# Fileset [phonopy_training_dataset.yaml.xz](https://mdr.nims.go.jp/filesets/2004a445-40a0-4044-9f64-dbabb5962e98/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 [First-principles lattice thermal conductivity calculation for Al6Cd4SO12 / I-43m (217) / materials id 9203](https://mdr.nims.go.jp/datasets/d4627bf3-a13b-40cb-b57e-0e4f40af7d01) ## Fulltext phonopy: version: "2.24.2" frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05space_group: type: "I-43m" number: 217 Hall_symbol: "I -4 2 3"primitive_matrix:- [ -0.500000000000000, 0.500000000000000, 0.500000000000000 ]- [ 0.500000000000000, -0.500000000000000, 0.500000000000000 ]- [ 0.500000000000000, 0.500000000000000, -0.500000000000000 ]supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ -4.424578395000000, 4.424578395000000, 4.424578395000000 ] # a - [ 4.424578395000000, -4.424578395000000, 4.424578395000000 ] # b - [ 4.424578395000000, 4.424578395000000, -4.424578395000000 ] # c points: - symbol: O # 1 coordinates: [ 0.720595600000008, 0.449518370000006, 0.449518370000006 ] mass: 15.999400 - symbol: O # 2 coordinates: [ 0.271077230000002, 0.550481629999994, 0.000000000000000 ] mass: 15.999400 - symbol: O # 3 coordinates: [ 0.279404399999992, 0.728922769999998, 0.728922769999998 ] mass: 15.999400 - symbol: O # 4 coordinates: [ 0.550481629999994, 0.000000000000000, 0.271077230000002 ] mass: 15.999400 - symbol: O # 5 coordinates: [ 0.449518370000006, 0.720595600000008, 0.449518370000006 ] mass: 15.999400 - symbol: O # 6 coordinates: [ 0.000000000000000, 0.271077230000002, 0.550481629999994 ] mass: 15.999400 - symbol: O # 7 coordinates: [ 0.550481629999994, 0.271077230000002, 0.000000000000000 ] mass: 15.999400 - symbol: O # 8 coordinates: [ 0.728922769999998, 0.728922769999998, 0.279404399999992 ] mass: 15.999400 - symbol: O # 9 coordinates: [ 0.449518370000006, 0.449518370000006, 0.720595600000008 ] mass: 15.999400 - symbol: O # 10 coordinates: [ 0.728922769999998, 0.279404399999992, 0.728922769999998 ] mass: 15.999400 - symbol: O # 11 coordinates: [ 0.271077230000002, 0.000000000000000, 0.550481629999994 ] mass: 15.999400 - symbol: O # 12 coordinates: [ 0.000000000000000, 0.550481629999994, 0.271077230000002 ] mass: 15.999400 - symbol: Al # 13 coordinates: [ 0.250000000000000, 0.500000000000000, 0.750000000000000 ] mass: 26.981539 - symbol: Al # 14 coordinates: [ 0.750000000000000, 0.500000000000000, 0.250000000000000 ] mass: 26.981539 - symbol: Al # 15 coordinates: [ 0.750000000000000, 0.250000000000000, 0.500000000000000 ] mass: 26.981539 - symbol: Al # 16 coordinates: [ 0.250000000000000, 0.750000000000000, 0.500000000000000 ] mass: 26.981539 - symbol: Al # 17 coordinates: [ 0.500000000000000, 0.750000000000000, 0.250000000000000 ] mass: 26.981539 - symbol: Al # 18 coordinates: [ 0.500000000000000, 0.250000000000000, 0.750000000000000 ] mass: 26.981539 - symbol: S # 19 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 32.065000 - symbol: Cd # 20 coordinates: [ 0.670993179999990, 0.670993179999990, 0.670993179999990 ] mass: 112.411000 - symbol: Cd # 21 coordinates: [ 0.000000000000000, 0.000000000000000, 0.329006820000010 ] mass: 112.411000 - symbol: Cd # 22 coordinates: [ 0.000000000000000, 0.329006820000010, 0.000000000000000 ] mass: 112.411000 - symbol: Cd # 23 coordinates: [ 0.329006820000010, 0.000000000000000, 0.000000000000000 ] mass: 112.411000 reciprocal_lattice: # without 2pi - [ 0.000000000000000, 0.113005117180210, 0.113005117180210 ] # a* - [ 0.113005117180210, 0.000000000000000, 0.113005117180210 ] # b* - [ 0.113005117180210, 0.113005117180210, 0.000000000000000 ] # c*unit_cell: lattice: - [ 8.849156790000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 8.849156790000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 8.849156790000000 ] # c points: - symbol: O # 1 coordinates: [ 0.589220570000002, 0.860297800000004, 0.860297800000004 ] mass: 15.999400 reduced_to: 1 - symbol: O # 2 coordinates: [ 0.139702199999996, 0.860297800000004, 0.410779429999998 ] mass: 15.999400 reduced_to: 2 - symbol: O # 3 coordinates: [ 0.589220570000002, 0.139702199999996, 0.139702199999996 ] mass: 15.999400 reduced_to: 3 - symbol: O # 4 coordinates: [ 0.360297800000004, 0.910779429999998, 0.639702199999996 ] mass: 15.999400 reduced_to: 4 - symbol: O # 5 coordinates: [ 0.860297800000004, 0.589220570000002, 0.860297800000004 ] mass: 15.999400 reduced_to: 5 - symbol: O # 6 coordinates: [ 0.410779429999998, 0.139702199999996, 0.860297800000004 ] mass: 15.999400 reduced_to: 6 - symbol: O # 7 coordinates: [ 0.860297800000004, 0.139702199999996, 0.410779429999998 ] mass: 15.999400 reduced_to: 7 - symbol: O # 8 coordinates: [ 0.139702199999996, 0.139702199999996, 0.589220570000002 ] mass: 15.999400 reduced_to: 8 - symbol: O # 9 coordinates: [ 0.360297800000004, 0.360297800000004, 0.089220570000002 ] mass: 15.999400 reduced_to: 9 - symbol: O # 10 coordinates: [ 0.139702199999996, 