# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/f76464fc-ac99-459b-82eb-472224d78ba5/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 RbCuSe4 / P2_12_12_1 (19) / materials id 18365](https://mdr.nims.go.jp/datasets/9cb0ea22-c585-41b4-ba13-f96665524897) ## 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: "P2_12_12_1" number: 19 Hall_symbol: "P 2ac 2ab"supercell_matrix:- [ 3, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 5.422063899999999, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 8.598000170000001, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 13.473620230000000 ] # c points: - symbol: Cu # 1 coordinates: [ 0.971614130000000, 0.868656360000000, 0.563261060000000 ] mass: 63.546000 - symbol: Cu # 2 coordinates: [ 0.528385870000000, 0.131343640000000, 0.063261060000000 ] mass: 63.546000 - symbol: Cu # 3 coordinates: [ 0.028385870000000, 0.368656360000000, 0.936738940000000 ] mass: 63.546000 - symbol: Cu # 4 coordinates: [ 0.471614130000000, 0.631343640000000, 0.436738940000000 ] mass: 63.546000 - symbol: Se # 5 coordinates: [ 0.660578350000000, 0.869164020000000, 0.088801040000000 ] mass: 78.960000 - symbol: Se # 6 coordinates: [ 0.839421650000000, 0.130835980000000, 0.588801040000000 ] mass: 78.960000 - symbol: Se # 7 coordinates: [ 0.339421650000000, 0.369164020000000, 0.411198960000000 ] mass: 78.960000 - symbol: Se # 8 coordinates: [ 0.160578350000000, 0.630835980000000, 0.911198960000000 ] mass: 78.960000 - symbol: Se # 9 coordinates: [ 0.643739590000000, 0.694504100000000, 0.596694840000000 ] mass: 78.960000 - symbol: Se # 10 coordinates: [ 0.143739590000000, 0.805495900000000, 0.403305160000000 ] mass: 78.960000 - symbol: Se # 11 coordinates: [ 0.356260410000000, 0.194504100000000, 0.903305160000000 ] mass: 78.960000 - symbol: Se # 12 coordinates: [ 0.856260410000000, 0.305495900000000, 0.096694840000000 ] mass: 78.960000 - symbol: Se # 13 coordinates: [ 0.342399270000000, 0.870786640000000, 0.665131210000000 ] mass: 78.960000 - symbol: Se # 14 coordinates: [ 0.842399270000000, 0.629213360000000, 0.334868790000000 ] mass: 78.960000 - symbol: Se # 15 coordinates: [ 0.657600730000000, 0.370786640000000, 0.834868790000000 ] mass: 78.960000 - symbol: Se # 16 coordinates: [ 0.157600730000000, 0.129213360000000, 0.165131210000000 ] mass: 78.960000 - symbol: Se # 17 coordinates: [ 0.397863550000000, 0.097391510000000, 0.558509970000000 ] mass: 78.960000 - symbol: Se # 18 coordinates: [ 0.897863550000000, 0.402608490000000, 0.441490030000000 ] mass: 78.960000 - symbol: Se # 19 coordinates: [ 0.602136450000000, 0.597391510000000, 0.941490030000000 ] mass: 78.960000 - symbol: Se # 20 coordinates: [ 0.102136450000000, 0.902608490000000, 0.058509970000000 ] mass: 78.960000 - symbol: Rb # 21 coordinates: [ 0.674953460000000, 0.048313820000000, 0.328286210000000 ] mass: 85.467800 - symbol: Rb # 22 coordinates: [ 0.174953460000000, 0.451686180000000, 0.671713790000000 ] mass: 85.467800 - symbol: Rb # 23 coordinates: [ 0.325046540000000, 0.548313820000000, 0.171713790000000 ] mass: 85.467800 - symbol: Rb # 24 coordinates: [ 0.825046540000000, 0.951686180000000, 0.828286210000000 ] mass: 85.467800 reciprocal_lattice: # without 2pi - [ 0.184431614684585, 0.000000000000000, 0.000000000000000 ] # a* - [ 0.000000000000000, 0.116306115402182, 0.000000000000000 ] # b* - [ 0.000000000000000, 0.000000000000000, 0.074219102433467 ] # c*unit_cell: lattice: - [ 5.422063900000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 8.598000170000001, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 13.473620230000000 ] # c points: - symbol: Cu # 1 coordinates: [ 0.971614130000000, 0.868656360000000, 0.563261060000000 ] mass: 63.546000 reduced_to: 1 - symbol: Cu # 2 coordinates: [ 0.528385870000000, 0.131343640000000, 0.063261060000000 ] mass: 63.546000 reduced_to: 2 - symbol: Cu # 3 coordinates: [ 0.028385870000000, 0.368656360000000, 0.936738940000000 ] mass: 63.546000 reduced_to: 3 - symbol: Cu # 4 coordinates: [ 0.471614130000000, 0.631343640000000, 0.436738940000000 ] mass: 63.546000 reduced_to: 4 - symbol: Se # 5 coordinates: [ 0.660578350000000, 0.869164020000000, 0.088801040000000 ] mass: 78.960000 reduced_to: 5 - symbol: Se # 6 coordinates: [ 0.839421650000000, 0.130835980000000, 0.588801040000000 ] mass: 78.960000 reduced_to: 6 - symbol: Se # 7 coordinates: [ 0.339421650000000, 0.369164020000000, 0.411198960000000 ] mass: 78.960000 reduced_to: 7 - symbol: Se # 8 coordinates: [ 0.160578350000000, 0.630835980000000, 0.911198960000000 ] mass: 78.960000 reduced_to: 8 - symbol: Se # 9 coordinates: [ 0.643739590000000, 0.694504100000000, 0.596694840000000 ] mass: 78.960000 reduced_to: 9 - symbol: Se # 10 coordinates: [ 0.143739590000000, 0.805495900000000, 0.403305160000000 ] mass: 78.960000 reduced_to: 10 - symbol: Se # 11 coordinates: [ 0.356260410000000, 