# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/1ac4d1a0-e5fc-4d4d-acbc-7f4c6b66cdc1/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 RbTeAu / Pmma (51) / materials id 9008](https://mdr.nims.go.jp/datasets/660152eb-8a54-4659-8648-b341f12a87eb) ## 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: "Pmma" number: 51 Hall_symbol: "-P 2a 2a"supercell_matrix:- [ 3, 0, 0 ]- [ 0, 3, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 5.825597350000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 5.128023080000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 7.167144430000000 ] # c points: - symbol: Rb # 1 coordinates: [ 0.250000000000000, 0.500000000000000, 0.711084980000000 ] mass: 85.467800 - symbol: Rb # 2 coordinates: [ 0.750000000000000, 0.500000000000000, 0.288915020000000 ] mass: 85.467800 - symbol: Te # 3 coordinates: [ 0.250000000000000, 0.000000000000000, 0.303179570000000 ] mass: 127.600000 - symbol: Te # 4 coordinates: [ 0.750000000000000, 0.000000000000000, 0.696820430000000 ] mass: 127.600000 - symbol: Au # 5 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 - symbol: Au # 6 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reciprocal_lattice: # without 2pi - [ 0.171656216507995, 0.000000000000000, 0.000000000000000 ] # a* - [ 0.000000000000000, 0.195006922628749, 0.000000000000000 ] # b* - [ 0.000000000000000, 0.000000000000000, 0.139525582296658 ] # c*unit_cell: lattice: - [ 5.825597350000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 5.128023080000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 7.167144430000000 ] # c points: - symbol: Rb # 1 coordinates: [ 0.250000000000000, 0.500000000000000, 0.711084980000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 2 coordinates: [ 0.750000000000000, 0.500000000000000, 0.288915020000000 ] mass: 85.467800 reduced_to: 2 - symbol: Te # 3 coordinates: [ 0.250000000000000, 0.000000000000000, 0.303179570000000 ] mass: 127.600000 reduced_to: 3 - symbol: Te # 4 coordinates: [ 0.750000000000000, 0.000000000000000, 0.696820430000000 ] mass: 127.600000 reduced_to: 4 - symbol: Au # 5 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 5 - symbol: Au # 6 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 6supercell: lattice: - [ 17.476792050000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 15.384069240000001, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 14.334288859999999 ] # c points: - symbol: Rb # 1 coordinates: [ 0.083333333333333, 0.166666666666667, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 2 coordinates: [ 0.416666666666667, 0.166666666666667, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 3 coordinates: [ 0.750000000000000, 0.166666666666667, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 4 coordinates: [ 0.083333333333333, 0.500000000000000, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 5 coordinates: [ 0.416666666666667, 0.500000000000000, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 6 coordinates: [ 0.750000000000000, 0.500000000000000, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 7 coordinates: [ 0.083333333333333, 0.833333333333333, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 8 coordinates: [ 0.416666666666667, 0.833333333333333, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 9 coordinates: [ 0.750000000000000, 0.833333333333333, 0.355542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 10 coordinates: [ 0.083333333333333, 0.166666666666667, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 11 coordinates: [ 0.416666666666667, 0.166666666666667, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 12 coordinates: [ 0.750000000000000, 0.166666666666667, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 13 coordinates: [ 0.083333333333333, 0.500000000000000, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 14 coordinates: [ 0.416666666666667, 0.500000000000000, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 15 coordinates: [ 0.750000000000000, 0.500000000000000, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 16 coordinates: [ 0.083333333333333, 0.833333333333333, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 17 coordinates: [ 0.416666666666667, 0.833333333333333, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 18 coordinates: [ 0.750000000000000, 0.833333333333333, 0.855542490000000 ] mass: 85.467800 reduced_to: 1 - symbol: Rb # 19 coordinates: [ 0.250000000000000, 0.166666666666667, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 20 coordinates: [ 0.583333333333333, 0.166666666666667, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 21 coordinates: [ 0.916666666666667, 0.166666666666667, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 22 coordinates: [ 0.250000000000000, 0.500000000000000, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 23 coordinates: [ 0.583333333333333, 0.500000000000000, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 24 coordinates: [ 0.916666666666667, 0.500000000000000, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 25 coordinates: [ 0.250000000000000, 0.833333333333333, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 26 coordinates: [ 0.583333333333333, 0.833333333333333, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 27 coordinates: [ 0.916666666666667, 0.833333333333333, 0.144457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 28 coordinates: [ 0.250000000000000, 0.166666666666667, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 29 coordinates: [ 0.583333333333333, 0.166666666666667, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 30 coordinates: [ 0.916666666666667, 0.166666666666667, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 31 coordinates: [ 0.250000000000000, 0.500000000000000, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 32 coordinates: [ 0.583333333333333, 0.500000000000000, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 33 coordinates: [ 0.916666666666667, 0.500000000000000, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 34 coordinates: [ 0.250000000000000, 0.833333333333333, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 35 coordinates: [ 0.583333333333333, 0.833333333333333, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Rb # 36 coordinates: [ 0.916666666666667, 0.833333333333333, 0.644457510000000 ] mass: 85.467800 reduced_to: 19 - symbol: Te # 37 coordinates: [ 0.083333333333333, 0.000000000000000, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 38 coordinates: [ 0.416666666666667, 0.000000000000000, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 39 coordinates: [ 0.750000000000000, 0.000000000000000, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 40 coordinates: [ 0.083333333333333, 0.333333333333333, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 41 coordinates: [ 0.416666666666667, 0.333333333333333, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 42 coordinates: [ 0.750000000000000, 0.333333333333333, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 43 coordinates: [ 0.083333333333333, 0.666666666666667, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 44 coordinates: [ 0.416666666666667, 0.666666666666667, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 45 coordinates: [ 0.750000000000000, 0.666666666666667, 0.151589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 46 coordinates: [ 0.083333333333333, 0.000000000000000, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 47 coordinates: [ 0.416666666666667, 0.000000000000000, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 48 coordinates: [ 0.750000000000000, 0.000000000000000, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 49 coordinates: [ 0.083333333333333, 0.333333333333333, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 50 coordinates: [ 0.416666666666667, 0.333333333333333, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 51 coordinates: [ 0.750000000000000, 0.333333333333333, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 52 coordinates: [ 0.083333333333333, 0.666666666666667, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 53 coordinates: [ 0.416666666666667, 0.666666666666667, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 54 coordinates: [ 0.750000000000000, 0.666666666666667, 0.651589785000000 ] mass: 127.600000 reduced_to: 37 - symbol: Te # 55 coordinates: [ 0.250000000000000, 0.000000000000000, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 56 coordinates: [ 0.583333333333333, 0.000000000000000, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 57 coordinates: [ 0.916666666666667, 0.000000000000000, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 58 coordinates: [ 0.250000000000000, 0.333333333333333, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 59 coordinates: [ 0.583333333333333, 0.333333333333333, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 60 coordinates: [ 0.916666666666667, 0.333333333333333, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 61 coordinates: [ 0.250000000000000, 0.666666666666667, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 62 coordinates: [ 0.583333333333333, 0.666666666666667, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 63 coordinates: [ 0.916666666666667, 0.666666666666667, 0.348410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 64 coordinates: [ 0.250000000000000, 0.000000000000000, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 65 coordinates: [ 0.583333333333333, 0.000000000000000, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 66 coordinates: [ 0.916666666666667, 0.000000000000000, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 67 coordinates: [ 0.250000000000000, 0.333333333333333, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 68 coordinates: [ 0.583333333333333, 0.333333333333333, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 69 coordinates: [ 0.916666666666667, 0.333333333333333, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 70 coordinates: [ 0.250000000000000, 0.666666666666667, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 71 coordinates: [ 0.583333333333333, 0.666666666666667, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Te # 72 coordinates: [ 0.916666666666667, 0.666666666666667, 0.848410215000000 ] mass: 127.600000 reduced_to: 55 - symbol: Au # 73 coordinates: [ 0.166666666666667, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 74 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 75 coordinates: [ 0.833333333333333, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 76 coordinates: [ 0.166666666666667, 0.333333333333333, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 77 coordinates: [ 0.500000000000000, 0.333333333333333, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 78 coordinates: [ 0.833333333333333, 0.333333333333333, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 79 coordinates: [ 0.166666666666667, 0.666666666666667, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 80 coordinates: [ 0.500000000000000, 0.666666666666667, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 81 coordinates: [ 0.833333333333333, 0.666666666666667, 0.000000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 82 coordinates: [ 0.166666666666667, 0.000000000000000, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 83 coordinates: [ 0.500000000000000, 0.000000000000000, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 84 coordinates: [ 0.833333333333333, 0.000000000000000, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 85 coordinates: [ 0.166666666666667, 