# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/865ba4c5-2460-47fc-a003-f1292e546e98/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 Sr2SnO4 / Cmce (64) / materials id 4941](https://mdr.nims.go.jp/datasets/80b5a5cf-4e9b-4543-ba6d-5a1a0370b9c6) ## 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: "Cmce" number: 64 Hall_symbol: "-C 2bc 2"primitive_matrix:- [ 0.500000000000000, 0.500000000000000, 0.000000000000000 ]- [ -0.500000000000000, 0.500000000000000, 0.000000000000000 ]- [ 0.000000000000000, 0.000000000000000, 1.000000000000000 ]supercell_matrix:- [ 2, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 2.857935600000000, -6.218359960000000, 0.000000000000000 ] # a - [ 2.857935600000000, 6.218359960000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 5.842260630000000 ] # c points: - symbol: O # 1 coordinates: [ 0.336357920000000, 0.663642080000000, 0.555371710000000 ] mass: 15.999400 - symbol: O # 2 coordinates: [ 0.663642080000000, 0.336357920000000, 0.444628290000000 ] mass: 15.999400 - symbol: O # 3 coordinates: [ 0.163642080000000, 0.836357920000000, 0.055371710000000 ] mass: 15.999400 - symbol: O # 4 coordinates: [ 0.836357920000000, 0.163642080000000, 0.944628290000000 ] mass: 15.999400 - symbol: O # 5 coordinates: [ 0.229300610000000, 0.270699390000000, 0.250000000000000 ] mass: 15.999400 - symbol: O # 6 coordinates: [ 0.270699390000000, 0.229300610000000, 0.750000000000000 ] mass: 15.999400 - symbol: O # 7 coordinates: [ 0.729300610000000, 0.770699390000000, 0.250000000000000 ] mass: 15.999400 - symbol: O # 8 coordinates: [ 0.770699390000000, 0.729300610000000, 0.750000000000000 ] mass: 15.999400 - symbol: Sr # 9 coordinates: [ 0.146909260000000, 0.853090740000000, 0.485405800000000 ] mass: 87.620000 - symbol: Sr # 10 coordinates: [ 0.853090740000000, 0.146909260000000, 0.514594200000000 ] mass: 87.620000 - symbol: Sr # 11 coordinates: [ 0.353090740000000, 0.646909260000000, 0.985405800000000 ] mass: 87.620000 - symbol: Sr # 12 coordinates: [ 0.646909260000000, 0.353090740000000, 0.014594200000000 ] mass: 87.620000 - symbol: Sn # 13 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 118.710000 - symbol: Sn # 14 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 118.710000 reciprocal_lattice: # without 2pi - [ 0.174951457968472, -0.080407053180627, 0.000000000000000 ] # a* - [ 0.174951457968472, 0.080407053180627, 0.000000000000000 ] # b* - [ 0.000000000000000, 0.000000000000000, 0.171166619110589 ] # c*unit_cell: lattice: - [ 5.715871200000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 12.436719920000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 5.842260630000000 ] # c points: - symbol: O # 1 coordinates: [ 0.000000000000000, 0.663642080000000, 0.555371710000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 2 coordinates: [ 0.500000000000000, 0.836357920000000, 0.444628290000000 ] mass: 15.999400 reduced_to: 2 - symbol: O # 3 coordinates: [ 0.000000000000000, 0.836357920000000, 0.055371710000000 ] mass: 15.999400 reduced_to: 3 - symbol: O # 4 coordinates: [ 0.500000000000000, 0.663642080000000, 0.944628290000000 ] mass: 15.999400 reduced_to: 4 - symbol: O # 5 coordinates: [ 0.750000000000000, 0.520699390000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 5 - symbol: O # 6 coordinates: [ 0.250000000000000, 0.979300610000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 6 - symbol: O # 7 coordinates: [ 0.250000000000000, 0.520699390000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 7 - symbol: O # 8 coordinates: [ 0.750000000000000, 0.979300610000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 8 - symbol: O # 9 coordinates: [ 0.500000000000000, 0.163642080000000, 0.555371710000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 10 coordinates: [ 0.000000000000000, 0.336357920000000, 0.444628290000000 ] mass: 15.999400 reduced_to: 2 - symbol: O # 11 coordinates: [ 0.500000000000000, 0.336357920000000, 0.055371710000000 ] mass: 15.999400 reduced_to: 3 - symbol: O # 12 coordinates: [ 0.000000000000000, 0.163642080000000, 0.944628290000000 ] mass: 15.999400 reduced_to: 4 - symbol: O # 13 coordinates: [ 0.250000000000000, 0.020699390000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 5 - symbol: O # 14 coordinates: [ 0.750000000000000, 0.479300610000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 6 - symbol: O # 15 coordinates: [ 0.750000000000000, 0.020699390000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 7 - symbol: O # 16 coordinates: [ 0.250000000000000, 0.479300610000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 8 - symbol: Sr # 17 coordinates: [ 0.000000000000000, 