0.589220570000002, 0.139702199999996 ] mass: 15.999400 reduced_to: 10 - symbol: O # 11 coordinates: [ 0.139702199999996, 0.410779429999998, 0.860297800000004 ] mass: 15.999400 reduced_to: 11 - symbol: O # 12 coordinates: [ 0.910779429999998, 0.360297800000004, 0.639702199999996 ] mass: 15.999400 reduced_to: 12 - symbol: O # 13 coordinates: [ 0.089220570000002, 0.360297800000004, 0.360297800000004 ] mass: 15.999400 reduced_to: 1 - symbol: O # 14 coordinates: [ 0.639702199999996, 0.360297800000004, 0.910779429999998 ] mass: 15.999400 reduced_to: 2 - symbol: O # 15 coordinates: [ 0.089220570000002, 0.639702199999996, 0.639702199999996 ] mass: 15.999400 reduced_to: 3 - symbol: O # 16 coordinates: [ 0.860297800000004, 0.410779429999998, 0.139702199999996 ] mass: 15.999400 reduced_to: 4 - symbol: O # 17 coordinates: [ 0.360297800000004, 0.089220570000002, 0.360297800000004 ] mass: 15.999400 reduced_to: 5 - symbol: O # 18 coordinates: [ 0.910779429999998, 0.639702199999996, 0.360297800000004 ] mass: 15.999400 reduced_to: 6 - symbol: O # 19 coordinates: [ 0.360297800000004, 0.639702199999996, 0.910779429999998 ] mass: 15.999400 reduced_to: 7 - symbol: O # 20 coordinates: [ 0.639702199999996, 0.639702199999996, 0.089220570000002 ] mass: 15.999400 reduced_to: 8 - symbol: O # 21 coordinates: [ 0.860297800000004, 0.860297800000004, 0.589220570000002 ] mass: 15.999400 reduced_to: 9 - symbol: O # 22 coordinates: [ 0.639702199999996, 0.089220570000002, 0.639702199999996 ] mass: 15.999400 reduced_to: 10 - symbol: O # 23 coordinates: [ 0.639702199999996, 0.910779429999998, 0.360297800000004 ] mass: 15.999400 reduced_to: 11 - symbol: O # 24 coordinates: [ 0.410779429999998, 0.860297800000004, 0.139702199999996 ] mass: 15.999400 reduced_to: 12 - symbol: Al # 25 coordinates: [ 0.500000000000000, 0.250000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 26 coordinates: [ 0.000000000000000, 0.250000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 26 - symbol: Al # 27 coordinates: [ 0.500000000000000, 0.000000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 27 - symbol: Al # 28 coordinates: [ 0.000000000000000, 0.500000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 28 - symbol: Al # 29 coordinates: [ 0.250000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: Al # 30 coordinates: [ 0.250000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 30 - symbol: Al # 31 coordinates: [ 0.000000000000000, 0.750000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 32 coordinates: [ 0.500000000000000, 0.750000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 26 - symbol: Al # 33 coordinates: [ 0.000000000000000, 0.500000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 27 - symbol: Al # 34 coordinates: [ 0.500000000000000, 0.000000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 28 - symbol: Al # 35 coordinates: [ 0.750000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: Al # 36 coordinates: [ 0.750000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 30 - symbol: S # 37 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 32.065000 reduced_to: 37 - symbol: S # 38 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 32.065000 reduced_to: 37 - symbol: Cd # 39 coordinates: [ 0.335496589999995, 0.335496589999995, 0.335496589999995 ] mass: 112.411000 reduced_to: 39 - symbol: Cd # 40 coordinates: [ 0.164503410000005, 0.164503410000005, 0.835496589999995 ] mass: 112.411000 reduced_to: 40 - symbol: Cd # 41 coordinates: [ 0.664503410000005, 0.335496589999995, 0.664503410000005 ] mass: 112.411000 reduced_to: 41 - symbol: Cd # 42 coordinates: [ 0.335496589999995, 0.664503410000005, 0.664503410000005 ] mass: 112.411000 reduced_to: 42 - symbol: Cd # 43 coordinates: [ 0.835496589999995, 0.835496589999995, 0.835496589999995 ] mass: 112.411000 reduced_to: 39 - symbol: Cd # 44 coordinates: [ 0.664503410000005, 0.664503410000005, 0.335496589999995 ] mass: 112.411000 reduced_to: 40 - symbol: Cd # 45 coordinates: [ 0.164503410000005, 0.835496589999995, 0.164503410000005 ] mass: 112.411000 reduced_to: 41 - symbol: Cd # 46 coordinates: [ 0.835496589999995, 0.164503410000005, 0.164503410000005 ] mass: 112.411000 reduced_to: 42supercell: lattice: - [ 8.849156790000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 8.849156790000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 8.849156790000000 ] # c points: - symbol: O # 1 coordinates: [ 0.589220570000002, 0.860297800000004, 0.860297800000004 ] mass: 15.999400 reduced_to: 1 - symbol: O # 2 coordinates: [ 0.139702199999996, 0.860297800000004, 0.410779429999998 ] mass: 15.999400 reduced_to: 2 - symbol: O # 3 coordinates: [ 0.589220570000002, 0.139702199999996, 0.139702199999996 ] mass: 15.999400 reduced_to: 3 - symbol: O # 4 coordinates: [ 0.360297800000004, 0.910779429999998, 0.639702199999996 ] mass: 15.999400 reduced_to: 4 - symbol: O # 5 coordinates: [ 0.860297800000004, 0.589220570000002, 