0.333333333333333, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 86 coordinates: [ 0.500000000000000, 0.333333333333333, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 87 coordinates: [ 0.833333333333333, 0.333333333333333, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 88 coordinates: [ 0.166666666666667, 0.666666666666667, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 89 coordinates: [ 0.500000000000000, 0.666666666666667, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 90 coordinates: [ 0.833333333333333, 0.666666666666667, 0.500000000000000 ] mass: 196.966569 reduced_to: 73 - symbol: Au # 91 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 92 coordinates: [ 0.333333333333333, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 93 coordinates: [ 0.666666666666667, 0.000000000000000, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 94 coordinates: [ 0.000000000000000, 0.333333333333333, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 95 coordinates: [ 0.333333333333333, 0.333333333333333, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 96 coordinates: [ 0.666666666666667, 0.333333333333333, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 97 coordinates: [ 0.000000000000000, 0.666666666666667, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 98 coordinates: [ 0.333333333333333, 0.666666666666667, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 99 coordinates: [ 0.666666666666667, 0.666666666666667, 0.000000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 100 coordinates: [ 0.000000000000000, 0.000000000000000, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 101 coordinates: [ 0.333333333333333, 0.000000000000000, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 102 coordinates: [ 0.666666666666667, 0.000000000000000, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 103 coordinates: [ 0.000000000000000, 0.333333333333333, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 104 coordinates: [ 0.333333333333333, 0.333333333333333, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 105 coordinates: [ 0.666666666666667, 0.333333333333333, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 106 coordinates: [ 0.000000000000000, 0.666666666666667, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 107 coordinates: [ 0.333333333333333, 0.666666666666667, 0.500000000000000 ] mass: 196.966569 reduced_to: 91 - symbol: Au # 108 coordinates: [ 0.666666666666667, 0.666666666666667, 0.500000000000000 ] mass: 196.966569 reduced_to: 91born_effective_charge:- # 1 (Rb) - [ 1.482622040000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 1.426065600000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.339366980000000 ]- # 2 (Rb) - [ 1.482622040000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 1.426065600000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.339366980000000 ]- # 3 (Te) - [ -2.800906350000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -0.891343130000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -2.363934110000000 ]- # 4 (Te) - [ -2.800906350000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, -0.891343130000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, -2.363934110000000 ]- # 5 (Au) - [ 1.318284310000000, 0.000000000000000, -2.342090860000000 ] - [ 0.000000000000000, -0.534722470000000, 0.000000000000000 ] - [ -0.354516910000000, 0.000000000000000, 1.024567130000000 ]- # 6 (Au) - [ 1.318284310000000, 0.000000000000000, 2.342090860000000 ] - [ 0.000000000000000, -0.534722470000000, 0.000000000000000 ] - [ 0.354516910000000, 0.000000000000000, 1.024567130000000 ]dielectric_constant: - [ 17.439398180000001, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 3.840847700000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 7.897937330000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0109655000000000, 0.0000000000000000, -0.0048301300000000 ] - [ 0.0004036800000000, 0.0000000000000000, -0.0048609800000000 ] - [ 0.0004020300000000, 0.0000000000000000, -0.0047792200000000 ] - [ -0.0003911300000000, -0.0000005400000000, -0.0048201100000000 ] - [ 0.0001550400000000, 0.0000787700000000, -0.0048533500000000 ] - [ 0.0001571600000000, -0.0000787900000000, -0.0047870700000000 ] - [ -0.0003911300000000, 0.0000005400000000, -0.0048201100000000 ] - [ 0.0001550400000000, -0.0000787700000000, -0.0048533500000000 ] - [ 0.0001571600000000, 0.0000787900000000, -0.0047870700000000 ] - [ -0.0000182900000000, 0.0000000000000000, -0.0048192900000000 ] - [ 0.0000110300000000, 0.0000000000000000, -0.0047821700000000 ] - [ 0.0000132700000000, 0.0000000000000000, -0.0048578600000000 ] - [ -0.0000077700000000, -0.0000000300000000, -0.0048194600000000 ] - [ 0.0000085700000000, 0.0000214200000000, -0.0047974600000000 ] - [ 0.0000112100000000, -0.0000209600000000, -0.0048426100000000 ] - [ -0.0000077700000000, 0.0000000300000000, -0.0048194600000000 ] - [ 0.0000085700000000, -0.0000214200000000, -0.0047974600000000 ] - [ 0.0000112100000000, 0.0000209600000000, -0.0048426100000000 ] - [ 0.0009067100000000, 0.0000000000000000, 0.0033280100000000 ] - [ 0.0000699600000000, 0.0000000000000000, 0.0048196700000000 ] - [ 0.0009013800000000, 0.0000000000000000, 0.0062998700000000 ] - [ -0.0000272600000000, 0.0000622400000000, 0.0046930900000000 ] - [ 0.0000513800000000, 0.0000000200000000, 0.0048197200000000 ] - [ -0.0000291500000000, -0.0000624600000000, 0.0049468500000000 ] - [ -0.0000272600000000, -0.0000622400000000, 0.0046930900000000 ] - [ 0.0000513800000000, -0.0000000200000000, 0.0048197200000000 ] - [ -0.0000291500000000, 0.0000624600000000, 0.0049468500000000 ] - [ 0.0001529200000000, 0.0000000000000000, 0.0053773400000000 ] - [ 0.0001411400000000, 0.0000000000000000, 0.0048197100000000 ] - [ 0.0001500200000000, 0.0000000000000000, 0.0042663900000000 ] - [ -0.0000176900000000, 0.0000988700000000, 0.0049689800000000 ] - [ 0.0000933900000000, 0.0000000600000000, 0.0048197200000000 ] - [ -0.0000199400000000, -0.0000988600000000, 0.0046713000000000 ] - [ -0.0000176900000000, -0.0000988700000000, 0.0049689800000000 ] - [ 0.0000933900000000, -0.0000000600000000, 0.0048197200000000 ] - [ -0.0000199400000000, 0.0000988600000000, 0.0046713000000000 ] - [ 0.0003648100000000, 0.0000021300000000, 0.0344078600000000 ] - [ -0.0000917300000000, 0.0000341000000000, 0.0345465700000000 ] - [ -0.0000850500000000, -0.0000339600000000, 0.0342660100000000 ] - [ 0.0003648100000000, -0.0000021300000000, 0.0344078600000000 ] - [ -0.0000917300000000, -0.0000341000000000, 0.0345465700000000 ] - [ -0.0000850500000000, 0.0000339600000000, 0.0342660100000000 ] - [ 0.0000461000000000, 0.0000000000000000, 0.0344061600000000 ] - [ -0.0000296600000000, 0.0000000000000000, 0.0344458800000000 ] - [ -0.0000232400000000, 0.0000000000000000, 0.0343664600000000 ] - [ 0.0003503900000000, -0.0000001900000000, 0.0344049500000000 ] - [ -0.0001997300000000, -0.0000287500000000, 0.0342496800000000 ] - [ -0.0001930000000000, 0.0000292300000000, 0.0345624300000000 ] - [ 0.0003503900000000, 0.0000001900000000, 0.0344049500000000 ] - [ -0.0001997300000000, 0.0000287500000000, 0.0342496800000000 ] - [ -0.0001930000000000, -0.0000292300000000, 0.0345624300000000 ] - [ 0.0000815400000000, 0.0000000000000000, 0.0344061000000000 ] - [ -0.0000438300000000, 0.0000000000000000, 0.0344170300000000 ] - [ -0.0000373600000000, 0.0000000000000000, 0.0343953500000000 ] - [ 0.0016811700000000, -0.0011132100000000, -0.0353021600000000 ] - [ -0.0001614500000000, 0.0000001300000000, -0.0344061000000000 ] - [ 0.0016246700000000, 0.0010649700000000, -0.0335143000000000 ] - [ 0.0016811700000000, 0.0011132100000000, -0.0353021600000000 ] - [ -0.0001614500000000, -0.0000001300000000, -0.0344061000000000 ] - [ 0.0016246700000000, -0.0010649700000000, -0.0335143000000000 ] - [ 0.0000391100000000, 0.0000000000000000, -0.0344444100000000 ] - [ -0.0000724600000000, 0.0000000000000000, -0.0344060500000000 ] - [ 0.0000329200000000, 0.0000000000000000, -0.0343676600000000 ] - [ 0.0000645900000000, 0.0000395900000000, -0.0344616900000000 ] - [ -0.0001289300000000, -0.0000000600000000, -0.0344061700000000 ] - [ 0.0000571900000000, -0.0000393700000000, -0.0343516300000000 ] - [ 0.0000645900000000, -0.0000395900000000, -0.0344616900000000 ] - [ -0.0001289300000000, 0.0000000600000000, -0.0344061700000000 ] - [ 0.0000571900000000, 0.0000393700000000, -0.0343516300000000 ] - [ 0.0000189100000000, 0.0000000000000000, -0.0344306500000000 ] - [ -0.0000317200000000, 0.0000000000000000, -0.0344060900000000 ] - [ 0.0000123400000000, 0.0000000000000000, -0.0343818800000000 ] - [ -0.0000508700000000, -0.0001394600000000, 0.0001321000000000 ] - [ 0.0000118700000000, 0.0000126600000000, -0.0001148800000000 ] - [ 0.0000393200000000, -0.0000379400000000, 0.0000238600000000 ] - [ -0.0000508700000000, 0.0001394600000000, 0.0001321000000000 ] - [ 0.0000118700000000, -0.0000126600000000, -0.0001148800000000 ] - [ 0.0000393200000000, 0.0000379400000000, 0.0000238600000000 ] - [ -0.0000508600000000, 0.0000000000000000, 0.0000318200000000 ] - [ 0.0000091100000000, 0.0000000000000000, -0.0000341100000000 ] - [ 0.0000424600000000, 0.0000000000000000, 0.0000019800000000 ] - [ -0.0000413300000000, -0.0011229000000000, 0.0017453500000000 ] - [ 0.0000501000000000, -0.0000008500000000, -0.0001542000000000 ] - [ 0.0003138100000000, -0.0002651200000000, -0.0004261600000000 ] - [ -0.0000413300000000, 0.0011229000000000, 0.0017453500000000 ] - [ 0.0000501000000000, 0.0000008500000000, -0.0001542000000000 ] - [ 0.0003138100000000, 0.0002651200000000, -0.0004261600000000 ] - [ -0.0000780700000000, 0.0000000000000000, 0.0000781600000000 ] - [ 0.0000132800000000, 0.0000000000000000, -0.0000517100000000 ] - [ 0.0000646400000000, 0.0000000000000000, -0.0000271100000000 ] - [ -0.0000027200000000, 0.0001387000000000, -0.0001300500000000 ] - [ 0.0000390700000000, 0.0000382500000000, -0.0000240100000000 ] - [ -0.0000350400000000, -0.0000123300000000, 0.0001137300000000 ] - [ -0.0000027200000000, -0.0001387000000000, -0.0001300500000000 ] - [ 0.0000390700000000, -0.0000382500000000, -0.0000240100000000 ] - [ -0.0000350400000000, 0.0000123300000000, 0.0001137300000000 ] - [ -0.0000039200000000, 0.0000000000000000, -0.0000305400000000 ] - [ 0.0000424500000000, 0.0000000000000000, -0.0000020200000000 ] - [ -0.0000377900000000, 0.0000000000000000, 0.0000329600000000 ] - [ 0.0000098400000000, 0.0011115700000000, -0.0017308700000000 ] - [ 0.0003150600000000, 0.0002644800000000, 0.0004261700000000 ] - [ 0.0000031000000000, 0.0000009100000000, 0.0001530600000000 ] - [ 0.0000098400000000, -0.0011115700000000, -0.0017308700000000 ] - [ 0.0003150600000000, -0.0002644800000000, 0.0004261700000000 ] - [ 0.0000031000000000, -0.0000009100000000, 0.0001530600000000 ] - [ -0.0000311700000000, 0.0000000000000000, -0.0000770300000000 ] - [ 0.0000646600000000, 0.0000000000000000, 0.0000272300000000 ] - [ -0.0000336400000000, 0.0000000000000000, 0.0000505000000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ 0.0000000000000000, -0.0158157000000000, -0.0048787300000000 ] - [ -0.0000014300000000, -0.0005277300000000, -0.0048199800000000 ] - [ 0.0000014300000000, -0.0005277300000000, -0.0048199800000000 ] - [ 0.0000000000000000, 0.0009139300000000, -0.0048949800000000 ] - [ 0.0000774900000000, 0.0002546900000000, -0.0048476300000000 ] - [ -0.0000774900000000, 0.0002546900000000, -0.0048476300000000 ] - [ 0.0000000000000000, 0.0009049500000000, -0.0047442800000000 ] - [ -0.0000800700000000, 0.0002548200000000, -0.0047927100000000 ] - [ 0.0000800700000000, 0.0002548200000000, -0.0047927100000000 ] - [ 