100000000 ] - [ -0.0001905100000000, -0.0001061200000000, -0.0001347700000000 ] - [ 0.0001905100000000, -0.0001061200000000, -0.0001347700000000 ] - [ 0.0001871600000000, -0.0001119300000000, -0.0001347700000000 ] - [ 0.0000000000000000, -0.0002184400000000, -0.0001856500000000 ] - [ -0.0001871600000000, -0.0001119300000000, -0.0001347700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000307300000000 ] - [ -0.0000033500000000, 0.0002180500000000, -0.0001347700000000 ] - [ -0.0000079800000000, -0.0000046100000000, -0.0000207900000000 ] - [ 0.0000079800000000, -0.0000046100000000, -0.0000207900000000 ] - [ 0.0000033500000000, 0.0002180500000000, -0.0001347700000000 ] - [ 0.0000000000000000, 0.0098369800000000, 0.0101734400000000 ] - [ 0.0005622200000000, -0.0003246000000000, 0.0011187500000000 ] - [ 0.0000000000000000, -0.0000694900000000, 0.0000942000000000 ] - [ -0.0005622200000000, -0.0003246000000000, 0.0011187500000000 ] - [ 0.0085190700000000, -0.0049184900000000, 0.0101734400000000 ] - [ -0.0085190700000000, -0.0049184900000000, 0.0101734400000000 ] - [ 0.0001526900000000, -0.0003204600000000, 0.0005360900000000 ] - [ -0.0001526900000000, -0.0003204600000000, 0.0005360900000000 ] - [ 0.0002011800000000, 0.0002924700000000, 0.0005360900000000 ] - [ 0.0000000000000000, 0.0006492000000000, 0.0011187500000000 ] - [ -0.0002011800000000, 0.0002924700000000, 0.0005360900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000981800000000 ] - [ 0.0003538700000000, 0.0000279900000000, 0.0005360900000000 ] - [ 0.0000601800000000, 0.0000347400000000, 0.0000942000000000 ] - [ -0.0000601800000000, 0.0000347400000000, 0.0000942000000000 ] - [ -0.0003538700000000, 0.0000279900000000, 0.0005360900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0481743700000000 ] - [ 0.0002760600000000, 0.0001081600000000, -0.0026975500000000 ] - [ 0.0000000000000000, -0.0000006300000000, -0.0016891300000000 ] - [ -0.0002760600000000, 0.0001081600000000, -0.0026975500000000 ] - [ -0.0002317000000000, 0.0001849900000000, -0.0026975500000000 ] - [ 0.0002317000000000, 0.0001849900000000, -0.0026975500000000 ] - [ 0.0000082900000000, 0.0000047900000000, -0.0016418500000000 ] - [ -0.0000082900000000, 0.0000047900000000, -0.0016418500000000 ] - [ 0.0000005500000000, 0.0000003200000000, -0.0016891300000000 ] - [ 0.0000000000000000, -0.0000439600000000, -0.0016413400000000 ] - [ -0.0000005500000000, 0.0000003200000000, -0.0016891300000000 ] - [ 0.0000000000000000, -0.0000095800000000, -0.0016418500000000 ] - [ 0.0000443600000000, -0.0002931500000000, -0.0026975500000000 ] - [ -0.0000380700000000, 0.0000219800000000, -0.0016413400000000 ] - [ 0.0000380700000000, 0.0000219800000000, -0.0016413400000000 ] - [ -0.0000443600000000, -0.0002931500000000, -0.0026975500000000 ] - [ 0.0002214600000000, -0.0001278600000000, -0.0009753200000000 ] - [ 0.0000529800000000, -0.0000063900000000, -0.0013366600000000 ] - [ -0.0000529800000000, -0.0000063900000000, -0.0013366600000000 ] - [ -0.0002214600000000, -0.0001278600000000, -0.0009753200000000 ] - [ 0.0000000000000000, 0.0002557200000000, -0.0009753200000000 ] - [ 0.0001354900000000, 0.0000782200000000, -0.0011009300000000 ] - [ 0.0000000000000000, 0.0000466200000000, -0.0013521000000000 ] - [ -0.0001354900000000, 0.0000782200000000, -0.0011009300000000 ] - [ -0.0000209600000000, 0.0000490800000000, -0.0013366600000000 ] - [ 0.0000209600000000, 0.0000490800000000, -0.0013366600000000 ] - [ 0.0000403700000000, -0.0000233100000000, -0.0013521000000000 ] - [ -0.0000403700000000, -0.0000233100000000, -0.0013521000000000 ] - [ 