# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/f264a055-220b-43ff-8d0c-feb31875c2ec/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 La2SeO2 / P-3m1 (164) / materials id 7233](https://mdr.nims.go.jp/datasets/4ae61d0b-a467-4e98-a9c6-c17ab20beff8) ## Fulltext phonopy: version: 2.17.1 frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05 nac_unit_conversion_factor: 14.399652 configuration: save_params: ".true."physical_unit: atomic_mass: "AMU" length: "angstrom" force_constants: "eV/angstrom^2"space_group: type: "P-3m1" number: 164 Hall_symbol: "-P 3 2\""supercell_matrix:- [ 3, 0, 0 ]- [ 0, 3, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 4.045933500000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.022966740000000, 3.503881190000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 7.092991500000000 ] # c points: - symbol: O # 1 coordinates: [ 0.666666670000000, 0.333333330000000, 0.624424800000000 ] mass: 15.999400 - symbol: O # 2 coordinates: [ 0.333333330000000, 0.666666670000000, 0.375575200000000 ] mass: 15.999400 - symbol: Se # 3 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 78.960000 - symbol: La # 4 coordinates: [ 0.666666670000000, 0.333333330000000, 0.287732210000000 ] mass: 138.905470 - symbol: La # 5 coordinates: [ 0.333333330000000, 0.666666670000000, 0.712267790000000 ] mass: 138.905470 reciprocal_lattice: # without 2pi - [ 0.247161748951138, 0.142698901708018, 0.000000000000000 ] # a* - [ 0.000000000000000, 0.285397804826824, 0.000000000000000 ] # b* - [ 0.000000000000000, 0.000000000000000, 0.140984237750743 ] # c*unit_cell: lattice: - [ 4.045933500000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.022966740000000, 3.503881190000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 7.092991500000000 ] # c points: - symbol: O # 1 coordinates: [ 0.666666670000000, 0.333333330000000, 0.624424800000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 2 coordinates: [ 0.333333330000000, 0.666666670000000, 0.375575200000000 ] mass: 15.999400 reduced_to: 2 - symbol: Se # 3 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 78.960000 reduced_to: 3 - symbol: La # 4 coordinates: [ 0.666666670000000, 0.333333330000000, 0.287732210000000 ] mass: 138.905470 reduced_to: 4 - symbol: La # 5 coordinates: [ 0.333333330000000, 0.666666670000000, 0.712267790000000 ] mass: 138.905470 reduced_to: 5supercell: lattice: - [ 12.137800500000001, 0.000000000000000, 0.000000000000000 ] # a - [ -6.068900220000001, 10.511643570000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 14.185983000000000 ] # c points: - symbol: O # 1 coordinates: [ 0.222222223333333, 0.111111110000000, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 2 coordinates: [ 0.555555556666667, 0.111111110000000, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 3 coordinates: [ 0.888888890000000, 0.111111110000000, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 4 coordinates: [ 0.222222223333333, 0.444444443333333, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 5 coordinates: [ 0.555555556666667, 0.444444443333333, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 6 coordinates: [ 0.888888890000000, 0.444444443333333, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 7 coordinates: [ 0.222222223333333, 0.777777776666667, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 8 coordinates: [ 0.555555556666667, 0.777777776666667, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 9 coordinates: [ 0.888888890000000, 0.777777776666667, 0.312212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 10 coordinates: [ 0.222222223333333, 0.111111110000000, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 11 coordinates: [ 0.555555556666667, 0.111111110000000, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 12 coordinates: [ 0.888888890000000, 0.111111110000000, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 13 coordinates: [ 0.222222223333333, 0.444444443333333, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 14 coordinates: [ 0.555555556666667, 0.444444443333333, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 15 coordinates: [ 0.888888890000000, 0.444444443333333, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 16 coordinates: [ 0.222222223333333, 0.777777776666667, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 17 coordinates: [ 0.555555556666667, 0.777777776666667, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 18 coordinates: [ 0.888888890000000, 0.777777776666667, 0.812212400000000 ] mass: 15.999400 reduced_to: 1 - symbol: O # 19 coordinates: [ 0.111111110000000, 0.222222223333333, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 20 coordinates: [ 0.444444443333333, 0.222222223333333, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 21 coordinates: [ 0.777777776666667, 0.222222223333333, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 22 coordinates: [ 0.111111110000000, 0.555555556666667, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 23 coordinates: [ 0.444444443333333, 0.555555556666667, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 24 coordinates: [ 0.777777776666667, 0.555555556666667, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 25 coordinates: [ 0.111111110000000, 0.888888890000000, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 26 coordinates: [ 0.444444443333333, 0.888888890000000, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 27 coordinates: [ 0.777777776666667, 0.888888890000000, 0.187787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 28 coordinates: [ 0.111111110000000, 0.222222223333333, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 29 coordinates: [ 0.444444443333333, 0.222222223333333, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 30 coordinates: [ 0.777777776666667, 0.222222223333333, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 31 coordinates: [ 0.111111110000000, 0.555555556666667, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 32 coordinates: [ 0.444444443333333, 0.555555556666667, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 33 coordinates: [ 0.777777776666667, 0.555555556666667, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 34 coordinates: [ 0.111111110000000, 0.888888890000000, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 35 coordinates: [ 0.444444443333333, 0.888888890000000, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: O # 36 coordinates: [ 0.777777776666667, 0.888888890000000, 0.687787600000000 ] mass: 15.999400 reduced_to: 19 - symbol: Se # 37 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 38 coordinates: [ 0.333333333333333, 0.000000000000000, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 39 coordinates: [ 0.666666666666667, 0.000000000000000, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 40 coordinates: [ 0.000000000000000, 0.333333333333333, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 41 coordinates: [ 0.333333333333333, 0.333333333333333, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 42 coordinates: [ 0.666666666666667, 0.333333333333333, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 43 coordinates: [ 0.000000000000000, 0.666666666666667, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 44 coordinates: [ 0.333333333333333, 0.666666666666667, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 45 coordinates: [ 0.666666666666667, 0.666666666666667, 0.000000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 46 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 47 coordinates: [ 0.333333333333333, 0.000000000000000, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 