# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/badc32a7-536f-46ad-b1b3-0fa6f0ab90dc/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 Ho2Ge2O7 / Fd-3m (227) / materials id 753692](https://mdr.nims.go.jp/datasets/53e11083-cba8-4c7d-96cc-f4f7291b628d) ## Fulltext phonopy: version: 2.17.1 frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05 configuration: save_params: ".true."physical_unit: atomic_mass: "AMU" length: "angstrom" force_constants: "eV/angstrom^2"space_group: type: "Fd-3m" number: 227 Hall_symbol: "F 4d 2 3 -1d"primitive_matrix:- [ 0.000000000000000, 0.500000000000000, 0.500000000000000 ]- [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ]- [ 0.500000000000000, 0.500000000000000, 0.000000000000000 ]supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 0.000000000000000, 4.938735145000000, 4.938735145000000 ] # a - [ 4.938735145000000, 0.000000000000000, 4.938735145000000 ] # b - [ 4.938735145000000, 4.938735145000000, 0.000000000000000 ] # c points: - symbol: Ho # 1 coordinates: [ 0.625000000000000, 0.625000000000000, 0.125000000000000 ] mass: 164.930320 - symbol: Ho # 2 coordinates: [ 0.625000000000000, 0.125000000000000, 0.625000000000000 ] mass: 164.930320 - symbol: Ho # 3 coordinates: [ 0.125000000000000, 0.625000000000000, 0.625000000000000 ] mass: 164.930320 - symbol: Ho # 4 coordinates: [ 0.625000000000000, 0.625000000000000, 0.625000000000000 ] mass: 164.930320 - symbol: Ge # 5 coordinates: [ 0.625000000000000, 0.125000000000000, 0.125000000000000 ] mass: 72.640000 - symbol: Ge # 6 coordinates: [ 0.125000000000000, 0.125000000000000, 0.125000000000000 ] mass: 72.640000 - symbol: Ge # 7 coordinates: [ 0.125000000000000, 0.125000000000000, 0.625000000000000 ] mass: 72.640000 - symbol: Ge # 8 coordinates: [ 0.125000000000000, 0.625000000000000, 0.125000000000000 ] mass: 72.640000 - symbol: O # 9 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 15.999400 - symbol: O # 10 coordinates: [ 0.453692400000000, 0.046307600000000, 0.046307600000000 ] mass: 15.999400 - symbol: O # 11 coordinates: [ 0.453692400000000, 0.453692400000000, 0.046307600000000 ] mass: 15.999400 - symbol: O # 12 coordinates: [ 0.453692400000000, 0.046307600000000, 0.453692400000000 ] mass: 15.999400 - symbol: O # 13 coordinates: [ 0.046307600000000, 0.046307600000000, 0.453692400000000 ] mass: 15.999400 - symbol: O # 14 coordinates: [ 0.046307600000000, 0.453692400000000, 0.046307600000000 ] mass: 15.999400 - symbol: O # 15 coordinates: [ 0.203692400000000, 0.796307600000000, 0.796307600000000 ] mass: 15.999400 - symbol: O # 16 coordinates: [ 0.046307600000000, 0.453692400000000, 0.453692400000000 ] mass: 15.999400 - symbol: O # 17 coordinates: [ 0.203692400000000, 0.796307600000000, 0.203692400000000 ] mass: 15.999400 - symbol: O # 18 coordinates: [ 0.203692400000000, 0.203692400000000, 0.796307600000000 ] mass: 15.999400 - symbol: O # 19 coordinates: [ 0.796307600000000, 0.796307600000000, 0.203692400000000 ] mass: 15.999400 - symbol: O # 20 coordinates: [ 0.796307600000000, 0.203692400000000, 0.796307600000000 ] mass: 15.999400 - symbol: O # 21 coordinates: [ 0.796307600000000, 0.203692400000000, 0.203692400000000 ] mass: 15.999400 - symbol: O # 22 coordinates: [ 0.750000000000000, 0.750000000000000, 0.750000000000000 ] mass: 15.999400 reciprocal_lattice: # without 2pi - [ -0.101240496872201, 0.101240496872201, 0.101240496872201 ] # a* - [ 0.101240496872201, -0.101240496872201, 0.101240496872201 ] # b* - [ 0.101240496872201, 0.101240496872201, -0.101240496872201 ] # c*unit_cell: lattice: - [ 9.877470290000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 9.877470290000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 9.877470290000000 ] # c points: - symbol: Ho # 1 coordinates: [ 0.375000000000000, 0.875000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 2 coordinates: [ 0.375000000000000, 0.625000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 3 coordinates: [ 0.125000000000000, 0.875000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 4 coordinates: [ 0.625000000000000, 0.625000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ho # 5 coordinates: [ 0.375000000000000, 0.375000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 6 coordinates: [ 0.375000000000000, 0.125000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 7 coordinates: [ 0.125000000000000, 0.375000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 8 coordinates: [ 0.625000000000000, 0.125000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ho # 9 coordinates: [ 0.875000000000000, 0.875000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 10 coordinates: [ 0.875000000000000, 0.625000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 11 coordinates: [ 0.625000000000000, 0.875000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 12 coordinates: [ 0.125000000000000, 0.625000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ho # 13 coordinates: [ 0.875000000000000, 0.375000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 14 coordinates: [ 0.875000000000000, 0.125000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 15 coordinates: [ 0.625000000000000, 0.375000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 16 coordinates: [ 0.125000000000000, 0.125000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ge # 17 coordinates: [ 0.625000000000000, 0.875000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 18 coordinates: [ 0.125000000000000, 0.125000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 19 coordinates: [ 0.375000000000000, 0.875000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 20 coordinates: [ 0.375000000000000, 0.125000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: Ge # 21 coordinates: [ 0.625000000000000, 0.375000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 22 coordinates: [ 0.125000000000000, 0.625000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 23 coordinates: [ 0.375000000000000, 0.375000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 24 coordinates: [ 0.375000000000000, 0.625000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: Ge # 25 coordinates: [ 0.125000000000000, 0.875000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 26 coordinates: [ 0.625000000000000, 0.125000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 27 coordinates: [ 0.875000000000000, 0.875000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 28 coordinates: [ 0.875000000000000, 0.125000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: Ge # 29 coordinates: [ 0.125000000000000, 0.375000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 30 coordinates: [ 0.625000000000000, 0.625000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 31 coordinates: [ 0.875000000000000, 0.375000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 32 coordinates: [ 0.875000000000000, 0.625000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: O # 33 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 34 coordinates: [ 0.546307600000000, 0.750000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 35 coordinates: [ 0.750000000000000, 0.750000000000000, 0.453692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 36 