0.853090740000000, 0.485405800000000 ] mass: 87.620000 reduced_to: 17 - symbol: Sr # 18 coordinates: [ 0.500000000000000, 0.646909260000000, 0.514594200000000 ] mass: 87.620000 reduced_to: 18 - symbol: Sr # 19 coordinates: [ 0.000000000000000, 0.646909260000000, 0.985405800000000 ] mass: 87.620000 reduced_to: 19 - symbol: Sr # 20 coordinates: [ 0.500000000000000, 0.853090740000000, 0.014594200000000 ] mass: 87.620000 reduced_to: 20 - symbol: Sr # 21 coordinates: [ 0.500000000000000, 0.353090740000000, 0.485405800000000 ] mass: 87.620000 reduced_to: 17 - symbol: Sr # 22 coordinates: [ 0.000000000000000, 0.146909260000000, 0.514594200000000 ] mass: 87.620000 reduced_to: 18 - symbol: Sr # 23 coordinates: [ 0.500000000000000, 0.146909260000000, 0.985405800000000 ] mass: 87.620000 reduced_to: 19 - symbol: Sr # 24 coordinates: [ 0.000000000000000, 0.353090740000000, 0.014594200000000 ] mass: 87.620000 reduced_to: 20 - symbol: Sn # 25 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 118.710000 reduced_to: 25 - symbol: Sn # 26 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 118.710000 reduced_to: 26 - symbol: Sn # 27 coordinates: [ 0.000000000000000, 0.500000000000000, 0.500000000000000 ] mass: 118.710000 reduced_to: 25 - symbol: Sn # 28 coordinates: [ 0.500000000000000, 0.500000000000000, 0.000000000000000 ] mass: 118.710000 reduced_to: 26supercell: lattice: - [ 11.431742399999999, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 12.436719920000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 11.684521260000000 ] # c points: - symbol: O # 1 coordinates: [ 0.000000000000000, 0.663642080000000, 0.277685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 2 coordinates: [ 0.500000000000000, 0.663642080000000, 0.277685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 3 coordinates: [ 0.000000000000000, 0.663642080000000, 0.777685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 4 coordinates: [ 0.500000000000000, 0.663642080000000, 0.777685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 5 coordinates: [ 0.250000000000000, 0.836357920000000, 0.222314145000000 ] mass: 15.999400 reduced_to: 5 - 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symbol: O # 15 coordinates: [ 0.250000000000000, 0.663642080000000, 0.972314145000000 ] mass: 15.999400 reduced_to: 13 - symbol: O # 16 coordinates: [ 0.750000000000000, 0.663642080000000, 0.972314145000000 ] mass: 15.999400 reduced_to: 13 - symbol: O # 17 coordinates: [ 0.375000000000000, 0.520699390000000, 0.125000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 18 coordinates: [ 0.875000000000000, 0.520699390000000, 0.125000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 19 coordinates: [ 0.375000000000000, 0.520699390000000, 0.625000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 20 coordinates: [ 0.875000000000000, 0.520699390000000, 0.625000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 21 coordinates: [ 0.125000000000000, 0.979300610000000, 0.375000000000000 ] mass: 15.999400 reduced_to: 21 - symbol: O # 22 coordinates: [ 0.625000000000000, 0.979300610000000, 0.375000000000000 ] mass: 15.999400 reduced_to: 21 - symbol: O # 23 coordinates: [ 0.125000000000000, 0.979300610000000, 0.875000000000000 ] mass: 15.999400 reduced_to: 21 - 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symbol: O # 33 coordinates: [ 0.250000000000000, 0.163642080000000, 0.277685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 34 coordinates: [ 0.750000000000000, 0.163642080000000, 0.277685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 35 coordinates: [ 0.250000000000000, 0.163642080000000, 0.777685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 36 coordinates: [ 0.750000000000000, 0.163642080000000, 0.777685855000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 37 coordinates: [ 0.000000000000000, 0.336357920000000, 0.222314145000000 ] mass: 15.999400 reduced_to: 5 - symbol: O # 38 coordinates: [ 0.500000000000000, 0.336357920000000, 0.222314145000000 ] mass: 15.999400 reduced_to: 5 - symbol: O # 39 coordinates: [ 0.000000000000000, 0.336357920000000, 0.722314145000000 ] mass: 15.999400 reduced_to: 5 - symbol: O # 40 coordinates: [ 0.500000000000000, 0.336357920000000, 0.722314145000000 ] mass: 15.999400 reduced_to: 5 - symbol: O # 41 coordinates: [ 0.250000000000000, 0.336357920000000, 0.027685855000000 ] mass: 15.999400 reduced_to: 9 - symbol: O # 42 coordinates: [ 0.750000000000000, 0.336357920000000, 0.027685855000000 ] mass: 15.999400 reduced_to: 9 - symbol: O # 43 coordinates: [ 0.250000000000000, 0.336357920000000, 0.527685855000000 ] mass: 15.999400 reduced_to: 