0.0000000000000000, -0.0005544200000000, -0.0048196800000000 ] - [ -0.0000010900000000, -0.0003892900000000, -0.0048200200000000 ] - [ 0.0000010900000000, -0.0003892900000000, -0.0048200200000000 ] - [ 0.0000000000000000, 0.0002971600000000, -0.0047909800000000 ] - [ 0.0000199400000000, 0.0001910200000000, -0.0047936600000000 ] - [ -0.0000199400000000, 0.0001910200000000, -0.0047936600000000 ] - [ 0.0000000000000000, 0.0002967700000000, -0.0048481900000000 ] - [ -0.0000224500000000, 0.0001904100000000, -0.0048464200000000 ] - [ 0.0000224500000000, 0.0001904100000000, -0.0048464200000000 ] - [ -0.0000019100000000, -0.0008395700000000, 0.0048231300000000 ] - [ 0.0000000000000000, -0.0003323500000000, 0.0048197500000000 ] - [ 0.0000019100000000, -0.0008395700000000, 0.0048231300000000 ] - [ 0.0000634600000000, 0.0002628500000000, 0.0047606300000000 ] - [ 0.0000000000000000, 0.0001668600000000, 0.0048077000000000 ] - [ -0.0000634600000000, 0.0002628500000000, 0.0047606300000000 ] - [ -0.0000612400000000, 0.0002629000000000, 0.0048799100000000 ] - [ 0.0000000000000000, 0.0001667000000000, 0.0048318800000000 ] - [ 0.0000612400000000, 0.0002629000000000, 0.0048799100000000 ] - [ 0.0000008000000000, -0.0007314100000000, 0.0048194700000000 ] - [ 0.0000000000000000, -0.0004230900000000, 0.0048196500000000 ] - [ -0.0000008000000000, -0.0007314100000000, 0.0048194700000000 ] - [ 0.0000999100000000, 0.0003867400000000, 0.0049343000000000 ] - [ 0.0000000000000000, 0.0002105700000000, 0.0048279700000000 ] - [ -0.0000999100000000, 0.0003867400000000, 0.0049343000000000 ] - [ -0.0000978200000000, 0.0003864800000000, 0.0047056300000000 ] - [ 0.0000000000000000, 0.0002104100000000, 0.0048113800000000 ] - [ 0.0000978200000000, 0.0003864800000000, 0.0047056300000000 ] - [ 0.0000000000000000, 0.0013628000000000, 0.0353066400000000 ] - [ 0.0000749300000000, 0.0000536400000000, 0.0344344900000000 ] - [ -0.0000749300000000, 0.0000536400000000, 0.0344344900000000 ] - [ 0.0000000000000000, 0.0013839600000000, 0.0334657400000000 ] - [ -0.0000813400000000, 0.0000538400000000, 0.0343776000000000 ] - [ 0.0000813400000000, 0.0000538400000000, 0.0343776000000000 ] - [ 0.0000000000000000, -0.0002040700000000, 0.0344060800000000 ] - [ -0.0000032200000000, -0.0001004800000000, 0.0344061100000000 ] - [ 0.0000032200000000, -0.0001004800000000, 0.0344061100000000 ] - [ 0.0000000000000000, 0.0000064400000000, 0.0343522600000000 ] - [ 0.0002234400000000, 0.0001055300000000, 0.0347112400000000 ] - [ -0.0002234400000000, 0.0001055300000000, 0.0347112400000000 ] - [ 0.0000000000000000, 0.0000078500000000, 0.0344651200000000 ] - [ -0.0002310500000000, 0.0001053200000000, 0.0341005000000000 ] - [ 0.0002310500000000, 0.0001053200000000, 0.0341005000000000 ] - [ 0.0000000000000000, -0.0002195000000000, 0.0344061200000000 ] - [ -0.0000032700000000, -0.0001262900000000, 0.0344062300000000 ] - [ 0.0000032700000000, -0.0001262900000000, 0.0344062300000000 ] - [ -0.0014585300000000, 0.0014365200000000, -0.0337802000000000 ] - [ 0.0000000000000000, 0.0000499100000000, -0.0346142100000000 ] - [ 0.0014585300000000, 0.0014365200000000, -0.0337802000000000 ] - [ 0.0015128900000000, 0.0014687600000000, -0.0350348800000000 ] - [ 0.0000000000000000, 0.0000496600000000, -0.0341974800000000 ] - [ -0.0015128900000000, 0.0014687600000000, -0.0350348800000000 ] - [ 0.0000030200000000, -0.0002454300000000, -0.0344061100000000 ] - [ 0.0000000000000000, -0.0001089100000000, -0.0344060100000000 ] - [ -0.0000030200000000, -0.0002454300000000, -0.0344061100000000 ] - [ 0.0002158600000000, 0.0000772500000000, -0.0346030100000000 ] - [ 0.0000000000000000, 0.0000497100000000, -0.0344692700000000 ] - [ -0.0002158600000000, 0.0000772500000000, -0.0346030100000000 ] - [ -0.0002097800000000, 0.0000762800000000, -0.0342091700000000 ] - [ 0.0000000000000000, 0.0000499100000000, -0.0343431400000000 ] - [ 0.0002097800000000, 0.0000762800000000, -0.0342091700000000 ] - [ 0.0000032500000000, -0.0001215100000000, -0.0344062500000000 ] - [ 0.0000000000000000, -0.0000848000000000, -0.0344060800000000 ] - [ -0.0000032500000000, -0.0001215100000000, -0.0344062500000000 ] - [ -0.0002419000000000, -0.0000658300000000, 0.0002711900000000 ] - [ 0.0000179400000000, 0.0000253100000000, 0.0000455000000000 ] - [ 0.0000187800000000, 0.0000502600000000, -0.0000965800000000 ] - [ 0.0001944500000000, -0.0000622100000000, -0.0002704000000000 ] - [ 0.0000287900000000, 0.0000250200000000, -0.0000466700000000 ] - [ -0.0000187100000000, 0.0000503200000000, 0.0000970100000000 ] - [ -0.0000234700000000, -0.0001129400000000, 0.0000006200000000 ] - [ 0.0000234400000000, -0.0000681700000000, -0.0000005600000000 ] - [ -0.0000000200000000, -0.0000848300000000, 0.0000000200000000 ] - [ -0.0009898500000000, 0.0020129100000000, -0.0018479800000000 ] - [ 0.0000118600000000, 0.0000434700000000, 0.0001074600000000 ] - [ 0.0002364200000000, -0.0001206000000000, -0.0004898100000000 ] - [ 0.0009732600000000, 0.0020573300000000, 0.0018975200000000 ] - [ 0.0000353800000000, 0.0000433000000000, -0.0001088300000000 ] - [ -0.0002381500000000, -0.0001198700000000, 0.0004887700000000 ] - [ -0.0000234500000000, -0.0001514600000000, 0.0000004800000000 ] - [ 0.0000234600000000, -0.0000819700000000, -0.0000006100000000 ] - [ 0.0000000400000000, -0.0001177600000000, 0.0000000500000000 ] - [ 0.0002419000000000, -0.0000658300000000, 0.0002711900000000 ] - [ -0.0000187800000000, 0.0000502600000000, -0.0000965800000000 ] - [ -0.0000179400000000, 0.0000253100000000, 0.0000455000000000 ] - [ -0.0001944500000000, -0.0000622100000000, -0.0002704000000000 ] - [ 0.0000187100000000, 0.0000503200000000, 0.0000970100000000 ] - [ -0.0000287900000000, 0.0000250200000000, -0.0000466700000000 ] - [ 0.0000234700000000, -0.0001129400000000, 0.0000006200000000 ] - [ 0.0000000200000000, -0.0000848300000000, 0.0000000200000000 ] - [ -0.0000234400000000, -0.0000681700000000, -0.0000005600000000 ] - [ 0.0009898500000000, 0.0020129100000000, -0.0018479800000000 ] - [ -0.0002364200000000, -0.0001206000000000, -0.0004898100000000 ] - [ -0.0000118600000000, 0.0000434700000000, 0.0001074600000000 ] - [ -0.0009732600000000, 0.0020573300000000, 0.0018975200000000 ] - [ 0.0002381500000000, -0.0001198700000000, 0.0004887700000000 ] - [ -0.0000353800000000, 0.0000433000000000, -0.0001088300000000 ] - [ 0.0000234500000000, -0.0001514600000000, 0.0000004800000000 ] - [ -0.0000000400000000, -0.0001177600000000, 0.0000000500000000 ] - [ -0.0000234600000000, -0.0000819700000000, -0.0000006100000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0150285400000000 ] - [ 0.0000399100000000, 0.0000000000000000, -0.0048948800000000 ] - [ -0.0000399100000000, 0.0000000000000000, -0.0048948800000000 ] - [ 0.0000000000000000, 0.0000749300000000, -0.0051528000000000 ] - [ 0.0000322700000000, 0.0000273400000000, -0.0048505900000000 ] - [ -0.0000322700000000, 0.0000273400000000, -0.0048505900000000 ] - [ 0.0000000000000000, -0.0000749300000000, -0.0051528000000000 ] - [ 0.0000322700000000, -0.0000273400000000, -0.0048505900000000 ] - [ -0.0000322700000000, -0.0000273400000000, -0.0048505900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0044809800000000 ] - [ -0.0000384300000000, 0.0000000000000000, -0.0047782100000000 ] - [ 0.0000384300000000, 0.0000000000000000, -0.0047782100000000 ] - [ 0.0000000000000000, -0.0000285000000000, -0.0045892500000000 ] - [ -0.0000234400000000, -0.0000261100000000, -0.0047871900000000 ] - [ 0.0000234400000000, -0.0000261100000000, -0.0047871900000000 ] - [ 0.0000000000000000, 0.0000285000000000, -0.0045892500000000 ] - [ -0.0000234400000000, 0.0000261100000000, -0.0047871900000000 ] - [ 0.0000234400000000, 0.0000261100000000, -0.0047871900000000 ] - [ -0.0014778500000000, 0.0000000000000000, 0.0057065000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0048006300000000 ] - [ 0.0014778500000000, 0.0000000000000000, 0.0057065000000000 ] - [ -0.0001259400000000, -0.0000595700000000, 0.0047373200000000 ] - [ 0.0000000000000000, -0.0000120600000000, 0.0048042900000000 ] - [ 0.0001259400000000, -0.0000595700000000, 0.0047373200000000 ] - [ -0.0001259400000000, 0.0000595700000000, 0.0047373200000000 ] - [ 0.0000000000000000, 0.0000120600000000, 0.0048042900000000 ] - [ 0.0001259400000000, 0.0000595700000000, 0.0047373200000000 ] - [ 0.0005589000000000, 0.0000000000000000, 0.0053939700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0048546400000000 ] - [ -0.0005589000000000, 0.0000000000000000, 0.0053939700000000 ] - [ 0.0001496000000000, 0.0001141800000000, 0.0049467600000000 ] - [ 0.0000000000000000, 0.0000082400000000, 0.0048371000000000 ] - [ -0.0001496000000000, 0.0001141800000000, 0.0049467600000000 ] - [ 0.0001496000000000, -0.0001141800000000, 0.0049467600000000 ] - [ 0.0000000000000000, -0.0000082400000000, 0.0048371000000000 ] - [ -0.0001496000000000, -0.0001141800000000, 0.0049467600000000 ] - [ 0.0000000000000000, 0.0009041800000000, 0.0352137100000000 ] - [ 0.0000394100000000, -0.0000348400000000, 0.0344652800000000 ] - [ -0.0000394100000000, -0.0000348400000000, 0.0344652800000000 ] - [ 0.0000000000000000, -0.0009041800000000, 0.0352137100000000 ] - [ 0.0000394100000000, 0.0000348400000000, 0.0344652800000000 ] - [ -0.0000394100000000, 0.0000348400000000, 0.0344652800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0344128000000000 ] - [ 0.0000094300000000, 0.0000000000000000, 0.0344146400000000 ] - [ -0.0000094300000000, 0.0000000000000000, 0.0344146400000000 ] - [ 0.0000000000000000, 0.0003864000000000, 0.0346189100000000 ] - [ -0.0000362600000000, 0.0000442200000000, 0.0343654100000000 ] - [ 0.0000362600000000, 0.0000442200000000, 0.0343654100000000 ] - [ 0.0000000000000000, -0.0003864000000000, 0.0346189100000000 ] - [ -0.0000362600000000, -0.0000442200000000, 0.0343654100000000 ] - [ 0.0000362600000000, -0.0000442200000000, 0.0343654100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0344215800000000 ] - [ -0.0000233500000000, 0.0000000000000000, 0.0343968600000000 ] - [ 0.0000233500000000, 0.0000000000000000, 0.0343968600000000 ] - [ 0.0001059100000000, 0.0000204700000000, -0.0341086000000000 ] - [ 0.0000000000000000, 0.0000026600000000, -0.0343539000000000 ] - [ -0.0001059100000000, 0.0000204700000000, -0.0341086000000000 ] - [ 0.0001059100000000, -0.0000204700000000, -0.0341086000000000 ] - [ 0.0000000000000000, -0.0000026600000000, -0.0343539000000000 ] - [ -0.0001059100000000, -0.0000204700000000, -0.0341086000000000 ] - [ -0.0000147600000000, 0.0000000000000000, -0.0343690500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0343863600000000 ] - [ 0.0000147600000000, 0.0000000000000000, -0.0343690500000000 ] - [ 0.0001207300000000, 0.0000127800000000, -0.0347242700000000 ] - [ 0.0000000000000000, 0.0000003100000000, -0.0344435500000000 ] - [ -0.0001207300000000, 0.0000127800000000, -0.0347242700000000 ] - [ 0.0001207300000000, -0.0000127800000000, -0.0347242700000000 ] - [ 0.0000000000000000, -0.0000003100000000, -0.0344435500000000 ] - [ -0.0001207300000000, -0.0000127800000000, -0.0347242700000000 ] - [ 0.0000102900000000, 0.0000000000000000, -0.0344569100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0344225600000000 ] - [ -0.0000102900000000, 0.0000000000000000, -0.0344569100000000 ] - [ -0.0002258400000000, -0.0001791700000000, 0.0003918000000000 ] - [ 0.0000076400000000, -0.0000077500000000, 0.0000105200000000 ] - [ 0.0000025700000000, -0.0000274800000000, -0.0000495700000000 ] - [ -0.0002258400000000, 0.0001791700000000, 0.0003918000000000 ] - [ 0.0000076400000000, 0.0000077500000000, 0.0000105200000000 ] - [ 0.0000025700000000, 0.0000274800000000, -0.0000495700000000 ] - [ -0.0000465200000000, 