0.194504100000000, 0.903305160000000 ] mass: 78.960000 reduced_to: 11 - symbol: Se # 12 coordinates: [ 0.856260410000000, 0.305495900000000, 0.096694840000000 ] mass: 78.960000 reduced_to: 12 - symbol: Se # 13 coordinates: [ 0.342399270000000, 0.870786640000000, 0.665131210000000 ] mass: 78.960000 reduced_to: 13 - symbol: Se # 14 coordinates: [ 0.842399270000000, 0.629213360000000, 0.334868790000000 ] mass: 78.960000 reduced_to: 14 - symbol: Se # 15 coordinates: [ 0.657600730000000, 0.370786640000000, 0.834868790000000 ] mass: 78.960000 reduced_to: 15 - symbol: Se # 16 coordinates: [ 0.157600730000000, 0.129213360000000, 0.165131210000000 ] mass: 78.960000 reduced_to: 16 - symbol: Se # 17 coordinates: [ 0.397863550000000, 0.097391510000000, 0.558509970000000 ] mass: 78.960000 reduced_to: 17 - symbol: Se # 18 coordinates: [ 0.897863550000000, 0.402608490000000, 0.441490030000000 ] mass: 78.960000 reduced_to: 18 - symbol: Se # 19 coordinates: [ 0.602136450000000, 0.597391510000000, 0.941490030000000 ] mass: 78.960000 reduced_to: 19 - symbol: Se # 20 coordinates: [ 0.102136450000000, 0.902608490000000, 0.058509970000000 ] mass: 78.960000 reduced_to: 20 - symbol: Rb # 21 coordinates: [ 0.674953460000000, 0.048313820000000, 0.328286210000000 ] mass: 85.467800 reduced_to: 21 - symbol: Rb # 22 coordinates: [ 0.174953460000000, 0.451686180000000, 0.671713790000000 ] mass: 85.467800 reduced_to: 22 - symbol: Rb # 23 coordinates: [ 0.325046540000000, 0.548313820000000, 0.171713790000000 ] mass: 85.467800 reduced_to: 23 - symbol: Rb # 24 coordinates: [ 0.825046540000000, 0.951686180000000, 0.828286210000000 ] mass: 85.467800 reduced_to: 24supercell: lattice: - [ 16.266191700000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 17.196000340000001, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 13.473620230000000 ] # c points: - symbol: Cu # 1 coordinates: [ 0.323871376666667, 0.434328180000000, 0.563261060000000 ] mass: 63.546000 reduced_to: 1 - symbol: Cu # 2 coordinates: [ 0.657204710000000, 0.434328180000000, 0.563261060000000 ] mass: 63.546000 reduced_to: 1 - symbol: Cu # 3 coordinates: [ 0.990538043333333, 0.434328180000000, 0.563261060000000 ] mass: 63.546000 reduced_to: 1 - symbol: Cu # 4 coordinates: [ 0.323871376666667, 0.934328180000000, 0.563261060000000 ] mass: 63.546000 reduced_to: 1 - symbol: Cu # 5 coordinates: [ 0.657204710000000, 0.934328180000000, 0.563261060000000 ] mass: 63.546000 reduced_to: 1 - symbol: Cu # 6 coordinates: [ 0.990538043333333, 0.934328180000000, 0.563261060000000 ] mass: 63.546000 reduced_to: 1 - symbol: Cu # 7 coordinates: [ 0.176128623333333, 0.065671820000000, 0.063261060000000 ] mass: 63.546000 reduced_to: 7 - symbol: Cu # 8 coordinates: [ 0.509461956666667, 0.065671820000000, 0.063261060000000 ] mass: 63.546000 reduced_to: 7 - symbol: Cu # 9 coordinates: [ 0.842795290000000, 0.065671820000000, 0.063261060000000 ] mass: 63.546000 reduced_to: 7 - symbol: Cu # 10 coordinates: [ 0.176128623333333, 0.565671820000000, 0.063261060000000 ] mass: 63.546000 reduced_to: 7 - symbol: Cu # 11 coordinates: [ 0.509461956666667, 0.565671820000000, 0.063261060000000 ] mass: 63.546000 reduced_to: 7 - symbol: Cu # 12 coordinates: [ 0.842795290000000, 0.565671820000000, 0.063261060000000 ] mass: 63.546000 reduced_to: 7 - symbol: Cu # 13 coordinates: [ 0.009461956666667, 0.184328180000000, 0.936738940000000 ] mass: 63.546000 reduced_to: 13 - symbol: Cu # 14 coordinates: [ 0.342795290000000, 0.184328180000000, 0.936738940000000 ] mass: 63.546000 reduced_to: 13 - symbol: Cu # 15 coordinates: [ 0.676128623333333, 0.184328180000000, 0.936738940000000 ] mass: 63.546000 reduced_to: 13 - symbol: Cu # 16 coordinates: [ 0.009461956666667, 0.684328180000000, 0.936738940000000 ] mass: 63.546000 reduced_to: 13 - symbol: Cu # 17 coordinates: [ 0.342795290000000, 0.684328180000000, 0.936738940000000 ] mass: 63.546000 reduced_to: 13 - symbol: Cu # 18 coordinates: [ 0.676128623333333, 0.684328180000000, 0.936738940000000 ] mass: 63.546000 reduced_to: 13 - symbol: Cu # 19 coordinates: [ 0.157204710000000, 0.315671820000000, 0.436738940000000 ] mass: 63.546000 reduced_to: 19 - symbol: Cu # 20 coordinates: [ 0.490538043333333, 0.315671820000000, 0.436738940000000 ] mass: 63.546000 reduced_to: 19 - symbol: Cu # 21 coordinates: [ 0.823871376666667, 0.315671820000000, 0.436738940000000 ] mass: 63.546000 reduced_to: 19 - symbol: Cu # 22 coordinates: [ 0.157204710000000, 0.815671820000000, 0.436738940000000 ] mass: 63.546000 reduced_to: 19 - symbol: Cu # 23 coordinates: [ 0.490538043333333, 0.815671820000000, 0.436738940000000 ] mass: 63.546000 reduced_to: 19 - symbol: Cu # 24 coordinates: [ 0.823871376666667, 0.815671820000000, 0.436738940000000 ] mass: 63.546000 reduced_to: 19 - symbol: Se # 25 coordinates: [ 0.220192783333333, 0.434582010000000, 0.088801040000000 ] mass: 78.960000 reduced_to: 25 - symbol: Se # 26 coordinates: [ 0.553526116666667, 0.434582010000000, 0.088801040000000 ] mass: 78.960000 reduced_to: 25 - symbol: Se # 27 coordinates: [ 0.886859450000000, 0.434582010000000, 0.088801040000000 ] mass: 78.960000 reduced_to: 25 - symbol: Se # 28 coordinates: [ 0.220192783333333, 0.934582010000000, 0.088801040000000 ] mass: 78.960000 reduced_to: 25 - symbol: Se # 29 coordinates: [ 0.553526116666667, 0.934582010000000, 0.088801040000000 ] mass: 78.960000 reduced_to: 25 - symbol: Se # 30 coordinates: [ 0.886859450000000, 0.934582010000000, 0.088801040000000 ] mass: 78.960000 reduced_to: 25 - symbol: Se # 31 coordinates: [ 0.279807216666667, 0.065417990000000, 0.588801040000000 ] mass: 78.960000 reduced_to: 31 - symbol: Se # 32 coordinates: [ 0.613140550000000, 0.065417990000000, 0.588801040000000 ] mass: 78.960000 reduced_to: 31 - symbol: Se # 33 coordinates: [ 0.946473883333333, 0.065417990000000, 0.588801040000000 ] mass: 78.960000 reduced_to: 31 - symbol: Se # 34 coordinates: [ 0.279807216666667, 0.565417990000000, 0.588801040000000 ] mass: 78.960000 reduced_to: 31 - symbol: Se # 35 coordinates: [ 0.613140550000000, 0.565417990000000, 0.588801040000000 ] mass: 78.960000 reduced_to: 31 - symbol: Se # 36 coordinates: [ 0.946473883333333, 0.565417990000000, 0.588801040000000 ] mass: 78.960000 reduced_to: 31 - symbol: Se # 37 coordinates: [ 0.113140550000000, 0.184582010000000, 0.411198960000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 38 coordinates: [ 0.446473883333333, 0.184582010000000, 0.411198960000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 39 coordinates: [ 0.779807216666667, 0.184582010000000, 0.411198960000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 40 coordinates: [ 0.113140550000000, 0.684582010000000, 0.411198960000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 41 coordinates: [ 0.446473883333333, 0.684582010000000, 0.411198960000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 42 coordinates: [ 0.779807216666667, 0.684582010000000, 0.411198960000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 43 coordinates: [ 0.053526116666667, 0.315417990000000, 0.911198960000000 ] mass: 78.960000 reduced_to: 43 - symbol: Se # 44 coordinates: [ 0.386859450000000, 0.315417990000000, 0.911198960000000 ] mass: 78.960000 reduced_to: 43 - symbol: Se # 45 coordinates: [ 0.720192783333333, 0.315417990000000, 0.911198960000000 ] mass: 78.960000 reduced_to: 43 - symbol: Se # 46 coordinates: [ 0.053526116666667, 0.815417990000000, 0.911198960000000 ] mass: 78.960000 reduced_to: 43 - symbol: Se # 47 coordinates: [ 0.386859450000000, 0.815417990000000, 0.911198960000000 ] mass: 78.960000 reduced_to: 43 - symbol: Se # 48 coordinates: [ 0.720192783333333, 0.815417990000000, 0.911198960000000 ] mass: 78.960000 reduced_to: 43 - symbol: Se # 49 coordinates: [ 0.214579863333333, 0.347252050000000, 0.596694840000000 ] mass: 78.960000 reduced_to: 49 - symbol: Se # 50 coordinates: [ 0.547913196666667, 0.347252050000000, 0.596694840000000 ] mass: 78.960000 reduced_to: 49 - symbol: Se # 51 coordinates: [ 0.881246530000000, 0.347252050000000, 0.596694840000000 ] mass: 78.960000 reduced_to: 49 - symbol: Se # 52 coordinates: [ 0.214579863333333, 0.847252050000000, 0.596694840000000 ] mass: 78.960000 reduced_to: 49 - symbol: Se # 53 coordinates: [ 0.547913196666667, 0.847252050000000, 0.596694840000000 ] mass: 78.960000 reduced_to: 49 - symbol: Se # 54 coordinates: [ 0.881246530000000, 0.847252050000000, 0.596694840000000 ] mass: 78.960000 reduced_to: 49 - symbol: Se # 55 coordinates: [ 0.047913196666667, 0.402747950000000, 0.403305160000000 ] mass: 78.960000 reduced_to: 55 - symbol: Se # 56 coordinates: [ 0.381246530000000, 0.402747950000000, 0.403305160000000 ] mass: 78.960000 reduced_to: 55 - symbol: Se # 57 coordinates: [ 0.714579863333333, 0.402747950000000, 0.403305160000000 ] mass: 78.960000 reduced_to: 55 - symbol: Se # 58 coordinates: [ 0.047913196666667, 0.902747950000000, 0.403305160000000 ] mass: 78.960000 reduced_to: 55 - symbol: Se # 59 coordinates: [ 0.381246530000000, 0.902747950000000, 0.403305160000000 ] mass: 78.960000 reduced_to: 55 - symbol: Se # 60 coordinates: [ 0.714579863333333, 0.902747950000000, 0.403305160000000 ] mass: 78.960000 reduced_to: 55 - symbol: Se # 61 coordinates: [ 0.118753470000000, 0.097252050000000, 0.903305160000000 ] mass: 78.960000 reduced_to: 61 - symbol: Se # 62 coordinates: [ 0.452086803333333, 0.097252050000000, 0.903305160000000 ] mass: 78.960000 reduced_to: 61 - symbol: Se # 63 coordinates: [ 0.785420136666667, 0.097252050000000, 0.903305160000000 ] mass: 78.960000 reduced_to: 61 - symbol: Se # 64 coordinates: [ 0.118753470000000, 0.597252050000000, 0.903305160000000 ] mass: 78.960000 reduced_to: 61 - symbol: Se # 65 coordinates: [ 0.452086803333333, 