coordinates: [ 0.750000000000000, 0.953692400000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 37 coordinates: [ 0.750000000000000, 0.750000000000000, 0.046307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 38 coordinates: [ 0.250000000000000, 0.046307600000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 39 coordinates: [ 0.296307600000000, 0.000000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 40 coordinates: [ 0.953692400000000, 0.750000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 41 coordinates: [ 0.000000000000000, 0.703692400000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 42 coordinates: [ 0.500000000000000, 0.000000000000000, 0.703692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 43 coordinates: [ 0.500000000000000, 0.000000000000000, 0.296307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 44 coordinates: [ 0.500000000000000, 0.796307600000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 45 coordinates: [ 0.703692400000000, 0.000000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 46 coordinates: [ 0.750000000000000, 0.750000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 46 - symbol: O # 47 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 48 coordinates: [ 0.546307600000000, 0.250000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 49 coordinates: [ 0.750000000000000, 0.250000000000000, 0.953692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 50 coordinates: [ 0.750000000000000, 0.453692400000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 51 coordinates: [ 0.750000000000000, 0.250000000000000, 0.546307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 52 coordinates: [ 0.250000000000000, 0.546307600000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 53 coordinates: [ 0.296307600000000, 0.500000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 54 coordinates: [ 0.953692400000000, 0.250000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 55 coordinates: [ 0.000000000000000, 0.203692400000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 56 coordinates: [ 0.500000000000000, 0.500000000000000, 0.203692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 57 coordinates: [ 0.500000000000000, 0.500000000000000, 0.796307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 58 coordinates: [ 0.500000000000000, 0.296307600000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 59 coordinates: [ 0.703692400000000, 0.500000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 60 coordinates: [ 0.750000000000000, 0.250000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 46 - symbol: O # 61 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 62 coordinates: [ 0.046307600000000, 0.750000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 63 coordinates: [ 0.250000000000000, 0.750000000000000, 0.953692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 64 coordinates: [ 0.250000000000000, 0.953692400000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 65 coordinates: [ 0.250000000000000, 0.750000000000000, 0.546307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 66 coordinates: [ 0.750000000000000, 0.046307600000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 67 coordinates: [ 0.796307600000000, 0.000000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 68 coordinates: [ 0.453692400000000, 0.750000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 69 coordinates: [ 0.500000000000000, 0.703692400000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 70 coordinates: [ 0.000000000000000, 0.000000000000000, 0.203692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 71 coordinates: [ 0.000000000000000, 0.000000000000000, 0.796307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 72 coordinates: [ 0.000000000000000, 0.796307600000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 73 coordinates: [ 0.203692400000000, 0.000000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 74 coordinates: [ 0.250000000000000, 0.750000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 46 - symbol: O # 75 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 76 coordinates: [ 0.046307600000000, 0.250000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 77 coordinates: [ 0.250000000000000, 0.250000000000000, 0.453692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 78 coordinates: [ 0.250000000000000, 0.453692400000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 79 coordinates: [ 0.250000000000000, 0.250000000000000, 0.046307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 80 coordinates: [ 0.750000000000000, 0.546307600000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 81 coordinates: [ 0.796307600000000, 0.500000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 82 coordinates: [ 0.453692400000000, 0.250000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 83 coordinates: [ 0.500000000000000, 0.203692400000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 84 coordinates: [ 0.000000000000000, 0.500000000000000, 0.703692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 85 coordinates: [ 0.000000000000000, 0.500000000000000, 0.296307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 86 coordinates: [ 0.000000000000000, 0.296307600000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 87 coordinates: [ 0.203692400000000, 0.500000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 88 coordinates: [ 0.250000000000000, 0.250000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 46supercell: lattice: - [ 9.877470290000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 9.877470290000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 9.877470290000000 ] # c points: - symbol: Ho # 1 coordinates: [ 0.375000000000000, 0.875000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 2 coordinates: [ 0.375000000000000, 0.625000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 3 coordinates: [ 0.125000000000000, 0.875000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 4 coordinates: [ 0.625000000000000, 0.625000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ho # 5 coordinates: [ 0.375000000000000, 0.375000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 6 coordinates: [ 0.375000000000000, 0.125000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 7 coordinates: [ 0.125000000000000, 0.375000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 8 coordinates: [ 0.625000000000000, 0.125000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ho # 9 coordinates: [ 0.875000000000000, 0.875000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 10 coordinates: [ 0.875000000000000, 0.625000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 11 coordinates: [ 0.625000000000000, 0.875000000000000, 0.875000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 12 coordinates: [ 0.125000000000000, 0.625000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ho # 13 coordinates: [ 0.875000000000000, 0.375000000000000, 0.125000000000000 ] mass: 164.930320 reduced_to: 1 - symbol: Ho # 14 coordinates: [ 0.875000000000000, 0.125000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 2 - symbol: Ho # 15 coordinates: [ 