48 coordinates: [ 0.666666666666667, 0.000000000000000, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 49 coordinates: [ 0.000000000000000, 0.333333333333333, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 50 coordinates: [ 0.333333333333333, 0.333333333333333, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 51 coordinates: [ 0.666666666666667, 0.333333333333333, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 52 coordinates: [ 0.000000000000000, 0.666666666666667, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 53 coordinates: [ 0.333333333333333, 0.666666666666667, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: Se # 54 coordinates: [ 0.666666666666667, 0.666666666666667, 0.500000000000000 ] mass: 78.960000 reduced_to: 37 - symbol: La # 55 coordinates: [ 0.222222223333333, 0.111111110000000, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 56 coordinates: [ 0.555555556666667, 0.111111110000000, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 57 coordinates: [ 0.888888890000000, 0.111111110000000, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 58 coordinates: [ 0.222222223333333, 0.444444443333333, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 59 coordinates: [ 0.555555556666667, 0.444444443333333, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 60 coordinates: [ 0.888888890000000, 0.444444443333333, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 61 coordinates: [ 0.222222223333333, 0.777777776666667, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 62 coordinates: [ 0.555555556666667, 0.777777776666667, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 63 coordinates: [ 0.888888890000000, 0.777777776666667, 0.143866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 64 coordinates: [ 0.222222223333333, 0.111111110000000, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 65 coordinates: [ 0.555555556666667, 0.111111110000000, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 66 coordinates: [ 0.888888890000000, 0.111111110000000, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 67 coordinates: [ 0.222222223333333, 0.444444443333333, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 68 coordinates: [ 0.555555556666667, 0.444444443333333, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 69 coordinates: [ 0.888888890000000, 0.444444443333333, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 70 coordinates: [ 0.222222223333333, 0.777777776666667, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 71 coordinates: [ 0.555555556666667, 0.777777776666667, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 72 coordinates: [ 0.888888890000000, 0.777777776666667, 0.643866105000000 ] mass: 138.905470 reduced_to: 55 - symbol: La # 73 coordinates: [ 0.111111110000000, 0.222222223333333, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 74 coordinates: [ 0.444444443333333, 0.222222223333333, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 75 coordinates: [ 0.777777776666667, 0.222222223333333, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 76 coordinates: [ 0.111111110000000, 0.555555556666667, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 77 coordinates: [ 0.444444443333333, 0.555555556666667, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 78 coordinates: [ 0.777777776666667, 0.555555556666667, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 79 coordinates: [ 0.111111110000000, 0.888888890000000, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 80 coordinates: [ 0.444444443333333, 0.888888890000000, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 81 coordinates: [ 0.777777776666667, 0.888888890000000, 0.356133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 82 coordinates: [ 0.111111110000000, 0.222222223333333, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 83 coordinates: [ 0.444444443333333, 0.222222223333333, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 84 coordinates: [ 0.777777776666667, 0.222222223333333, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 85 coordinates: [ 0.111111110000000, 0.555555556666667, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 86 coordinates: [ 0.444444443333333, 0.555555556666667, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 87 coordinates: [ 0.777777776666667, 0.555555556666667, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 88 coordinates: [ 0.111111110000000, 0.888888890000000, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 89 coordinates: [ 0.444444443333333, 0.888888890000000, 0.856133895000000 ] mass: 138.905470 reduced_to: 73 - symbol: La # 90 coordinates: [ 0.777777776666667, 0.888888890000000, 0.856133895000000 ] mass: 138.905470 reduced_to: 73born_effective_charge:- # 1 (O) - [ -2.901405440000000, 0.000000000000000, 0.000000000000000 ] - [ -0.000000000000000, -2.901405440000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -3.111970440000000 ]- # 2 (O) - [ -2.901405440000000, 0.000000000000000, 0.000000000000000 ] - [ -0.000000000000000, -2.901405440000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -3.111970440000000 ]- # 3 (Se) - [ -1.869845900000000, 0.000000000000000, 0.000000000000000 ] - [ -0.000000000000000, -1.869845900000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -2.401215170000000 ]- # 4 (La) - [ 3.836328390000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 3.836328390000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 4.312578020000000 ]- # 5 (La) - [ 3.836328390000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 3.836328390000001, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 4.312578020000000 ]dielectric_constant: - [ 5.592923900000000, -0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 5.592923910000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 5.741851810000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0682089600000000, -0.0007409500000000, -0.0006010200000000 ] - [ 0.0078020000000000, -0.0033644000000000, -0.0017031400000000 ] - [ 0.0077381900000000, 0.0033292200000000, 0.0010596300000000 ] - [ -0.0010412100000000, -0.0083980100000000, 0.0011200200000000 ] - [ -0.0010547000000000, 0.0084762800000000, -0.0017730800000000 ] - [ 0.0011797400000000, 0.0000059100000000, -0.0003139000000000 ] - [ -0.0010750200000000, -0.0017345400000000, -0.0002444500000000 ] - [ 0.0011792600000000, 0.0000017200000000, -0.0003135800000000 ] - [ -0.0010202400000000, 0.0017529100000000, -0.0003757100000000 ] - [ -0.0003101800000000, -0.0000010600000000, -0.0003068700000000 ] - [ 0.0001661900000000, 0.0000065700000000, 0.0000961800000000 ] - [ 0.0001712300000000, -0.0000091000000000, -0.0007123800000000 ] - [ -0.0000925100000000, -0.0001442400000000, -0.0003426900000000 ] - [ -0.0000952300000000, 0.0001430000000000, -0.0002735300000000 ] - [ 0.0001643800000000, 0.0000013800000000, -0.0003075200000000 ] - [ -0.0000946300000000, -0.0001572600000000, 0.0000616300000000 ] - [ 0.0001641600000000, 0.0000001900000000, -0.0003080000000000 ] - [ -0.0000926200000000, 0.0001617600000000, -0.0006776500000000 ] - [ 0.0058135600000000, -0.0055273800000000, 0.0130347900000000 ] - [ 0.0057998200000000, 0.0055802400000000, -0.0125825800000000 ] - [ 0.0023764700000000, 0.0000023800000000, 0.0003040500000000 ] - [ 0.0011060100000000, -0.0007251600000000, 0.0006034100000000 ] - [ -0.0023457900000000, 0.0000004200000000, 0.0003060500000000 ] - [ 0.0011103900000000, 0.0007395900000000, 0.0000131400000000 ] - [ -0.0038126400000000, 0.0000530000000000, 0.0003425000000000 ] - [ 0.0003780500000000, -0.0015816600000000, -0.0002791500000000 ] - [ 0.0003864000000000, 0.0015682500000000, 