0.0000000000000000, 0.0000299300000000 ] - [ 0.0000198700000000, 0.0000000000000000, 0.0000056200000000 ] - [ -0.0000014200000000, 0.0000000000000000, -0.0000054900000000 ] - [ 0.0011053700000000, -0.0015618500000000, 0.0009121800000000 ] - [ 0.0000643100000000, -0.0000005300000000, -0.0000056300000000 ] - [ -0.0001641800000000, -0.0001105000000000, -0.0000237500000000 ] - [ 0.0011053700000000, 0.0015618500000000, 0.0009121800000000 ] - [ 0.0000643100000000, 0.0000005300000000, -0.0000056300000000 ] - [ -0.0001641800000000, 0.0001105000000000, -0.0000237500000000 ] - [ -0.0000041800000000, 0.0000000000000000, -0.0000266800000000 ] - [ 0.0000277100000000, 0.0000000000000000, -0.0000090100000000 ] - [ -0.0000024900000000, 0.0000000000000000, 0.0000132100000000 ] - [ 0.0002258400000000, -0.0001791700000000, 0.0003918000000000 ] - [ -0.0000025700000000, -0.0000274800000000, -0.0000495700000000 ] - [ -0.0000076400000000, -0.0000077500000000, 0.0000105200000000 ] - [ 0.0002258400000000, 0.0001791700000000, 0.0003918000000000 ] - [ -0.0000025700000000, 0.0000274800000000, -0.0000495700000000 ] - [ -0.0000076400000000, 0.0000077500000000, 0.0000105200000000 ] - [ 0.0000465200000000, 0.0000000000000000, 0.0000299300000000 ] - [ 0.0000014200000000, 0.0000000000000000, -0.0000054900000000 ] - [ -0.0000198700000000, 0.0000000000000000, 0.0000056200000000 ] - [ -0.0011053700000000, -0.0015618500000000, 0.0009121800000000 ] - [ 0.0001641800000000, -0.0001105000000000, -0.0000237500000000 ] - [ -0.0000643100000000, -0.0000005300000000, -0.0000056300000000 ] - [ -0.0011053700000000, 0.0015618500000000, 0.0009121800000000 ] - [ 0.0001641800000000, 0.0001105000000000, -0.0000237500000000 ] - [ -0.0000643100000000, 0.0000005300000000, -0.0000056300000000 ] - [ 0.0000041800000000, 0.0000000000000000, -0.0000266800000000 ] - [ 0.0000024900000000, 0.0000000000000000, 0.0000132100000000 ] - [ -0.0000277100000000, 0.0000000000000000, -0.0000090100000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0054418700000000 ] - [ -0.0000425100000000, 0.0000000000000000, -0.0047448400000000 ] - [ 0.0000425100000000, 0.0000000000000000, -0.0047448400000000 ] - [ 0.0000000000000000, -0.0000757900000000, -0.0044865100000000 ] - [ -0.0000347000000000, -0.0000275700000000, -0.0047893400000000 ] - [ 0.0000347000000000, -0.0000275700000000, -0.0047893400000000 ] - [ 0.0000000000000000, 0.0000757900000000, -0.0044865100000000 ] - [ -0.0000347000000000, 0.0000275700000000, -0.0047893400000000 ] - [ 0.0000347000000000, 0.0000275700000000, -0.0047893400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0051587100000000 ] - [ 0.0000365800000000, 0.0000000000000000, -0.0048621200000000 ] - [ -0.0000365800000000, 0.0000000000000000, -0.0048621200000000 ] - [ 0.0000000000000000, 0.0000287100000000, -0.0050501800000000 ] - [ 0.0000210300000000, 0.0000266300000000, -0.0048530800000000 ] - [ -0.0000210300000000, 0.0000266300000000, -0.0048530800000000 ] - [ 0.0000000000000000, -0.0000287100000000, -0.0050501800000000 ] - [ 0.0000210300000000, -0.0000266300000000, -0.0048530800000000 ] - [ -0.0000210300000000, -0.0000266300000000, -0.0048530800000000 ] - [ 0.0014946900000000, 0.0000000000000000, 0.0039284500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0048390700000000 ] - [ -0.0014946900000000, 0.0000000000000000, 0.0039284500000000 ] - [ 0.0001285000000000, 0.0000597000000000, 0.0049032700000000 ] - [ 0.0000000000000000, 0.0000121300000000, 0.0048353000000000 ] - [ -0.0001285000000000, 0.0000597000000000, 0.0049032700000000 ] - [ 0.0001285000000000, -0.0000597000000000, 0.0049032700000000 ] - [ 0.0000000000000000, -0.0000121300000000, 0.0048353000000000 ] - [ -0.0001285000000000, -0.0000597000000000, 0.0049032700000000 ] - [ -0.0005513800000000, 0.0000000000000000, 0.0042497900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0047847900000000 ] - [ 0.0005513800000000, 0.0000000000000000, 0.0042497900000000 ] - [ -0.0001474000000000, -0.0001145100000000, 0.0046929300000000 ] - [ 0.0000000000000000, -0.0000083800000000, 0.0048022100000000 ] - [ 0.0001474000000000, -0.0001145100000000, 0.0046929300000000 ] - [ -0.0001474000000000, 0.0001145100000000, 0.0046929300000000 ] - [ 0.0000000000000000, 0.0000083800000000, 0.0048022100000000 ] - [ 0.0001474000000000, 0.0001145100000000, 0.0046929300000000 ] - [ 0.0000000000000000, -0.0009428200000000, 0.0335519000000000 ] - [ -0.0000464800000000, 0.0000352200000000, 0.0343466800000000 ] - [ 0.0000464800000000, 0.0000352200000000, 0.0343466800000000 ] - [ 0.0000000000000000, 0.0009428200000000, 0.0335519000000000 ] - [ -0.0000464800000000, -0.0000352200000000, 0.0343466800000000 ] - [ 0.0000464800000000, -0.0000352200000000, 0.0343466800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0343993500000000 ] - [ -0.0000159700000000, 0.0000000000000000, 0.0343976200000000 ] - [ 0.0000159700000000, 0.0000000000000000, 0.0343976200000000 ] - [ 0.0000000000000000, -0.0003844500000000, 0.0341989800000000 ] - [ 0.0000298400000000, -0.0000441600000000, 0.0344474500000000 ] - [ -0.0000298400000000, -0.0000441600000000, 0.0344474500000000 ] - [ 0.0000000000000000, 0.0003844500000000, 0.0341989800000000 ] - [ 0.0000298400000000, 0.0000441600000000, 0.0344474500000000 ] - [ -0.0000298400000000, 0.0000441600000000, 0.0344474500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0343908400000000 ] - [ 0.0000168000000000, 0.0000000000000000, 0.0344156200000000 ] - [ -0.0000168000000000, 0.0000000000000000, 0.0344156200000000 ] - [ -0.0001035700000000, -0.0000178600000000, -0.0347042000000000 ] - [ 0.0000000000000000, -0.0000027400000000, -0.0344584200000000 ] - [ 0.0001035700000000, -0.0000178600000000, -0.0347042000000000 ] - [ -0.0001035700000000, 0.0000178600000000, -0.0347042000000000 ] - [ 0.0000000000000000, 0.0000027400000000, -0.0344584200000000 ] - [ 0.0001035700000000, 0.0000178600000000, -0.0347042000000000 ] - [ 0.0000210800000000, 0.0000000000000000, -0.0344432900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0344258100000000 ] - [ -0.0000210800000000, 0.0000000000000000, -0.0344432900000000 ] - [ -0.0001140600000000, -0.0000118100000000, -0.0340881600000000 ] - [ 0.0000000000000000, -0.0000004200000000, -0.0343682400000000 ] - [ 0.0001140600000000, -0.0000118100000000, -0.0340881600000000 ] - [ -0.0001140600000000, 0.0000118100000000, -0.0340881600000000 ] - [ 0.0000000000000000, 0.0000004200000000, -0.0343682400000000 ] - [ 0.0001140600000000, 0.0000118100000000, -0.0340881600000000 ] - [ -0.0000038700000000, 0.0000000000000000, -0.0343554800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0343894500000000 ] - [ 0.0000038700000000, 0.0000000000000000, -0.0343554800000000 ] - [ 0.0001777800000000, 0.0001759700000000, -0.0003930200000000 ] - [ 0.0000393100000000, 0.0000078600000000, -0.0000118500000000 ] - [ -0.0000022700000000, 0.0000277600000000, 0.0000501900000000 ] - [ 0.0001777800000000, -0.0001759700000000, -0.0003930200000000 ] - [ 0.0000393100000000, -0.0000078600000000, -0.0000118500000000 ] - [ -0.0000022700000000, -0.0000277600000000, 0.0000501900000000 ] - [ -0.0000003200000000, 0.0000000000000000, -0.0000288100000000 ] - [ 0.0000272400000000, 0.0000000000000000, -0.0000076900000000 ] - [ 0.0000013900000000, 0.0000000000000000, 0.0000056000000000 ] - [ -0.0011288800000000, 0.0015287900000000, -0.0008995700000000 ] - [ -0.0000172000000000, 0.0000005400000000, 0.0000046700000000 ] - [ 0.0001642800000000, 0.0001108900000000, 0.0000224200000000 ] - [ -0.0011288800000000, -0.0015287900000000, -0.0008995700000000 ] - [ -0.0000172000000000, -0.0000005400000000, 0.0000046700000000 ] - [ 0.0001642800000000, -0.0001108900000000, 0.0000224200000000 ] - [ -0.0000426700000000, 0.0000000000000000, 0.0000277400000000 ] - [ 0.0000191800000000, 0.0000000000000000, 0.0000078200000000 ] - [ 0.0000025200000000, 0.0000000000000000, -0.0000131900000000 ] - [ -0.0001777800000000, 0.0001759700000000, -0.0003930200000000 ] - [ 0.0000022700000000, 0.0000277600000000, 0.0000501900000000 ] - [ -0.0000393100000000, 0.0000078600000000, -0.0000118500000000 ] - [ -0.0001777800000000, -0.0001759700000000, -0.0003930200000000 ] - [ 0.0000022700000000, -0.0000277600000000, 0.0000501900000000 ] - [ -0.0000393100000000, -0.0000078600000000, -0.0000118500000000 ] - [ 0.0000003200000000, 0.0000000000000000, -0.0000288100000000 ] - [ -0.0000013900000000, 0.0000000000000000, 0.0000056000000000 ] - [ -0.0000272400000000, 0.0000000000000000, -0.0000076900000000 ] - [ 0.0011288800000000, 0.0015287900000000, -0.0008995700000000 ] - [ -0.0001642800000000, 0.0001108900000000, 0.0000224200000000 ] - [ 0.0000172000000000, 0.0000005400000000, 0.0000046700000000 ] - [ 0.0011288800000000, -0.0015287900000000, -0.0008995700000000 ] - [ -0.0001642800000000, -0.0001108900000000, 0.0000224200000000 ] - [ 0.0000172000000000, -0.0000005400000000, 0.0000046700000000 ] - [ 0.0000426700000000, 0.0000000000000000, 0.0000277400000000 ] - [ -0.0000025200000000, 0.0000000000000000, -0.0000131900000000 ] - [ -0.0000191800000000, 0.0000000000000000, 0.0000078200000000 ]- atom: 37 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0003607100000000, -0.0000026600000000, -0.0048232100000000 ] - [ -0.0000873000000000, -0.0000778600000000, -0.0048628900000000 ] - [ -0.0000848300000000, 0.0000780600000000, -0.0047771900000000 ] - [ 0.0000416100000000, 0.0000000000000000, -0.0048193400000000 ] - [ -0.0000255300000000, 0.0000000000000000, -0.0048326800000000 ] - [ -0.0000235000000000, 0.0000000000000000, -0.0048075300000000 ] - [ 0.0003607100000000, 0.0000026600000000, -0.0048232100000000 ] - [ -0.0000873000000000, 0.0000778600000000, -0.0048628900000000 ] - [ -0.0000848300000000, -0.0000780600000000, -0.0047771900000000 ] - [ 0.0003452600000000, 0.0000006300000000, -0.0048209300000000 ] - [ -0.0001951700000000, -0.0002272100000000, -0.0047863300000000 ] - [ -0.0001929400000000, 0.0002269300000000, -0.0048540800000000 ] - [ 0.0000768000000000, 0.0000000000000000, -0.0048198400000000 ] - [ -0.0000389600000000, 0.0000000000000000, -0.0047989600000000 ] - [ -0.0000369700000000, 0.0000000000000000, -0.0048410300000000 ] - [ 0.0003452600000000, -0.0000006300000000, -0.0048209300000000 ] - [ -0.0001951700000000, 0.0002272100000000, -0.0047863300000000 ] - [ -0.0001929400000000, -0.0002269300000000, -0.0048540800000000 ] - [ 0.0016806600000000, 0.0015126700000000, 0.0049259000000000 ] - [ -0.0001650700000000, 0.0000001900000000, 0.0048195800000000 ] - [ 0.0016296100000000, -0.0014592000000000, 0.0047157400000000 ] - [ 0.0000391200000000, 0.0000000000000000, 0.0048026900000000 ] - [ -0.0000767200000000, 0.0000000000000000, 0.0048197000000000 ] - [ 0.0000359800000000, 0.0000000000000000, 0.0048374000000000 ] - [ 0.0016806600000000, -0.0015126700000000, 0.0049259000000000 ] - [ -0.0001650700000000, -0.0000001900000000, 0.0048195800000000 ] - [ 0.0016296100000000, 0.0014592000000000, 0.0047157400000000 ] - [ 0.0000647900000000, -0.0002127700000000, 0.0049376700000000 ] - [ -0.0001340000000000, -0.0000000700000000, 0.0048196900000000 ] - [ 0.0000623200000000, 0.0002124300000000, 0.0047023100000000 ] - [ 0.0000189900000000, 0.0000000000000000, 0.0048275900000000 ] - [ -0.0000359900000000, 0.0000000000000000, 0.0048197200000000 ] - [ 0.0000167300000000, 0.0000000000000000, 0.0048125000000000 ] - [ 0.0000647900000000, 0.0002127700000000, 0.0049376700000000 ] - [ -0.0001340000000000, 0.0000000700000000, 0.0048196900000000 ] - [ 0.0000623200000000, -0.0002124300000000, 0.0047023100000000 ] - [ -0.0552123700000000, 0.0000000000000000, 0.0352843200000000 ] - [ 0.0006554500000000, 0.0000000000000000, 0.0345046800000000 ] - [ 0.0006609500000000, 0.0000000000000000, 0.0343074600000000 ] - [ -0.0002946100000000, -0.0000017700000000, 0.0344061600000000 ] - [ 0.0001185000000000, 0.0000870400000000, 0.0343510000000000 ] - [ 0.0001243900000000, -0.0000867200000000, 0.0344610800000000 ] - [ -0.0002946100000000, 0.0000017700000000, 0.0344061600000000 ] - [ 0.0001185000000000, -0.0000870400000000, 0.0343510000000000 ] - [ 0.0001243900000000, 0.0000867200000000, 0.0344610800000000 ] - [ -0.0000935700000000, 0.0000000000000000, 0.0344065800000000 ] - [ 0.0012786600000000, 0.0000000000000000, 0.0342944000000000 ] - [ 0.0012778400000000, 0.0000000000000000, 0.0345249300000000 ] - [ -0.0000648600000000, -0.0000000200000000, 0.0344061200000000 ] - [ 0.0000378500000000, 0.0000255000000000, 0.0343765200000000 ] - [ 0.0000447400000000, -0.0000251100000000, 0.0344357700000000 ] - [ -0.0000648600000000, 0.0000000200000000, 0.0344061200000000 ] - [ 0.0000378500000000, -0.0000255000000000, 0.0343765200000000 ] - [ 0.0000447400000000, 0.0000251100000000, 0.0344357700000000 ] - [ 0.0003657500000000, 0.0000000000000000, -0.0335957900000000 ] - [ -0.0002918600000000, 0.0000000000000000, -0.0344057100000000 ] - [ 0.0003494300000000, 0.0000000000000000, -0.0352076600000000 ] - [ -0.0000173400000000, 0.0000380200000000, -0.0343123900000000 ] - [ 0.0000665300000000, -0.0000000200000000, -0.0344060100000000 ] - [ -0.0000235100000000, -0.0000383100000000, -0.0344999800000000 ] - [ -0.0000173400000000, -0.0000380200000000, -0.0343123900000000 ] - [ 0.0000665300000000, 0.0000000200000000, -0.0344060100000000 ] - [ -0.0000235100000000, 0.0000383100000000, -0.0344999800000000 ] - [ -0.0003025500000000, 0.0000000000000000, -0.0379417600000000 ] - [ 0.0002557900000000, 0.0000000000000000, -0.0344048100000000 ] - [ -0.0003370200000000, 0.0000000000000000, -0.0309216800000000 ] - [ -0.0000356600000000, 0.0000771100000000, -0.0343505300000000 ] - [ 0.0000814600000000, -0.0000000600000000, -0.0344061400000000 ] - [ -0.0000417200000000, -0.0000773800000000, -0.0344615400000000 ] - [ -0.0000356600000000, -0.0000771100000000, -0.0343505300000000 ] - [ 0.0000814600000000, 0.0000000600000000, -0.0344061400000000 ] - [ -0.0000417200000000, 0.0000773800000000, -0.0344615400000000 ] - [ 0.0214730700000000, 0.0000000000000000, -0.0274792500000000 ] - [ -0.0002449600000000, 0.0000000000000000, 0.0003110600000000 ] - [ 0.0013848900000000, 0.0000000000000000, 0.0009155800000000 ] - [ -0.0000282700000000, 0.0000329900000000, -0.0001087400000000 ] - [ -0.0000231100000000, 0.0000250400000000, 0.0000864500000000 ] - [ 0.0000575200000000, -0.0000597000000000, 0.0000165900000000 ] - [ -0.0000282700000000, -0.0000329900000000, -0.0001087400000000 ] - [ -0.0000231100000000, -0.0000250400000000, 0.0000864500000000 ] - [ 0.0000575200000000, 0.0000597000000000, 0.0000165900000000 ] - [ -0.0001219600000000, 0.0000000000000000, -0.0003587300000000 ] - [ 0.0000903100000000, 0.0000000000000000, 0.0004287400000000 ] - [ -0.0000655500000000, 0.0000000000000000, 0.0000188800000000 ] - [ -0.0000254500000000, 0.0000214800000000, -0.0000582800000000 ] - [ -0.0000143100000000, 0.0000102600000000, 0.0000457500000000 ] - [ 0.0000374600000000, -0.0000402700000000, 0.0000128700000000 ] - [ -0.0000254500000000, -0.0000214800000000, -0.0000582800000000 ] - [ -0.0000143100000000, -0.0000102600000000, 0.0000457500000000 ] - [ 0.0000374600000000, 0.0000402700000000, 0.0000128700000000 ] - [ 0.0213161800000000, 0.0000000000000000, 0.0266415700000000 ] - [ 0.0013830200000000, 0.0000000000000000, -0.0009161100000000 ] - [ -0.0002929200000000, 0.0000000000000000, -0.0003124100000000 ] - [ 0.0000182000000000, -0.0000331200000000, 0.0001092000000000 ] - [ 0.0000577600000000, 0.0000598600000000, -0.0000163800000000 ] - [ -0.0000699500000000, -0.0000249700000000, -0.0000875000000000 ] - [ 0.0000182000000000, 0.0000331200000000, 0.0001092000000000 ] - [ 0.0000577600000000, -0.0000598600000000, -0.0000163800000000 ] - [ -0.0000699500000000, 0.0000249700000000, -0.0000875000000000 ] - [ -0.0000747900000000, 0.0000000000000000, 0.0003596400000000 ] - [ -0.0000669500000000, 0.0000000000000000, -0.0000147800000000 ] - [ 0.0000460800000000, 0.0000000000000000, -0.0004314300000000 ] - [ 0.0000218500000000, -0.0000216600000000, 0.0000593600000000 ] - [ 0.0000374700000000, 0.0000403100000000, -0.0000126500000000 ] - [ -0.0000612200000000, -0.0000102700000000, -0.0000470000000000 ] - [ 0.0000218500000000, 0.0000216600000000, 0.0000593600000000 ] - [ 0.0000374700000000, -0.0000403100000000, -0.0000126500000000 ] - [ -0.0000612200000000, 0.0000102700000000, -0.0000470000000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ 0.0000000000000000, 0.0013788900000000, -0.0038794800000000 ] - [ -0.0000352500000000, 0.0000536300000000, -0.0048548600000000 ] - [ 0.0000352500000000, 0.0000536300000000, -0.0048548600000000 ] - [ 0.0000000000000000, -0.0002050200000000, -0.0048205200000000 ] - [ -0.0000011300000000, -0.0000998400000000, -0.0048201100000000 ] - [ 0.0000011300000000, -0.0000998400000000, -0.0048201100000000 ] - [ 0.0000000000000000, 0.0013674300000000, -0.0057262600000000 ] - [ 0.0000324000000000, 0.0000535800000000, -0.0047846800000000 ] - [ -0.0000324000000000, 0.0000535800000000, -0.0047846800000000 ] - [ 0.0000000000000000, 0.0000079700000000, -0.0044323300000000 ] - [ 0.0000286500000000, 0.0001057500000000, -0.0047760700000000 ] - [ -0.0000286500000000, 0.0001057500000000, -0.0047760700000000 ] - [ 0.0000000000000000, -0.0002198000000000, -0.0048193000000000 ] - [ -0.0000011700000000, -0.0001261300000000, -0.0048200800000000 ] - [ 0.0000011700000000, -0.0001261300000000, -0.0048200800000000 ] - [ 0.0000000000000000, 0.0000068000000000, -0.0052037300000000 ] - [ -0.0000297300000000, 0.0001035300000000, -0.0048645700000000 ] - [ 0.0000297300000000, 0.0001035300000000, -0.0048645700000000 ] - [ 0.0011109900000000, 0.0014662400000000, 0.0047998900000000 ] - [ 0.0000000000000000, 0.0000516200000000, 0.0048170900000000 ] - [ -0.0011109900000000, 0.0014662400000000, 0.0047998900000000 ] - [ 0.0000002600000000, -0.0002461000000000, 0.0048200200000000 ] - [ 0.0000000000000000, -0.0001090700000000, 0.0048197100000000 ] - [ -0.0000002600000000, -0.0002461000000000, 0.0048200200000000 ] - [ -0.0010673800000000, 0.0014395300000000, 0.0048381000000000 ] - [ 0.0000000000000000, 0.0000500600000000, 0.0048226500000000 ] - [ 0.0010673800000000, 0.0014395300000000, 0.0048381000000000 ] - [ -0.0000381700000000, 0.0000782300000000, 0.0048067800000000 ] - [ 0.0000000000000000, 0.0000492600000000, 0.0048190600000000 ] - [ 0.0000381700000000, 0.0000782300000000, 0.0048067800000000 ] - [ 0.0000010900000000, -0.0001204800000000, 0.0048200900000000 ] - [ 0.0000000000000000, -0.0000847000000000, 0.0048196700000000 ] - [ -0.0000010900000000, -0.0001204800000000, 0.0048200900000000 ] - [ 0.0000403500000000, 0.0000770300000000, 0.0048313800000000 ] - [ 0.0000000000000000, 0.0000491400000000, 0.0048199000000000 ] - [ -0.0000403500000000, 0.0000770300000000, 0.0048313800000000 ] - [ 0.0000000000000000, -0.0155945300000000, 0.0341636700000000 ] - [ -0.0000035700000000, -0.0000968700000000, 0.0344047100000000 ] - [ 0.0000035700000000, -0.0000968700000000, 0.0344047100000000 ] - [ 0.0000000000000000, 0.0012360600000000, 0.0342564800000000 ] - [ 0.0000838200000000, 0.0000846900000000, 0.0344134300000000 ] - [ -0.0000838200000000, 0.0000846900000000, 0.0344134300000000 ] - [ 0.0000000000000000, 0.0012255700000000, 0.0345571100000000 ] - [ -0.0000899900000000, 0.0000849200000000, 0.0343988500000000 ] - [ 0.0000899900000000, 0.0000849200000000, 0.0343988500000000 ] - [ 0.0000000000000000, 0.0000247800000000, 0.0344084200000000 ] - [ -0.0000039800000000, -0.0001057400000000, 0.0344109100000000 ] - [ 0.0000039800000000, -0.0001057400000000, 0.0344109100000000 ] - [ 0.0000000000000000, 0.0000168400000000, 0.0344248700000000 ] - [ 0.0000220500000000, 0.0000014500000000, 0.0344374900000000 ] - [ -0.0000220500000000, 0.0000014500000000, 0.0344374900000000 ] - [ 0.0000000000000000, 0.0000169800000000, 0.0343872700000000 ] - [ -0.0000286900000000, 0.0000012000000000, 0.0343750100000000 ] - [ 0.0000286900000000, 0.0000012000000000, 0.0343750100000000 ] - [ 0.0000008400000000, -0.0002615000000000, -0.0344036600000000 ] - [ 0.0000000000000000, -0.0000789900000000, -0.0344058500000000 ] - [ -0.0000008400000000, -0.0002615000000000, -0.0344036600000000 ] - [ 0.0000413300000000, 0.0000524900000000, -0.0343180400000000 ] - [ 0.0000000000000000, 0.0000166900000000, -0.0344251500000000 ] - [ -0.0000413300000000, 0.0000524900000000, -0.0343180400000000 ] - [ -0.0000351100000000, 0.0000528300000000, -0.0344942400000000 ] - [ 0.0000000000000000, 0.0000168000000000, -0.0343872000000000 ] - [ 0.0000351100000000, 0.0000528300000000, -0.0344942400000000 ] - [ -0.0000015700000000, -0.0025909000000000, -0.0343931500000000 ] - [ 0.0000000000000000, 0.0000071400000000, -0.0344029500000000 ] - [ 0.0000015700000000, -0.0025909000000000, -0.0343931500000000 ] - [ 0.0000806700000000, 0.0000174500000000, -0.0345154800000000 ] - [ 0.0000000000000000, -0.0000032000000000, -0.0344680300000000 ] - [ -0.0000806700000000, 0.0000174500000000, -0.0345154800000000 ] - [ -0.0000737400000000, 0.0000181400000000, -0.0342975000000000 ] - [ 0.0000000000000000, -0.0000028200000000, -0.0343443600000000 ] - [ 0.0000737400000000, 0.0000181400000000, -0.0342975000000000 ] - [ -0.0001092200000000, 0.0049765800000000, 0.0000883200000000 ] - [ 0.0000232200000000, -0.0000033200000000, -0.0000012300000000 ] - [ 0.0000043600000000, -0.0002580000000000, 0.0000024300000000 ] - [ -0.0001248500000000, 0.0001271500000000, 0.0001699400000000 ] - [ 0.0000101500000000, 0.0000221000000000, 0.0000351100000000 ] - [ 0.0000052700000000, 0.0000380000000000, -0.0000526300000000 ] - [ 0.0000774600000000, 0.0001273600000000, -0.0001676500000000 ] - [ 0.0000366300000000, 0.0000223300000000, -0.0000361900000000 ] - [ -0.0000051500000000, 0.0000382100000000, 0.0000523300000000 ] - [ -0.0000229800000000, -0.0000474200000000, 0.0000003000000000 ] - [ 0.0000236200000000, 0.0000742100000000, -0.0000013300000000 ] - [ -0.0000007200000000, 0.0000772900000000, -0.0000036100000000 ] - [ -0.0000023300000000, 0.0000358500000000, -0.0000054700000000 ] - [ 0.0000257100000000, 0.0000063500000000, 0.0000101800000000 ] - [ 0.0000207600000000, 0.0000327500000000, -0.0000471700000000 ] - [ -0.0000446000000000, 0.0000361700000000, 0.0000064000000000 ] - [ 0.0000211800000000, 0.0000064200000000, -0.0000113500000000 ] - [ -0.0000206500000000, 0.0000328800000000, 0.0000470200000000 ] - [ 0.0001092200000000, 0.0049765800000000, 0.0000883200000000 ] - [ -0.0000043600000000, -0.0002580000000000, 0.0000024300000000 ] - [ -0.0000232200000000, -0.0000033200000000, -0.0000012300000000 ] - [ 0.0001248500000000, 0.0001271500000000, 0.0001699400000000 ] - [ -0.0000052700000000, 0.0000380000000000, -0.0000526300000000 ] - [ -0.0000101500000000, 0.0000221000000000, 0.0000351100000000 ] - [ -0.0000774600000000, 0.0001273600000000, -0.0001676500000000 ] - [ 0.0000051500000000, 0.0000382100000000, 0.0000523300000000 ] - [ -0.0000366300000000, 0.0000223300000000, -0.0000361900000000 ] - [ 0.0000229800000000, -0.0000474200000000, 0.0000003000000000 ] - [ 0.0000007200000000, 0.0000772900000000, -0.0000036100000000 ] - [ -0.0000236200000000, 0.0000742100000000, -0.0000013300000000 ] - [ 0.0000023300000000, 0.0000358500000000, -0.0000054700000000 ] - [ -0.0000207600000000, 0.0000327500000000, -0.0000471700000000 ] - [ -0.0000257100000000, 0.0000063500000000, 0.0000101800000000 ] - [ 0.0000446000000000, 0.0000361700000000, 