9 - symbol: O # 44 coordinates: [ 0.750000000000000, 0.336357920000000, 0.527685855000000 ] mass: 15.999400 reduced_to: 9 - symbol: O # 45 coordinates: [ 0.000000000000000, 0.163642080000000, 0.472314145000000 ] mass: 15.999400 reduced_to: 13 - symbol: O # 46 coordinates: [ 0.500000000000000, 0.163642080000000, 0.472314145000000 ] mass: 15.999400 reduced_to: 13 - symbol: O # 47 coordinates: [ 0.000000000000000, 0.163642080000000, 0.972314145000000 ] mass: 15.999400 reduced_to: 13 - symbol: O # 48 coordinates: [ 0.500000000000000, 0.163642080000000, 0.972314145000000 ] mass: 15.999400 reduced_to: 13 - symbol: O # 49 coordinates: [ 0.125000000000000, 0.020699390000000, 0.125000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 50 coordinates: [ 0.625000000000000, 0.020699390000000, 0.125000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 51 coordinates: [ 0.125000000000000, 0.020699390000000, 0.625000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 52 coordinates: [ 0.625000000000000, 0.020699390000000, 0.625000000000000 ] mass: 15.999400 reduced_to: 17 - symbol: O # 53 coordinates: [ 0.375000000000000, 0.479300610000000, 0.375000000000000 ] mass: 15.999400 reduced_to: 21 - symbol: O # 54 coordinates: [ 0.875000000000000, 0.479300610000000, 0.375000000000000 ] mass: 15.999400 reduced_to: 21 - symbol: O # 55 coordinates: [ 0.375000000000000, 0.479300610000000, 0.875000000000000 ] mass: 15.999400 reduced_to: 21 - symbol: O # 56 coordinates: [ 0.875000000000000, 0.479300610000000, 0.875000000000000 ] mass: 15.999400 reduced_to: 21 - symbol: O # 57 coordinates: [ 0.375000000000000, 0.020699390000000, 0.125000000000000 ] mass: 15.999400 reduced_to: 25 - symbol: O # 58 coordinates: [ 0.875000000000000, 0.020699390000000, 0.125000000000000 ] mass: 15.999400 reduced_to: 25 - symbol: O # 59 coordinates: [ 0.375000000000000, 0.020699390000000, 0.625000000000000 ] mass: 15.999400 reduced_to: 25 - symbol: O # 60 coordinates: [ 0.875000000000000, 0.020699390000000, 0.625000000000000 ] mass: 15.999400 reduced_to: 25 - symbol: O # 61 coordinates: [ 0.125000000000000, 0.479300610000000, 0.375000000000000 ] mass: 15.999400 reduced_to: 29 - symbol: O # 62 coordinates: [ 0.625000000000000, 0.479300610000000, 0.375000000000000 ] mass: 15.999400 reduced_to: 29 - symbol: O # 63 coordinates: [ 0.125000000000000, 0.479300610000000, 0.875000000000000 ] mass: 15.999400 reduced_to: 29 - symbol: O # 64 coordinates: [ 0.625000000000000, 0.479300610000000, 0.875000000000000 ] mass: 15.999400 reduced_to: 29 - symbol: Sr # 65 coordinates: [ 0.000000000000000, 0.853090740000000, 0.242702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 66 coordinates: [ 0.500000000000000, 0.853090740000000, 0.242702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 67 coordinates: [ 0.000000000000000, 0.853090740000000, 0.742702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 68 coordinates: [ 0.500000000000000, 0.853090740000000, 0.742702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 69 coordinates: [ 0.250000000000000, 0.646909260000000, 0.257297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 70 coordinates: [ 0.750000000000000, 0.646909260000000, 0.257297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 71 coordinates: [ 0.250000000000000, 0.646909260000000, 0.757297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 72 coordinates: [ 0.750000000000000, 0.646909260000000, 0.757297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 73 coordinates: [ 0.000000000000000, 0.646909260000000, 0.492702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 74 coordinates: [ 0.500000000000000, 0.646909260000000, 0.492702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 75 coordinates: [ 0.000000000000000, 0.646909260000000, 0.992702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 76 coordinates: [ 0.500000000000000, 0.646909260000000, 0.992702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 77 coordinates: [ 0.250000000000000, 0.853090740000000, 0.007297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sr # 78 coordinates: [ 0.750000000000000, 0.853090740000000, 0.007297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sr # 79 coordinates: [ 0.250000000000000, 0.853090740000000, 0.507297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sr # 80 coordinates: [ 0.750000000000000, 0.853090740000000, 0.507297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sr # 81 coordinates: [ 0.250000000000000, 0.353090740000000, 0.242702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 82 coordinates: [ 0.750000000000000, 0.353090740000000, 