0.0008946800000000 ] - [ -0.0006081500000000, -0.0002592600000000, -0.0000321900000000 ] - [ -0.0006102600000000, 0.0002582700000000, 0.0006617700000000 ] - [ 0.0015423400000000, -0.0000023600000000, 0.0003149800000000 ] - [ 0.0002605800000000, -0.0007386600000000, 0.0002693800000000 ] - [ -0.0002905300000000, -0.0000010700000000, 0.0003130100000000 ] - [ 0.0002568500000000, 0.0007439200000000, 0.0003573400000000 ] - [ -0.0010575700000000, -0.0000010400000000, 0.0003148300000000 ] - [ 0.0007008200000000, -0.0005734900000000, 0.0009165700000000 ] - [ 0.0007016700000000, 0.0005717000000000, -0.0002886300000000 ] - [ -0.0005840200000000, 0.0001595500000000, 0.0002138100000000 ] - [ -0.0006116100000000, -0.0001510100000000, -0.0001932900000000 ] - [ 0.0006730700000000, -0.0000011300000000, -0.0000019000000000 ] - [ 0.0004754600000000, -0.0002489600000000, 0.0007150400000000 ] - [ -0.0008673100000000, -0.0000128300000000, 0.0000065300000000 ] - [ 0.0004739100000000, 0.0002488500000000, -0.0007209900000000 ] - [ 0.0000430900000000, 0.0000043200000000, 0.0000024800000000 ] - [ -0.0000237200000000, -0.0004008500000000, 0.0003873000000000 ] - [ -0.0000221500000000, 0.0004034400000000, -0.0003886800000000 ] - [ 0.0009141300000000, 0.0027299800000000, -0.0048744800000000 ] - [ 0.0008935900000000, -0.0027509500000000, 0.0048920400000000 ] - [ 0.0010390400000000, -0.0000025700000000, 0.0000030900000000 ] - [ 0.0034000900000000, -0.0019238700000000, -0.0040765200000000 ] - [ -0.0038423000000000, -0.0000110000000000, -0.0000075000000000 ] - [ 0.0034225200000000, 0.0019406600000000, 0.0041164200000000 ] - [ 0.0000647500000000, 0.0000131600000000, -0.0000136900000000 ] - [ -0.0000110500000000, -0.0006047100000000, -0.0000028000000000 ] - [ -0.0000085100000000, 0.0006060000000000, 0.0000076900000000 ] - [ 0.0173539300000000, 0.0000253000000000, -0.0056701900000000 ] - [ -0.0042059300000000, 0.0015956500000000, -0.0023933600000000 ] - [ -0.0041962600000000, -0.0015869600000000, -0.0088651400000000 ] - [ 0.0006579400000000, 0.0039065000000000, -0.0083308200000000 ] - [ 0.0006656900000000, -0.0039114400000000, -0.0029416000000000 ] - [ -0.0013160700000000, -0.0000017500000000, -0.0056442500000000 ] - [ 0.0002574400000000, 0.0014509700000000, -0.0051117100000000 ] - [ -0.0006981800000000, 0.0000005100000000, -0.0056443500000000 ] - [ 0.0002167200000000, -0.0014732600000000, -0.0061852900000000 ] - [ 0.0024664100000000, -0.0000000900000000, -0.0056480600000000 ] - [ -0.0013930600000000, 0.0000008100000000, -0.0073474600000000 ] - [ -0.0013974600000000, 0.0000129400000000, -0.0039505700000000 ] - [ 0.0008085400000000, 0.0006927200000000, -0.0051516100000000 ] - [ 0.0008175300000000, -0.0006949400000000, -0.0061394100000000 ] - [ -0.0016377800000000, -0.0000086500000000, -0.0056535800000000 ] - [ 0.0003162900000000, 0.0015692800000000, -0.0068509600000000 ] - [ -0.0006412800000000, -0.0000025400000000, -0.0056515000000000 ] - [ 0.0003133100000000, -0.0015687400000000, -0.0044420300000000 ] - [ 0.0131200500000000, -0.0008449900000000, 0.0042795700000000 ] - [ 0.0141635000000000, 0.0014553000000000, 0.0074083700000000 ] - [ -0.0056700800000000, -0.0000052600000000, 0.0056511300000000 ] - [ -0.0018484700000000, 0.0021840500000000, 0.0057863100000000 ] - [ 0.0037717000000000, -0.0000044700000000, 0.0056458700000000 ] - [ -0.0018645000000000, -0.0022161300000000, 0.0055095300000000 ] - [ 0.0116491400000000, -0.0000423400000000, 0.0056768000000000 ] - [ -0.0021667200000000, 0.0034478500000000, 0.0052618800000000 ] - [ -0.0021666300000000, -0.0034144400000000, 0.0060218900000000 ] - [ 0.0003233100000000, 0.0000607300000000, 0.0056508400000000 ] - [ 0.0003290900000000, -0.0000536000000000, 0.0056267200000000 ] - [ -0.0006912900000000, -0.0000001500000000, 0.0056428300000000 ] - [ -0.0001153000000000, 0.0003296200000000, 0.0053146600000000 ] - [ 0.0002509600000000, -0.0000015500000000, 0.0056384900000000 ] - [ -0.0001199700000000, -0.0003320300000000, 0.0059715200000000 ] - [ 0.0004252200000000, -0.0000026100000000, 0.0056396700000000 ] - [ -0.0001965800000000, 0.0002580900000000, 0.0052635100000000 ] - [ -0.0001980800000000, -0.0002595800000000, 0.0060198800000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0758627000000000 ] - [ 0.0013662100000000, -0.0008677900000000, -0.0032498900000000 ] - [ -0.0013662100000000, -0.0008677900000000, -0.0032498900000000 ] - [ 0.0000684300000000, 0.0016170700000000, -0.0032498900000000 ] - [ -0.0000684300000000, 0.0016170700000000, -0.0032498900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0015734300000000 ] - [ 0.0014346300000000, -0.0007492700000000, -0.0032498900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0015756800000000 ] - [ -0.0014346300000000, -0.0007492700000000, -0.0032498900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0019720100000000 ] - [ -0.0004008000000000, -0.0001913700000000, 0.0013455000000000 ] - [ 0.0004008000000000, -0.0001913700000000, 0.0013455000000000 ] - [ 0.0003661300000000, -0.0002514200000000, 0.0013455000000000 ] - [ -0.0003661300000000, -0.0002514200000000, 0.0013455000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009821300000000 ] - [ -0.0000346700000000, 0.0004427900000000, 0.0013455000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009839200000000 ] - [ 0.0000346700000000, 0.0004427900000000, 0.0013455000000000 ] - [ 0.0127417500000000, -0.0073564500000000, -0.0011890600000000 ] - [ -0.0127417500000000, -0.0073564500000000, -0.0011890600000000 ] - [ 0.0000000000000000, -0.0003406500000000, -0.0010318300000000 ] - [ 0.0002950100000000, 0.0001703200000000, -0.0010318300000000 ] - [ 0.0000000000000000, -0.0006774900000000, -0.0013589100000000 ] - [ -0.0002950100000000, 0.0001703200000000, -0.0010318300000000 ] - [ 0.0000000000000000, 0.0147129000000000, -0.0011890600000000 ] - [ -0.0005867200000000, 0.0003387400000000, -0.0013589100000000 ] - [ 0.0005867200000000, 0.0003387400000000, -0.0013589100000000 ] - [ -0.0003469300000000, 0.0002003000000000, 0.0022082500000000 ] - [ 0.0003469300000000, 0.0002003000000000, 0.0022082500000000 ] - [ 0.0000000000000000, 0.0000549400000000, 0.0016032400000000 ] - [ -0.0000475800000000, -0.0000274700000000, 0.0016032400000000 ] - [ 0.0000000000000000, 0.0006948800000000, 0.0021712500000000 ] - [ 0.0000475800000000, -0.0000274700000000, 0.0016032400000000 ] - [ 0.0000000000000000, -0.0004006000000000, 0.0022082500000000 ] - [ 0.0006017800000000, -0.0003474400000000, 0.0021712500000000 ] - [ -0.0006017800000000, -0.0003474400000000, 0.0021712500000000 ] - [ 0.0028981600000000, 0.0016732600000000, 0.0032100300000000 ] - [ -0.0028981600000000, 0.0016732600000000, 0.0032100300000000 ] - [ 0.0000000000000000, 0.0000932200000000, 0.0004088900000000 ] - [ 0.0003710700000000, -0.0002142400000000, 0.0004974200000000 ] - [ 0.0000000000000000, -0.0033465100000000, 0.0032100300000000 ] - [ -0.0003710700000000, -0.0002142400000000, 0.0004974200000000 ] - [ 0.0000000000000000, 0.0004284700000000, 0.0004974200000000 ] - [ -0.0000807300000000, -0.0000466100000000, 0.0004088900000000 ] - [ 0.0000807300000000, -0.0000466100000000, 0.0004088900000000 ] - [ -0.0031435000000000, -0.0018149000000000, 0.0035659600000000 ] - [ 0.0031435000000000, -0.0018149000000000, 0.0035659600000000 ] - [ 0.0000000000000000, -0.0000275300000000, -0.0000956400000000 ] - [ -0.0007919100000000, 0.0004572100000000, 0.0007204500000000 ] - [ 0.0000000000000000, 0.0036298000000000, 0.0035659600000000 ] - [ 0.0007919100000000, 0.0004572100000000, 0.0007204500000000 ] - [ 0.0000000000000000, -0.0009144200000000, 0.0007204500000000 ] - [ 0.0000238400000000, 