0.860297800000004 ] mass: 15.999400 reduced_to: 5 - symbol: O # 6 coordinates: [ 0.410779429999998, 0.139702199999996, 0.860297800000004 ] mass: 15.999400 reduced_to: 6 - symbol: O # 7 coordinates: [ 0.860297800000004, 0.139702199999996, 0.410779429999998 ] mass: 15.999400 reduced_to: 7 - symbol: O # 8 coordinates: [ 0.139702199999996, 0.139702199999996, 0.589220570000002 ] mass: 15.999400 reduced_to: 8 - symbol: O # 9 coordinates: [ 0.360297800000004, 0.360297800000004, 0.089220570000002 ] mass: 15.999400 reduced_to: 9 - symbol: O # 10 coordinates: [ 0.139702199999996, 0.589220570000002, 0.139702199999996 ] mass: 15.999400 reduced_to: 10 - symbol: O # 11 coordinates: [ 0.139702199999996, 0.410779429999998, 0.860297800000004 ] mass: 15.999400 reduced_to: 11 - symbol: O # 12 coordinates: [ 0.910779429999998, 0.360297800000004, 0.639702199999996 ] mass: 15.999400 reduced_to: 12 - symbol: O # 13 coordinates: [ 0.089220570000002, 0.360297800000004, 0.360297800000004 ] mass: 15.999400 reduced_to: 1 - symbol: O # 14 coordinates: [ 0.639702199999996, 0.360297800000004, 0.910779429999998 ] mass: 15.999400 reduced_to: 2 - symbol: O # 15 coordinates: [ 0.089220570000002, 0.639702199999996, 0.639702199999996 ] mass: 15.999400 reduced_to: 3 - symbol: O # 16 coordinates: [ 0.860297800000004, 0.410779429999998, 0.139702199999996 ] mass: 15.999400 reduced_to: 4 - symbol: O # 17 coordinates: [ 0.360297800000004, 0.089220570000002, 0.360297800000004 ] mass: 15.999400 reduced_to: 5 - symbol: O # 18 coordinates: [ 0.910779429999998, 0.639702199999996, 0.360297800000004 ] mass: 15.999400 reduced_to: 6 - symbol: O # 19 coordinates: [ 0.360297800000004, 0.639702199999996, 0.910779429999998 ] mass: 15.999400 reduced_to: 7 - symbol: O # 20 coordinates: [ 0.639702199999996, 0.639702199999996, 0.089220570000002 ] mass: 15.999400 reduced_to: 8 - symbol: O # 21 coordinates: [ 0.860297800000004, 0.860297800000004, 0.589220570000002 ] mass: 15.999400 reduced_to: 9 - symbol: O # 22 coordinates: [ 0.639702199999996, 0.089220570000002, 0.639702199999996 ] mass: 15.999400 reduced_to: 10 - symbol: O # 23 coordinates: [ 0.639702199999996, 0.910779429999998, 0.360297800000004 ] mass: 15.999400 reduced_to: 11 - symbol: O # 24 coordinates: [ 0.410779429999998, 0.860297800000004, 0.139702199999996 ] mass: 15.999400 reduced_to: 12 - symbol: Al # 25 coordinates: [ 0.500000000000000, 0.250000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 26 coordinates: [ 0.000000000000000, 0.250000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 26 - symbol: Al # 27 coordinates: [ 0.500000000000000, 0.000000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 27 - symbol: Al # 28 coordinates: [ 0.000000000000000, 0.500000000000000, 0.750000000000000 ] mass: 26.981539 reduced_to: 28 - symbol: Al # 29 coordinates: [ 0.250000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: Al # 30 coordinates: [ 0.250000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 30 - symbol: Al # 31 coordinates: [ 0.000000000000000, 0.750000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 25 - symbol: Al # 32 coordinates: [ 0.500000000000000, 0.750000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 26 - symbol: Al # 33 coordinates: [ 0.000000000000000, 0.500000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 27 - symbol: Al # 34 coordinates: [ 0.500000000000000, 0.000000000000000, 0.250000000000000 ] mass: 26.981539 reduced_to: 28 - symbol: Al # 35 coordinates: [ 0.750000000000000, 0.500000000000000, 0.000000000000000 ] mass: 26.981539 reduced_to: 29 - symbol: Al # 36 coordinates: [ 0.750000000000000, 0.000000000000000, 0.500000000000000 ] mass: 26.981539 reduced_to: 30 - symbol: S # 37 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 32.065000 reduced_to: 37 - symbol: S # 38 coordinates: [ 0.500000000000000, 0.500000000000000, 0.500000000000000 ] mass: 32.065000 reduced_to: 37 - symbol: Cd # 39 coordinates: [ 0.335496589999995, 0.335496589999995, 0.335496589999995 ] mass: 112.411000 reduced_to: 39 - symbol: Cd # 40 coordinates: [ 0.164503410000005, 0.164503410000005, 0.835496589999995 ] mass: 112.411000 reduced_to: 40 - symbol: Cd # 41 coordinates: [ 0.664503410000005, 0.335496589999995, 0.664503410000005 ] mass: 112.411000 reduced_to: 41 - symbol: Cd # 42 coordinates: [ 0.335496589999995, 0.664503410000005, 0.664503410000005 ] mass: 112.411000 reduced_to: 42 - symbol: Cd # 43 coordinates: [ 0.835496589999995, 0.835496589999995, 0.835496589999995 ] mass: 112.411000 reduced_to: 39 - symbol: Cd # 44 coordinates: [ 0.664503410000005, 0.664503410000005, 0.335496589999995 ] mass: 112.411000 reduced_to: 40 - symbol: Cd # 45 coordinates: [ 0.164503410000005, 0.835496589999995, 0.164503410000005 ] mass: 112.411000 reduced_to: 41 - symbol: Cd # 46 coordinates: [ 0.835496589999995, 0.164503410000005, 0.164503410000005 ] mass: 112.411000 reduced_to: 42nac: born_effective_charge: - # 1 (O) - [ -2.148877228695651, 