0.242702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 83 coordinates: [ 0.250000000000000, 0.353090740000000, 0.742702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 84 coordinates: [ 0.750000000000000, 0.353090740000000, 0.742702900000000 ] mass: 87.620000 reduced_to: 65 - symbol: Sr # 85 coordinates: [ 0.000000000000000, 0.146909260000000, 0.257297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 86 coordinates: [ 0.500000000000000, 0.146909260000000, 0.257297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 87 coordinates: [ 0.000000000000000, 0.146909260000000, 0.757297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 88 coordinates: [ 0.500000000000000, 0.146909260000000, 0.757297100000000 ] mass: 87.620000 reduced_to: 69 - symbol: Sr # 89 coordinates: [ 0.250000000000000, 0.146909260000000, 0.492702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 90 coordinates: [ 0.750000000000000, 0.146909260000000, 0.492702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 91 coordinates: [ 0.250000000000000, 0.146909260000000, 0.992702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 92 coordinates: [ 0.750000000000000, 0.146909260000000, 0.992702900000000 ] mass: 87.620000 reduced_to: 73 - symbol: Sr # 93 coordinates: [ 0.000000000000000, 0.353090740000000, 0.007297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sr # 94 coordinates: [ 0.500000000000000, 0.353090740000000, 0.007297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sr # 95 coordinates: [ 0.000000000000000, 0.353090740000000, 0.507297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sr # 96 coordinates: [ 0.500000000000000, 0.353090740000000, 0.507297100000000 ] mass: 87.620000 reduced_to: 77 - symbol: Sn # 97 coordinates: [ 0.250000000000000, 0.000000000000000, 0.250000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 98 coordinates: [ 0.750000000000000, 0.000000000000000, 0.250000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 99 coordinates: [ 0.250000000000000, 0.000000000000000, 0.750000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 100 coordinates: [ 0.750000000000000, 0.000000000000000, 0.750000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 101 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 118.710000 reduced_to: 101 - symbol: Sn # 102 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 118.710000 reduced_to: 101 - symbol: Sn # 103 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 118.710000 reduced_to: 101 - symbol: Sn # 104 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 118.710000 reduced_to: 101 - symbol: Sn # 105 coordinates: [ 0.000000000000000, 0.500000000000000, 0.250000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 106 coordinates: [ 0.500000000000000, 0.500000000000000, 0.250000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 107 coordinates: [ 0.000000000000000, 0.500000000000000, 0.750000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 108 coordinates: [ 0.500000000000000, 0.500000000000000, 0.750000000000000 ] mass: 118.710000 reduced_to: 97 - symbol: Sn # 109 coordinates: [ 0.250000000000000, 0.500000000000000, 0.000000000000000 ] mass: 118.710000 reduced_to: 101 - symbol: Sn # 110 coordinates: [ 0.750000000000000, 0.500000000000000, 0.000000000000000 ] mass: 118.710000 reduced_to: 101 - symbol: Sn # 111 coordinates: [ 0.250000000000000, 0.500000000000000, 0.500000000000000 ] mass: 118.710000 reduced_to: 101 - symbol: Sn # 112 coordinates: [ 0.750000000000000, 0.500000000000000, 0.500000000000000 ] mass: 118.710000 reduced_to: 101born_effective_charge:- # 1 (O) - [ -1.917115470000000, -0.000000000000000, 0.000000000000000 ] - [ -0.000000000000000, -2.719183910000000, 0.040291910000000 ] - [ -0.000000000000000, -0.011046250000000, -1.980915060000000 ]- # 2 (O) - [ -1.917115470000000, -0.000000000000000, 0.000000000000000 ] - [ -0.000000000000000, -2.719183910000000, 0.040291910000000 ] - [ -0.000000000000000, -0.011046250000000, -1.980915060000001 ]- # 3 (O) - [ -1.917115470000000, -0.000000000000000, -0.000000000000000 ] - [ -0.000000000000000, -2.719183910000000, -0.040291910000000 ] - [ 0.000000000000000, 0.011046250000000, -1.980915060000001 ]- # 4 (O) - [ -1.917115470000000, -0.000000000000000, -0.000000000000000 ] - [ -0.000000000000000, -2.719183910000000, -0.040291910000000 ] - [ 0.000000000000000, 0.011046250000000, -1.980915060000001 ]- # 5 (O) - [ -2.498366160000000, 0.000000000000000, -0.673693450000000 ] - [ 0.000000000000000, -1.667319400000000, 0.000000000000000 ] - [ -0.598757880000000, 0.000000000000000, -2.595385160000000 ]- # 6 (O) - 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