0.0000320300000000, -0.0000426900000000, -0.0013366600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0014221700000000 ] - [ -0.0000320300000000, -0.0000426900000000, -0.0013366600000000 ] - [ 0.0000000000000000, -0.0001564500000000, -0.0011009300000000 ] - [ -0.0026097900000000, 0.0015067600000000, 0.0037373600000000 ] - [ -0.0001598900000000, -0.0000318700000000, 0.0013398000000000 ] - [ 0.0001598900000000, -0.0000318700000000, 0.0013398000000000 ] - [ 0.0026097900000000, 0.0015067600000000, 0.0037373600000000 ] - [ 0.0000000000000000, -0.0030135300000000, 0.0037373600000000 ] - [ -0.0012552300000000, -0.0007247100000000, 0.0026582900000000 ] - [ 0.0000000000000000, -0.0000045500000000, 0.0012817100000000 ] - [ 0.0012552300000000, -0.0007247100000000, 0.0026582900000000 ] - [ 0.0001075400000000, -0.0001225400000000, 0.0013398000000000 ] - [ -0.0001075400000000, -0.0001225400000000, 0.0013398000000000 ] - [ -0.0000039400000000, 0.0000022800000000, 0.0012817100000000 ] - [ 0.0000039400000000, 0.0000022800000000, 0.0012817100000000 ] - [ -0.0000523500000000, 0.0001544100000000, 0.0013398000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0015008600000000 ] - [ 0.0000523500000000, 0.0001544100000000, 0.0013398000000000 ] - [ 0.0000000000000000, 0.0014494200000000, 0.0026582900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0034355300000000 ] - [ 0.0003104900000000, 0.0000876100000000, 0.0018167300000000 ] - [ 0.0000000000000000, -0.0000078700000000, 0.0014713700000000 ] - [ -0.0003104900000000, 0.0000876100000000, 0.0018167300000000 ] - [ -0.0002311200000000, 0.0002250900000000, 0.0018167300000000 ] - [ 0.0002311200000000, 0.0002250900000000, 0.0018167300000000 ] - [ 0.0000487600000000, 0.0000281500000000, 0.0014685700000000 ] - [ -0.0000487600000000, 0.0000281500000000, 0.0014685700000000 ] - [ 0.0000068200000000, 0.0000039400000000, 0.0014713700000000 ] - [ 0.0000000000000000, 0.0000630700000000, 0.0014684500000000 ] - [ -0.0000068200000000, 0.0000039400000000, 0.0014713700000000 ] - [ 0.0000000000000000, -0.0000563100000000, 0.0014685700000000 ] - [ 0.0000793700000000, -0.0003126900000000, 0.0018167300000000 ] - [ 0.0000546200000000, -0.0000315300000000, 0.0014684500000000 ] - [ -0.0000546200000000, -0.0000315300000000, 0.0014684500000000 ] - [ -0.0000793700000000, -0.0003126900000000, 0.0018167300000000 ]- atom: 65 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0004946300000000 ] - [ -0.0001389800000000, -0.0000207900000000, 0.0004356200000000 ] - [ 0.0000000000000000, 0.0000096900000000, 0.0001246200000000 ] - [ 0.0001389800000000, -0.0000207900000000, 0.0004356200000000 ] - [ 0.0000875000000000, -0.0001099700000000, 0.0004356200000000 ] - [ -0.0000875000000000, -0.0001099700000000, 0.0004356200000000 ] - [ -0.0000606200000000, -0.0000350000000000, 0.0002052900000000 ] - [ 0.0000606200000000, -0.0000350000000000, 0.0002052900000000 ] - [ -0.0000083900000000, -0.0000048500000000, 0.0001246200000000 ] - [ 0.0000000000000000, -0.0000576000000000, 0.0001236100000000 ] - [ 0.0000083900000000, -0.0000048500000000, 0.0001246200000000 ] - [ 0.0000000000000000, 0.0000699900000000, 0.0002052900000000 ] - [ -0.0000514900000000, 0.0001307600000000, 0.0004356200000000 ] - [ -0.0000498900000000, 0.0000288000000000, 0.0001236100000000 ] - [ 0.0000498900000000, 0.0000288000000000, 0.0001236100000000 ] - [ 0.0000514900000000, 0.0001307600000000, 0.0004356200000000 ] - [ -0.0023883000000000, 0.0013788900000000, -0.0026758300000000 ] - [ 0.0001235400000000, -0.0000181700000000, -0.0001011000000000 ] - [ -0.0001235400000000, -0.0000181700000000, -0.0001011000000000 ] - [ 0.0023883000000000, 0.0013788900000000, -0.0026758300000000 ] - [ 0.0000000000000000, -0.0027577700000000, -0.0026758300000000 ] - [ 0.0003280000000000, 0.0001893700000000, -0.0000720300000000 ] - [ 0.0000000000000000, 0.0000077000000000, -0.0001010400000000 ] - [ -0.0003280000000000, 0.0001893700000000, -0.0000720300000000 ] - [ -0.0000460400000000, 0.0001160700000000, -0.0001011000000000 ] - [ 0.0000460400000000, 0.0001160700000000, -0.0001011000000000 ] - [ 0.0000066600000000, -0.0000038500000000, -0.0001010400000000 ] - [ -0.0000066600000000, -0.0000038500000000, -0.0001010400000000 ] - [ 0.0000775000000000, -0.0000979100000000, -0.0001011000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001084500000000 ] - [ -0.0000775000000000, -0.0000979100000000, -0.0001011000000000 ] - [ 0.0000000000000000, -0.0003787400000000, -0.0000720300000000 ] - [ 0.0000000000000000, -0.0007281300000000, 0.0007153300000000 ] - [ 0.0001881300000000, -0.0001086200000000, 0.0001844600000000 ] - [ 0.0000000000000000, -0.0000093000000000, 0.0000204800000000 ] - [ -0.0001881300000000, -0.0001086200000000, 0.0001844600000000 ] - [ -0.0006305800000000, 0.0003640600000000, 0.0007153300000000 ] - [ 0.0006305800000000, 0.0003640600000000, 0.0007153300000000 ] - [ 0.0001892200000000, 0.0001055500000000, 0.0001342400000000 ] - [ -0.0001892200000000, 0.0001055500000000, 0.0001342400000000 ] - [ -0.0001860200000000, 0.0001110900000000, 0.0001342400000000 ] - [ 0.0000000000000000, 0.0002172400000000, 0.0001844600000000 ] - [ 0.0001860200000000, 0.0001110900000000, 0.0001342400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000303100000000 ] - [ 0.0000032000000000, -0.0002166400000000, 0.0001342400000000 ] - [ 0.0000080600000000, 0.0000046500000000, 0.0000204800000000 ] - [ -0.0000080600000000, 0.0000046500000000, 0.0000204800000000 ] - [ -0.0000032000000000, -0.0002166400000000, 0.0001342400000000 ] - [ 0.0000000000000000, -0.0101366300000000, -0.0102484900000000 ] - [ -0.0005601500000000, 0.0003234000000000, -0.0011204900000000 ] - [ 0.0000000000000000, 0.0000685000000000, -0.0000943300000000 ] - [ 0.0005601500000000, 0.0003234000000000, -0.0011204900000000 ] - [ -0.0087785700000000, 0.0050683100000000, -0.0102484900000000 ] - [ 0.0087785700000000, 0.0050683100000000, -0.0102484900000000 ] - [ -0.0001500300000000, 0.0003198800000000, -0.0005362800000000 ] - [ 0.0001500300000000, 0.0003198800000000, -0.0005362800000000 ] - [ -0.0002020100000000, -0.0002898700000000, -0.0005362800000000 ] - [ 0.0000000000000000, -0.0006468000000000, -0.0011204900000000 ] - [ 0.0002020100000000, -0.0002898700000000, -0.0005362800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000962400000000 ] - [ -0.0003520400000000, -0.0000300100000000, -0.0005362800000000 ] - [ -0.0000593200000000, -0.0000342500000000, -0.0000943300000000 ] - [ 0.0000593200000000, -0.0000342500000000, -0.0000943300000000 ] - [ 0.0003520400000000, -0.0000300100000000, -0.0005362800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0452658200000000 ] - [ -0.0002809100000000, -0.0001076800000000, -0.0002689200000000 ] - [ 0.0000000000000000, 0.0000009800000000, -0.0012732800000000 ] - [ 0.0002809100000000, -0.0001076800000000, -0.0002689200000000 ] - [ 0.0002337100000000, -0.0001894300000000, -0.0002689200000000 ] - [ -0.0002337100000000, -0.0001894300000000, -0.0002689200000000 ] - [ -0.0000077200000000, -0.0000044600000000, -0.0013234700000000 ] - [ 0.0000077200000000, -0.0000044600000000, -0.0013234700000000 ] - [ -0.0000008500000000, -0.0000004900000000, -0.0012732800000000 ] - [ 0.0000000000000000, 