0.0000064000000000 ] - [ 0.0000206500000000, 0.0000328800000000, 0.0000470200000000 ] - [ -0.0000211800000000, 0.0000064200000000, -0.0000113500000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0009411200000000, -0.0039659000000000 ] - [ -0.0001418900000000, 0.0000279700000000, -0.0047584800000000 ] - [ 0.0001418900000000, 0.0000279700000000, -0.0047584800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0048113400000000 ] - [ -0.0000412400000000, 0.0000000000000000, -0.0048109500000000 ] - [ 0.0000412400000000, 0.0000000000000000, -0.0048109500000000 ] - [ 0.0000000000000000, -0.0009411200000000, -0.0039659000000000 ] - [ -0.0001418900000000, -0.0000279700000000, -0.0047584800000000 ] - [ 0.0001418900000000, -0.0000279700000000, -0.0047584800000000 ] - [ 0.0000000000000000, -0.0000512300000000, -0.0046130700000000 ] - [ 0.0001555900000000, 0.0003056500000000, -0.0048616300000000 ] - [ -0.0001555900000000, 0.0003056500000000, -0.0048616300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0048034000000000 ] - [ -0.0000113300000000, 0.0000000000000000, -0.0048281100000000 ] - [ 0.0000113300000000, 0.0000000000000000, -0.0048281100000000 ] - [ 0.0000000000000000, 0.0000512300000000, -0.0046130700000000 ] - [ 0.0001555900000000, -0.0003056500000000, -0.0048616300000000 ] - [ -0.0001555900000000, -0.0003056500000000, -0.0048616300000000 ] - [ -0.0008951000000000, -0.0006284000000000, 0.0051209300000000 ] - [ 0.0000000000000000, 0.0002090200000000, 0.0048715700000000 ] - [ 0.0008951000000000, -0.0006284000000000, 0.0051209300000000 ] - [ -0.0000368400000000, 0.0000000000000000, 0.0048553400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0048388700000000 ] - [ 0.0000368400000000, 0.0000000000000000, 0.0048553400000000 ] - [ -0.0008951000000000, 0.0006284000000000, 0.0051209300000000 ] - [ 0.0000000000000000, -0.0002090200000000, 0.0048715700000000 ] - [ 0.0008951000000000, 0.0006284000000000, 0.0051209300000000 ] - [ -0.0000534200000000, 0.0001965000000000, 0.0045010000000000 ] - [ 0.0000000000000000, 0.0000624600000000, 0.0047804100000000 ] - [ 0.0000534200000000, 0.0001965000000000, 0.0045010000000000 ] - [ -0.0000231700000000, 0.0000000000000000, 0.0047671600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0048014100000000 ] - [ 0.0000231700000000, 0.0000000000000000, 0.0047671600000000 ] - [ -0.0000534200000000, -0.0001965000000000, 0.0045010000000000 ] - [ 0.0000000000000000, -0.0000624600000000, 0.0047804100000000 ] - [ 0.0000534200000000, -0.0001965000000000, 0.0045010000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0688589900000000 ] - [ -0.0001032300000000, 0.0000000000000000, 0.0343462000000000 ] - [ 0.0001032300000000, 0.0000000000000000, 0.0343462000000000 ] - [ 0.0000000000000000, 0.0001490200000000, 0.0339943700000000 ] - [ 0.0000517700000000, -0.0000077200000000, 0.0343759800000000 ] - [ -0.0000517700000000, -0.0000077200000000, 0.0343759800000000 ] - [ 0.0000000000000000, -0.0001490200000000, 0.0339943700000000 ] - [ 0.0000517700000000, 0.0000077200000000, 0.0343759800000000 ] - [ -0.0000517700000000, 0.0000077200000000, 0.0343759800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0348262100000000 ] - [ 0.0001154900000000, 0.0000000000000000, 0.0358431900000000 ] - [ -0.0001154900000000, 0.0000000000000000, 0.0358431900000000 ] - [ 0.0000000000000000, -0.0000186000000000, 0.0344750700000000 ] - [ 0.0000262400000000, -0.0000308600000000, 0.0344684800000000 ] - [ -0.0000262400000000, -0.0000308600000000, 0.0344684800000000 ] - [ 0.0000000000000000, 0.0000186000000000, 0.0344750700000000 ] - [ 0.0000262400000000, 0.0000308600000000, 0.0344684800000000 ] - [ -0.0000262400000000, 0.0000308600000000, 0.0344684800000000 ] - [ 0.0008151400000000, 0.0000000000000000, -0.0328536100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0344972800000000 ] - [ -0.0008151400000000, 0.0000000000000000, -0.0328536100000000 ] - [ 0.0000974500000000, 0.0000885200000000, -0.0343140300000000 ] - [ 0.0000000000000000, -0.0000190100000000, -0.0344249100000000 ] - [ -0.0000974500000000, 0.0000885200000000, -0.0343140300000000 ] - [ 0.0000974500000000, -0.0000885200000000, -0.0343140300000000 ] - [ 0.0000000000000000, 0.0000190100000000, -0.0344249100000000 ] - [ -0.0000974500000000, -0.0000885200000000, -0.0343140300000000 ] - [ -0.0034644400000000, 0.0000000000000000, -0.0296671800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0342246100000000 ] - [ 0.0034644400000000, 0.0000000000000000, -0.0296671800000000 ] - [ 0.0000587400000000, -0.0001093700000000, -0.0344710400000000 ] - [ 0.0000000000000000, -0.0000618800000000, -0.0344318000000000 ] - [ -0.0000587400000000, -0.0001093700000000, -0.0344710400000000 ] - [ 0.0000587400000000, 0.0001093700000000, -0.0344710400000000 ] - [ 0.0000000000000000, 0.0000618800000000, -0.0344318000000000 ] - [ -0.0000587400000000, 0.0001093700000000, -0.0344710400000000 ] - [ -0.0358720900000000, 0.0000000000000000, 0.0435808000000000 ] - [ -0.0000338500000000, 0.0000000000000000, -0.0001656500000000 ] - [ 0.0008197000000000, 0.0000000000000000, 0.0004815100000000 ] - [ -0.0000936300000000, 0.0000131700000000, 0.0001066100000000 ] - [ 0.0000125500000000, -0.0000265300000000, 0.0000261200000000 ] - [ -0.0000202000000000, -0.0000151200000000, -0.0000243000000000 ] - [ -0.0000936300000000, -0.0000131700000000, 0.0001066100000000 ] - [ 0.0000125500000000, 0.0000265300000000, 0.0000261200000000 ] - [ -0.0000202000000000, 0.0000151200000000, -0.0000243000000000 ] - [ -0.0000133400000000, 0.0000000000000000, -0.0002166100000000 ] - [ 0.0001253600000000, 0.0000000000000000, -0.0001072200000000 ] - [ -0.0000847500000000, 0.0000000000000000, -0.0007754700000000 ] - [ 0.0000172400000000, 0.0000365100000000, 0.0000075400000000 ] - [ 0.0000256500000000, -0.0000188200000000, 0.0000100700000000 ] - [ 0.0000364200000000, 0.0000121900000000, -0.0000725400000000 ] - [ 0.0000172400000000, -0.0000365100000000, 0.0000075400000000 ] - [ 0.0000256500000000, 0.0000188200000000, 0.0000100700000000 ] - [ 0.0000364200000000, -0.0000121900000000, -0.0000725400000000 ] - [ 0.0358720900000000, 0.0000000000000000, 0.0435808000000000 ] - [ -0.0008197000000000, 0.0000000000000000, 0.0004815100000000 ] - [ 0.0000338500000000, 0.0000000000000000, -0.0001656500000000 ] - [ 0.0000936300000000, 0.0000131700000000, 0.0001066100000000 ] - [ 0.0000202000000000, -0.0000151200000000, -0.0000243000000000 ] - [ -0.0000125500000000, -0.0000265300000000, 0.0000261200000000 ] - [ 0.0000936300000000, -0.0000131700000000, 0.0001066100000000 ] - [ 0.0000202000000000, 0.0000151200000000, -0.0000243000000000 ] - [ -0.0000125500000000, 0.0000265300000000, 0.0000261200000000 ] - [ 0.0000133400000000, 0.0000000000000000, -0.0002166100000000 ] - [ 0.0000847500000000, 0.0000000000000000, -0.0007754700000000 ] - [ -0.0001253600000000, 0.0000000000000000, -0.0001072200000000 ] - [ -0.0000172400000000, 0.0000365100000000, 0.0000075400000000 ] - [ -0.0000364200000000, 0.0000121900000000, -0.0000725400000000 ] - [ -0.0000256500000000, -0.0000188200000000, 0.0000100700000000 ] - [ -0.0000172400000000, -0.0000365100000000, 0.0000075400000000 ] - [ -0.0000364200000000, -0.0000121900000000, -0.0000725400000000 ] - [ -0.0000256500000000, 0.0000188200000000, 0.0000100700000000 ]- atom: 37 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, -0.0009001900000000, -0.0056279400000000 ] - [ 0.0001393300000000, -0.0000287400000000, -0.0048773600000000 ] - [ -0.0001393300000000, -0.0000287400000000, -0.0048773600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0048246700000000 ] - [ 0.0000389000000000, 0.0000000000000000, -0.0048263700000000 ] - [ -0.0000389000000000, 0.0000000000000000, -0.0048263700000000 ] - [ 0.0000000000000000, 0.0009001900000000, -0.0056279400000000 ] - [ 0.0001393300000000, 0.0000287400000000, -0.0048773600000000 ] - [ -0.0001393300000000, 0.0000287400000000, -0.0048773600000000 ] - [ 0.0000000000000000, 0.0000612400000000, -0.0050327200000000 ] - [ -0.0001577700000000, -0.0003052300000000, -0.0047782800000000 ] - [ 0.0001577700000000, -0.0003052300000000, -0.0047782800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0048342500000000 ] - [ 0.0000093400000000, 0.0000000000000000, -0.0048100100000000 ] - [ -0.0000093400000000, 0.0000000000000000, -0.0048100100000000 ] - [ 0.0000000000000000, -0.0000612400000000, -0.0050327200000000 ] - [ -0.0001577700000000, 0.0003052300000000, -0.0047782800000000 ] - [ 0.0001577700000000, 0.0003052300000000, -0.0047782800000000 ] - [ 0.0008925100000000, 0.0006260800000000, 0.0045243100000000 ] - [ 0.0000000000000000, -0.0002076600000000, 0.0047664900000000 ] - [ -0.0008925100000000, 0.0006260800000000, 0.0045243100000000 ] - [ 0.0000394200000000, 0.0000000000000000, 0.0047829400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0047984100000000 ] - [ -0.0000394200000000, 0.0000000000000000, 0.0047829400000000 ] - [ 0.0008925100000000, -0.0006260800000000, 0.0045243100000000 ] - [ 0.0000000000000000, 0.0002076600000000, 0.0047664900000000 ] - [ -0.0008925100000000, -0.0006260800000000, 0.0045243100000000 ] - [ 0.0000564700000000, -0.0001973400000000, 0.0051352100000000 ] - [ 0.0000000000000000, -0.0000635900000000, 0.0048555700000000 ] - [ -0.0000564700000000, -0.0001973400000000, 0.0051352100000000 ] - [ 0.0000251900000000, 0.0000000000000000, 0.0048698700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0048352800000000 ] - [ -0.0000251900000000, 0.0000000000000000, 0.0048698700000000 ] - [ 0.0000564700000000, 0.0001973400000000, 0.0051352100000000 ] - [ 0.0000000000000000, 0.0000635900000000, 0.0048555700000000 ] - [ -0.0000564700000000, 0.0001973400000000, 0.0051352100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.1409160700000000 ] - [ 0.0000943100000000, 0.0000000000000000, 0.0344561400000000 ] - [ -0.0000943100000000, 0.0000000000000000, 0.0344561400000000 ] - [ 0.0000000000000000, -0.0001518400000000, 0.0348142800000000 ] - [ -0.0000584100000000, 0.0000070700000000, 0.0344326600000000 ] - [ 0.0000584100000000, 0.0000070700000000, 0.0344326600000000 ] - [ 0.0000000000000000, 0.0001518400000000, 0.0348142800000000 ] - [ -0.0000584100000000, -0.0000070700000000, 0.0344326600000000 ] - [ 0.0000584100000000, -0.0000070700000000, 0.0344326600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0339878000000000 ] - [ -0.0001145600000000, 0.0000000000000000, 0.0329784000000000 ] - [ 0.0001145600000000, 0.0000000000000000, 0.0329784000000000 ] - [ 0.0000000000000000, 0.0000188800000000, 0.0343339100000000 ] - [ -0.0000329800000000, 0.0000315300000000, 0.0343405800000000 ] - [ 0.0000329800000000, 0.0000315300000000, 0.0343405800000000 ] - [ 0.0000000000000000, -0.0000188800000000, 0.0343339100000000 ] - [ -0.0000329800000000, -0.0000315300000000, 0.0343405800000000 ] - [ 0.0000329800000000, -0.0000315300000000, 0.0343405800000000 ] - [ -0.0007969900000000, 0.0000000000000000, -0.0359322700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0343179900000000 ] - [ 0.0007969900000000, 0.0000000000000000, -0.0359322700000000 ] - [ -0.0000903700000000, -0.0000877800000000, -0.0344947300000000 ] - [ 0.0000000000000000, 0.0000191000000000, -0.0343838900000000 ] - [ 0.0000903700000000, -0.0000877800000000, -0.0344947300000000 ] - [ -0.0000903700000000, 0.0000877800000000, -0.0344947300000000 ] - [ 0.0000000000000000, -0.0000191000000000, -0.0343838900000000 ] - [ 0.0000903700000000, 0.0000877800000000, -0.0344947300000000 ] - [ 0.0035560300000000, 0.0000000000000000, -0.0392412000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0345769200000000 ] - [ -0.0035560300000000, 0.0000000000000000, -0.0392412000000000 ] - [ -0.0000525900000000, 0.0001085000000000, -0.0343372500000000 ] - [ 0.0000000000000000, 0.0000616600000000, -0.0343764700000000 ] - [ 0.0000525900000000, 0.0001085000000000, -0.0343372500000000 ] - [ -0.0000525900000000, -0.0001085000000000, -0.0343372500000000 ] - [ 0.0000000000000000, -0.0000616600000000, -0.0343764700000000 ] - [ 0.0000525900000000, -0.0001085000000000, -0.0343372500000000 ] - [ 0.0371998900000000, 0.0000000000000000, -0.0451777200000000 ] - [ 0.0000817200000000, 0.0000000000000000, 0.0001627300000000 ] - [ -0.0008257800000000, 0.0000000000000000, -0.0004789000000000 ] - [ 0.0000468800000000, -0.0000136000000000, -0.0001059400000000 ] - [ 0.0000345000000000, 0.0000263000000000, -0.0000274700000000 ] - [ 0.0000200800000000, 0.0000148300000000, 0.0000244500000000 ] - [ 0.0000468800000000, 0.0000136000000000, -0.0001059400000000 ] - [ 0.0000345000000000, -0.0000263000000000, -0.0000274700000000 ] - [ 0.0000200800000000, -0.0000148300000000, 0.0000244500000000 ] - [ -0.0000350400000000, 0.0000000000000000, 0.0002168100000000 ] - [ -0.0000774200000000, 0.0000000000000000, 0.0001084100000000 ] - [ 0.0000802600000000, 0.0000000000000000, 0.0007681800000000 ] - [ -0.0000639400000000, -0.0000361500000000, -0.0000062200000000 ] - [ 0.0000212600000000, 0.0000189900000000, -0.0000112700000000 ] - [ -0.0000362800000000, -0.0000119800000000, 0.0000722600000000 ] - [ -0.0000639400000000, 0.0000361500000000, -0.0000062200000000 ] - [ 0.0000212600000000, -0.0000189900000000, -0.0000112700000000 ] - [ -0.0000362800000000, 0.0000119800000000, 0.0000722600000000 ] - [ -0.0371998900000000, 0.0000000000000000, -0.0451777200000000 ] - [ 0.0008257800000000, 0.0000000000000000, -0.0004789000000000 ] - [ -0.0000817200000000, 0.0000000000000000, 0.0001627300000000 ] - [ -0.0000468800000000, -0.0000136000000000, -0.0001059400000000 ] - [ -0.0000200800000000, 0.0000148300000000, 0.0000244500000000 ] - [ -0.0000345000000000, 0.0000263000000000, -0.0000274700000000 ] - [ -0.0000468800000000, 0.0000136000000000, -0.0001059400000000 ] - [ -0.0000200800000000, -0.0000148300000000, 0.0000244500000000 ] - [ -0.0000345000000000, -0.0000263000000000, -0.0000274700000000 ] - [ 0.0000350400000000, 0.0000000000000000, 0.0002168100000000 ] - [ -0.0000802600000000, 0.0000000000000000, 0.0007681800000000 ] - [ 0.0000774200000000, 0.0000000000000000, 0.0001084100000000 ] - [ 0.0000639400000000, -0.0000361500000000, -0.0000062200000000 ] - [ 0.0000362800000000, -0.0000119800000000, 0.0000722600000000 ] - [ -0.0000212600000000, 0.0000189900000000, -0.0000112700000000 ] - [ 0.0000639400000000, 0.0000361500000000, -0.0000062200000000 ] - [ 0.0000362800000000, 0.0000119800000000, 0.0000722600000000 ] - [ -0.0000212600000000, -0.0000189900000000, -0.0000112700000000 ]- atom: 73 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0000019600000000, -0.0002192300000000, -0.0050219500000000 ] - [ -0.0000097100000000, 0.0000183700000000, -0.0048168800000000 ] - [ 0.0000114500000000, -0.0000056700000000, -0.0048354800000000 ] - [ -0.0000026700000000, 0.0000000000000000, -0.0048431900000000 ] - [ -0.0000069600000000, 0.0000000000000000, -0.0048210600000000 ] - [ 0.0000094200000000, 0.0000000000000000, -0.0048236300000000 ] - [ -0.0000019600000000, 0.0002192300000000, -0.0050219500000000 ] - [ -0.0000097100000000, -0.0000183700000000, -0.0048168800000000 ] - [ 0.0000114500000000, 0.0000056700000000, -0.0048354800000000 ] - [ 0.0000095500000000, -0.0009745900000000, -0.0037098900000000 ] - [ 0.0002640900000000, 0.0002378600000000, -0.0049859000000000 ] - [ 0.0000498200000000, -0.0000109700000000, -0.0047809200000000 ] - [ -0.0000290300000000, 0.0000000000000000, -0.0048004700000000 ] - [ 0.0000156700000000, 0.0000000000000000, -0.0048222800000000 ] - [ 0.0000126300000000, 0.0000000000000000, -0.0048159700000000 ] - [ 0.0000095500000000, 0.0009745900000000, -0.0037098900000000 ] - [ 0.0002640900000000, -0.0002378600000000, -0.0049859000000000 ] - [ 0.0000498200000000, 0.0000109700000000, -0.0047809200000000 ] - [ 0.0000072300000000, 0.0009884400000000, 0.0059449600000000 ] - [ 0.0000513100000000, 0.0000125500000000, 0.0048614900000000 ] - [ 0.0002660500000000, -0.0002367500000000, 0.0046571400000000 ] - [ -0.0000311500000000, 0.0000000000000000, 0.0048399600000000 ] - [ 0.0000147200000000, 0.0000000000000000, 0.0048244300000000 ] - [ 0.0000157500000000, 0.0000000000000000, 0.0048174300000000 ] - [ 0.0000072300000000, -0.0009884400000000, 0.0059449600000000 ] - [ 0.0000513100000000, -0.0000125500000000, 0.0048614900000000 ] - [ 0.0002660500000000, 0.0002367500000000, 0.0046571400000000 ] - [ -0.0000027900000000, 0.0002172800000000, 0.0046196600000000 ] - [ 0.0000135800000000, 0.0000049600000000, 0.0048029400000000 ] - [ -0.0000100500000000, -0.0000190400000000, 0.0048216800000000 ] - [ -0.0000048200000000, 0.0000000000000000, 0.0047967300000000 ] - [ 0.0000115500000000, 0.0000000000000000, 0.0048162400000000 ] - [ -0.0000069400000000, 0.0000000000000000, 0.0048181800000000 ] - [ -0.0000027900000000, -0.0002172800000000, 0.0046196600000000 ] - [ 0.0000135800000000, -0.0000049600000000, 0.0048029400000000 ] - [ -0.0000100500000000, 0.0000190400000000, 0.0048216800000000 ] - [ 0.0213039200000000, 0.0000000000000000, -0.0016546200000000 ] - [ 0.0013432500000000, 0.0000000000000000, 0.0352384700000000 ] - [ -0.0002465500000000, 0.0000000000000000, 0.0343442300000000 ] - [ 0.0000250400000000, 0.0001009700000000, 0.0343358100000000 ] - [ 0.0000039100000000, -0.0000050800000000, 0.0343857400000000 ] - [ -0.0000236000000000, 0.0000126600000000, 0.0343951700000000 ] - [ 0.0000250400000000, -0.0001009700000000, 0.0343358100000000 ] - [ 0.0000039100000000, 0.0000050800000000, 0.0343857400000000 ] - [ -0.0000236000000000, -0.0000126600000000, 0.0343951700000000 ] - [ -0.0000687700000000, 0.0000000000000000, 0.0344185800000000 ] - [ -0.0001196200000000, 0.0000000000000000, 0.0343218200000000 ] - [ 0.0000877600000000, 0.0000000000000000, 0.0345107900000000 ] - [ 0.0000279700000000, -0.0000208900000000, 0.0344464500000000 ] - [ -0.0000168300000000, -0.0000209000000000, 0.0344421600000000 ] - [ -0.0000152000000000, -0.0000017300000000, 0.0344088200000000 ] - [ 0.0000279700000000, 0.0000208900000000, 0.0344464500000000 ] - [ -0.0000168300000000, 0.0000209000000000, 0.0344421600000000 ] - [ -0.0000152000000000, 0.0000017300000000, 0.0344088200000000 ] - [ -0.0000745700000000, 0.0000000000000000, -0.0343969400000000 ] - [ 0.0001014400000000, 0.0000000000000000, -0.0343071100000000 ] - [ -0.0001189800000000, 0.0000000000000000, -0.0344863000000000 ] - [ 0.0000213000000000, 0.0000210400000000, -0.0343660700000000 ] - [ -0.0000087200000000, 0.0000019700000000, -0.0344037900000000 ] - [ -0.0000169300000000, 0.0000212600000000, -0.0343702900000000 ] - [ 0.0000213000000000, -0.0000210400000000, -0.0343660700000000 ] - [ -0.0000087200000000, -0.0000019700000000, -0.0344037900000000 ] - [ -0.0000169300000000, -0.0000212600000000, -0.0343702900000000 ] - [ 0.0215367100000000, 0.0000000000000000, -0.0714064000000000 ] - [ -0.0002378600000000, 0.0000000000000000, -0.0344581500000000 ] - [ 0.0013165800000000, 0.0000000000000000, -0.0335929300000000 ] - [ 0.0000185000000000, -0.0001009000000000, -0.0344761900000000 ] - [ -0.0000170700000000, -0.0000131200000000, -0.0344171200000000 ] - [ 0.0000036800000000, 0.0000048700000000, -0.0344261100000000 ] - [ 0.0000185000000000, 0.0001009000000000, -0.0344761900000000 ] - [ -0.0000170700000000, 0.0000131200000000, -0.0344171200000000 ] - [ 0.0000036800000000, -0.0000048700000000, -0.0344261100000000 ] - [ -0.0781893800000000, 0.0000000000000000, 0.0584488100000000 ] - [ -0.0015321400000000, 0.0000000000000000, -0.0005381000000000 ] - [ -0.0014700200000000, 0.0000000000000000, -0.0005338100000000 ] - [ -0.0001066100000000, -0.0000001400000000, 0.0000695900000000 ] - [ 0.0000056500000000, -0.0000013000000000, -0.0000023800000000 ] - [ 0.0000525200000000, 0.0000012200000000, -0.0000037500000000 ] - [ -0.0001066100000000, 0.0000001400000000, 0.0000695900000000 ] - [ 0.0000056500000000, 0.0000013000000000, -0.0000023800000000 ] - [ 0.0000525200000000, -0.0000012200000000, -0.0000037500000000 ] - [ 0.0000267100000000, 0.0000000000000000, -0.0000159500000000 ] - [ 0.0000308000000000, 0.0000000000000000, 0.0000731500000000 ] - [ 0.0000766100000000, 0.0000000000000000, 0.0000675300000000 ] - [ -0.0000282400000000, 0.0000000400000000, 0.0000074900000000 ] - [ 0.0000085200000000, -0.0000081600000000, -0.0000133000000000 ] - [ 0.0000564400000000, 0.0000093200000000, -0.0000145200000000 ] - [ -0.0000282400000000, -0.0000000400000000, 0.0000074900000000 ] - [ 0.0000085200000000, 0.0000081600000000, -0.0000133000000000 ] - [ 0.0000564400000000, -0.0000093200000000, -0.0000145200000000 ] - [ 0.0171259300000000, 0.0000000000000000, 0.0052539800000000 ] - [ 0.0181551900000000, 0.0000000000000000, 0.0053264400000000 ] - [ -0.0003792500000000, 0.0000000000000000, 0.0004506200000000 ] - [ 0.0000234100000000, 0.0000222000000000, 0.0000097500000000 ] - [ 0.0000704700000000, -0.0000223200000000, 0.0000109100000000 ] - [ -0.0000381800000000, -0.0000001100000000, 0.0000190900000000 ] - [ 0.0000234100000000, -0.0000222000000000, 0.0000097500000000 ] - [ 0.0000704700000000, 0.0000223200000000, 0.0000109100000000 ] - [ -0.0000381800000000, 0.0000001100000000, 0.0000190900000000 ] - [ -0.0000090800000000, 0.0000000000000000, -0.0000643600000000 ] - [ 0.0000343900000000, 0.0000000000000000, -0.0000623400000000 ] - [ -0.0000172100000000, 0.0000000000000000, -0.0000660000000000 ] - [ -0.0000157300000000, 0.0000051900000000, -0.0000171100000000 ] - [ 0.0000310900000000, -0.0000051100000000, -0.0000159600000000 ] - [ -0.0000469800000000, 0.0000000400000000, 0.0000099000000000 ] - [ -0.0000157300000000, -0.0000051900000000, -0.0000171100000000 ] - [ 0.0000310900000000, 0.0000051100000000, -0.0000159600000000 ] - [ -0.0000469800000000, -0.0000000400000000, 0.0000099000000000 ]- atom: 73 displacement: [ 0.0000000000000000, 0.0100000000000000, 0.0000000000000000 ] forces: - [ -0.0001382200000000, -0.0000632500000000, -0.0049966400000000 ] - [ -0.0000380600000000, 0.0000510400000000, -0.0048476400000000 ] - [ 0.0000114200000000, 0.0000256300000000, -0.0048280700000000 ] - [ 0.0000010600000000, -0.0001127600000000, -0.0048202000000000 ] - [ 0.0000000300000000, -0.0000844700000000, -0.0048198500000000 ] - [ -0.0000011000000000, -0.0000677200000000, -0.0048201000000000 ] - [ 0.0001400000000000, -0.0000642300000000, -0.0046415400000000 ] - [ 0.0000381300000000, 0.0000502100000000, -0.0047921200000000 ] - [ -0.0000138100000000, 0.0000253800000000, -0.0048119200000000 ] - [ -0.0011314600000000, 0.0020551300000000, -0.0063843900000000 ] - [ -0.0002643700000000, -0.0001202500000000, -0.0049300600000000 ] - [ -0.0000020000000000, 0.0000433900000000, -0.0048204700000000 ] - [ 0.0000010900000000, -0.0001516200000000, -0.0048199300000000 ] - [ -0.0000001000000000, -0.0001172700000000, -0.0048196400000000 ] - [ -0.0000010000000000, -0.0000816200000000, -0.0048200500000000 ] - [ 0.0011029300000000, 0.0020156700000000, -0.0032936400000000 ] - [ 0.0002651700000000, -0.0001202600000000, -0.0047079800000000 ] - [ -0.0000002500000000, 0.0000431800000000, -0.0048194200000000 ] - [ 0.0011314600000000, 0.0020551300000000, 0.0063843900000000 ] - [ 0.0000020000000000, 0.0000433900000000, 0.0048204700000000 ] - [ 0.0002643700000000, -0.0001202500000000, 0.0049300600000000 ] - [ -0.0000010900000000, -0.0001516200000000, 0.0048199300000000 ] - [ 0.0000010000000000, -0.0000816200000000, 0.0048200500000000 ] - [ 0.0000001000000000, -0.0001172700000000, 