0.625000000000000, 0.375000000000000, 0.375000000000000 ] mass: 164.930320 reduced_to: 3 - symbol: Ho # 16 coordinates: [ 0.125000000000000, 0.125000000000000, 0.625000000000000 ] mass: 164.930320 reduced_to: 4 - symbol: Ge # 17 coordinates: [ 0.625000000000000, 0.875000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 18 coordinates: [ 0.125000000000000, 0.125000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 19 coordinates: [ 0.375000000000000, 0.875000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 20 coordinates: [ 0.375000000000000, 0.125000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: Ge # 21 coordinates: [ 0.625000000000000, 0.375000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 22 coordinates: [ 0.125000000000000, 0.625000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 23 coordinates: [ 0.375000000000000, 0.375000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 24 coordinates: [ 0.375000000000000, 0.625000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: Ge # 25 coordinates: [ 0.125000000000000, 0.875000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 26 coordinates: [ 0.625000000000000, 0.125000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 27 coordinates: [ 0.875000000000000, 0.875000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 28 coordinates: [ 0.875000000000000, 0.125000000000000, 0.875000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: Ge # 29 coordinates: [ 0.125000000000000, 0.375000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 17 - symbol: Ge # 30 coordinates: [ 0.625000000000000, 0.625000000000000, 0.125000000000000 ] mass: 72.640000 reduced_to: 18 - symbol: Ge # 31 coordinates: [ 0.875000000000000, 0.375000000000000, 0.625000000000000 ] mass: 72.640000 reduced_to: 19 - symbol: Ge # 32 coordinates: [ 0.875000000000000, 0.625000000000000, 0.375000000000000 ] mass: 72.640000 reduced_to: 20 - symbol: O # 33 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 34 coordinates: [ 0.546307600000000, 0.750000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 35 coordinates: [ 0.750000000000000, 0.750000000000000, 0.453692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 36 coordinates: [ 0.750000000000000, 0.953692400000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 37 coordinates: [ 0.750000000000000, 0.750000000000000, 0.046307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 38 coordinates: [ 0.250000000000000, 0.046307600000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 39 coordinates: [ 0.296307600000000, 0.000000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 40 coordinates: [ 0.953692400000000, 0.750000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 41 coordinates: [ 0.000000000000000, 0.703692400000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 42 coordinates: [ 0.500000000000000, 0.000000000000000, 0.703692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 43 coordinates: [ 0.500000000000000, 0.000000000000000, 0.296307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 44 coordinates: [ 0.500000000000000, 0.796307600000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 45 coordinates: [ 0.703692400000000, 0.000000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 46 coordinates: [ 0.750000000000000, 0.750000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 46 - symbol: O # 47 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 48 coordinates: [ 0.546307600000000, 0.250000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 49 coordinates: [ 0.750000000000000, 0.250000000000000, 0.953692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 50 coordinates: [ 0.750000000000000, 0.453692400000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 51 coordinates: [ 0.750000000000000, 0.250000000000000, 0.546307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 52 coordinates: [ 0.250000000000000, 0.546307600000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 53 coordinates: [ 0.296307600000000, 0.500000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 54 coordinates: [ 0.953692400000000, 0.250000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 55 coordinates: [ 0.000000000000000, 0.203692400000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 56 coordinates: [ 0.500000000000000, 0.500000000000000, 0.203692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 57 coordinates: [ 0.500000000000000, 0.500000000000000, 0.796307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 58 coordinates: [ 0.500000000000000, 0.296307600000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 59 coordinates: [ 0.703692400000000, 0.500000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 60 coordinates: [ 0.750000000000000, 0.250000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 46 - symbol: O # 61 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 62 coordinates: [ 0.046307600000000, 0.750000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 63 coordinates: [ 0.250000000000000, 0.750000000000000, 0.953692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 64 coordinates: [ 0.250000000000000, 0.953692400000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 65 coordinates: [ 0.250000000000000, 0.750000000000000, 0.546307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 66 coordinates: [ 0.750000000000000, 0.046307600000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 67 coordinates: [ 0.796307600000000, 0.000000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 68 coordinates: [ 0.453692400000000, 0.750000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 69 coordinates: [ 0.500000000000000, 0.703692400000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 70 coordinates: [ 0.000000000000000, 0.000000000000000, 0.203692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 71 coordinates: [ 0.000000000000000, 0.000000000000000, 0.796307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 72 coordinates: [ 0.000000000000000, 0.796307600000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 73 coordinates: [ 0.203692400000000, 0.000000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 74 coordinates: [ 0.250000000000000, 0.750000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 46 - symbol: O # 75 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 15.999400 reduced_to: 33 - symbol: O # 76 coordinates: [ 0.046307600000000, 0.250000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 34 - symbol: O # 77 coordinates: [ 0.250000000000000, 0.250000000000000, 0.453692400000000 ] mass: 15.999400 reduced_to: 35 - symbol: O # 78 coordinates: [ 0.250000000000000, 0.453692400000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 36 - symbol: O # 79 coordinates: [ 0.250000000000000, 0.250000000000000, 0.046307600000000 ] mass: 15.999400 reduced_to: 37 - symbol: O # 80 coordinates: [ 0.750000000000000, 0.546307600000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 38 - symbol: O # 81 coordinates: [ 0.796307600000000, 0.500000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 39 - symbol: O # 82 coordinates: [ 0.453692400000000, 0.250000000000000, 0.250000000000000 ] mass: 15.999400 reduced_to: 40 - symbol: O # 83 coordinates: [ 0.500000000000000, 0.203692400000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 41 - symbol: O # 84 coordinates: [ 0.000000000000000, 0.500000000000000, 0.703692400000000 ] mass: 15.999400 reduced_to: 42 - symbol: O # 85 coordinates: [ 0.000000000000000, 0.500000000000000, 0.296307600000000 ] mass: 15.999400 reduced_to: 43 - symbol: O # 86 coordinates: [ 0.000000000000000, 0.296307600000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 44 - symbol: O # 87 coordinates: [ 0.203692400000000, 0.500000000000000, 0.500000000000000 ] mass: 15.999400 reduced_to: 45 - symbol: O # 88 coordinates: [ 0.250000000000000, 0.250000000000000, 0.750000000000000 ] mass: 15.999400 reduced_to: 46displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.1492356700000000, -0.0667080100000000, 0.0667080100000000 ] - [ -0.0192470400000000, 0.0038888900000000, -0.0038888900000000 ] - [ 0.0169821400000000, -0.0038592800000000, -0.0222707300000000 ] - [ -0.0000386300000000, -0.0017035800000000, -0.0002468300000000 ] - [ -0.0032889100000000, 0.0007114500000000, -0.0007114500000000 ] - [ -0.0192485000000000, 0.0038171800000000, -0.0038171800000000 ] - [ -0.0000282000000000, 0.0002489900000000, 0.0017007900000000 ] - [ 0.0170446200000000, 0.0224863800000000, 0.0038466100000000 ] - [ 0.0053989200000000, 0.0007117800000000, 0.0001007300000000 ] - [ 0.0064577400000000, -0.0002604200000000, 0.0002371300000000 ] - [ 0.0170446200000000, -0.0038466100000000, -0.0224863800000000 ] - [ 0.0169821400000000, 0.0222707300000000, 0.0038592800000000 ] - [ 0.0053989200000000, -0.0001007300000000, -0.0007117800000000 ] - [ 0.0064577400000000, -0.0002371300000000, 0.0002604200000000 ] - [ -0.0000386300000000, 0.0002468300000000, 0.0017035800000000 ] - [ -0.0000282000000000, -0.0017007900000000, -0.0002489900000000 ] - [ 0.0136344200000000, 0.0017645100000000, 0.0186201000000000 ] - [ 0.0136331100000000, -0.0184883200000000, -0.0017490600000000 ] - [ -0.0084262300000000, 0.0007810800000000, 0.0004837400000000 ] - [ -0.0212996300000000, 0.0030921700000000, -0.0031300600000000 ] - [ 0.0009044400000000, -0.0003943500000000, -0.0016241000000000 ] - [ 0.0009111800000000, 0.0016252400000000, 0.0003967500000000 ] - [ -0.0084262300000000, -0.0004837400000000, -0.0007810800000000 ] - [ -0.0212996300000000, 0.0031300600000000, -0.0030921700000000 ] - [ 0.0136331100000000, 0.0017490600000000, 0.0184883200000000 ] - [ 0.0009044400000000, 0.0016241000000000, 0.0003943500000000 ] - [ 0.0153169600000000, -0.0000872400000000, 0.0000872400000000 ] - [ 0.0067138100000000, 0.0005802400000000, -0.0005802400000000 ] - [ 0.0009111800000000, -0.0003967500000000, -0.0016252400000000 ] - [ 0.0136344200000000, -0.0186201000000000, -0.0017645100000000 ] - [ 0.0027365600000000, -0.0001936500000000, 0.0001936500000000 ] - [ 0.0067104300000000, 0.0005652200000000, -0.0005652200000000 ] - [ 0.0298439400000000, 0.0202385200000000, -0.0202385200000000 ] - [ 0.0070879500000000, 0.0037098000000000, -0.0037098000000000 ] - [ -0.0038037300000000, 0.0009476300000000, -0.0022575400000000 ] - [ -0.0076401300000000, -0.0016147700000000, -0.0007141400000000 ] - [ -0.0076401300000000, 0.0007141400000000, 0.0016147700000000 ] - [ 0.0109535000000000, 0.0051218700000000, 0.0047632800000000 ] - [ 0.0049901200000000, 0.0003271900000000, 0.0014866400000000 ] - [ -0.0058385100000000, -0.0006415800000000, 0.0006415800000000 ] - [ -0.0024467300000000, -0.0008414300000000, 0.0008932900000000 ] - [ 0.0020134500000000, -0.0004465300000000, 0.0023928800000000 ] - [ 0.0112157100000000, -0.0046140100000000, -0.0049313500000000 ] - [ 0.0034599300000000, 0.0013684400000000, -0.0040916900000000 ] - [ -0.0024203100000000, -0.0006357300000000, -0.0018810200000000 ] - [ -0.0038926900000000, 0.0021628500000000, 0.0026917300000000 ] - [ 0.0031721800000000, -0.0013303800000000, 0.0013303800000000 ] - [ 0.0005028700000000, -0.0001813200000000, 0.0001813200000000 ] - [ -0.0024467000000000, -0.0008999900000000, 0.0008585700000000 ] - [ -0.0012640900000000, 0.0000018400000000, 0.0004191600000000 ] - [ -0.0012640900000000, -0.0004191600000000, -0.0000018400000000 ] - [ 0.0008314000000000, -0.0025133000000000, -0.0018806900000000 ] - [ 0.0049901200000000, -0.0014866400000000, -0.0003271900000000 ] - [ -0.0013800600000000, 0.0003241000000000, -0.0003241000000000 ] - [ -0.0038199200000000, 0.0022813400000000, -0.0009507700000000 ] - [ 0.0034599300000000, 0.0040916900000000, -0.0013684400000000 ] - [ 0.0008353900000000, 0.0018750700000000, 0.0024878000000000 ] - [ 0.0020134500000000, -0.0023928800000000, 0.0004465300000000 ] - [ -0.0024203100000000, 0.0018810200000000, 0.0006357300000000 ] - [ -0.0038926900000000, -0.0026917300000000, -0.0021628500000000 ] - [ -0.0038970100000000, 0.0021620100000000, 0.0026790900000000 ] - [ -0.0024607700000000, -0.0006443200000000, -0.0018901500000000 ] - [ 0.0109535000000000, -0.0047632800000000, -0.0051218700000000 ] - [ 0.0034534800000000, 0.0013962300000000, -0.0040918500000000 ] - [ 0.0020052600000000, -0.0004458800000000, 0.0023733400000000 ] - [ -0.0024467000000000, -0.0008585700000000, 0.0008999900000000 ] - [ -0.0058596800000000, -0.0006533500000000, 0.0006533500000000 ] - [ 0.0050162100000000, 0.0003240000000000, 0.0014861900000000 ] - [ 0.0112157100000000, 0.0049313500000000, 0.0046140100000000 ] - [ -0.0076231000000000, 0.0006741200000000, 0.0016248000000000 ] - [ -0.0038199200000000, 0.0009507700000000, -0.0022813400000000 ] - [ -0.0076231000000000, -0.0016248000000000, -0.0006741200000000 ] - [ 0.0065702300000000, 0.0040712500000000, -0.0040712500000000 ] - [ 0.0292248000000000, 0.0193440700000000, -0.0193440700000000 ] - [ -0.0038970100000000, -0.0026790900000000, -0.0021620100000000 ] - [ -0.0024607700000000, 0.0018901500000000, 0.0006443200000000 ] - [ 0.0008314000000000, 0.0018806900000000, 0.0025133000000000 ] - [ 0.0020052600000000, -0.0023733400000000, 0.0004458800000000 ] - [ 0.0034534800000000, 0.0040918500000000, -0.0013962300000000 ] - [ -0.0038037300000000, 0.0022575400000000, -0.0009476300000000 ] - [ -0.0013928600000000, 0.0003250500000000, -0.0003250500000000 ] - [ 0.0050162100000000, -0.0014861900000000, -0.0003240000000000 ] - [ 0.0008353900000000, -0.0024878000000000, -0.0018750700000000 ] - [ -0.0012680400000000, -0.0004171000000000, 0.0000155600000000 ] - [ -0.0024467300000000, -0.0008932900000000, 0.0008414300000000 ] - [ -0.0012680400000000, -0.0000155600000000, 0.0004171000000000 ] - [ 0.0005167000000000, -0.0001830200000000, 0.0001830200000000 ] - [ 0.0031645700000000, -0.0013227600000000, 0.0013227600000000 ]- atom: 17 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0136207000000000, 0.0031116100000000, 0.0184862800000000 ] - [ 0.0136207000000000, 0.0184862800000000, 0.0031116100000000 ] - [ 0.0153090200000000, 0.0004831000000000, 0.0004831000000000 ] - [ -0.0212948700000000, 0.0017736800000000, 0.0017488100000000 ] - [ 0.0009087700000000, 0.0005751800000000, -0.0016268700000000 ] - [ 0.0009087700000000, -0.0016268700000000, 0.0005751800000000 ] - [ 0.0027317700000000, 0.0001949800000000, 0.0001949800000000 ] - [ -0.0212948700000000, 0.0017488100000000, 0.0017736800000000 ] - [ 0.0136486000000000, 