0.597252050000000, 0.903305160000000 ] mass: 78.960000 reduced_to: 61 - symbol: Se # 66 coordinates: [ 0.785420136666667, 0.597252050000000, 0.903305160000000 ] mass: 78.960000 reduced_to: 61 - symbol: Se # 67 coordinates: [ 0.285420136666667, 0.152747950000000, 0.096694840000000 ] mass: 78.960000 reduced_to: 67 - symbol: Se # 68 coordinates: [ 0.618753470000000, 0.152747950000000, 0.096694840000000 ] mass: 78.960000 reduced_to: 67 - symbol: Se # 69 coordinates: [ 0.952086803333333, 0.152747950000000, 0.096694840000000 ] mass: 78.960000 reduced_to: 67 - symbol: Se # 70 coordinates: [ 0.285420136666667, 0.652747950000000, 0.096694840000000 ] mass: 78.960000 reduced_to: 67 - symbol: Se # 71 coordinates: [ 0.618753470000000, 0.652747950000000, 0.096694840000000 ] mass: 78.960000 reduced_to: 67 - symbol: Se # 72 coordinates: [ 0.952086803333333, 0.652747950000000, 0.096694840000000 ] mass: 78.960000 reduced_to: 67 - symbol: Se # 73 coordinates: [ 0.114133090000000, 0.435393320000000, 0.665131210000000 ] mass: 78.960000 reduced_to: 73 - symbol: Se # 74 coordinates: [ 0.447466423333333, 0.435393320000000, 0.665131210000000 ] mass: 78.960000 reduced_to: 73 - symbol: Se # 75 coordinates: [ 0.780799756666667, 0.435393320000000, 0.665131210000000 ] mass: 78.960000 reduced_to: 73 - symbol: Se # 76 coordinates: [ 0.114133090000000, 0.935393320000000, 0.665131210000000 ] mass: 78.960000 reduced_to: 73 - symbol: Se # 77 coordinates: [ 0.447466423333333, 0.935393320000000, 0.665131210000000 ] mass: 78.960000 reduced_to: 73 - symbol: Se # 78 coordinates: [ 0.780799756666667, 0.935393320000000, 0.665131210000000 ] mass: 78.960000 reduced_to: 73 - symbol: Se # 79 coordinates: [ 0.280799756666667, 0.314606680000000, 0.334868790000000 ] mass: 78.960000 reduced_to: 79 - symbol: Se # 80 coordinates: [ 0.614133090000000, 0.314606680000000, 0.334868790000000 ] mass: 78.960000 reduced_to: 79 - symbol: Se # 81 coordinates: [ 0.947466423333333, 0.314606680000000, 0.334868790000000 ] mass: 78.960000 reduced_to: 79 - symbol: Se # 82 coordinates: [ 0.280799756666667, 0.814606680000000, 0.334868790000000 ] mass: 78.960000 reduced_to: 79 - symbol: Se # 83 coordinates: [ 0.614133090000000, 0.814606680000000, 0.334868790000000 ] mass: 78.960000 reduced_to: 79 - symbol: Se # 84 coordinates: [ 0.947466423333333, 0.814606680000000, 0.334868790000000 ] mass: 78.960000 reduced_to: 79 - symbol: Se # 85 coordinates: [ 0.219200243333333, 0.185393320000000, 0.834868790000000 ] mass: 78.960000 reduced_to: 85 - symbol: Se # 86 coordinates: [ 0.552533576666667, 0.185393320000000, 0.834868790000000 ] mass: 78.960000 reduced_to: 85 - symbol: Se # 87 coordinates: [ 0.885866910000000, 0.185393320000000, 0.834868790000000 ] mass: 78.960000 reduced_to: 85 - symbol: Se # 88 coordinates: [ 0.219200243333333, 0.685393320000000, 0.834868790000000 ] mass: 78.960000 reduced_to: 85 - symbol: Se # 89 coordinates: [ 0.552533576666667, 0.685393320000000, 0.834868790000000 ] mass: 78.960000 reduced_to: 85 - symbol: Se # 90 coordinates: [ 0.885866910000000, 0.685393320000000, 0.834868790000000 ] mass: 78.960000 reduced_to: 85 - symbol: Se # 91 coordinates: [ 0.052533576666667, 0.064606680000000, 0.165131210000000 ] mass: 78.960000 reduced_to: 91 - symbol: Se # 92 coordinates: [ 0.385866910000000, 0.064606680000000, 0.165131210000000 ] mass: 78.960000 reduced_to: 91 - symbol: Se # 93 coordinates: [ 0.719200243333333, 0.064606680000000, 0.165131210000000 ] mass: 78.960000 reduced_to: 91 - symbol: Se # 94 coordinates: [ 0.052533576666667, 0.564606680000000, 0.165131210000000 ] mass: 78.960000 reduced_to: 91 - symbol: Se # 95 coordinates: [ 0.385866910000000, 0.564606680000000, 0.165131210000000 ] mass: 78.960000 reduced_to: 91 - symbol: Se # 96 coordinates: [ 0.719200243333333, 0.564606680000000, 0.165131210000000 ] mass: 78.960000 reduced_to: 91 - symbol: Se # 97 coordinates: [ 0.132621183333333, 0.048695755000000, 0.558509970000000 ] mass: 78.960000 reduced_to: 97 - symbol: Se # 98 coordinates: [ 0.465954516666667, 0.048695755000000, 0.558509970000000 ] mass: 78.960000 reduced_to: 97 - symbol: Se # 99 coordinates: [ 0.799287850000000, 0.048695755000000, 0.558509970000000 ] mass: 78.960000 reduced_to: 97 - symbol: Se # 100 coordinates: [ 0.132621183333333, 0.548695755000000, 0.558509970000000 ] mass: 78.960000 reduced_to: 97 - symbol: Se # 101 coordinates: [ 0.465954516666667, 0.548695755000000, 0.558509970000000 ] mass: 78.960000 reduced_to: 97 - symbol: Se # 102 coordinates: [ 0.799287850000000, 0.548695755000000, 0.558509970000000 ] mass: 78.960000 reduced_to: 97 - symbol: Se # 103 coordinates: [ 0.299287850000000, 0.201304245000000, 0.441490030000000 ] mass: 78.960000 reduced_to: 103 - symbol: Se # 104 coordinates: [ 0.632621183333333, 0.201304245000000, 0.441490030000000 ] mass: 78.960000 reduced_to: 103 - symbol: Se # 105 coordinates: [ 0.965954516666667, 0.201304245000000, 0.441490030000000 ] mass: 78.960000 reduced_to: 103 - symbol: Se # 106 coordinates: [ 0.299287850000000, 0.701304245000000, 0.441490030000000 ] mass: 78.960000 reduced_to: 103 - symbol: Se # 107 coordinates: [ 0.632621183333333, 0.701304245000000, 0.441490030000000 ] mass: 78.960000 reduced_to: 103 - symbol: Se # 108 coordinates: [ 0.965954516666667, 0.701304245000000, 0.441490030000000 ] mass: 78.960000 reduced_to: 103 - symbol: Se # 109 coordinates: [ 0.200712150000000, 0.298695755000000, 0.941490030000000 ] mass: 78.960000 reduced_to: 109 - symbol: Se # 110 coordinates: [ 0.534045483333333, 0.298695755000000, 0.941490030000000 ] mass: 78.960000 reduced_to: 109 - symbol: Se # 111 coordinates: [ 0.867378816666667, 0.298695755000000, 0.941490030000000 ] mass: 78.960000 reduced_to: 109 - symbol: Se # 112 coordinates: [ 0.200712150000000, 0.798695755000000, 0.941490030000000 ] mass: 78.960000 reduced_to: 109 - symbol: Se # 113 coordinates: [ 0.534045483333333, 0.798695755000000, 0.941490030000000 ] mass: 78.960000 reduced_to: 109 - symbol: Se # 114 coordinates: [ 0.867378816666667, 0.798695755000000, 0.941490030000000 ] mass: 78.960000 reduced_to: 109 - symbol: Se # 115 coordinates: [ 0.034045483333333, 0.451304245000000, 0.058509970000000 ] mass: 78.960000 reduced_to: 115 - symbol: Se # 116 coordinates: [ 0.367378816666667, 0.451304245000000, 0.058509970000000 ] mass: 78.960000 reduced_to: 115 - symbol: Se # 117 coordinates: [ 0.700712150000000, 0.451304245000000, 0.058509970000000 ] mass: 78.960000 reduced_to: 115 - symbol: Se # 118 coordinates: [ 0.034045483333333, 0.951304245000000, 0.058509970000000 ] mass: 78.960000 reduced_to: 115 - symbol: Se # 119 coordinates: [ 0.367378816666667, 0.951304245000000, 0.058509970000000 ] mass: 78.960000 reduced_to: 115 - symbol: Se # 120 coordinates: [ 0.700712150000000, 0.951304245000000, 0.058509970000000 ] mass: 78.960000 reduced_to: 115 - symbol: Rb # 121 coordinates: [ 0.224984486666667, 0.024156910000000, 0.328286210000000 ] mass: 85.467800 reduced_to: 121 - symbol: Rb # 122 coordinates: [ 0.558317820000000, 0.024156910000000, 0.328286210000000 ] mass: 85.467800 reduced_to: 121 - symbol: Rb # 123 coordinates: [ 0.891651153333333, 0.024156910000000, 0.328286210000000 ] mass: 85.467800 reduced_to: 121 - symbol: Rb # 124 coordinates: [ 0.224984486666667, 0.524156910000000, 0.328286210000000 ] mass: 85.467800 reduced_to: 121 - symbol: Rb # 125 coordinates: [ 0.558317820000000, 0.524156910000000, 0.328286210000000 ] mass: 85.467800 reduced_to: 121 - symbol: Rb # 126 coordinates: [ 0.891651153333333, 0.524156910000000, 0.328286210000000 ] mass: 85.467800 reduced_to: 121 - symbol: Rb # 127 coordinates: [ 0.058317820000000, 0.225843090000000, 0.671713790000000 ] mass: 85.467800 reduced_to: 127 - symbol: Rb # 128 coordinates: [ 0.391651153333333, 0.225843090000000, 0.671713790000000 ] mass: 85.467800 reduced_to: 127 - symbol: Rb # 129 coordinates: [ 0.724984486666667, 0.225843090000000, 0.671713790000000 ] mass: 85.467800 reduced_to: 127 - symbol: Rb # 130 coordinates: [ 0.058317820000000, 0.725843090000000, 0.671713790000000 ] mass: 85.467800 reduced_to: 127 - symbol: Rb # 131 coordinates: [ 0.391651153333333, 0.725843090000000, 0.671713790000000 ] mass: 85.467800 reduced_to: 127 - symbol: Rb # 132 coordinates: [ 0.724984486666667, 0.725843090000000, 0.671713790000000 ] mass: 85.467800 reduced_to: 127 - symbol: Rb # 133 coordinates: [ 0.108348846666667, 0.274156910000000, 0.171713790000000 ] mass: 85.467800 reduced_to: 133 - symbol: Rb # 134 coordinates: [ 0.441682180000000, 0.274156910000000, 0.171713790000000 ] mass: 85.467800 reduced_to: 133 - symbol: Rb # 135 coordinates: [ 0.775015513333333, 0.274156910000000, 0.171713790000000 ] mass: 85.467800 reduced_to: 133 - symbol: Rb # 136 coordinates: [ 0.108348846666667, 0.774156910000000, 0.171713790000000 ] mass: 85.467800 reduced_to: 133 - symbol: Rb # 137 coordinates: [ 0.441682180000000, 0.774156910000000, 0.171713790000000 ] mass: 85.467800 reduced_to: 133 - symbol: Rb # 138 coordinates: [ 0.775015513333333, 0.774156910000000, 0.171713790000000 ] mass: 85.467800 reduced_to: 133 - symbol: Rb # 139 coordinates: [ 0.275015513333333, 0.475843090000000, 0.828286210000000 ] mass: 85.467800 reduced_to: 139 - symbol: Rb # 140 coordinates: [ 0.608348846666667, 0.475843090000000, 0.828286210000000 ] mass: 85.467800 reduced_to: 139 - symbol: Rb # 141 coordinates: [ 0.941682180000000, 0.475843090000000, 0.828286210000000 ] mass: 85.467800 reduced_to: 139 - symbol: Rb # 142 coordinates: [ 0.275015513333333, 0.975843090000000, 0.828286210000000 ] mass: 85.467800 reduced_to: 139 - symbol: Rb # 143 coordinates: [ 0.608348846666667, 0.975843090000000, 0.828286210000000 ] mass: 85.467800 reduced_to: 139 - symbol: Rb # 144 coordinates: [ 0.941682180000000, 