0.0000430900000000, -0.0013231400000000 ] - [ 0.0000008500000000, -0.0000004900000000, -0.0012732800000000 ] - [ 0.0000000000000000, 0.0000089200000000, -0.0013234700000000 ] - [ -0.0000472000000000, 0.0002971200000000, -0.0002689200000000 ] - [ 0.0000373200000000, -0.0000215500000000, -0.0013231400000000 ] - [ -0.0000373200000000, -0.0000215500000000, -0.0013231400000000 ] - [ 0.0000472000000000, 0.0002971200000000, -0.0002689200000000 ] - [ -0.0002209000000000, 0.0001275400000000, -0.0019861600000000 ] - [ -0.0000524900000000, 0.0000063300000000, -0.0016264100000000 ] - [ 0.0000524900000000, 0.0000063300000000, -0.0016264100000000 ] - [ 0.0002209000000000, 0.0001275400000000, -0.0019861600000000 ] - [ 0.0000000000000000, -0.0002550700000000, -0.0019861600000000 ] - [ -0.0001349100000000, -0.0000778900000000, -0.0018614900000000 ] - [ 0.0000000000000000, -0.0000458300000000, -0.0016110600000000 ] - [ 0.0001349100000000, -0.0000778900000000, -0.0018614900000000 ] - [ 0.0000207600000000, -0.0000486200000000, -0.0016264100000000 ] - [ -0.0000207600000000, -0.0000486200000000, -0.0016264100000000 ] - [ -0.0000396900000000, 0.0000229200000000, -0.0016110600000000 ] - [ 0.0000396900000000, 0.0000229200000000, -0.0016110600000000 ] - [ -0.0000317300000000, 0.0000422900000000, -0.0016264100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0015415000000000 ] - [ 0.0000317300000000, 0.0000422900000000, -0.0016264100000000 ] - [ 0.0000000000000000, 0.0001557800000000, -0.0018614900000000 ] - [ 0.0026307400000000, -0.0015188600000000, -0.0007886100000000 ] - [ 0.0001599000000000, 0.0000327300000000, 0.0016239500000000 ] - [ -0.0001599000000000, 0.0000327300000000, 0.0016239500000000 ] - [ -0.0026307400000000, -0.0015188600000000, -0.0007886100000000 ] - [ 0.0000000000000000, 0.0030377100000000, -0.0007886100000000 ] - [ 0.0012465400000000, 0.0007196900000000, 0.0003039500000000 ] - [ 0.0000000000000000, 0.0000041400000000, 0.0016842600000000 ] - [ -0.0012465400000000, 0.0007196900000000, 0.0003039500000000 ] - [ -0.0001082900000000, 0.0001221100000000, 0.0016239500000000 ] - [ 0.0001082900000000, 0.0001221100000000, 0.0016239500000000 ] - [ 0.0000035900000000, -0.0000020700000000, 0.0016842600000000 ] - [ -0.0000035900000000, -0.0000020700000000, 0.0016842600000000 ] - [ 0.0000516100000000, -0.0001548400000000, 0.0016239500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0014634300000000 ] - [ -0.0000516100000000, -0.0001548400000000, 0.0016239500000000 ] - [ 0.0000000000000000, -0.0014393800000000, 0.0003039500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004629200000000 ] - [ -0.0003093500000000, -0.0000871400000000, 0.0011487500000000 ] - [ 0.0000000000000000, 0.0000077700000000, 0.0014922200000000 ] - [ 0.0003093500000000, -0.0000871400000000, 0.0011487500000000 ] - [ 0.0002301400000000, -0.0002243300000000, 0.0011487500000000 ] - [ -0.0002301400000000, -0.0002243300000000, 0.0011487500000000 ] - [ -0.0000479200000000, -0.0000276600000000, 0.0014951600000000 ] - [ 0.0000479200000000, -0.0000276600000000, 0.0014951600000000 ] - [ -0.0000067300000000, -0.0000038900000000, 0.0014922200000000 ] - [ 0.0000000000000000, -0.0000626300000000, 0.0014952900000000 ] - [ 0.0000067300000000, -0.0000038900000000, 0.0014922200000000 ] - [ 0.0000000000000000, 0.0000553300000000, 0.0014951600000000 ] - [ -0.0000792100000000, 0.0003114800000000, 0.0011487500000000 ] - [ -0.0000542400000000, 0.0000313200000000, 0.0014952900000000 ] - [ 0.0000542400000000, 0.0000313200000000, 0.0014952900000000 ] - [ 0.0000792100000000, 0.0003114800000000, 0.0011487500000000 ]