0.093817290000000, 0.093817290000000 ] - [ -0.010798570000000, -1.739307498695653, 0.479824030000000 ] - [ -0.010798570000000, 0.479824030000000, -1.739307498695653 ] - # 2 (O) - [ -1.739307498695653, -0.479824030000000, -0.010798570000000 ] - [ -0.479824030000000, -1.739307498695653, 0.010798570000000 ] - [ 0.093817290000000, -0.093817290000000, -2.148877228695651 ] - # 3 (O) - [ -2.148877228695651, -0.093817290000000, -0.093817290000000 ] - [ 0.010798570000000, -1.739307498695653, 0.479824030000000 ] - [ 0.010798570000000, 0.479824030000000, -1.739307498695653 ] - # 4 (O) - [ -1.739307498695653, 0.010798570000000, -0.479824030000000 ] - [ -0.093817290000000, -2.148877228695651, 0.093817290000000 ] - [ -0.479824030000000, -0.010798570000000, -1.739307498695653 ] - # 5 (O) - [ -1.739307498695653, -0.010798570000000, 0.479824030000000 ] - [ 0.093817290000000, -2.148877228695651, 0.093817290000000 ] - [ 0.479824030000000, -0.010798570000000, -1.739307498695653 ] - # 6 (O) - [ -2.148877228695651, 0.093817290000000, -0.093817290000000 ] - [ -0.010798570000000, -1.739307498695653, -0.479824030000000 ] - [ 0.010798570000000, -0.479824030000000, -1.739307498695653 ] - # 7 (O) - [ -1.739307498695653, -0.479824030000000, 0.010798570000000 ] - [ -0.479824030000000, -1.739307498695653, -0.010798570000000 ] - [ -0.093817290000000, 0.093817290000000, -2.148877228695651 ] - # 8 (O) - [ -1.739307498695653, 0.479824030000000, 0.010798570000000 ] - [ 0.479824030000000, -1.739307498695653, 0.010798570000000 ] - [ -0.093817290000000, -0.093817290000000, -2.148877228695651 ] - # 9 (O) - [ -1.739307498695653, 0.479824030000000, -0.010798570000000 ] - [ 0.479824030000000, -1.739307498695653, -0.010798570000000 ] - [ 0.093817290000000, 0.093817290000000, -2.148877228695651 ] - # 10 (O) - [ -1.739307498695653, 0.010798570000000, 0.479824030000000 ] - [ -0.093817290000000, -2.148877228695651, -0.093817290000000 ] - [ 0.479824030000000, 0.010798570000000, -1.739307498695653 ] - # 11 (O) - [ -1.739307498695653, -0.010798570000000, -0.479824030000000 ] - [ 0.093817290000000, -2.148877228695651, -0.093817290000000 ] - [ -0.479824030000000, 0.010798570000000, -1.739307498695653 ] - # 12 (O) - [ -2.148877228695651, -0.093817290000000, 0.093817290000000 ] - [ 0.010798570000000, -1.739307498695653, -0.479824030000000 ] - [ -0.010798570000000, -0.479824030000000, -1.739307498695653 ] - # 13 (Al) - [ 2.529737401304348, 0.000000000000000, 0.312546670000000 ] - [ 0.000000000000000, 2.560255101304349, -0.000000000000000 ] - [ -0.312546670000000, -0.000000000000000, 2.529737401304348 ] - # 14 (Al) - [ 2.529737401304348, 0.000000000000000, -0.312546670000000 ] - [ 0.000000000000000, 2.560255101304349, -0.000000000000000 ] - [ 0.312546670000000, -0.000000000000000, 2.529737401304348 ] - # 15 (Al) - [ 2.529737401304348, -0.312546670000000, 0.000000000000000 ] - [ 0.312546670000000, 2.529737401304348, -0.000000000000000 ] - [ 0.000000000000000, -0.000000000000000, 2.560255101304349 ] - # 16 (Al) - [ 2.529737401304348, 0.312546670000000, 0.000000000000000 ] - [ -0.312546670000000, 2.529737401304348, -0.000000000000000 ] - [ 0.000000000000000, -0.000000000000000, 2.560255101304349 ] - # 17 (Al) - [ 2.560255101304349, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 2.529737401304348, -0.312546670000000 ] - [ 0.000000000000000, 0.312546670000000, 2.529737401304348 ] - # 18 (Al) - [ 2.560255101304349, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 2.529737401304348, 0.312546670000000 ] - [ 0.000000000000000, -0.312546670000000, 2.529737401304348 ] - # 19 (S) - [ -1.414571468695653, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -1.414571468695653, -0.000000000000000 ] - [ 0.000000000000000, -0.000000000000000, -1.414571468695653 ] - # 20 (Cd) - [ 2.171270141304348, 0.134509370000000, 0.134509370000000 ] - [ 0.134509370000000, 2.171270141304348, 0.134509370000000 ] - [ 0.134509370000000, 0.134509370000000, 2.171270141304348 ] - # 21 (Cd) - [ 2.171270141304348, 0.134509370000000, -0.134509370000000 ] - [ 0.134509370000000, 2.171270141304348, -0.134509370000000 ] - [ -0.134509370000000, -0.134509370000000, 2.171270141304348 ] - # 22 (Cd) - [ 2.171270141304348, -0.134509370000000, 0.134509370000000 ] - [ -0.134509370000000, 2.171270141304348, -0.134509370000000 ] - [ 0.134509370000000, -0.134509370000000, 2.171270141304348 ] - # 23 (Cd) - [ 2.171270141304348, -0.134509370000000, -0.134509370000000 ] - [ -0.134509370000000, 2.171270141304348, 0.134509370000000 ] - [ -0.134509370000000, 0.134509370000000, 2.171270141304348 ] dielectric_constant: - [ 3.303224499999999, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 3.303224499999999, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 3.303224499999999 ] unit_conversion_factor: 14.399652dataset: displacements: - # 1 - [ -0.0237403541416571, 0.0170444711898522, -0.0067735948422534 ] - [ -0.0089548458650297, -0.0243965826460994, 