0.0000137600000000, -0.0000956400000000 ] - [ -0.0000238400000000, 0.0000137600000000, -0.0000956400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0163048700000000 ] - [ 0.0032990800000000, -0.0010443000000000, -0.0041717500000000 ] - [ -0.0032990800000000, -0.0010443000000000, -0.0041717500000000 ] - [ -0.0007451500000000, 0.0033792400000000, -0.0041717500000000 ] - [ 0.0007451500000000, 0.0033792400000000, -0.0041717500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0045033200000000 ] - [ 0.0025539300000000, -0.0023349400000000, -0.0041717500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0044279200000000 ] - [ -0.0025539300000000, -0.0023349400000000, -0.0041717500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0094097900000000 ] - [ -0.0009916800000000, -0.0004120100000000, -0.0080548200000000 ] - [ 0.0009916800000000, -0.0004120100000000, -0.0080548200000000 ] - [ 0.0008526600000000, -0.0006528200000000, -0.0080548200000000 ] - [ -0.0008526600000000, -0.0006528200000000, -0.0080548200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0072155400000000 ] - [ -0.0001390300000000, 0.0010648300000000, -0.0080548200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0069224500000000 ] - [ 0.0001390300000000, 0.0010648300000000, -0.0080548200000000 ] - [ -0.0014832400000000, 0.0008563500000000, 0.0224294300000000 ] - [ 0.0014832400000000, 0.0008563500000000, 0.0224294300000000 ] - [ 0.0000000000000000, -0.0001808200000000, 0.0073508900000000 ] - [ 0.0001565900000000, 0.0000904100000000, 0.0073508900000000 ] - [ 0.0000000000000000, -0.0009308700000000, 0.0082118400000000 ] - [ -0.0001565900000000, 0.0000904100000000, 0.0073508900000000 ] - [ 0.0000000000000000, -0.0017127000000000, 0.0224294300000000 ] - [ -0.0008061600000000, 0.0004654400000000, 0.0082118400000000 ] - [ 0.0008061600000000, 0.0004654400000000, 0.0082118400000000 ] - [ -0.0006261200000000, 0.0003614900000000, 0.0027206400000000 ] - [ 0.0006261200000000, 0.0003614900000000, 0.0027206400000000 ] - [ 0.0000000000000000, 0.0001327000000000, 0.0040014700000000 ] - [ -0.0001149200000000, -0.0000663500000000, 0.0040014700000000 ] - [ 0.0000000000000000, 0.0006728800000000, 0.0032535700000000 ] - [ 0.0001149200000000, -0.0000663500000000, 0.0040014700000000 ] - [ 0.0000000000000000, -0.0007229800000000, 0.0027206400000000 ] - [ 0.0005827300000000, -0.0003364400000000, 0.0032535700000000 ] - [ -0.0005827300000000, -0.0003364400000000, 0.0032535700000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0772057900000000 ] - [ -0.0013958500000000, 0.0008788100000000, 0.0026479600000000 ] - [ 0.0013958500000000, 0.0008788100000000, 0.0026479600000000 ] - [ -0.0000631500000000, -0.0016482500000000, 0.0026479600000000 ] - [ 0.0000631500000000, -0.0016482500000000, 0.0026479600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009608700000000 ] - [ -0.0014590000000000, 0.0007694300000000, 0.0026479600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009588000000000 ] - [ 0.0014590000000000, 0.0007694300000000, 0.0026479600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0026135200000000 ] - [ 0.0004075600000000, 0.0001942000000000, -0.0019822600000000 ] - [ -0.0004075600000000, 0.0001942000000000, -0.0019822600000000 ] - [ -0.0003719600000000, 0.0002558500000000, -0.0019822600000000 ] - [ 0.0003719600000000, 0.0002558500000000, -0.0019822600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0016198500000000 ] - [ 0.0000355900000000, -0.0004500600000000, -0.0019822600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0016189600000000 ] - [ -0.0000355900000000, -0.0004500600000000, -0.0019822600000000 ] - [ -0.0128766000000000, 0.0074343100000000, 0.0018995300000000 ] - [ 0.0128766000000000, 0.0074343100000000, 0.0018995300000000 ] - [ 0.0000000000000000, 0.0003415900000000, 0.0016709900000000 ] - [ -0.0002958200000000, -0.0001707900000000, 0.0016709900000000 ] - [ 0.0000000000000000, 0.0006780500000000, 0.0019999100000000 ] - [ 0.0002958200000000, -0.0001707900000000, 0.0016709900000000 ] - [ 0.0000000000000000, -0.0148686200000000, 0.0018995300000000 ] - [ 0.0005872100000000, -0.0003390300000000, 0.0019999100000000 ] - [ -0.0005872100000000, -0.0003390300000000, 0.0019999100000000 ] - [ 0.0003471300000000, -0.0002004100000000, -0.0015990400000000 ] - [ -0.0003471300000000, -0.0002004100000000, -0.0015990400000000 ] - [ 0.0000000000000000, -0.0000485200000000, -0.0009915100000000 ] - [ 0.0000420200000000, 0.0000242600000000, -0.0009915100000000 ] - [ 0.0000000000000000, -0.0006960800000000, -0.0015586900000000 ] - [ -0.0000420200000000, 0.0000242600000000, -0.0009915100000000 ] - [ 0.0000000000000000, 0.0004008300000000, -0.0015990400000000 ] - [ -0.0006028200000000, 0.0003480400000000, -0.0015586900000000 ] - [ 0.0006028200000000, 0.0003480400000000, -0.0015586900000000 ] - [ -0.0029371500000000, -0.0016957700000000, -0.0032415600000000 ] - [ 0.0029371500000000, -0.0016957700000000, -0.0032415600000000 ] - [ 0.0000000000000000, -0.0000930800000000, -0.0004064100000000 ] - [ -0.0003740700000000, 0.0002159700000000, -0.0004959300000000 ] - [ 0.0000000000000000, 0.0033915300000000, -0.0032415600000000 ] - [ 0.0003740700000000, 0.0002159700000000, -0.0004959300000000 ] - [ 0.0000000000000000, -0.0004319400000000, -0.0004959300000000 ] - [ 0.0000806100000000, 0.0000465400000000, -0.0004064100000000 ] - [ -0.0000806100000000, 0.0000465400000000, -0.0004064100000000 ] - [ 0.0031151200000000, 0.0017985200000000, -0.0035590800000000 ] - [ -0.0031151200000000, 0.0017985200000000, -0.0035590800000000 ] - [ 0.0000000000000000, 0.0000297200000000, 0.0000906800000000 ] - [ 0.0008098500000000, -0.0004675700000000, -0.0007494900000000 ] - [ 0.0000000000000000, -0.0035970300000000, -0.0035590800000000 ] - [ -0.0008098500000000, -0.0004675700000000, -0.0007494900000000 ] - [ 0.0000000000000000, 0.0009351300000000, -0.0007494900000000 ] - [ -0.0000257400000000, -0.0000148600000000, 0.0000906800000000 ] - [ 0.0000257400000000, -0.0000148600000000, 0.0000906800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0296353300000000 ] - [ -0.0033106200000000, 0.0010437400000000, -0.0071229200000000 ] - [ 0.0033106200000000, 0.0010437400000000, -0.0071229200000000 ] - [ 0.0007514000000000, -0.0033889500000000, -0.0071229200000000 ] - [ -0.0007514000000000, -0.0033889500000000, -0.0071229200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0067746900000000 ] - [ -0.0025592200000000, 0.0023452100000000, -0.0071229200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0068442400000000 ] - [ 0.0025592200000000, 0.0023452100000000, -0.0071229200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0018330900000000 ] - [ 0.0009864800000000, 0.0003971600000000, -0.0031899200000000 ] - [ -0.0009864800000000, 0.0003971600000000, -0.0031899200000000 ] - [ -0.0008371900000000, 0.0006557400000000, -0.0031899200000000 ] - [ 0.0008371900000000, 0.0006557400000000, -0.0031899200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0040345600000000 ] - [ 0.0001492900000000, -0.0010529000000000, -0.0031899200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0043239800000000 ] - [ -0.0001492900000000, -0.0010529000000000, -0.0031899200000000 ] - [ 0.0013147700000000, -0.0007590800000000, -0.0111917300000000 ] - [ -0.0013147700000000, -0.0007590800000000, -0.0111917300000000 ] - [ 0.0000000000000000, 0.0001848000000000, 0.0039026100000000 ] - [ -0.0001600400000000, -0.0000924000000000, 0.0039026100000000 ] - [ 0.0000000000000000, 0.0009521000000000, 0.0030524900000000 ] - [ 0.0001600400000000, -0.0000924000000000, 0.0039026100000000 ] - [ 0.0000000000000000, 0.0015181600000000, -0.0111917300000000 ] - [ 0.0008245500000000, -0.0004760500000000, 0.0030524900000000 ] - [ -0.0008245500000000, -0.0004760500000000, 0.0030524900000000 ] - [ 0.0006359700000000, -0.0003671800000000, 0.0085642700000000 ] - [ -0.0006359700000000, -0.0003671800000000, 0.0085642700000000 ] - [ 0.0000000000000000, -0.0001409300000000, 0.0072764200000000 ] - [ 0.0001220500000000, 0.0000704600000000, 0.0072764200000000 ] - [ 0.0000000000000000, -0.0006823100000000, 0.0080217600000000 ] - [ -0.0001220500000000, 0.0000704600000000, 0.0072764200000000 ] - [ 0.0000000000000000, 0.0007343500000000, 0.0085642700000000 ] - [ -0.0005909000000000, 0.0003411600000000, 0.0080217600000000 ] - [ 0.0005909000000000, 0.0003411600000000, 0.0080217600000000 ]- atom: 37 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0005995300000000, 0.0001528100000000, 0.0026135400000000 ] - [ 0.0006742800000000, -0.0000004000000000, -0.0003108900000000 ] - [ -0.0005960700000000, -0.0001567500000000, -0.0032214500000000 ] - [ 0.0000433300000000, 0.0000009300000000, -0.0003133700000000 ] - [ -0.0000234700000000, 0.0004036000000000, -0.0002325100000000 ] - [ -0.0000226500000000, -0.0004015700000000, -0.0003928400000000 ] - [ 0.0004735300000000, -0.0002492700000000, 0.0000598600000000 ] - [ 0.0004742900000000, 0.0002478300000000, -0.0006858100000000 ] - [ -0.0008658100000000, -0.0000008100000000, -0.0003212700000000 ] - [ 0.0009001600000000, 0.0027493800000000, -0.0034474200000000 ] - [ 0.0010389000000000, 0.0000032700000000, -0.0003131800000000 ] - [ 0.0009087400000000, -0.0027317900000000, 0.0028111700000000 ] - [ 0.0000629600000000, -0.0000108900000000, -0.0003106900000000 ] - [ -0.0000098400000000, 0.0006062100000000, -0.0003367300000000 ] - [ -0.0000092300000000, -0.0006047400000000, -0.0002873500000000 ] - [ 0.0034139100000000, -0.0019382000000000, -0.0011146300000000 ] - [ 0.0034090000000000, 0.0019280600000000, 0.0004884200000000 ] - [ -0.0038418200000000, 0.0000012700000000, -0.0003055700000000 ] - [ -0.0038418200000000, -0.0000012700000000, 0.0003055700000000 ] - [ 0.0034139100000000, 0.0019382000000000, 0.0011146300000000 ] - [ 0.0034090000000000, -0.0019280600000000, -0.0004884200000000 ] - [ -0.0000098400000000, -0.0006062100000000, 0.0003367300000000 ] - [ -0.0000092300000000, 0.0006047400000000, 0.0002873500000000 ] - [ 0.0000629600000000, 0.0000108900000000, 0.0003106900000000 ] - [ 0.0009001600000000, -0.0027493800000000, 0.0034474200000000 ] - [ 0.0010389000000000, -0.0000032700000000, 0.0003131800000000 ] - [ 0.0009087400000000, 0.0027317900000000, -0.0028111700000000 ] - [ -0.0008658100000000, 0.0000008100000000, 0.0003212700000000 ] - [ 0.0004735300000000, 0.0002492700000000, -0.0000598600000000 ] - [ 0.0004742900000000, -0.0002478300000000, 0.0006858100000000 ] - [ -0.0000234700000000, -0.0004036000000000, 0.0002325100000000 ] - [ -0.0000226500000000, 0.0004015700000000, 0.0003928400000000 ] - [ 0.0000433300000000, -0.0000009300000000, 0.0003133700000000 ] - [ -0.0005995300000000, -0.0001528100000000, -0.0026135400000000 ] - [ 0.0006742800000000, 0.0000004000000000, 0.0003108900000000 ] - [ -0.0005960700000000, 0.0001567500000000, 0.0032214500000000 ] - [ -0.0502312500000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0040431200000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0039972100000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0004236400000000, -0.0020747400000000, 0.0004381200000000 ] - [ 0.0004212900000000, 0.0020790000000000, -0.0004410100000000 ] - [ 0.0004293100000000, 0.0000007800000000, -0.0000008800000000 ] - [ 0.0004212900000000, -0.0020790000000000, 0.0004410100000000 ] - [ 0.0004293100000000, -0.0000007800000000, 0.0000008800000000 ] - [ 0.0004236400000000, 0.0020747400000000, -0.0004381200000000 ] - [ -0.0007354700000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0002562400000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0002594700000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0000786000000000, -0.0001941900000000, 0.0000291700000000 ] - [ -0.0000791200000000, 0.0001948400000000, -0.0000290600000000 ] - [ 0.0001851000000000, 0.0000015200000000, 0.0000001200000000 ] - [ -0.0000791200000000, -0.0001948400000000, 0.0000290600000000 ] - [ 0.0001851000000000, -0.0000015200000000, -0.0000001200000000 ] - [ -0.0000786000000000, 0.0001941900000000, -0.0000291700000000 ] - [ 0.0081026200000000, 0.0022291400000000, -0.0020159600000000 ] - [ -0.0030298500000000, -0.0000017600000000, -0.0056354200000000 ] - [ 0.0079139600000000, -0.0020789100000000, -0.0089945300000000 ] - [ 0.0006154900000000, 0.0000041300000000, -0.0056238700000000 ] - [ -0.0003733700000000, -0.0015434700000000, -0.0053307900000000 ] - [ -0.0003593200000000, 0.0015313600000000, -0.0059152000000000 ] - [ -0.0013835800000000, 0.0011573200000000, -0.0062015400000000 ] - [ -0.0013935000000000, -0.0011572100000000, -0.0050508800000000 ] - [ 0.0042783600000000, 0.0000162400000000, -0.0056329100000000 ] - [ 0.0003572000000000, -0.0006226600000000, -0.0044198200000000 ] - [ -0.0006374400000000, 0.0000029500000000, -0.0056254300000000 ] - [ 0.0003535200000000, 0.0006132600000000, -0.0068372400000000 ] - [ -0.0000417500000000, 0.0000048300000000, -0.0056333900000000 ] - [ 0.0000086700000000, -0.0003720200000000, -0.0055305300000000 ] - [ 0.0000117800000000, 0.0003759400000000, -0.0057179600000000 ] - [ -0.0006941200000000, 0.0003706900000000, -0.0048307700000000 ] - [ -0.0006815300000000, -0.0003749400000000, -0.0064153500000000 ] - [ 0.0014259000000000, 0.0000037700000000, -0.0056269900000000 ] - [ 0.0014259000000000, -0.0000037700000000, 0.0056269900000000 ] - [ -0.0006941200000000, -0.0003706900000000, 0.0048307700000000 ] - [ -0.0006815300000000, 0.0003749400000000, 0.0064153500000000 ] - [ 0.0000086700000000, 0.0003720200000000, 0.0055305300000000 ] - [ 0.0000117800000000, -0.0003759400000000, 0.0057179600000000 ] - [ -0.0000417500000000, -0.0000048300000000, 0.0056333900000000 ] - [ 0.0003572000000000, 0.0006226600000000, 0.0044198200000000 ] - [ -0.0006374400000000, -0.0000029500000000, 0.0056254300000000 ] - [ 0.0003535200000000, -0.0006132600000000, 0.0068372400000000 ] - [ 0.0042783600000000, -0.0000162400000000, 0.0056329100000000 ] - [ -0.0013835800000000, -0.0011573200000000, 0.0062015400000000 ] - [ -0.0013935000000000, 0.0011572100000000, 0.0050508800000000 ] - [ -0.0003733700000000, 0.0015434700000000, 0.0053307900000000 ] - [ -0.0003593200000000, -0.0015313600000000, 0.0059152000000000 ] - [ 0.0006154900000000, -0.0000041300000000, 0.0056238700000000 ] - [ 0.0081026200000000, -0.0022291400000000, 0.0020159600000000 ] - [ -0.0030298500000000, 0.0000017600000000, 0.0056354200000000 ] - [ 0.0079139600000000, 0.0020789100000000, 0.0089945300000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0002035700000000, 0.0001175300000000, 0.0029123000000000 ] - [ 0.0000000000000000, -0.0004488400000000, 0.0000928200000000 ] - [ -0.0002035700000000, 0.0001175300000000, 0.0029123000000000 ] - [ 0.0000000000000000, 0.0008298900000000, 0.0001821700000000 ] - [ -0.0003887100000000, 0.0002244200000000, 0.0000928200000000 ] - [ 0.0003887100000000, 0.0002244200000000, 0.0000928200000000 ] - [ 0.0007187100000000, -0.0004149500000000, 0.0001821700000000 ] - [ -0.0007187100000000, -0.0004149500000000, 0.0001821700000000 ] - [ 0.0000000000000000, -0.0002350600000000, 0.0029123000000000 ] - [ -0.0048668000000000, -0.0028098500000000, 0.0032421600000000 ] - [ 0.0000000000000000, 0.0000056100000000, -0.0004050300000000 ] - [ 0.0048668000000000, -0.0028098500000000, 0.0032421600000000 ] - [ 0.0000000000000000, -0.0047193000000000, 0.0004211200000000 ] - [ 0.0000048500000000, -0.0000028000000000, -0.0004050300000000 ] - [ -0.0000048500000000, -0.0000028000000000, -0.0004050300000000 ] - [ -0.0040870400000000, 0.0023596500000000, 0.0004211200000000 ] - [ 0.0040870400000000, 0.0023596500000000, 0.0004211200000000 ] - [ 0.0000000000000000, 0.0056197000000000, 0.0032421600000000 ] - [ 0.0000000000000000, 0.0056566000000000, 0.0038838400000000 ] - [ 0.0041047400000000, 0.0023698700000000, 0.0010489300000000 ] - [ -0.0041047400000000, 0.0023698700000000, 0.0010489300000000 ] - [ -0.0000051000000000, -0.0000029500000000, 0.0002188200000000 ] - [ 0.0000051000000000, -0.0000029500000000, 0.0002188200000000 ] - [ 0.0000000000000000, -0.0047397400000000, 0.0010489300000000 ] - [ 0.0048987600000000, -0.0028283000000000, 0.0038838400000000 ] - [ 0.0000000000000000, 0.0000058900000000, 0.0002188200000000 ] - [ -0.0048987600000000, -0.0028283000000000, 0.0038838400000000 ] - [ 0.0000000000000000, -0.0002336800000000, 0.0035387700000000 ] - [ -0.0007168700000000, -0.0004138800000000, 0.0008113700000000 ] - [ 0.0007168700000000, -0.0004138800000000, 0.0008113700000000 ] - [ 0.0003876300000000, 0.0002238000000000, 0.0007223300000000 ] - [ -0.0003876300000000, 0.0002238000000000, 0.0007223300000000 ] - [ 0.0000000000000000, 0.0008277700000000, 0.0008113700000000 ] - [ -0.0002023700000000, 0.0001168400000000, 0.0035387700000000 ] - [ 0.0000000000000000, -0.0004476000000000, 0.0007223300000000 ] - [ 0.0002023700000000, 0.0001168400000000, 0.0035387700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0676601800000000 ] - [ -0.0000073200000000, -0.0005073800000000, -0.0023911100000000 ] - [ 0.0000073200000000, -0.0005073800000000, -0.0023911100000000 ] - [ 0.0004430600000000, 0.0002473600000000, -0.0023911100000000 ] - [ -0.0004430600000000, 0.0002473600000000, -0.0023911100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0011261700000000 ] - [ 0.0004357500000000, 0.0002600300000000, -0.0023911100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0011259700000000 ] - [ -0.0004357500000000, 0.0002600300000000, -0.0023911100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0018373600000000 ] - [ 0.0000001700000000, -0.0000329100000000, 0.0010481900000000 ] - [ -0.0000001700000000, -0.0000329100000000, 0.0010481900000000 ] - [ 0.0000284200000000, 0.0000166000000000, 0.0010481900000000 ] - [ -0.0000284200000000, 0.0000166000000000, 0.0010481900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0008091100000000 ] - [ 0.0000285900000000, 0.0000163100000000, 0.0010481900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0008086200000000 ] - [ -0.0000285900000000, 0.0000163100000000, 0.0010481900000000 ] - [ 0.0018305000000000, 0.0010568400000000, 0.0017866500000000 ] - [ 0.0000000000000000, 0.0010068900000000, -0.0044102700000000 ] - [ -0.0018305000000000, 0.0010568400000000, 0.0017866500000000 ] - [ 0.0000000000000000, -0.0019959800000000, -0.0043317500000000 ] - [ 0.0008720000000000, -0.0005034500000000, -0.0044102700000000 ] - [ -0.0008720000000000, -0.0005034500000000, -0.0044102700000000 ] - [ -0.0017285700000000, 0.0009979900000000, -0.0043317500000000 ] - [ 0.0017285700000000, 0.0009979900000000, -0.0043317500000000 ] - [ 0.0000000000000000, -0.0021136800000000, 0.0017866500000000 ] - [ 0.0007940700000000, 0.0004584600000000, -0.0087833500000000 ] - [ 0.0000000000000000, 0.0000828400000000, -0.0064534400000000 ] - [ -0.0007940700000000, 0.0004584600000000, -0.0087833500000000 ] - [ 0.0000000000000000, 0.0006720300000000, -0.0074047400000000 ] - [ 0.0000717400000000, -0.0000414200000000, -0.0064534400000000 ] - [ -0.0000717400000000, -0.0000414200000000, -0.0064534400000000 ] - [ 0.0005819900000000, -0.0003360100000000, -0.0074047400000000 ] - [ -0.0005819900000000, -0.0003360100000000, -0.0074047400000000 ] - [ 0.0000000000000000, -0.0009169100000000, -0.0087833500000000 ] - [ 0.0000000000000000, -0.0009221900000000, 0.0024796700000000 ] - [ -0.0005854100000000, -0.0003379900000000, 0.0038605200000000 ] - [ 0.0005854100000000, -0.0003379900000000, 0.0038605200000000 ] - [ -0.0000709900000000, -0.0000409900000000, 0.0048141600000000 ] - [ 0.0000709900000000, -0.0000409900000000, 0.0048141600000000 ] - [ 0.0000000000000000, 0.0006759700000000, 0.0038605200000000 ] - [ -0.0007986400000000, 0.0004611000000000, 0.0024796700000000 ] - [ 0.0000000000000000, 0.0000819700000000, 0.0048141600000000 ] - [ 0.0007986400000000, 0.0004611000000000, 0.0024796700000000 ] - [ 0.0000000000000000, -0.0018397000000000, 0.0128400700000000 ] - [ 0.0017301700000000, 0.0009989100000000, 0.0069257700000000 ] - [ -0.0017301700000000, 0.0009989100000000, 0.0069257700000000 ] - [ -0.0008677800000000, -0.0005010100000000, 0.0068453800000000 ] - [ 0.0008677800000000, -0.0005010100000000, 0.0068453800000000 ] - [ 0.0000000000000000, -0.0019978300000000, 0.0069257700000000 ] - [ -0.0015932300000000, 0.0009198500000000, 0.0128400700000000 ] - [ 0.0000000000000000, 0.0010020300000000, 0.0068453800000000 ] - [ 0.0015932300000000, 0.0009198500000000, 0.0128400700000000 ]- atom: 55 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0173608000000000, 0.0000249400000000, -0.0002783100000000 ] - [ -0.0042074700000000, 0.0011046400000000, -0.0036361800000000 ] - [ -0.0041871200000000, -0.0010965500000000, 0.0029766900000000 ] - [ 0.0002451300000000, 0.0041473900000000, 0.0022367000000000 ] - [ 0.0002400800000000, -0.0041627700000000, -0.0028781200000000 ] - [ -0.0006931600000000, -0.0000058100000000, -0.0003136900000000 ] - [ 0.0006887700000000, 0.0012100500000000, -0.0010554400000000 ] - [ -0.0013124700000000, 0.0000002000000000, -0.0003155200000000 ] - [ 0.0006470400000000, -0.0012242300000000, 0.0004416100000000 ] - [ 0.0024696000000000, -0.0000011300000000, -0.0003098600000000 ] - [ -0.0013863000000000, -0.0005775400000000, 0.0006797900000000 ] - [ -0.0013923500000000, 0.0005848300000000, -0.0013016000000000 ] - [ 0.0003193000000000, 0.0009784600000000, -0.0004538300000000 ] - [ 0.0003201200000000, -0.0009818400000000, -0.0001674900000000 ] - [ -0.0006355900000000, -0.0000028100000000, -0.0003095200000000 ] - [ 0.0008151300000000, 0.0012789800000000, 0.0005354000000000 ] - [ -0.0016316400000000, -0.0000041700000000, -0.0003112100000000 ] - [ 0.0008196400000000, -0.0012821000000000, -0.0011588500000000 ] - [ 0.0131043200000000, -0.0008276100000000, -0.0009256900000000 ] - [ 0.0141920200000000, 0.0014777000000000, 0.0018810800000000 ] - [ -0.0056640300000000, -0.0000108400000000, 0.0003077300000000 ] - [ -0.0018487300000000, 0.0021897400000000, 0.0004694500000000 ] - [ 0.0037772100000000, -0.0000006400000000, 0.0003111500000000 ] - [ -0.0018555400000000, -0.0022113400000000, 0.0001542500000000 ] - [ 0.0116541500000000, -0.0000910900000000, 0.0003331400000000 ] - [ -0.0021609600000000, 0.0034492400000000, -0.0005041200000000 ] - [ -0.0021646800000000, -0.0034101800000000, 0.0011236000000000 ] - [ 0.0003305000000000, 0.0000575200000000, -0.0003152600000000 ] - [ 0.0003308200000000, -0.0000555400000000, 0.0009448800000000 ] - [ -0.0006864500000000, 0.0000006700000000, 0.0003155300000000 ] - [ -0.0001136500000000, 0.0003292800000000, 0.0001967800000000 ] - [ 0.0002566200000000, -0.0000006700000000, 0.0003144100000000 ] - [ -0.0001139000000000, -0.0003319900000000, 0.0004323600000000 ] - [ 0.0004284300000000, -0.0000001300000000, 0.0003162900000000 ] - [ -0.0001916600000000, 0.0002593600000000, 0.0008985000000000 ] - [ -0.0001920400000000, -0.0002586300000000, -0.0002747900000000 ] - [ 0.0078947000000000, 0.0020884100000000, 0.0015837200000000 ] - [ 0.0081335600000000, -0.0022227700000000, -0.0018439900000000 ] - [ -0.0030263200000000, 0.0000057500000000, 0.0000121800000000 ] - [ -0.0013803800000000, 0.0011485500000000, -0.0017197400000000 ] - [ 0.0042812500000000, -0.0000428100000000, 0.0000461300000000 ] - [ -0.0013855900000000, -0.0011581500000000, 0.0017368700000000 ] - [ 0.0006145500000000, -0.0000034600000000, -0.0000054900000000 ] - [ -0.0003565600000000, 0.0015362700000000, -0.0008683600000000 ] - [ -0.0003610600000000, -0.0015437500000000, 0.0008708300000000 ] - [ 0.0003541600000000, -0.0006139000000000, 0.0008004900000000 ] - [ 0.0003655700000000, 0.0006199600000000, -0.0007923900000000 ] - [ -0.0006326300000000, 0.0000010600000000, -0.0000017700000000 ] - [ -0.0006822600000000, 0.0003745200000000, 0.0005823600000000 ] - [ 0.0014285300000000, 0.0000007200000000, -0.0000003500000000 ] - [ -0.0006812400000000, -0.0003767900000000, -0.0005843100000000 ] - [ -0.0000310300000000, -0.0000052200000000, 0.0000055500000000 ] - [ 0.0000129100000000, 0.0003718800000000, -0.0000720200000000 ] - [ 0.0000108900000000, -0.0003723900000000, 0.0000715600000000 ] - [ -0.1094993800000000, -0.0005001100000000, -0.0059378200000000 ] - [ 0.0228688500000000, -0.0035752900000000, -0.0070130400000000 ] - [ 0.0225854800000000, 0.0035294000000000, -0.0042659400000000 ] - [ 0.0004604200000000, -0.0163514600000000, -0.0022884800000000 ] - [ 0.0004508700000000, 0.0164694200000000, -0.0089967300000000 ] - [ 0.0023992000000000, 0.0000133100000000, -0.0056364700000000 ] - [ 0.0004045900000000, -0.0093007700000000, -0.0036429500000000 ] - [ 0.0023991000000000, -0.0000035400000000, -0.0056396900000000 ] - [ 0.0005063600000000, 0.0093081000000000, -0.0076011200000000 ] - [ -0.0009132300000000, -0.0000018500000000, -0.0056405000000000 ] - [ 0.0004593800000000, 0.0000281600000000, -0.0059756000000000 ] - [ 0.0004646800000000, -0.0000318200000000, -0.0052985300000000 ] - [ -0.0002195900000000, -0.0003646800000000, -0.0054646800000000 ] - [ -0.0002192400000000, 0.0003629300000000, -0.0058112200000000 ] - [ 0.0004393700000000, 0.0000027800000000, -0.0056390600000000 ] - [ -0.0002206800000000, -0.0004216600000000, -0.0058051700000000 ] - [ 0.0004390400000000, 0.0000011000000000, -0.0056361800000000 ] - [ -0.0002182200000000, 0.0004245700000000, -0.0054728400000000 ] - [ 0.0009777200000000, -0.0027559300000000, -0.0134920300000000 ] - [ 0.0009104100000000, 0.0027596500000000, 0.0249284800000000 ] - [ 0.0039247600000000, 0.0000063500000000, 0.0056478800000000 ] - [ 0.0012603500000000, -0.0015280200000000, 0.0051416600000000 ] - [ -0.0025120000000000, -0.0000018000000000, 0.0056413500000000 ] - [ 0.0012674700000000, 0.0015441100000000, 0.0061365600000000 ] - [ -0.0038323200000000, 0.0000379800000000, 0.0055699000000000 ] - [ 0.0011382000000000, -0.0021198600000000, 0.0075588900000000 ] - [ 0.0011510900000000, 0.0021009100000000, 0.0037313400000000 ] - [ -0.0008052200000000, -0.0033584500000000, 0.0092611400000000 ] - [ -0.0008067100000000, 0.0033540300000000, 0.0020050200000000 ] - [ 0.0024080900000000, -0.0000027600000000, 0.0056302500000000 ] - [ 0.0001503400000000, -0.0012990900000000, 0.0064241000000000 ] - [ -0.0000950900000000, 0.0000020600000000, 0.0056403300000000 ] - [ 0.0001509100000000, 0.0013094500000000, 0.0048480900000000 ] - [ -0.0066203000000000, 0.0000019800000000, 0.0056413700000000 ] - [ 0.0033096400000000, -0.0019679700000000, 0.0033045600000000 ] - [ 0.0033147100000000, 0.0019654700000000, 0.0079660200000000 ]- atom: 55 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0237615900000000 ] - [ -0.0032405800000000, 0.0012470100000000, 0.0011765400000000 ] - [ 0.0032405800000000, 0.0012470100000000, 0.0011765400000000 ] - [ 0.0005403500000000, -0.0034299300000000, 0.0011765400000000 ] - [ -0.0005403500000000, -0.0034299300000000, 0.0011765400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009042400000000 ] - [ -0.0027002300000000, 0.0021829200000000, 0.0011765400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0008301400000000 ] - [ 0.0027002300000000, 0.0021829200000000, 0.0011765400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0040934100000000 ] - [ 0.0016948100000000, 0.0004131500000000, -0.0027440900000000 ] - [ -0.0016948100000000, 0.0004131500000000, -0.0027440900000000 ] - [ -0.0012052000000000, 0.0012611800000000, -0.0027440900000000 ] - [ 0.0012052000000000, 0.0012611800000000, -0.0027440900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0016091900000000 ] - [ 0.0004896100000000, -0.0016743300000000, -0.0027440900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0019063700000000 ] - [ -0.0004896100000000, -0.0016743300000000, -0.0027440900000000 ] - [ -0.0016566100000000, 0.0009564500000000, 0.0171828500000000 ] - [ 0.0016566100000000, 0.0009564500000000, 0.0171828500000000 ] - [ 0.0000000000000000, -0.0001590800000000, 0.0020511800000000 ] - [ 0.0001377700000000, 0.0000795400000000, 0.0020511800000000 ] - [ 0.0000000000000000, -0.0004363400000000, 0.0029054400000000 ] - [ -0.0001377700000000, 0.0000795400000000, 0.0020511800000000 ] - [ 0.0000000000000000, -0.0019128900000000, 0.0171828500000000 ] - [ -0.0003778800000000, 0.0002181700000000, 0.0029054400000000 ] - [ 0.0003778800000000, 0.0002181700000000, 0.0029054400000000 ] - [ 0.0000129500000000, -0.0000074800000000, -0.0026035700000000 ] - [ -0.0000129500000000, -0.0000074800000000, -0.0026035700000000 ] - [ 0.0000000000000000, 0.0003791000000000, -0.0013184200000000 ] - [ -0.0003283100000000, -0.0001895500000000, -0.0013184200000000 ] - [ 0.0000000000000000, -0.0004384300000000, -0.0020694000000000 ] - [ 0.0003283100000000, -0.0001895500000000, -0.0013184200000000 ] - [ 0.0000000000000000, 0.0000149500000000, -0.0026035700000000 ] - [ -0.0003796900000000, 0.0002192200000000, -0.0020694000000000 ] - [ 0.0003796900000000, 0.0002192200000000, -0.0020694000000000 ] - [ 0.0033775700000000, 0.0019500400000000, 0.0072035800000000 ] - [ -0.0033775700000000, 0.0019500400000000, 0.0072035800000000 ] - [ 0.0000000000000000, 0.0003307700000000, 0.0012193700000000 ] - [ -0.0005738400000000, 0.0003313100000000, 0.0012957100000000 ] - [ 0.0000000000000000, -0.0039000800000000, 0.0072035800000000 ] - [ 0.0005738400000000, 0.0003313100000000, 0.0012957100000000 ] - [ 0.0000000000000000, -0.0006626100000000, 0.0012957100000000 ] - [ -0.0002864500000000, -0.0001653800000000, 0.0012193700000000 ] - [ 0.0002864500000000, -0.0001653800000000, 0.0012193700000000 ] - [ 0.0012136300000000, 0.0007006900000000, -0.0031536200000000 ] - [ -0.0012136300000000, 0.0007006900000000, -0.0031536200000000 ] - [ 0.0000000000000000, 0.0001129700000000, -0.0008123400000000 ] - [ 0.0007969600000000, -0.0004601300000000, -0.0017674800000000 ] - [ 0.0000000000000000, -0.0014013800000000, -0.0031536200000000 ] - [ -0.0007969600000000, -0.0004601300000000, -0.0017674800000000 ] - [ 0.0000000000000000, 0.0009202500000000, -0.0017674800000000 ] - [ -0.0000978400000000, -0.0000564900000000, -0.0008123400000000 ] - [ 0.0000978400000000, -0.0000564900000000, -0.0008123400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.1240319800000000 ] - [ 0.0013413700000000, -0.0030676800000000, -0.0133892200000000 ] - [ -0.0013413700000000, -0.0030676800000000, -0.0133892200000000 ] - [ 0.0019860000000000, 0.0026955000000000, -0.0133892200000000 ] - [ -0.0019860000000000, 0.0026955000000000, -0.0133892200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0083628800000000 ] - [ 0.0033273700000000, 0.0003721700000000, -0.0133892200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0083644900000000 ] - [ -0.0033273700000000, 0.0003721700000000, -0.0133892200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0007234000000000 ] - [ 0.0003369900000000, -0.0000107700000000, -0.0023719200000000 ] - [ -0.0003369900000000, -0.0000107700000000, -0.0023719200000000 ] - [ -0.0001591700000000, 0.0002972300000000, -0.0023719200000000 ] - [ 0.0001591700000000, 0.0002972300000000, -0.0023719200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0032817700000000 ] - [ 0.0001778200000000, -0.0002864600000000, -0.0023719200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0032547700000000 ] - [ -0.0001778200000000, -0.0002864600000000, -0.0023719200000000 ] - [ -0.0193426700000000, 0.0111675000000000, 0.0187437500000000 ] - [ 0.0193426700000000, 0.0111675000000000, 0.0187437500000000 ] - [ 0.0000000000000000, 0.0005722400000000, 0.0051587100000000 ] - [ -0.0004955800000000, -0.0002861200000000, 0.0051587100000000 ] - [ 0.0000000000000000, 0.0022091300000000, 0.0051199800000000 ] - [ 0.0004955800000000, -0.0002861200000000, 0.0051587100000000 ] - [ 0.0000000000000000, -0.0223350000000000, 0.0187437500000000 ] - [ 0.0019131600000000, -0.0011045600000000, 0.0051199800000000 ] - [ -0.0019131600000000, -0.0011045600000000, 0.0051199800000000 ] - [ 0.0036041600000000, -0.0020808600000000, 0.0123549000000000 ] - [ -0.0036041600000000, -0.0020808600000000, 0.0123549000000000 ] - [ 0.0000000000000000, -0.0009120700000000, 0.0068174100000000 ] - [ 0.0007898800000000, 0.0004560300000000, 0.0068174100000000 ] - [ 0.0000000000000000, -0.0026760000000000, 0.0097067900000000 ] - [ -0.0007898800000000, 0.0004560300000000, 0.0068174100000000 ] - [ 0.0000000000000000, 0.0041617200000000, 0.0123549000000000 ] - [ -0.0023174900000000, 0.0013380000000000, 0.0097067900000000 ] - [ 0.0023174900000000, 0.0013380000000000, 0.0097067900000000 ]- atom: 55 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0221769700000000 ] - [ 0.0032274600000000, -0.0012453600000000, -0.0017731200000000 ] - [ -0.0032274600000000, -0.0012453600000000, -0.0017731200000000 ] - [ -0.0005352200000000, 0.0034177400000000, -0.0017731200000000 ] - [ 0.0005352200000000, 0.0034177400000000, -0.0017731200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0015161300000000 ] - [ 0.0026922400000000, -0.0021723800000000, -0.0017731200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0014424800000000 ] - [ -0.0026922400000000, -0.0021723800000000, -0.0017731200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0034767400000000 ] - [ -0.0017030100000000, -0.0004079900000000, 0.0021191700000000 ] - [ 0.0017030100000000, -0.0004079900000000, 0.0021191700000000 ] - [ 0.0012048400000000, -0.0012708600000000, 0.0021191700000000 ] - [ -0.0012048400000000, -0.0012708600000000, 0.0021191700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0009846500000000 ] - [ -0.0004981700000000, 0.0016788500000000, 0.0021191700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0012777900000000 ] - [ 0.0004981700000000, 0.0016788500000000, 0.0021191700000000 ] - [ 0.0014628300000000, -0.0008445700000000, -0.0164604400000000 ] - [ -0.0014628300000000, -0.0008445700000000, -0.0164604400000000 ] - [ 0.0000000000000000, 0.0001635900000000, -0.0014137000000000 ] - [ -0.0001416700000000, -0.0000817900000000, -0.0014137000000000 ] - [ 0.0000000000000000, 0.0004414000000000, -0.0022690300000000 ] - [ 0.0001416700000000, -0.0000817900000000, -0.0014137000000000 ] - [ 0.0000000000000000, 0.0016891300000000, -0.0164604400000000 ] - [ 0.0003822600000000, -0.0002207000000000, -0.0022690300000000 ] - [ -0.0003822600000000, -0.0002207000000000, -0.0022690300000000 ] - [ -0.0000080000000000, 0.0000046200000000, 0.0032267700000000 ] - [ 0.0000080000000000, 0.0000046200000000, 0.0032267700000000 ] - [ 0.0000000000000000, -0.0003799400000000, 0.0019395100000000 ] - [ 0.0003290400000000, 0.0001899700000000, 0.0019395100000000 ] - [ 0.0000000000000000, 0.0004323300000000, 0.0026859500000000 ] - [ -0.0003290400000000, 0.0001899700000000, 0.0019395100000000 ] - [ 0.0000000000000000, -0.0000092300000000, 0.0032267700000000 ] - [ 0.0003744100000000, -0.0002161600000000, 0.0026859500000000 ] - [ -0.0003744100000000, -0.0002161600000000, 0.0026859500000000 ] - [ -0.0036012000000000, -0.0020791600000000, -0.0074292200000000 ] - [ 0.0036012000000000, -0.0020791600000000, -0.0074292200000000 ] - [ 0.0000000000000000, -0.0003335200000000, -0.0012234600000000 ] - [ 0.0005750500000000, -0.0003320000000000, -0.0013032400000000 ] - [ 0.0000000000000000, 0.0041583100000000, -0.0074292200000000 ] - [ -0.0005750500000000, -0.0003320000000000, -0.0013032400000000 ] - [ 0.0000000000000000, 0.0006640100000000, -0.0013032400000000 ] - [ 0.0002888400000000, 0.0001667600000000, -0.0012234600000000 ] - [ -0.0002888400000000, 0.0001667600000000, -0.0012234600000000 ] - [ -0.0012017600000000, -0.0006938300000000, 0.0031390200000000 ] - [ 0.0012017600000000, -0.0006938300000000, 0.0031390200000000 ] - [ 0.0000000000000000, -0.0001125900000000, 0.0008184000000000 ] - [ -0.0007897500000000, 0.0004559600000000, 0.0017663700000000 ] - [ 0.0000000000000000, 0.0013876700000000, 0.0031390200000000 ] - [ 0.0007897500000000, 0.0004559600000000, 0.0017663700000000 ] - [ 0.0000000000000000, -0.0009119300000000, 0.0017663700000000 ] - [ 0.0000975000000000, 0.0000562900000000, 0.0008184000000000 ] - [ -0.0000975000000000, 0.0000562900000000, 0.0008184000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.1103336000000000 ] - [ -0.0014083700000000, 0.0030948600000000, 0.0021395500000000 ] - [ 0.0014083700000000, 0.0030948600000000, 0.0021395500000000 ] - [ -0.0019760500000000, -0.0027671200000000, 0.0021395500000000 ] - [ 0.0019760500000000, -0.0027671200000000, 0.0021395500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0028984100000000 ] - [ -0.0033844200000000, -0.0003277500000000, 0.0021395500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0029040200000000 ] - [ 0.0033844200000000, -0.0003277500000000, 0.0021395500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0105296100000000 ] - [ -0.0003372500000000, 0.0000030600000000, -0.0088749100000000 ] - [ 0.0003372500000000, 0.0000030600000000, -0.0088749100000000 ] - [ 0.0001659700000000, -0.0002935900000000, -0.0088749100000000 ] - [ -0.0001659700000000, -0.0002935900000000, -0.0088749100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0079847500000000 ] - [ -0.0001712700000000, 0.0002905300000000, -0.0088749100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0079817200000000 ] - [ 0.0001712700000000, 0.0002905300000000, -0.0088749100000000 ] - [ 0.0190752900000000, -0.0110131200000000, -0.0073588400000000 ] - [ -0.0190752900000000, -0.0110131200000000, -0.0073588400000000 ] - [ 0.0000000000000000, -0.0005736500000000, 0.0060891600000000 ] - [ 0.0004968000000000, 0.0002868300000000, 0.0060891600000000 ] - [ 0.0000000000000000, -0.0022032300000000, 0.0061340900000000 ] - [ -0.0004968000000000, 0.0002868300000000, 0.0060891600000000 ] - [ 0.0000000000000000, 0.0220262500000000, -0.0073588400000000 ] - [ -0.0019080600000000, 0.0011016200000000, 0.0061340900000000 ] - [ 0.0019080600000000, 0.0011016200000000, 0.0061340900000000 ] - [ -0.0036476000000000, 0.0021059400000000, -0.0011279200000000 ] - [ 0.0036476000000000, 0.0021059400000000, -0.0011279200000000 ] - [ 0.0000000000000000, 0.0009062000000000, 0.0044662300000000 ] - [ -0.0007847900000000, -0.0004531000000000, 0.0044662300000000 ] - [ 0.0000000000000000, 0.0026961000000000, 0.0015527100000000 ] - [ 0.0007847900000000, -0.0004531000000000, 0.0044662300000000 ] - [ 0.0000000000000000, -0.0042118900000000, -0.0011279200000000 ] - [ 0.0023348900000000, -0.0013480500000000, 0.0015527100000000 ] - [ -0.0023348900000000, -0.0013480500000000, 0.0015527100000000 ]