0.0031106400000000, 0.0186169900000000 ] - [ 0.0009031300000000, -0.0016297400000000, 0.0005695100000000 ] - [ -0.0084209900000000, -0.0007814300000000, 0.0000842100000000 ] - [ 0.0067188400000000, -0.0004006100000000, -0.0004006100000000 ] - [ 0.0009031300000000, 0.0005695100000000, -0.0016297400000000 ] - [ 0.0136486000000000, 0.0186169900000000, 0.0031106400000000 ] - [ -0.0084209900000000, 0.0000842100000000, -0.0007814300000000 ] - [ 0.0067133500000000, -0.0003840200000000, -0.0003840200000000 ] - [ -0.2342916200000000, -0.0143458800000000, -0.0143458800000000 ] - [ 0.0084060400000000, 0.0002433300000000, 0.0002418300000000 ] - [ 0.0176597300000000, -0.0075890000000000, -0.0224075100000000 ] - [ 0.0176597300000000, -0.0224075100000000, -0.0075890000000000 ] - [ -0.0029064600000000, -0.0001162300000000, -0.0001162300000000 ] - [ 0.0084060400000000, 0.0002418300000000, 0.0002433300000000 ] - [ 0.0021195500000000, -0.0002465300000000, 0.0040948800000000 ] - [ 0.0021195500000000, 0.0040948800000000, -0.0002465300000000 ] - [ 0.0060316900000000, -0.0001171800000000, 0.0007033400000000 ] - [ -0.0159045600000000, 0.0075469500000000, 0.0075469500000000 ] - [ 0.0177063700000000, -0.0075200900000000, -0.0225400900000000 ] - [ 0.0021036700000000, 0.0040909600000000, -0.0002436200000000 ] - [ 0.0060316900000000, 0.0007033400000000, -0.0001171800000000 ] - [ -0.0159413800000000, 0.0075590400000000, 0.0075590400000000 ] - [ 0.0021036700000000, -0.0002436200000000, 0.0040909600000000 ] - [ 0.0177063700000000, -0.0225400900000000, -0.0075200900000000 ] - [ 0.0034298900000000, 0.0014653100000000, -0.0042988400000000 ] - [ 0.0327816100000000, 0.0083296700000000, 0.0083296700000000 ] - [ 0.0337556900000000, -0.0145302000000000, 0.0070960200000000 ] - [ 0.0337556900000000, 0.0070960200000000, -0.0145302000000000 ] - [ 0.0055904500000000, 0.0051984800000000, 0.0023347800000000 ] - [ -0.0093437500000000, 0.0013404300000000, -0.0032019300000000 ] - [ -0.0088799400000000, 0.0034693600000000, 0.0034693600000000 ] - [ -0.0089107900000000, 0.0034945000000000, 0.0034945000000000 ] - [ -0.0093258200000000, 0.0013551100000000, -0.0032175300000000 ] - [ 0.0055705100000000, 0.0051863100000000, 0.0023270400000000 ] - [ 0.0324413300000000, -0.0130309000000000, 0.0062092100000000 ] - [ 0.0324413300000000, 0.0062092100000000, -0.0130309000000000 ] - [ 0.0329006600000000, 0.0086877900000000, 0.0086877900000000 ] - [ 0.0034390900000000, 0.0014692800000000, -0.0042976400000000 ] - [ 0.0034298900000000, -0.0042988400000000, 0.0014653100000000 ] - [ 0.0019210900000000, 0.0004600000000000, 0.0004600000000000 ] - [ 0.0020210300000000, -0.0006660900000000, -0.0010141500000000 ] - [ 0.0020210300000000, -0.0010141500000000, -0.0006660900000000 ] - [ 0.0002687900000000, -0.0043033800000000, -0.0013293100000000 ] - [ -0.0013704300000000, -0.0010101000000000, 0.0003072100000000 ] - [ -0.0010634600000000, -0.0002675900000000, -0.0002675900000000 ] - [ -0.0010448300000000, -0.0002695500000000, -0.0002695500000000 ] - [ -0.0013689300000000, -0.0009994400000000, 0.0003094100000000 ] - [ 0.0002603100000000, -0.0043224000000000, -0.0013152500000000 ] - [ 0.0020210100000000, -0.0006722300000000, -0.0010239500000000 ] - [ 0.0020210100000000, -0.0010239500000000, -0.0006722300000000 ] - [ 0.0019324600000000, 0.0004604000000000, 0.0004604000000000 ] - [ 0.0034390900000000, -0.0042976400000000, 0.0014692800000000 ] - [ -0.0072380800000000, -0.0012125600000000, -0.0012125600000000 ] - [ -0.0033302600000000, 0.0007561900000000, -0.0010055300000000 ] - [ -0.0033757800000000, -0.0007177300000000, -0.0010706200000000 ] - [ -0.0019414200000000, 0.0005773000000000, 0.0015132700000000 ] - [ -0.0093437500000000, -0.0032019300000000, 0.0013404300000000 ] - [ 0.0002687900000000, -0.0013293100000000, -0.0043033800000000 ] - [ -0.0003586900000000, -0.0027683600000000, 0.0074815000000000 ] - [ -0.0003552900000000, -0.0027602800000000, 0.0074929700000000 ] - [ 0.0002603100000000, -0.0013152500000000, -0.0043224000000000 ] - [ -0.0093258200000000, -0.0032175300000000, 0.0013551100000000 ] - [ -0.0033717400000000, -0.0007236000000000, -0.0010900700000000 ] - [ -0.0019561200000000, 0.0005737400000000, 0.0015369300000000 ] - [ -0.0033194300000000, 0.0007543900000000, -0.0010032300000000 ] - [ -0.0072314200000000, -0.0011940400000000, -0.0011940400000000 ] - [ -0.0015679400000000, -0.0000755600000000, -0.0000755600000000 ] - [ -0.0033302600000000, -0.0010055300000000, 0.0007561900000000 ] - [ -0.0019414200000000, 0.0015132700000000, 0.0005773000000000 ] - [ -0.0033757800000000, -0.0010706200000000, -0.0007177300000000 ] - [ -0.0013704300000000, 0.0003072100000000, -0.0010101000000000 ] - [ 0.0055904500000000, 0.0023347800000000, 0.0051984800000000 ] - [ -0.0003586900000000, 0.0074815000000000, -0.0027683600000000 ] - [ -0.0003552900000000, 0.0074929700000000, -0.0027602800000000 ] - [ 0.0055705100000000, 0.0023270400000000, 0.0051863100000000 ] - [ -0.0013689300000000, 0.0003094100000000, -0.0009994400000000 ] - [ -0.0019561200000000, 0.0015369300000000, 0.0005737400000000 ] - [ -0.0033717400000000, -0.0010900700000000, -0.0007236000000000 ] - [ -0.0033194300000000, -0.0010032300000000, 0.0007543900000000 ] - [ -0.0015739800000000, -0.0000810700000000, -0.0000810700000000 ]- atom: 33 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0292431300000000, 0.0192658700000000, -0.0192658700000000 ] - [ 0.0031637000000000, -0.0021593000000000, 0.0021593000000000 ] - [ -0.0038979200000000, 0.0013292600000000, 0.0026823400000000 ] - [ 0.0031786400000000, 0.0021624000000000, 0.0021624000000000 ] - [ 0.0031637000000000, 0.0021593000000000, -0.0021593000000000 ] - [ 0.0292431300000000, -0.0192658700000000, 0.0192658700000000 ] - [ -0.0038979200000000, 0.0026823400000000, 0.0013292600000000 ] - [ 0.0298265400000000, 0.0203130000000000, 0.0203130000000000 ] - [ -0.0038911900000000, -0.0013269700000000, 0.0026918200000000 ] - [ -0.0038911900000000, 0.0026918200000000, -0.0013269700000000 ] - [ 0.0298265400000000, -0.0203130000000000, -0.0203130000000000 ] - [ -0.0038979200000000, -0.0026823400000000, -0.0013292600000000 ] - [ -0.0038911900000000, -0.0026918200000000, 0.0013269700000000 ] - [ -0.0038911900000000, 0.0013269700000000, -0.0026918200000000 ] - [ 0.0031786400000000, -0.0021624000000000, -0.0021624000000000 ] - [ -0.0038979200000000, -0.0013292600000000, -0.0026823400000000 ] - [ 0.0034525300000000, 0.0014611100000000, -0.0012026600000000 ] - [ -0.0072389600000000, 0.0042811300000000, 0.0042811300000000 ] - [ 0.0034163300000000, -0.0014744000000000, -0.0012042900000000 ] - [ 0.0034163300000000, 0.0014744000000000, 0.0012042900000000 ] - [ 0.0034525300000000, -0.0012026600000000, 0.0014611100000000 ] - [ -0.0015734300000000, 0.0000792000000000, 0.0000792000000000 ] - [ 0.0034163300000000, 0.0012042900000000, 0.0014744000000000 ] - [ 0.0034163300000000, -0.0012042900000000, -0.0014744000000000 ] - [ -0.0072389600000000, -0.0042811300000000, -0.0042811300000000 ] - [ 0.0034525300000000, -0.0014611100000000, 0.0012026600000000 ] - [ -0.0072295100000000, 0.0043158400000000, -0.0043158400000000 ] - [ -0.0072295100000000, -0.0043158400000000, 0.0043158400000000 ] - [ -0.0015734300000000, -0.0000792000000000, -0.0000792000000000 ] - [ 0.0034525300000000, 0.0012026600000000, -0.0014611100000000 ] - [ -0.0015648900000000, 0.0000762400000000, -0.0000762400000000 ] - [ -0.0015648900000000, -0.0000762400000000, 0.0000762400000000 ] - [ -0.1651913400000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0035838900000000, 0.0004676200000000, -0.0004676200000000 ] - [ -0.0000839800000000, -0.0003965000000000, -0.0002975300000000 ] - [ 0.0015172500000000, -0.0018020600000000, 0.0036585000000000 ] - [ 0.0015172500000000, -0.0036585000000000, 0.0018020600000000 ] - [ 0.0015457000000000, -0.0018604300000000, -0.0036238000000000 ] - [ -0.0009036300000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0020063900000000, -0.0003210500000000, 0.0003210500000000 ] - [ 0.0012036600000000, 0.0000201900000000, -0.0003794800000000 ] - [ -0.0055666100000000, 0.0015166200000000, 0.0000606100000000 ] - [ -0.0055666100000000, -0.0015166200000000, -0.0000606100000000 ] - [ -0.0009383300000000, -0.0000212400000000, -0.0003819000000000 ] - [ -0.0008685200000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0101050500000000, -0.0093483100000000, -0.0093483100000000 ] - [ -0.0022146400000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0035838900000000, -0.0004676200000000, 0.0004676200000000 ] - [ 0.0015172500000000, 0.0036585000000000, -0.0018020600000000 ] - [ -0.0000839800000000, -0.0002975300000000, -0.0003965000000000 ] - [ -0.0000839800000000, 0.0003965000000000, 0.0002975300000000 ] - [ -0.0000793200000000, -0.0003484200000000, 0.0003997700000000 ] - [ -0.0009036300000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0020063900000000, 0.0003210500000000, -0.0003210500000000 ] - [ 0.0038964800000000, 0.0000463500000000, 0.0004197000000000 ] - [ -0.0009383300000000, 0.0003819000000000, 0.0000212400000000 ] - [ -0.0009383300000000, -0.0003819000000000, -0.0000212400000000 ] - [ -0.0055666100000000, -0.0000606100000000, -0.0015166200000000 ] - [ -0.0008685200000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0101050500000000, 0.0093483100000000, 0.0093483100000000 ] - [ 0.0027739700000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0019511000000000, 0.0003031500000000, 0.0003031500000000 ] - [ 0.0015457000000000, 0.0036238000000000, 0.0018604300000000 ] - [ 0.0015457000000000, 0.0018604300000000, 0.0036238000000000 ] - [ -0.0000793200000000, 0.0003997700000000, -0.0003484200000000 ] - [ 0.0015172500000000, 0.0018020600000000, -0.0036585000000000 ] - [ 0.0163882100000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0035411500000000, -0.0004623000000000, -0.0004623000000000 ] - [ -0.0055666100000000, 0.0000606100000000, 0.0015166200000000 ] - [ 0.0038964800000000, 0.0004197000000000, 0.0000463500000000 ] - [ 0.0038964800000000, -0.0004197000000000, -0.0000463500000000 ] - [ 0.0038964800000000, -0.0000463500000000, -0.0004197000000000 ] - [ 0.0162135900000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0100620300000000, 0.0093325000000000, -0.0093325000000000 ] - [ 0.0027739700000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0019511000000000, -0.0003031500000000, -0.0003031500000000 ] - [ -0.0000793200000000, -0.0003997700000000, 0.0003484200000000 ] - [ -0.0000793200000000, 0.0003484200000000, -0.0003997700000000 ] - [ 0.0015457000000000, -0.0036238000000000, -0.0018604300000000 ] - [ -0.0000839800000000, 0.0002975300000000, 0.0003965000000000 ] - [ 0.0004244400000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0035411500000000, 0.0004623000000000, 0.0004623000000000 ] - [ -0.0009383300000000, 0.0000212400000000, 0.0003819000000000 ] - [ 0.0012036600000000, -0.0003794800000000, 0.0000201900000000 ] - [ 0.0012036600000000, 0.0003794800000000, -0.0000201900000000 ] - [ 0.0012036600000000, -0.0000201900000000, 0.0003794800000000 ] - [ 0.0004682500000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0100620300000000, -0.0093325000000000, 0.0093325000000000 ]- atom: 34 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ 0.0037827100000000, 0.0111970000000000, 0.0046133600000000 ] - [ -0.0040058500000000, 0.0109645300000000, 0.0047598700000000 ] - [ 0.0006457300000000, 0.0020207200000000, -0.0004450800000000 ] - [ 0.0003177400000000, 0.0034336000000000, 0.0006972100000000 ] - [ -0.0001766200000000, -0.0024469900000000, 0.0008943100000000 ] - [ 0.0001873100000000, -0.0024371900000000, 0.0009067700000000 ] - [ -0.0003199500000000, -0.0012677000000000, -0.0004124900000000 ] - [ -0.0015005800000000, -0.0076312600000000, 0.0041018300000000 ] - [ -0.0006304200000000, 0.0008447200000000, -0.0009428500000000 ] - [ 0.0006462900000000, 0.0008192700000000, -0.0009514700000000 ] - [ -0.0003328500000000, 0.0034707300000000, 0.0006996100000000 ] - [ -0.0006502000000000, 0.0019920800000000, -0.0004515600000000 ] - [ 0.0018812400000000, -0.0038126900000000, -0.0018718200000000 ] - [ -0.0018876100000000, -0.0038066400000000, -0.0018881600000000 ] - [ 0.0014726200000000, -0.0076237100000000, 0.0040714500000000 ] - [ 0.0003260600000000, -0.0012614200000000, -0.0004185400000000 ] - [ 0.0090103100000000, 0.0337597000000000, 0.0146203600000000 ] - [ 0.0010103000000000, -0.0033703800000000, 0.0006793200000000 ] - [ 0.0027397800000000, 0.0002774900000000, -0.0032043600000000 ] - [ 0.0075171600000000, -0.0093433100000000, -0.0043364100000000 ] - [ 0.0004510900000000, -0.0019584100000000, -0.0015121900000000 ] - [ -0.0007498500000000, 0.0020180900000000, 0.0007226100000000 ] - [ -0.0074557700000000, -0.0093296800000000, -0.0042944800000000 ] - [ -0.0027863900000000, 0.0002449200000000, -0.0032148700000000 ] - [ 0.0007564800000000, 0.0020195100000000, 0.0007175600000000 ] - [ -0.0004676700000000, -0.0019408200000000, -0.0015300600000000 ] - [ -0.0034703700000000, 0.0056039400000000, 0.0052069700000000 ] - [ -0.0002679000000000, -0.0013660500000000, 0.0003100400000000 ] - [ -0.0010042500000000, -0.0033762100000000, 0.0006615400000000 ] - [ -0.0080102500000000, 0.0324287600000000, 0.0129448500000000 ] - [ 0.0002712300000000, -0.0013755900000000, 0.0003042800000000 ] - [ 0.0034902800000000, 0.0055474400000000, 0.0051712700000000 ] - [ 0.0004620700000000, 0.0015371100000000, -0.0036523200000000 ] - [ -0.0006790100000000, -0.1510599900000000, -0.0758888400000000 ] - [ 0.0009221700000000, -0.0046918700000000, -0.0002660800000000 ] - [ 0.0118397600000000, 0.0082268900000000, -0.0009733500000000 ] - [ -0.0009890400000000, -0.0046848300000000, -0.0002193400000000 ] - [ -0.0025002400000000, 0.0014710500000000, -0.0004084900000000 ] - [ -0.0018968700000000, -0.0001305500000000, 0.0017040300000000 ] - [ 0.0000104400000000, -0.0024042000000000, -0.0000016100000000 ] - [ 0.0004696700000000, -0.0009897200000000, 0.0000696100000000 ] - [ 0.0000694200000000, 0.0003135400000000, 0.0007350200000000 ] - [ -0.0125932100000000, 0.0346254300000000, 0.0095024800000000 ] - [ -0.0034369300000000, -0.0032633400000000, 0.0124264900000000 ] - [ 0.0016656900000000, 0.0012487700000000, 0.0025320400000000 ] - [ 0.0000020700000000, -0.0009361600000000, 0.0004039100000000 ] - [ -0.0004708600000000, 0.0015373200000000, -0.0036239200000000 ] - [ -0.0000169400000000, 0.0010408600000000, 0.0005709600000000 ] - [ 