0.0149872442672294 ] - [ 0.0154695513071375, -0.0033770429470561, -0.0254811413262746 ] - [ -0.0036958650566623, -0.0041079122040943, 0.0294867027455834 ] - [ -0.0011827962753607, -0.0249803219965434, 0.0165705915983709 ] - [ 0.0291136881077388, -0.0024781412815529, -0.0068008808660328 ] - [ -0.0035738069447047, 0.0074980118546535, 0.0288272045496863 ] - [ 0.0156210975682183, -0.0205625294824907, -0.0152696984923052 ] - [ 0.0015035398796905, 0.0298483669633146, 0.0026104324265323 ] - [ -0.0200322903553521, -0.0135387909984408, 0.0177597432813486 ] - [ -0.0284698284277562, 0.0031294929000405, -0.0089260934054447 ] - [ -0.0298910033055086, -0.0025317146024337, -0.0003440095375123 ] - 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[ -0.0164121700000000, 0.1418945900000000, -0.1690277100000000 ] - [ -0.0034699500000000, 0.0642276400000000, 0.1024271700000000 ] - # 15 - [ 0.2622882200000000, -0.3578626700000000, 0.2987399600000000 ] - [ -0.9418584000000000, -1.1048680700000002, 0.0458573000000000 ] - [ 0.7288394000000000, -0.2381406100000000, 0.4343484200000000 ] - [ -0.9482851000000000, -0.6880950800000001, -0.6599940100000000 ] - [ 0.7454838800000000, 0.0341713600000000, -0.5556467900000001 ] - [ 0.0158432300000000, -0.4631336200000000, -0.3365908700000000 ] - [ 0.0556864200000000, -0.1145627200000000, 0.2906203900000000 ] - [ -0.7987248700000000, 0.5496675700000000, 0.3279877700000000 ] - [ 0.0510309200000000, 0.0062206900000000, -0.3456715500000000 ] - [ -0.3289089800000000, 0.3161198800000000, 0.1899119600000000 ] - [ -0.8072373500000000, 0.2640589300000000, -0.8078708000000000 ] - [ -0.0302143000000000, 0.8223794299999999, 0.9558488300000001 ] - [ 0.1184081600000000, 0.3568994300000000, -0.3152451700000000 ] - 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[ -0.3387099700000000, -0.1286756100000000, 0.0614620200000000 ] - # 16 - [ -0.3552100300000000, -0.2071233200000000, 0.3869714000000000 ] - [ -0.2906283800000000, -0.3923053400000000, 0.2322432800000000 ] - [ 0.1525152900000000, -0.7964033400000000, 0.8091494100000001 ] - [ -0.6414034200000001, -0.2187993200000000, -0.6525492800000000 ] - [ 0.0685735700000000, 0.1041930200000000, -0.1022636500000000 ] - [ 0.2453560700000000, 0.0778734300000000, 0.2890154300000000 ] - [ -0.0780163700000000, 0.0726050300000000, -0.3434787700000000 ] - [ 0.4056705000000000, -0.5283179200000000, 0.0188072400000000 ] - [ -0.8456254200000000, 0.7055046899999999, 0.2883567200000000 ] - [ 0.1663858100000000, 0.4780883200000000, -0.1573937300000000 ] - [ -0.2047041000000000, 0.1319643500000000, -0.1502270500000000 ] - [ 0.0076620500000000, -0.5048361100000001, -0.5865407199999999 ] - [ -0.1389624200000000, -0.0305466400000000, -0.0670689300000000 ] - [ 0.2148664900000000, 0.2140480800000000, -0.1238669900000000 ] - 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# 17 - [ 0.6280771200000000, -0.3388402300000000, 0.1618457800000000 ] - [ -0.4139424400000000, -0.3601406400000000, 0.2794615400000000 ] - [ 0.5209297500000000, -0.3785923800000000, 0.6359409400000000 ] - [ 0.3052443500000000, -0.2803893800000000, 0.1970581900000000 ] - [ -0.4514164200000000, 0.7190016299999999, 0.3545326000000000 ] - [ 0.0888724800000000, 0.1806697300000000, 0.0246875000000000 ] - [ -0.6096619999999999, -0.4762855400000000, -0.3066041500000000 ] - [ 0.2606511400000000, -0.1145310000000000, 0.0670640700000000 ] - [ 0.7946949300000000, -0.7322691600000000, -0.1644329700000000 ] - [ 0.4782351500000000, -0.2585515700000000, -0.7026959800000000 ] - [ -0.3079861700000000, -0.1053296000000000, -0.5559280500000000 ] - [ 0.6583260500000000, 0.0853198700000000, -0.3184876500000000 ] - [ 0.5063955299999999, -0.6892954400000001, 0.5182921199999999 ] - [ -0.4890355400000000, -0.2069152300000000, 0.4747350400000000 ] - [ 0.3153160800000000, -0.1301742400000000, 0.4008586800000000 ] - [ -0.0632496900000000, 0.3183725400000000, 0.0011830000000000 ] - [ 0.5920215400000001, 0.2472068000000000, -0.4695762500000000 ] - [ 0.4671278900000000, 0.1391707900000000, 0.4483411100000000 ] - [ 0.1639083500000000, 0.0995622700000000, 0.5137736400000000 ] - [ 0.8091651300000000, -0.5622589400000000, 0.2140823200000000 ] - [ -0.0773798300000000, -0.1849455100000000, 0.5213850900000000 ] - [ 0.2635627100000000, -0.2438395400000000, -0.3473217300000000 ] - [ 0.4719882000000000, 0.4148268100000000, 0.6755712199999999 ] - [ -0.1975089900000000, 0.4926010000000000, 0.6723420700000000 ] - [ -0.4708090700000000, 1.1910842499999998, -0.3777999200000000 ] - [ -0.0851676400000000, 0.2697052300000000, 0.9221352800000000 ] - [ -0.7110767600000000, -0.0031702900000000, 0.0080451400000000 ] - [ 0.1264238400000000, -1.0247628199999999, -0.4312852500000000 ] - [ -0.3637881900000000, 0.5862771100000000, 0.3957640500000000 ] - [ -0.0241071800000000, 0.8765016300000000, 0.7230222400000000 ] - [ -0.0676857700000000, -0.2105761400000000, -1.3370450400000000 ] - 