0.975843090000000, 0.828286210000000 ] mass: 85.467800 reduced_to: 139born_effective_charge:- # 1 (Cu) - [ -0.518009430000000, -0.658733760000000, -0.090074350000000 ] - [ -0.206751810000000, 0.270206060000000, 0.349751910000000 ] - [ -0.082592900000000, 0.100059200000000, 0.214994990000000 ]- # 2 (Cu) - [ -0.518009430000000, -0.658733760000000, 0.090074350000000 ] - [ -0.206751810000000, 0.270206060000000, -0.349751910000000 ] - [ 0.082592900000000, -0.100059200000000, 0.214994990000000 ]- # 3 (Cu) - [ -0.518009430000000, 0.658733760000000, -0.090074350000000 ] - [ 0.206751810000000, 0.270206060000000, -0.349751910000000 ] - [ -0.082592900000000, -0.100059200000000, 0.214994990000000 ]- # 4 (Cu) - [ -0.518009430000000, 0.658733760000000, 0.090074350000000 ] - [ 0.206751810000000, 0.270206060000000, 0.349751910000000 ] - [ 0.082592900000000, 0.100059200000000, 0.214994990000000 ]- # 5 (Se) - [ -0.542071590000000, -0.495755480000000, 0.375787230000000 ] - [ -1.190581410000000, -1.693108980000000, -0.341691350000000 ] - [ 0.002633500000000, -0.145001280000000, -1.004179640000000 ]- # 6 (Se) - [ -0.542071590000000, -0.495755480000000, -0.375787230000000 ] - [ -1.190581410000000, -1.693108980000000, 0.341691350000000 ] - [ -0.002633500000000, 0.145001280000000, -1.004179640000000 ]- # 7 (Se) - [ -0.542071590000000, 0.495755480000000, 0.375787230000000 ] - [ 1.190581410000000, -1.693108980000000, 0.341691350000000 ] - [ 0.002633500000000, 0.145001280000000, -1.004179640000000 ]- # 8 (Se) - [ -0.542071590000000, 0.495755480000000, -0.375787230000000 ] - [ 1.190581410000000, -1.693108980000000, -0.341691350000000 ] - [ -0.002633500000000, -0.145001280000000, -1.004179640000000 ]- # 9 (Se) - [ -0.445627020000000, -0.232860160000000, -0.191424000000000 ] - [ 0.137307920000000, -0.681456270000000, 0.408396350000000 ] - [ -0.400657410000000, 0.335364410000000, -0.365838210000000 ]- # 10 (Se) - [ -0.445627020000000, 0.232860160000000, 0.191424000000000 ] - [ -0.137307920000000, -0.681456270000000, 0.408396350000000 ] - [ 0.400657410000000, 0.335364410000000, -0.365838210000000 ]- # 11 (Se) - [ -0.445627020000000, 0.232860160000000, -0.191424000000000 ] - [ -0.137307920000000, -0.681456270000000, -0.408396350000000 ] - [ -0.400657410000000, -0.335364410000000, -0.365838210000000 ]- # 12 (Se) - [ -0.445627020000000, -0.232860160000000, 0.191424000000000 ] - [ 0.137307920000000, -0.681456270000000, -0.408396350000000 ] - [ 0.400657410000000, -0.335364410000000, -0.365838210000000 ]- # 13 (Se) - [ -0.620321130000000, -0.449069670000000, 0.084676950000000 ] - [ -0.880873450000000, -0.913106430000000, 0.336399130000000 ] - [ 0.156433370000000, 0.335079010000000, -0.729787990000000 ]- # 14 (Se) - [ -0.620321130000000, 0.449069670000000, -0.084676950000000 ] - [ 0.880873450000000, -0.913106430000000, 0.336399130000000 ] - [ -0.156433370000000, 0.335079010000000, -0.729787990000000 ]- # 15 (Se) - [ -0.620321130000000, 0.449069670000000, 0.084676950000000 ] - [ 0.880873450000000, -0.913106430000000, -0.336399130000000 ] - [ 0.156433370000000, -0.335079010000000, -0.729787990000000 ]- # 16 (Se) - [ -0.620321130000000, -0.449069670000000, -0.084676950000000 ] - [ -0.880873450000000, -0.913106430000000, -0.336399130000000 ] - [ -0.156433370000000, -0.335079010000000, -0.729787990000000 ]- # 17 (Se) - [ 0.950213020000000, 0.613069190000000, 0.462018900000000 ] - [ 1.301466060000000, 1.587367740000000, -1.850258980000000 ] - [ 0.196787440000000, -1.064663090000000, 0.238801680000000 ]- # 18 (Se) - [ 0.950213020000000, -0.613069190000000, -0.462018900000000 ] - [ -1.301466060000000, 1.587367740000000, -1.850258980000001 ] - [ -0.196787440000000, -1.064663090000000, 0.238801680000000 ]- # 19 (Se) - [ 0.950213020000000, -0.613069190000000, 0.462018900000000 ] - [ -1.301466060000000, 1.587367740000000, 1.850258980000001 ] - [ 0.196787440000000, 1.064663090000000, 0.238801680000000 ]- # 20 (Se) - [ 0.950213020000000, 0.613069190000000, -0.462018900000000 ] - [ 1.301466060000000, 1.587367740000000, 1.850258980000001 ] - [ -0.196787440000000, 1.064663090000000, 0.238801680000000 ]- # 21 (Rb) - [ 1.175816150000000, -0.049628520000000, -0.119217320000000 ] - [ -0.051434710000000, 1.430097870000000, 0.092007650000000 ] - [ -0.012155050000000, -0.143855700000000, 1.646009150000000 ]- # 22 (Rb) - [ 1.175816150000000, 0.049628520000000, 0.119217320000000 ] - [ 0.051434710000000, 1.430097870000000, 0.092007650000000 ] - [ 0.012155050000000, -0.143855700000000, 1.646009150000000 ]- # 23 (Rb) - [ 1.175816150000000, 0.049628520000000, -0.119217320000000 ] - [ 0.051434710000000, 1.430097870000000, -0.092007650000000 ] - [ -0.012155050000000, 0.143855700000000, 1.646009150000000 ]- # 24 (Rb) - [ 1.175816150000000, -0.049628520000000, 0.119217320000000 ] - [ -0.051434710000000, 1.430097870000000, -0.092007650000000 ] - [ 