0.0000267200000000, 0.0014696000000000, -0.0001764700000000 ] - [ -0.0000589300000000, 0.0002836200000000, 0.0003039300000000 ] - [ -0.0000147100000000, 0.0014724300000000, -0.0002060600000000 ] - [ 0.0000561800000000, -0.0004390100000000, -0.0000238500000000 ] - [ 0.0018588000000000, -0.0001127900000000, 0.0016861300000000 ] - [ 0.0000143000000000, 0.0005323400000000, 0.0000025000000000 ] - [ -0.0004769100000000, 0.0013197900000000, 0.0001313900000000 ] - [ 0.0123257300000000, 0.0338719600000000, 0.0093687400000000 ] - [ -0.0000706700000000, 0.0003338500000000, 0.0007142700000000 ] - [ -0.0004678900000000, 0.0032331100000000, 0.0015632900000000 ] - [ -0.0016436500000000, 0.0012814500000000, 0.0025468300000000 ] - [ 0.0000057100000000, 0.0038844800000000, 0.0003792000000000 ] - [ 0.0003032900000000, -0.0000916800000000, 0.0003920300000000 ] - [ -0.0000114700000000, -0.0005251800000000, 0.0001045200000000 ] - [ 0.0004003900000000, -0.0022506300000000, -0.0006038200000000 ] - [ -0.0000605100000000, -0.0004158700000000, -0.0000165900000000 ] - [ -0.0004011300000000, -0.0022528100000000, -0.0006286600000000 ] - [ 0.0000617500000000, 0.0002449600000000, 0.0003060600000000 ] - [ 0.0004338800000000, -0.0001325200000000, -0.0016955600000000 ] - [ 0.0000193800000000, -0.0021295800000000, 0.0037368000000000 ] - [ 0.0034831400000000, -0.0031148000000000, 0.0124888400000000 ] - [ 0.0015815300000000, 0.0003188300000000, -0.0004566700000000 ] - [ -0.0001323400000000, -0.0000012200000000, -0.0003248500000000 ] - [ -0.0004837800000000, -0.0010171900000000, 0.0000756200000000 ] - [ -0.0025941800000000, 0.0018550300000000, -0.0024661400000000 ] - [ 0.0000191700000000, -0.0055657300000000, 0.0015178700000000 ] - [ -0.0003030500000000, -0.0000825500000000, 0.0003910500000000 ] - [ -0.0000115200000000, 0.0017508600000000, 0.0001037400000000 ] - [ -0.0003042000000000, 0.0014723800000000, -0.0000288300000000 ] - [ 0.0024648800000000, 0.0015039100000000, -0.0003900800000000 ] - [ 0.0002978300000000, 0.0014702400000000, -0.0000569600000000 ] - [ -0.0116577400000000, 0.0081155200000000, -0.0009419800000000 ] - [ -0.0004555000000000, -0.0001138700000000, -0.0016938200000000 ] - [ 0.0000074900000000, 0.0097161200000000, -0.0037345800000000 ] - [ 0.0004777000000000, 0.0032735400000000, 0.0015961700000000 ] - [ 0.0001342900000000, 0.0000055200000000, -0.0002976600000000 ] - [ -0.0015776000000000, 0.0003259400000000, -0.0004740300000000 ] - [ 0.0004810100000000, 0.0012998000000000, 0.0001315200000000 ] - [ 0.0026277500000000, 0.0018650600000000, -0.0024661700000000 ] - [ -0.0000031300000000, 0.0012103500000000, -0.0003771900000000 ]- atom: 34 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0065979300000000, 0.0051627800000000, -0.0051627800000000 ] - [ 0.0065979300000000, -0.0051627800000000, 0.0051627800000000 ] - [ -0.0058346600000000, 0.0023679900000000, 0.0023679900000000 ] - [ 0.0050157300000000, 0.0013768900000000, -0.0016178300000000 ] - [ 0.0005010100000000, -0.0008542000000000, 0.0008542000000000 ] - [ 0.0005010100000000, 0.0008542000000000, -0.0008542000000000 ] - [ -0.0013867400000000, 0.0000068700000000, 0.0000068700000000 ] - [ 0.0050157300000000, -0.0016178300000000, 0.0013768900000000 ] - [ -0.0024323000000000, -0.0025041900000000, -0.0022621600000000 ] - [ -0.0024323000000000, 0.0025041900000000, 0.0022621600000000 ] - [ 0.0050157300000000, -0.0013768900000000, 0.0016178300000000 ] - [ -0.0058346600000000, -0.0023679900000000, -0.0023679900000000 ] - [ -0.0024323000000000, 0.0022621600000000, 0.0025041900000000 ] - [ -0.0024323000000000, -0.0022621600000000, -0.0025041900000000 ] - [ 0.0050157300000000, 0.0016178300000000, -0.0013768900000000 ] - [ -0.0013867400000000, -0.0000068700000000, -0.0000068700000000 ] - [ 0.0328490600000000, 0.0069196000000000, 0.0069196000000000 ] - [ -0.0033222700000000, 0.0010777700000000, 0.0010152800000000 ] - [ -0.0003812200000000, 0.0013357500000000, 0.0013585900000000 ] - [ -0.0003812200000000, 0.0013585900000000, 0.0013357500000000 ] - [ 0.0019321600000000, 0.0005724700000000, 0.0005724700000000 ] - [ -0.0033222700000000, 0.0010152800000000, 0.0010777700000000 ] - [ -0.0003812200000000, -0.0013585900000000, -0.0013357500000000 ] - [ -0.0003812200000000, -0.0013357500000000, -0.0013585900000000 ] - [ -0.0033222700000000, -0.0010152800000000, -0.0010777700000000 ] - [ 0.0019321600000000, -0.0005724700000000, -0.0005724700000000 ] - [ -0.0088927300000000, -0.0023407300000000, 0.0023407300000000 ] - [ -0.0010470800000000, -0.0010054800000000, 0.0010054800000000 ] - [ -0.0033222700000000, -0.0010777700000000, -0.0010152800000000 ] - [ 0.0328490600000000, -0.0069196000000000, -0.0069196000000000 ] - [ -0.0010470800000000, 0.0010054800000000, -0.0010054800000000 ] - [ -0.0088927300000000, 0.0023407300000000, -0.0023407300000000 ] - [ -0.0035440700000000, -0.0018337700000000, 0.0018337700000000 ] - [ -0.1100521400000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0081995700000000, 0.0002447400000000, 0.0133795500000000 ] - [ 0.0081995700000000, 0.0133795500000000, 0.0002447400000000 ] - [ 0.0081995700000000, -0.0002447400000000, -0.0133795500000000 ] - [ 0.0014925200000000, -0.0015339200000000, -0.0006096200000000 ] - [ 0.0002793900000000, -0.0004435300000000, -0.0004435300000000 ] - [ 0.0042510000000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0032502800000000, -0.0003884900000000, 0.0007286900000000 ] - [ -0.0010128300000000, -0.0004726100000000, -0.0003851800000000 ] - [ -0.0031275200000000, -0.0094658500000000, -0.0013648500000000 ] - [ -0.0031275200000000, -0.0013648500000000, -0.0094658500000000 ] - [ -0.0011623600000000, 0.0016434300000000, 0.0016434300000000 ] - [ -0.0008856600000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0035440700000000, 0.0018337700000000, -0.0018337700000000 ] - [ -0.0007745900000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0004161100000000, 0.0000301100000000, -0.0002560600000000 ] - [ -0.0004161100000000, -0.0002560600000000, 0.0000301100000000 ] - [ -0.0004161100000000, -0.0000301100000000, 0.0002560600000000 ] - [ 0.0002645700000000, 0.0002515300000000, -0.0001881100000000 ] - [ 0.0002793900000000, 0.0004435300000000, 0.0004435300000000 ] - [ 0.0003926600000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0013008900000000, -0.0003971000000000, -0.0003181900000000 ] - [ -0.0031275200000000, 0.0094658500000000, 0.0013648500000000 ] - [ -0.0010128300000000, 0.0004726100000000, 0.0003851800000000 ] - [ -0.0010128300000000, 0.0003851800000000, 0.0004726100000000 ] - [ -0.0011623600000000, -0.0016434300000000, -0.0016434300000000 ] - [ -0.0008856600000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0019785100000000, -0.0003182400000000, -0.0003182400000000 ] - [ 0.0012947800000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0014925200000000, 0.0006096200000000, 0.0015339200000000 ] - [ 0.0002645700000000, -0.0002515300000000, 0.0001881100000000 ] - [ 0.0014925200000000, -0.0006096200000000, -0.0015339200000000 ] - [ -0.0004161100000000, 0.0002560600000000, -0.0000301100000000 ] - [ 0.0002788900000000, 0.0018865300000000, -0.0018865300000000 ] - [ -0.0003555100000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0031275200000000, 