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# 18 - [ -0.6493447099999999, -0.2150559900000000, 0.1806202100000000 ] - [ 0.1402727100000000, 0.2336949100000000, 0.5655404700000001 ] - [ 0.0967773400000000, 0.6841576300000001, -0.7326264400000000 ] - [ -0.2236183300000000, -0.5594468100000001, -0.1314064100000000 ] - [ 0.7355447300000000, 0.4804566400000000, -0.7689941500000000 ] - [ -0.3138838800000000, -0.0385127900000000, -0.1407864200000000 ] - [ -0.6899973800000000, -0.5330887500000000, -0.2886857200000000 ] - [ 0.1352472500000000, -0.1755715700000000, -0.4074500600000000 ] - [ -0.8653938500000000, 0.9538605099999999, 0.0109295900000000 ] - [ 0.1123036700000000, -0.1047617700000000, 0.0278843300000000 ] - [ -0.6188610899999999, 0.0679970100000000, -0.4759802500000000 ] - [ 0.3963480500000000, -0.0646601800000000, -0.3107176300000000 ] - [ -0.3886814000000000, 0.6344177099999999, -0.4276573700000000 ] - [ 0.0218777700000000, -0.0252005000000000, 0.2301390100000000 ] - [ -0.1356866500000000, 0.7830333700000001, -0.9394811400000000 ] - 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# 20 - [ -0.4140777700000000, 0.2570120900000000, -0.0039119100000000 ] - [ 0.6177581100000000, 0.8190785000000000, -0.1123238100000000 ] - [ 0.1149668900000000, 0.6454993300000000, -0.7054864599999999 ] - [ 0.3393388700000000, -0.2699166300000000, 0.4202187000000000 ] - [ 0.8085386999999999, 0.0461850300000000, -0.7464662800000000 ] - [ -0.0607231800000000, 0.7122479700000001, 0.6104693600000001 ] - [ -0.0444817300000000, -0.1870752600000000, 0.3115530200000000 ] - [ -0.5492264400000000, 0.4471217700000000, 0.1982916500000000 ] - [ -0.3009965900000000, 0.1212895000000000, -0.3703587300000000 ] - [ -0.1329707600000000, -0.3498776700000000, -0.0984698100000000 ] - [ 0.4457433500000000, -0.4626763200000000, 0.2178300500000000 ] - [ 0.2271870400000000, 0.3245158700000000, 0.3784569200000000 ] - [ -0.2298482300000000, 0.2106347600000000, -0.3726298300000000 ] - [ -0.1608766500000000, -0.4334065100000000, -0.4694097400000000 ] - [ -0.1381249700000000, -0.1960906600000000, 0.0716020400000000 ] - 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[ -0.2241099900000000, 0.3166596500000000, 0.0300823600000000 ] - [ -0.2523078200000000, -0.0207127800000000, -0.0938730400000000 ] - # 94 - [ 0.0328802800000000, 0.1353744600000000, -0.1904555700000000 ] - [ 0.1595743200000000, 0.0793409400000000, -0.0327766500000000 ] - [ 0.0123421100000000, -0.3577301300000000, 0.3597110400000000 ] - [ 0.2335336500000000, -0.3672646200000000, 0.3113198600000000 ] - [ -0.2163059100000000, 0.2195033900000000, 0.2911482600000000 ] - [ 0.1785942700000000, 0.0576700000000000, 0.2019170100000000 ] - [ 0.7065134400000000, 0.6376424400000000, -0.2161064200000000 ] - [ 0.8558002900000000, -0.8551669200000001, -0.1997906700000000 ] - [ 0.4632748300000000, -0.4487959000000000, 0.3829289700000000 ] - [ 0.1486626100000000, 0.3208935000000000, 0.1296299600000000 ] - [ -0.1111668200000000, -0.1122368600000000, -0.3392225800000000 ] - [ 0.3503378100000000, -0.2332466900000000, -0.2366896200000000 ] - [ -0.3322780300000000, -0.2574566000000000, 0.2095860800000000 ] - 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[ 0.2033176600000000, 0.2714381700000000, 0.0010187200000000 ] - # 95 - [ 0.1222951000000000, -0.0889294700000000, 0.2385582900000000 ] - [ -0.3847074300000000, -0.4841219600000000, 0.3882482700000000 ] - [ -0.3439772200000000, -0.4437993800000000, 0.4355183700000000 ] - [ -0.9777015500000000, -0.2928115400000000, -0.5931601600000000 ] - [ 0.3092869499999999, -0.0169293000000000, -0.5346763100000000 ] - [ 0.2358001300000000, -0.0593201900000000, -0.0628688300000000 ] - [ 0.3728155200000000, 0.2898794600000000, 0.6082987900000000 ] - [ -0.1801725700000000, 0.2645074500000000, 0.7168280299999999 ] - [ -0.6241229500000000, 0.6021021100000000, 0.4917882500000000 ] - [ 0.2426426300000000, 0.3821420000000000, 0.1405961300000000 ] - [ -0.2770598900000000, -0.2070392700000000, -0.5327888399999999 ] - [ 0.4449556400000000, 0.3023609100000000, 0.1419315200000000 ] - [ 0.0157089100000000, 0.8229737800000000, -0.4894777200000000 ] - [ 0.1896595600000000, 0.4520555700000000, 0.0022881300000000 ] - [ 0.3024130000000000, 0.0961629100000000, 0.1252971300000000 ] - [ -0.2003284200000000, 0.3334683400000000, 0.0244117500000000 ] - [ 0.9367408200000000, 0.0644146800000000, -1.0267124500000000 ] - [ 0.5828183900000000, 0.0089082800000000, 0.1925682000000000 ] - [ 0.2612665400000000, 0.2353048200000000, -0.0308154200000000 ] - [ 0.0034851200000000, -0.0207776400000000, 0.6772714700000001 ] - [ 0.0844720200000000, 0.1237037400000000, 0.1196171200000000 ] - [ -0.4556203400000000, 0.5044251100000000, 0.5917576900000000 ] - [ -0.7650435299999999, 0.3087071000000000, -0.7062713600000000 ] - [ 0.3419506400000000, 0.1410135000000000, 0.2519043600000000 ] - [ 0.4127177000000000, -0.9229948000000000, -0.6074082500000000 ] - [ -0.9846193400000001, -0.5579389900000000, -0.4110603400000000 ] - [ 0.8952229300000000, 0.3172792500000000, 0.2830742300000000 ] - [ -0.1925494900000000, -0.7493292800000000, 0.6262590700000000 ] - [ 0.3558843300000000, -0.7817369600000000, 0.1931935100000000 ] - [ -0.2819175100000000, 0.1326353200000000, 0.1662913900000000 ] - 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[ 0.1077865400000000, 0.2836653000000000, -0.0515359100000000 ] - # 96 - [ 0.3443467700000000, -0.5436061099999999, 0.4856530000000000 ] - [ -0.5741337100000000, -0.4045692200000000, 0.2365771500000000 ] - [ 0.4047755600000000, 0.2117297500000000, -0.3339195500000000 ] - [ 0.2768605500000000, 0.2637209700000000, 0.3919029500000000 ] - [ -0.2191153700000000, 0.0271338100000000, 0.0361125700000000 ] - [ -0.6195090200000001, -0.0835844400000000, -0.2292929500000000 ] - [ -0.3090405600000000, -0.1785799600000000, 0.0873756000000000 ] - [ -0.0908760000000000, 0.3680165800000000, 0.0148291300000000 ] - [ -0.2811327100000000, 0.1593303800000000, -0.0825634200000000 ] - [ 0.2987957900000000, -0.5321685500000000, -0.3572408900000000 ] - [ -0.1947051900000000, -0.3306544100000000, -0.5032043700000000 ] - [ -0.1405183600000000, -0.4220762200000000, -0.5557967800000000 ] - [ 0.4144662800000000, 0.1472375700000000, -0.0260902000000000 ] - [ -0.1493885100000000, -0.1766525500000000, -0.4464363900000000 ] - 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# 97 - [ 0.3748990400000000, 0.1006229900000000, -0.1249486500000000 ] - [ 0.5724112400000000, 0.5028674200000000, -0.4288687600000000 ] - [ 0.6532484700000000, 0.1273943900000000, -0.1027394500000000 ] - [ -1.0450078100000000, -0.2005192900000000, -0.9536426800000001 ] - [ 0.4536298700000000, 0.3435674100000000, -0.4118075900000000 ] - [ -0.2283172200000000, -0.5305307300000000, -0.6515295700000000 ] - [ -0.5678117899999999, -0.3591384500000000, -0.3274172700000000 ] - [ -0.5247521800000000, 0.5470470399999999, -0.1137358000000000 ] - [ 0.0349085800000000, -0.2943926300000000, 0.3423547700000000 ] - [ 0.0824775100000000, -0.4270551200000000, -0.1655348600000000 ] - [ -0.2393376500000000, 0.2996021400000000, 0.0565088800000000 ] - [ 0.2378098000000000, -0.2982673200000000, -0.3263940000000000 ] - [ 0.0299829200000000, 0.4039229400000000, -0.4272763400000000 ] - [ 0.7668115799999999, 0.6385728000000001, 0.0810635700000000 ] - [ -0.2633727500000000, 0.2786274200000000, -0.1594129200000000 ] - 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# 143 - [ -0.1203103400000000, 0.1332762600000000, -0.1483951600000000 ] - [ 0.1329375500000000, 0.3235698000000000, 0.3242010300000000 ] - [ 0.2305612600000000, -0.3498987600000000, 0.4977268500000000 ] - [ -0.5450101300000000, -0.1991669400000000, -0.2873242300000000 ] - [ -0.2144830100000000, 0.2493645000000000, 0.1622822900000000 ] - [ -0.5057376600000001, -0.5971622500000000, -0.6257529300000000 ] - [ -0.3485592500000000, -0.3370627600000000, 0.1800949400000000 ] - [ 0.8674786099999999, -0.7523052800000001, 0.5408441600000000 ] - [ 0.5415561400000000, -0.8120846900000001, -0.0150822600000000 ] - [ -0.6280197000000000, -0.3537405300000000, 0.2057987600000000 ] - [ 0.1722859400000000, 0.0181402300000000, 0.1634818400000000 ] - [ -0.0310637800000000, 0.3958857300000000, 0.4046465700000000 ] - [ 0.0336355600000000, -0.7891882500000000, 0.7360791799999999 ] - [ -0.0519328400000000, -0.1290324200000000, 0.4700500200000000 ] - [ 0.2674889700000000, -0.3574304200000000, 0.4945096800000000 ] - [ 0.1749290100000000, -0.7736295399999999, 0.4313455900000000 ] - [ 0.3039708600000000, 0.1110278900000000, -0.2502118400000000 ] - [ -0.2267360200000000, -0.2487251900000000, -0.1777085000000000 ] - [ -0.0299883000000000, 0.1384770200000000, -0.3607633700000000 ] - [ 0.4322377800000000, -0.3754849300000000, -0.3799087100000000 ] - [ -0.1427866200000000, 0.1159420100000000, 0.1811963400000000 ] - [ 0.5686899100000000, -0.2892192700000000, -0.4600310900000000 ] - [ -0.0604620700000000, 0.0143710100000000, -0.0603544400000000 ] - [ 0.5933073800000001, -0.0118692800000000, -0.3942259600000000 ] - [ -0.0786195000000000, 1.3485069699999999, 0.1539936400000000 ] - [ -0.5687625800000000, 1.0250036299999998, -0.9219572600000000 ] - [ -0.3951729600000000, 0.4282771500000000, 0.1579952300000000 ] - [ -0.4021119400000000, -0.3862041900000000, -0.6268590400000000 ] - [ 0.4953241200000000, -0.3575809900000000, -0.0782947400000000 ] - [ 0.3269504200000000, 0.3674792400000000, 0.0461044100000000 ] - 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# 144 - [ -0.1369469400000000, 0.3666377100000000, -0.2911196100000000 ] - [ -0.6586131100000000, -0.2776141800000000, 0.0224856000000000 ] - [ 0.3085873600000000, -0.8289600499999999, 0.7749931900000000 ] - [ 0.4885752500000000, 0.1788811000000000, 0.3499673400000000 ] - [ -0.5947755000000000, 0.4244314600000000, 0.4939229800000000 ] - [ -0.3971373200000000, -0.4217522800000000, -0.4502965400000000 ] - [ -0.0462435000000000, -0.1537559900000000, -0.2429548500000000 ] - [ 0.2338674100000000, -0.2026873000000000, -0.2233645000000000 ] - [ -0.5658151900000000, 0.5142593100000000, -0.3304324200000000 ] - [ -0.3812655300000000, 0.0666249600000000, 0.2518181900000000 ] - [ -0.2506837300000000, -0.2391844600000000, -0.4526244700000000 ] - [ 0.2150681100000000, -0.3395559600000000, -0.4058602700000000 ] - [ 0.3771357000000000, -0.4967813500000000, 0.3636727600000000 ] - [ -0.3651255900000000, -0.4936519300000000, -0.4241696400000000 ] - [ -0.4339571300000000, -0.0168594400000000, -0.1030900100000000 ] - 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[ 1.0871283199999999, 0.1058272200000000, 0.3691328200000000 ] - [ 0.0689154200000000, -0.5502774100000000, 0.5197612000000000 ] - [ -0.0095446600000000, 0.5916114400000000, -0.0397570700000000 ] - [ 0.9916926200000000, -0.1343862100000000, -0.3904185100000001 ] - [ 0.1390464300000000, 0.0092518400000000, 0.8971445200000000 ] - [ 0.3709489400000000, -0.0500335400000000, 0.7511566500000001 ] - [ -0.1700788800000000, 0.0443501000000000, 0.0128880300000000 ] - [ -0.0400148800000000, -0.0415430300000000, -0.1717616900000000 ] - [ -0.0308306800000000, 0.3818664000000000, 0.0649172400000000 ] - [ 0.2863772300000000, -0.0377469700000000, -0.0542630100000000 ] - [ -0.0584975100000000, -0.0471027500000000, 0.1169259700000000 ] - [ 0.0612709600000000, 0.1984586000000000, -0.1097835200000000 ] - [ 0.0837308000000000, 0.1803402800000000, -0.0566224700000000 ] - [ 0.0677871100000000, -0.0178379300000000, 0.2827967700000000 ] - [ -0.0242488700000000, -0.0157867400000000, 0.0199822700000000 ] - [ -0.0285103300000000, -0.0220366700000000, 0.0567730900000000 ] - # 145 - [ -0.3217696400000000, 0.4593278800000000, -0.5586865800000000 ] - [ 0.7028374800000000, 0.7339671700000000, -0.1474569500000000 ] - [ -0.0443408000000000, 0.7030602100000001, -0.7143351700000000 ] - [ -0.9531200000000000, -0.0010924000000000, -0.7779444400000001 ] - [ -0.4668758900000000, 0.0946843700000000, 0.5178970899999999 ] - [ 0.0235355700000000, -0.8410751599999999, -0.9020640799999999 ] - [ 0.3129889200000000, 0.0742054600000000, 0.2921797400000000 ] - [ -0.0687822000000000, 0.2316867500000000, 0.4894537300000000 ] - [ 0.3741341600000000, -0.4679589000000000, 0.5680822099999999 ] - [ 0.0037399800000000, -0.3737017900000000, -0.0218023100000000 ] - [ 0.3344777800000000, -0.3960477700000000, 0.4206700000000000 ] - [ -0.2147038900000000, -0.2501921400000000, -0.0722326100000000 ] - [ -0.3611747300000000, -0.6849185300000000, 0.8422357400000000 ] - [ 0.3136851400000000, 0.0138724700000000, -0.3176716900000000 ] - [ -0.6402445400000001, 0.2626823700000000, -0.3505459500000000 ] - 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# 146 - [ 0.3657251000000000, -1.0388190200000000, 0.8725636400000000 ] - [ -0.1709103400000000, 0.1634745600000000, -0.0118454200000000 ] - [ 0.0876272200000000, -0.5745404600000000, 0.6210653700000001 ] - [ 0.6474300600000000, 0.5010314299999999, 0.3338674500000000 ] - [ -0.1206390300000000, -0.0227944500000000, 0.1817386400000000 ] - [ 0.0084952500000000, 0.7659364300000000, 0.6585757200000001 ] - [ -0.0185934300000000, -0.1949623100000000, 0.0403544600000000 ] - [ -0.2989162300000000, 0.2370998600000000, -0.5853574300000000 ] - [ -0.9424692400000000, 0.9511622300000000, -0.2424739700000000 ] - [ -0.2092559000000000, 0.3453240900000000, 0.3371940900000000 ] - [ -0.2558645500000000, -0.3156138000000000, -0.4053419200000000 ] - [ 0.5442861299999999, 0.3751824900000000, 0.2687603400000000 ] - [ 0.4444095000000000, 0.4489252500000000, -0.7219517800000000 ] - [ -0.1478135000000000, 0.1042622900000000, -0.0318446200000000 ] - [ -0.5076214600000001, 0.3431899600000000, -0.4168862300000000 ] - 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# 147 - [ 0.1062958200000000, 0.1574047300000000, -0.0488233900000000 ] - [ 0.0099112500000000, -0.1524736100000000, -0.7242955300000000 ] - [ 0.4469951800000000, 0.1822627100000000, -0.1543775700000000 ] - [ 0.4286983600000000, -0.1299929400000000, 0.4994211700000000 ] - [ -0.4082308300000000, -0.0605514600000000, 0.4806020300000000 ] - [ -0.0231964200000000, -0.4341706300000000, -0.6797371700000000 ] - [ -0.2757582700000000, -0.1189239900000000, -0.5802316000000001 ] - [ 0.2841213800000000, -0.1700677300000000, -0.4270802500000000 ] - [ -0.3287487100000000, 0.2838179700000000, -0.0651998500000000 ] - [ -0.5601854600000000, -0.2346869400000000, 0.4851036000000000 ] - [ 0.0007496200000000, 0.0731537400000000, 0.1866177800000000 ] - [ -0.0522914900000000, -0.3669818700000000, -0.4762823800000000 ] - [ -0.0172260600000000, 0.0647016300000000, -0.1099471000000000 ] - [ 0.2013765900000000, 0.1573894600000000, 0.6992355700000000 ] - [ 0.6043385099999999, 0.9838013300000000, -0.6338038900000000 ] - 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