0.012155050000000, 0.143855700000000, 1.646009150000000 ]dielectric_constant: - [ 15.497578430000001, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 10.410764950000001, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 6.333645500000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0443970100000000, -0.0658311400000000, -0.0072055400000000 ] - [ 0.0132668000000000, -0.0600525500000000, -0.0147476600000000 ] - [ 0.0132672100000000, -0.0603934500000000, -0.0151363900000000 ] - [ 0.0132896000000000, -0.0601465000000000, -0.0147340400000000 ] - [ 0.0132807800000000, -0.0601451700000000, -0.0147280800000000 ] - [ 0.0132808500000000, -0.0601287700000000, -0.0147335800000000 ] - [ -0.0133127200000000, 0.0601113700000000, -0.0147259000000000 ] - [ -0.0132944600000000, 0.0601461100000000, -0.0147260100000000 ] - [ -0.0132908700000000, 0.0601371600000000, -0.0147244100000000 ] - [ -0.0132840800000000, 0.0601513000000000, -0.0146994600000000 ] - [ -0.0132533300000000, 0.0601243700000000, -0.0147057900000000 ] - [ -0.0132891000000000, 0.0601339600000000, -0.0147265700000000 ] - [ -0.0133053200000000, -0.0601324500000000, 0.0147269400000000 ] - [ -0.0133567500000000, -0.0601788600000000, 0.0146842100000000 ] - [ -0.0133031300000000, -0.0601448000000000, 0.0147253900000000 ] - [ -0.0133045600000000, -0.0601357500000000, 0.0147239300000000 ] - [ -0.0133551600000000, -0.0601299500000000, 0.0147340800000000 ] - [ -0.0133030100000000, -0.0601440200000000, 0.0147200300000000 ] - [ 0.0142214200000000, 0.0605337700000000, 0.0157594300000000 ] - [ 0.0142267900000000, 0.0596016800000000, 0.0143434700000000 ] - [ 0.0133218700000000, 0.0601372300000000, 0.0147147900000000 ] - [ 0.0132976300000000, 0.0601423400000000, 0.0147033800000000 ] - [ 0.0133002700000000, 0.0601747100000000, 0.0147457400000000 ] - [ 0.0132759100000000, 0.0601534400000000, 0.0147238100000000 ] - [ 0.1007995000000000, -0.0721450900000000, 0.0728284400000000 ] - [ 0.1007393100000000, -0.0721744400000000, 0.0727909800000000 ] - [ 0.1008072100000000, -0.0721737000000000, 0.0728015900000000 ] - [ 0.1007933000000000, -0.0721301000000000, 0.0728217600000000 ] - [ 0.1007891900000000, -0.0721842000000000, 0.0727879800000000 ] - [ 0.1008018100000000, -0.0721842000000000, 0.0727942800000000 ] - [ -0.1007775500000000, 0.0722715300000000, 0.0727049900000000 ] - [ -0.1007913700000000, 0.0721950000000000, 0.0728060700000000 ] - [ -0.1008341100000000, 0.0721506200000000, 0.0728088600000000 ] - [ -0.0990458000000000, 0.0664275400000000, 0.0717909200000000 ] - [ -0.0981671200000000, 0.0732170900000000, 0.0735307100000000 ] - [ -0.1005756000000000, 0.0724503200000000, 0.0729745300000000 ] - [ -0.1009471200000000, -0.0721889500000000, -0.0727890300000000 ] - [ -0.1007538100000000, -0.0721549100000000, -0.0728751600000000 ] - [ -0.1007304100000000, -0.0721902500000000, -0.0729370900000000 ] - [ -0.1010928300000000, -0.0720473800000000, -0.0729648000000000 ] - [ -0.1006824200000000, -0.0725134800000000, -0.0727785700000000 ] - [ -0.1007771200000000, -0.0721221600000000, -0.0728275200000000 ] - [ 0.1008002700000000, 0.0722210200000000, -0.0727529700000000 ] - [ 0.1007806800000000, 0.0722093300000000, -0.0727988500000000 ] - [ 0.1007825400000000, 0.0721984700000000, -0.0728047400000000 ] - [ 0.1008089200000000, 0.0721713400000000, -0.0728019400000000 ] - [ 0.1007907300000000, 0.0721556900000000, -0.0727860000000000 ] - [ 0.1007980200000000, 0.0721660300000000, -0.0728012700000000 ] - [ 0.0226071500000000, 0.0030892300000000, -0.0352678700000000 ] - [ 0.0087846000000000, -0.0167608200000000, -0.0331536200000000 ] - [ 0.0058980700000000, -0.0141873300000000, -0.0318548300000000 ] - [ 0.0059115200000000, -0.0142360400000000, -0.0318276700000000 ] - [ 0.0059437300000000, -0.0141960800000000, -0.0318166500000000 ] - [ 0.0059343900000000, -0.0142163200000000, -0.0318424100000000 ] - [ 0.0057552000000000, 0.0141635600000000, 0.0316944100000000 ] - [ 0.0128417600000000, 0.0115486000000000, 0.0208421600000000 ] - [ 0.0058745400000000, 0.0142671100000000, 0.0319496700000000 ] - [ 0.0059038300000000, 0.0142080100000000, 0.0318257800000000 ] - [ 0.0059937800000000, 0.0142521900000000, 0.0318606800000000 ] - [ 0.0059211700000000, 0.0142393100000000, 0.0318496700000000 ] - [ -0.0058438900000000, -0.0142018900000000, 0.0318711300000000 ] - [ -0.0059124200000000, -0.0141845100000000, 0.0318512000000000 ] - [ -0.0059129800000000, -0.0142077100000000, 0.0318373100000000 ] - [ -0.0059178800000000, -0.0142421200000000, 0.0318443100000000 ] - [ -0.0059477300000000, -0.0143686300000000, 0.0317540800000000 ] - [ -0.0059290400000000, -0.0142383100000000, 0.0318436400000000 ] - [ -0.0059367600000000, 0.0142736100000000, -0.0318052100000000 ] - [ -0.0059296400000000, 0.0142287300000000, -0.0318239900000000 ] - [ -0.0059304500000000, 0.0142234900000000, -0.0318285300000000 ] - [ -0.0059544100000000, 0.0142023100000000, -0.0318132400000000 ] - [ -0.0059252900000000, 0.0142291200000000, -0.0318356200000000 ] - [ -0.0059197300000000, 0.0142243300000000, -0.0318324400000000 ] - [ -0.0171933100000000, -0.0605717000000000, 0.0404687500000000 ] - [ -0.0113572500000000, -0.0575486500000000, 0.0556965000000000 ] - [ -0.0243746700000000, -0.0562888100000000, 0.0428391200000000 ] - [ -0.0244972700000000, -0.0561646400000000, 0.0426552600000000 ] - [ -0.0245126400000000, -0.0561320100000000, 0.0426203400000000 ] - [ -0.0245422400000000, -0.0561752700000000, 0.0426861600000000 ] - [ -0.0263434700000000, 0.0561069700000000, -0.0423952500000000 ] - [ -0.0245513000000000, 0.0562064400000000, -0.0426840100000000 ] - [ -0.0243775800000000, 0.0563697300000000, -0.0426798100000000 ] - [ -0.0245722800000000, 0.0561961800000000, -0.0429354500000000 ] - [ -0.0245817500000000, 0.0561918800000000, -0.0427209600000000 ] - [ -0.0245718500000000, 0.0561675300000000, -0.0426152400000000 ] - [ 0.0244603600000000, -0.0561417700000000, -0.0426355900000000 ] - [ 0.0245339600000000, -0.0562141600000000, -0.0426989600000000 ] - [ 0.0245265800000000, -0.0561877100000000, -0.0426846000000000 ] - [ 0.0245621200000000, -0.0561716500000000, -0.0427948600000000 ] - [ 0.0246694200000000, -0.0561522200000000, -0.0427727500000000 ] - [ 0.0245432200000000, -0.0561862300000000, -0.0427140700000000 ] - [ 0.0245311600000000, 0.0561900700000000, 0.0427125500000000 ] - [ 0.0245680700000000, 0.0561805300000000, 0.0427216500000000 ] - [ 0.0245418200000000, 0.0561796100000000, 0.0426894200000000 ] - [ 0.0245312800000000, 0.0562210800000000, 0.0427267200000000 ] - [ 0.0246129800000000, 0.0562678300000000, 0.0426785700000000 ] - [ 0.0245213300000000, 0.0562047500000000, 0.0426984500000000 ] - [ 0.1075738900000000, -0.0109294000000000, -0.0334421700000000 ] - [ 0.1076461700000000, -0.0110441900000000, -0.0333694600000000 ] - [ 0.1076723200000000, -0.0109826200000000, -0.0334505000000000 ] - [ 0.1119952200000000, -0.0110331400000000, -0.0350058700000000 ] - [ 0.1089532700000000, -0.0056629500000000, -0.0358026300000000 ] - [ 0.1077297900000000, -0.0107920100000000, -0.0332853900000000 ] - [ 0.1078157800000000, 0.0106935600000000, 0.0338013600000000 ] - [ 0.1075730500000000, 0.0108165000000000, 0.0335602000000000 ] - [ 0.1078055000000000, 0.0108620700000000, 0.0335246600000000 ] - [ 0.1073066700000000, 0.0107587800000000, 0.0340959000000000 ] - [ 0.1077367900000000, 0.0107778600000000, 0.0335667700000000 ] - [ 0.1078176500000000, 0.0110296600000000, 0.0332578600000000 ] - [ -0.1076831200000000, -0.0110718900000000, 0.0333827900000000 ] - [ -0.1075895300000000, -0.0109179000000000, 0.0334298600000000 ] - [ -0.1076039300000000, -0.0109721400000000, 0.0334429700000000 ] - [ -0.1076597200000000, -0.0110029900000000, 0.0334718500000000 ] - [ -0.1076657300000000, -0.0109720400000000, 0.0335055900000000 ] - [ -0.1076385400000000, -0.0109527200000000, 0.0334801300000000 ] - [ -0.1076410000000000, 0.0109134500000000, -0.0334889900000000 ] - [ -0.1076597800000000, 0.0108700200000000, -0.0334511100000000 ] - [ -0.1075877800000000, 0.0109549900000000, -0.0334822800000000 ] - [ -0.1076278000000000, 0.0109563700000000, -0.0334542200000000 ] - [ -0.1076617800000000, 0.0109507900000000, -0.0334497200000000 ] - [ -0.1076228900000000, 0.0109559400000000, -0.0334589100000000 ] - [ 0.0042539300000000, -0.0175215700000000, -0.0096699300000000 ] - [ 0.0042594300000000, -0.0175062000000000, -0.0096638700000000 ] - [ 0.0042662800000000, -0.0174759800000000, -0.0096540600000000 ] - [ 0.0042978900000000, -0.0175642500000000, -0.0090438200000000 ] - [ 0.0044562700000000, -0.0173266800000000, -0.0096423400000000 ] - [ 0.0042707200000000, -0.0174629700000000, -0.0096793300000000 ] - [ 0.0044706000000000, 0.0175176600000000, 0.0096671600000000 ] - [ 0.0040762300000000, 0.0171584500000000, 0.0097855000000000 ] - [ 0.0042289600000000, 0.0175047900000000, 0.0096333200000000 ] - [ 0.0043614900000000, 0.0174509600000000, 0.0096107400000000 ] - [ 0.0041091300000000, 0.0174586100000000, 0.0095927100000000 ] - [ 0.0042367600000000, 0.0173740200000000, 0.0096140000000000 ] - [ -0.0043053800000000, -0.0174854800000000, 0.0096548900000000 ] - [ -0.0041670100000000, -0.0176042800000000, 0.0095360600000000 ] - [ -0.0042439600000000, -0.0174850300000000, 0.0096677200000000 ] - [ -0.0042604200000000, -0.0174600400000000, 0.0097072300000000 ] - [ -0.0042763300000000, -0.0174475000000000, 0.0096985300000000 ] - [ -0.0042546400000000, -0.0174663000000000, 0.0096855500000000 ] - [ -0.0044301700000000, 0.0174038600000000, -0.0102417000000000 ] - [ -0.0039131900000000, 0.0175528300000000, -0.0094449300000000 ] - [ -0.0043705000000000, 0.0174888700000000, -0.0095800900000000 ] - 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