0.0013648500000000, 0.0094658500000000 ] - [ 0.0032502800000000, 0.0007286900000000, -0.0003884900000000 ] - [ 0.0013008900000000, 0.0003181900000000, 0.0003971000000000 ] - [ 0.0032502800000000, 0.0003884900000000, -0.0007286900000000 ] - [ 0.0045189300000000, -0.0026012100000000, 0.0026012100000000 ] - [ 0.0161648600000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0019785100000000, 0.0003182400000000, 0.0003182400000000 ] - [ 0.0012947800000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0002645700000000, 0.0001881100000000, -0.0002515300000000 ] - [ 0.0014925200000000, 0.0015339200000000, 0.0006096200000000 ] - [ 0.0002645700000000, -0.0001881100000000, 0.0002515300000000 ] - [ 0.0081995700000000, -0.0133795500000000, -0.0002447400000000 ] - [ 0.0002788900000000, -0.0018865300000000, 0.0018865300000000 ] - [ -0.0003555100000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0010128300000000, -0.0003851800000000, -0.0004726100000000 ] - [ 0.0013008900000000, -0.0003181900000000, -0.0003971000000000 ] - [ 0.0032502800000000, -0.0007286900000000, 0.0003884900000000 ] - [ 0.0013008900000000, 0.0003971000000000, 0.0003181900000000 ] - [ 0.0045189300000000, 0.0026012100000000, -0.0026012100000000 ] - [ 0.0004493300000000, 0.0000000000000000, 0.0000000000000000 ]- atom: 34 displacement: [ -0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0070451800000000, -0.0048858600000000, 0.0048858600000000 ] - [ -0.0070451800000000, 0.0048858600000000, -0.0048858600000000 ] - [ 0.0058577700000000, -0.0024016800000000, -0.0024016800000000 ] - [ -0.0049978100000000, -0.0013871500000000, 0.0016201200000000 ] - [ -0.0005083600000000, 0.0008592800000000, -0.0008592800000000 ] - [ -0.0005083600000000, -0.0008592800000000, 0.0008592800000000 ] - [ 0.0013835300000000, -0.0000061600000000, -0.0000061600000000 ] - [ -0.0049978100000000, 0.0016201200000000, -0.0013871500000000 ] - [ 0.0024428600000000, 0.0024997800000000, 0.0022615400000000 ] - [ 0.0024428600000000, -0.0024997800000000, -0.0022615400000000 ] - [ -0.0049978100000000, 0.0013871500000000, -0.0016201200000000 ] - [ 0.0058577700000000, 0.0024016800000000, 0.0024016800000000 ] - [ 0.0024428600000000, -0.0022615400000000, -0.0024997800000000 ] - [ 0.0024428600000000, 0.0022615400000000, 0.0024997800000000 ] - [ -0.0049978100000000, -0.0016201200000000, 0.0013871500000000 ] - [ 0.0013835300000000, 0.0000061600000000, 0.0000061600000000 ] - [ -0.0328324100000000, -0.0063745600000000, -0.0063745600000000 ] - [ 0.0033279700000000, -0.0010874200000000, -0.0010241500000000 ] - [ 0.0003378900000000, -0.0013122900000000, -0.0013364400000000 ] - [ 0.0003378900000000, -0.0013364400000000, -0.0013122900000000 ] - [ -0.0019249700000000, -0.0005780400000000, -0.0005780400000000 ] - [ 0.0033279700000000, -0.0010241500000000, -0.0010874200000000 ] - [ 0.0003378900000000, 0.0013364400000000, 0.0013122900000000 ] - [ 0.0003378900000000, 0.0013122900000000, 0.0013364400000000 ] - [ 0.0033279700000000, 0.0010241500000000, 0.0010874200000000 ] - [ -0.0019249700000000, 0.0005780400000000, 0.0005780400000000 ] - [ 0.0088965000000000, 0.0023255100000000, -0.0023255100000000 ] - [ 0.0010568800000000, 0.0010057500000000, -0.0010057500000000 ] - [ 0.0033279700000000, 0.0010874200000000, 0.0010241500000000 ] - [ -0.0328324100000000, 0.0063745600000000, 0.0063745600000000 ] - [ 0.0010568800000000, -0.0010057500000000, 0.0010057500000000 ] - [ 0.0088965000000000, -0.0023255100000000, 0.0023255100000000 ] - [ 0.0035716500000000, 0.0018386900000000, -0.0018386900000000 ] - [ 0.1104500500000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0081233400000000, -0.0002551200000000, -0.0132072800000000 ] - [ -0.0081233400000000, -0.0132072800000000, -0.0002551200000000 ] - [ -0.0081233400000000, 0.0002551200000000, 0.0132072800000000 ] - [ -0.0014772500000000, 0.0015124500000000, 0.0006271600000000 ] - [ -0.0003088400000000, 0.0004428800000000, 0.0004428800000000 ] - [ -0.0042608000000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0032678500000000, 0.0004150100000000, -0.0007396300000000 ] - [ 0.0010007700000000, 0.0004565300000000, 0.0004279400000000 ] - [ 0.0032564700000000, 0.0093965000000000, 0.0013006100000000 ] - [ 0.0032564700000000, 0.0013006100000000, 0.0093965000000000 ] - [ 0.0011886200000000, -0.0016695000000000, -0.0016695000000000 ] - [ 0.0008819100000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0035716500000000, -0.0018386900000000, 0.0018386900000000 ] - [ 0.0007058000000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0004363200000000, -0.0000528500000000, 0.0002975000000000 ] - [ 0.0004363200000000, 0.0002975000000000, -0.0000528500000000 ] - [ 0.0004363200000000, 0.0000528500000000, -0.0002975000000000 ] - [ -0.0002583200000000, -0.0002907800000000, 0.0001941100000000 ] - [ -0.0003088400000000, -0.0004428800000000, -0.0004428800000000 ] - [ -0.0003770100000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0013119600000000, 0.0004202600000000, 0.0003098900000000 ] - [ 0.0032564700000000, -0.0093965000000000, -0.0013006100000000 ] - [ 0.0010007700000000, -0.0004565300000000, -0.0004279400000000 ] - [ 0.0010007700000000, -0.0004279400000000, -0.0004565300000000 ] - [ 0.0011886200000000, 0.0016695000000000, 0.0016695000000000 ] - [ 0.0008819100000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0019829200000000, 0.0003253200000000, 0.0003253200000000 ] - [ -0.0013384300000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0014772500000000, -0.0006271600000000, -0.0015124500000000 ] - [ -0.0002583200000000, 0.0002907800000000, -0.0001941100000000 ] - [ -0.0014772500000000, 0.0006271600000000, 0.0015124500000000 ] - [ 0.0004363200000000, -0.0002975000000000, 0.0000528500000000 ] - [ -0.0003018700000000, -0.0018935200000000, 0.0018935200000000 ] - [ 0.0003942600000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0032564700000000, -0.0013006100000000, -0.0093965000000000 ] - [ -0.0032678500000000, -0.0007396300000000, 0.0004150100000000 ] - [ -0.0013119600000000, -0.0003098900000000, -0.0004202600000000 ] - [ -0.0032678500000000, -0.0004150100000000, 0.0007396300000000 ] - [ -0.0045249900000000, 0.0026223000000000, -0.0026223000000000 ] - [ -0.0164575300000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0019829200000000, -0.0003253200000000, -0.0003253200000000 ] - [ -0.0013384300000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0002583200000000, -0.0001941100000000, 0.0002907800000000 ] - [ -0.0014772500000000, -0.0015124500000000, -0.0006271600000000 ] - [ -0.0002583200000000, 0.0001941100000000, -0.0002907800000000 ] - [ -0.0081233400000000, 0.0132072800000000, 0.0002551200000000 ] - [ -0.0003018700000000, 0.0018935200000000, -0.0018935200000000 ] - [ 0.0003942600000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0010007700000000, 0.0004279400000000, 0.0004565300000000 ] - [ -0.0013119600000000, 0.0003098900000000, 0.0004202600000000 ] - [ -0.0032678500000000, 0.0007396300000000, -0.0004150100000000 ] - [ -0.0013119600000000, -0.0004202600000000, -0.0003098900000000 ] - [ -0.0045249900000000, -0.0026223000000000, 0.0026223000000000 ] - [ -0.0004497900000000, 0.0000000000000000, 0.0000000000000000 ]