0.0048196400000000 ] - [ -0.0011029300000000, 0.0020156700000000, 0.0032936400000000 ] - [ 0.0000002500000000, 0.0000431800000000, 0.0048194200000000 ] - [ -0.0002651700000000, -0.0001202600000000, 0.0047079800000000 ] - [ 0.0001382200000000, -0.0000632500000000, 0.0049966400000000 ] - [ -0.0000114200000000, 0.0000256300000000, 0.0048280700000000 ] - [ 0.0000380600000000, 0.0000510400000000, 0.0048476400000000 ] - [ -0.0000010600000000, -0.0001127600000000, 0.0048202000000000 ] - [ 0.0000011000000000, -0.0000677200000000, 0.0048201000000000 ] - [ -0.0000000300000000, -0.0000844700000000, 0.0048198500000000 ] - [ -0.0001400000000000, -0.0000642300000000, 0.0046415400000000 ] - [ 0.0000138100000000, 0.0000253800000000, 0.0048119200000000 ] - [ -0.0000381300000000, 0.0000502100000000, 0.0047921200000000 ] - [ 0.0000610200000000, 0.0049766800000000, 0.0342893200000000 ] - [ -0.0000036700000000, -0.0002580900000000, 0.0344003300000000 ] - [ -0.0000032200000000, -0.0000034000000000, 0.0344020800000000 ] - [ -0.0000305500000000, 0.0001271100000000, 0.0343938800000000 ] - [ 0.0000603300000000, 0.0000391700000000, 0.0344201100000000 ] - [ -0.0000285400000000, 0.0000221400000000, 0.0344318900000000 ] - [ 0.0000361700000000, 0.0001279200000000, 0.0344199400000000 ] - [ -0.0000599100000000, 0.0000388200000000, 0.0343918800000000 ] - [ 0.0000221600000000, 0.0000223700000000, 0.0343806900000000 ] - [ 0.0000040400000000, -0.0000471900000000, 0.0344073700000000 ] - [ -0.0000027500000000, 0.0000773300000000, 0.0344065000000000 ] - [ -0.0000051000000000, 0.0000743500000000, 0.0344083800000000 ] - [ -0.0000180400000000, 0.0000358400000000, 0.0343698000000000 ] - [ 0.0000397800000000, 0.0000327600000000, 0.0343938600000000 ] - [ -0.0000130900000000, 0.0000064600000000, 0.0344250300000000 ] - [ 0.0000246200000000, 0.0000361500000000, 0.0344423900000000 ] - [ -0.0000399500000000, 0.0000329700000000, 0.0344185000000000 ] - [ 0.0000066400000000, 0.0000064600000000, 0.0343872300000000 ] - [ -0.0000040400000000, -0.0000471900000000, -0.0344073700000000 ] - [ 0.0000051000000000, 0.0000743500000000, -0.0344083800000000 ] - [ 0.0000027500000000, 0.0000773300000000, -0.0344065000000000 ] - [ 0.0000180400000000, 0.0000358400000000, -0.0343698000000000 ] - [ 0.0000130900000000, 0.0000064600000000, -0.0344250300000000 ] - [ -0.0000397800000000, 0.0000327600000000, -0.0343938600000000 ] - [ -0.0000246200000000, 0.0000361500000000, -0.0344423900000000 ] - [ -0.0000066400000000, 0.0000064600000000, -0.0343872300000000 ] - [ 0.0000399500000000, 0.0000329700000000, -0.0344185000000000 ] - [ -0.0000610200000000, 0.0049766800000000, -0.0342893200000000 ] - [ 0.0000032200000000, -0.0000034000000000, -0.0344020800000000 ] - [ 0.0000036700000000, -0.0002580900000000, -0.0344003300000000 ] - [ 0.0000305500000000, 0.0001271100000000, -0.0343938800000000 ] - [ 0.0000285400000000, 0.0000221400000000, -0.0344318900000000 ] - [ -0.0000603300000000, 0.0000391700000000, -0.0344201100000000 ] - [ -0.0000361700000000, 0.0001279200000000, -0.0344199400000000 ] - [ -0.0000221600000000, 0.0000223700000000, -0.0343806900000000 ] - [ 0.0000599100000000, 0.0000388200000000, -0.0343918800000000 ] - [ 0.0000000000000000, -0.0175928900000000, 0.0000000000000000 ] - [ -0.0000172800000000, 0.0001170800000000, 0.0000018900000000 ] - [ 0.0000172800000000, 0.0001170800000000, -0.0000018900000000 ] - [ 0.0000000000000000, 0.0000787100000000, 0.0000000000000000 ] - [ -0.0000247400000000, 0.0000286700000000, 0.0000384800000000 ] - [ 0.0000247400000000, 0.0000286700000000, -0.0000384800000000 ] - [ 0.0000000000000000, 0.0000818500000000, 0.0000000000000000 ] - [ -0.0000222000000000, 0.0000285800000000, -0.0000370400000000 ] - [ 0.0000222000000000, 0.0000285800000000, 0.0000370400000000 ] - [ 0.0000000000000000, -0.0001009900000000, 0.0000000000000000 ] - [ -0.0000230000000000, -0.0003412800000000, 0.0000009500000000 ] - [ 0.0000230000000000, -0.0003412800000000, -0.0000009500000000 ] - [ 0.0000000000000000, 0.0000593100000000, 0.0000000000000000 ] - [ -0.0000326400000000, 0.0000142800000000, 0.0000252200000000 ] - [ 0.0000326400000000, 0.0000142800000000, -0.0000252200000000 ] - [ 0.0000000000000000, 0.0000595100000000, 0.0000000000000000 ] - [ -0.0000152000000000, 0.0000133300000000, -0.0000241700000000 ] - [ 0.0000152000000000, 0.0000133300000000, 0.0000241700000000 ] - [ 0.0000059600000000, 0.0000560800000000, 0.0000120800000000 ] - [ -0.0000059600000000, 0.0000560800000000, -0.0000120800000000 ] - [ 0.0000000000000000, -0.0001644400000000, 0.0000000000000000 ] - [ -0.0000011700000000, 0.0000746500000000, 0.0000648000000000 ] - [ 0.0000011700000000, 0.0000746500000000, -0.0000648000000000 ] - [ 0.0000000000000000, 0.0000142600000000, 0.0000000000000000 ] - [ -0.0000457800000000, 0.0000745800000000, -0.0000659100000000 ] - [ 0.0000457800000000, 0.0000745800000000, 0.0000659100000000 ] - [ 0.0000000000000000, 0.0000143700000000, 0.0000000000000000 ] - [ -0.0000230300000000, -0.0000407800000000, -0.0000017100000000 ] - [ 0.0000230300000000, -0.0000407800000000, 0.0000017100000000 ] - [ 0.0000000000000000, 0.0000007700000000, 0.0000000000000000 ] - [ -0.0000182600000000, 0.0000350000000000, 0.0000281300000000 ] - [ 0.0000182600000000, 0.0000350000000000, -0.0000281300000000 ] - [ 0.0000000000000000, 0.0000053400000000, 0.0000000000000000 ] - [ -0.0000285200000000, 0.0000351900000000, -0.0000293300000000 ] - [ 0.0000285200000000, 0.0000351900000000, 0.0000293300000000 ] - [ 0.0000000000000000, 0.0000053600000000, 0.0000000000000000 ]- atom: 73 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0001317600000000, 0.0002703600000000, -0.0044254600000000 ] - [ 0.0000229200000000, -0.0000964800000000, -0.0048672500000000 ] - [ -0.0001151100000000, 0.0000458200000000, -0.0048070300000000 ] - [ 0.0000320400000000, 0.0000000000000000, -0.0047888500000000 ] - [ 0.0000008900000000, 0.0000000000000000, -0.0048233700000000 ] - [ -0.0000342500000000, 0.0000000000000000, -0.0048117300000000 ] - [ 0.0001317600000000, -0.0002703600000000, -0.0044254600000000 ] - [ 0.0000229200000000, 0.0000964800000000, -0.0048672500000000 ] - [ -0.0001151100000000, -0.0000458200000000, -0.0048070300000000 ] - [ 0.0017258700000000, -0.0018522500000000, -0.0039222400000000 ] - [ -0.0004277700000000, -0.0004894400000000, -0.0048419400000000 ] - [ -0.0001545900000000, 0.0001085600000000, -0.0048240500000000 ] - [ 0.0000790400000000, 0.0000000000000000, -0.0048456500000000 ] - [ -0.0000282300000000, 0.0000000000000000, -0.0048039100000000 ] - [ -0.0000515400000000, 0.0000000000000000, -0.0048271900000000 ] - [ 0.0017258700000000, 0.0018522500000000, -0.0039222400000000 ] - [ -0.0004277700000000, 0.0004894400000000, -0.0048419400000000 ] - [ -0.0001545900000000, -0.0001085600000000, -0.0048240500000000 ] - [ 0.0017511000000000, 0.0018931200000000, 0.0057357200000000 ] - [ -0.0001522900000000, -0.0001077900000000, 0.0048133000000000 ] - [ -0.0004270900000000, 0.0004897800000000, 0.0047957500000000 ] - [ 0.0000770700000000, 0.0000000000000000, 0.0047916100000000 ] - [ -0.0000493900000000, 0.0000000000000000, 0.0048099400000000 ] - [ -0.0000282900000000, 0.0000000000000000, 0.0048325200000000 ] - [ 0.0017511000000000, -0.0018931200000000, 0.0057357200000000 ] - [ -0.0001522900000000, 0.0001077900000000, 0.0048133000000000 ] - [ -0.0004270900000000, -0.0004897800000000, 0.0047957500000000 ] - [ 0.0001316600000000, -0.0002712200000000, 0.0052118600000000 ] - [ -0.0001130200000000, -0.0000458800000000, 0.0048294100000000 ] - [ 0.0000227300000000, 0.0000972900000000, 0.0047682800000000 ] - [ 0.0000299700000000, 0.0000000000000000, 0.0048480500000000 ] - [ -0.0000318800000000, 0.0000000000000000, 0.0048243500000000 ] - [ 0.0000008300000000, 0.0000000000000000, 0.0048129200000000 ] - [ 0.0001316600000000, 0.0002712200000000, 0.0052118600000000 ] - [ -0.0001130200000000, 0.0000458800000000, 0.0048294100000000 ] - [ 0.0000227300000000, -0.0000972900000000, 0.0047682800000000 ] - [ -0.0277516800000000, 0.0000000000000000, 0.0795912800000000 ] - [ 0.0009117200000000, 0.0000000000000000, 0.0348766000000000 ] - [ 0.0003118800000000, 0.0000000000000000, 0.0342327400000000 ] - [ -0.0001029300000000, -0.0001685800000000, 0.0345112400000000 ] - [ 0.0000111300000000, 0.0000517500000000, 0.0343798200000000 ] - [ 0.0000860200000000, -0.0000365400000000, 0.0344308500000000 ] - [ -0.0001029300000000, 0.0001685800000000, 0.0345112400000000 ] - [ 0.0000111300000000, -0.0000517500000000, 0.0343798200000000 ] - [ 0.0000860200000000, 0.0000365400000000, 0.0344308500000000 ] - [ -0.0003522600000000, 0.0000000000000000, 0.0341896000000000 ] - [ 0.0000113100000000, 0.0000000000000000, 0.0336302800000000 ] - [ 0.0004247900000000, 0.0000000000000000, 0.0342985400000000 ] - [ -0.0000533600000000, 0.0000059300000000, 0.0344116300000000 ] - [ 0.0000067600000000, 0.0000469300000000, 0.0343315700000000 ] - [ 0.0000459100000000, -0.0000106900000000, 0.0344139700000000 ] - [ -0.0000533600000000, -0.0000059300000000, 0.0344116300000000 ] - [ 0.0000067600000000, -0.0000469300000000, 0.0343315700000000 ] - [ 0.0000459100000000, 0.0000106900000000, 0.0344139700000000 ] - [ -0.0003604500000000, 0.0000000000000000, -0.0346215900000000 ] - [ 0.0004410300000000, 0.0000000000000000, -0.0345126700000000 ] - [ 0.0000120200000000, 0.0000000000000000, -0.0351718600000000 ] - [ -0.0000597700000000, -0.0000059600000000, -0.0343967700000000 ] - [ 0.0000523200000000, 0.0000107600000000, -0.0343943200000000 ] - [ 0.0000069400000000, -0.0000467300000000, -0.0344763100000000 ] - [ -0.0000597700000000, 0.0000059600000000, -0.0343967700000000 ] - [ 0.0000523200000000, -0.0000107600000000, -0.0343943200000000 ] - [ 0.0000069400000000, 0.0000467300000000, -0.0344763100000000 ] - [ -0.0263766900000000, 0.0000000000000000, 0.0091683700000000 ] - [ 0.0003184200000000, 0.0000000000000000, -0.0345606800000000 ] - [ 0.0009089900000000, 0.0000000000000000, -0.0339155100000000 ] - [ -0.0001094700000000, 0.0001682900000000, -0.0342972400000000 ] - [ 0.0000926500000000, 0.0000363100000000, -0.0343773700000000 ] - [ 0.0000108900000000, -0.0000518800000000, -0.0344280100000000 ] - [ -0.0001094700000000, -0.0001682900000000, -0.0342972400000000 ] - [ 0.0000926500000000, -0.0000363100000000, -0.0343773700000000 ] - [ 0.0000108900000000, 0.0000518800000000, -0.0344280100000000 ] - [ 0.0584276900000000, 0.0000000000000000, -0.0894933100000000 ] - [ -0.0005289300000000, 0.0000000000000000, 0.0003305400000000 ] - [ -0.0004950000000000, 0.0000000000000000, 0.0003257800000000 ] - [ 0.0000213600000000, -0.0000000100000000, -0.0001773300000000 ] - [ -0.0000025400000000, 0.0000378000000000, 0.0000497800000000 ] - [ 0.0000442000000000, -0.0000376800000000, 0.0000484700000000 ] - [ 0.0000213600000000, 0.0000000100000000, -0.0001773300000000 ] - [ -0.0000025400000000, -0.0000378000000000, 0.0000497800000000 ] - [ 0.0000442000000000, 0.0000376800000000, 0.0000484700000000 ] - [ -0.0000642000000000, 0.0000000000000000, -0.0001637000000000 ] - [ 0.0000716900000000, 0.0000000000000000, 0.0005240000000000 ] - [ 0.0001168900000000, 0.0000000000000000, 0.0005183300000000 ] - [ -0.0000406800000000, 0.0000000900000000, -0.0000428700000000 ] - [ -0.0000139200000000, 0.0000253600000000, 0.0000333900000000 ] - [ 0.0000339700000000, -0.0000241700000000, 0.0000323100000000 ] - [ -0.0000406800000000, -0.0000000900000000, -0.0000428700000000 ] - [ -0.0000139200000000, -0.0000253600000000, 0.0000333900000000 ] - [ 0.0000339700000000, 0.0000241700000000, 0.0000323100000000 ] - [ -0.0052462800000000, 0.0000000000000000, -0.0020773000000000 ] - [ -0.0052863200000000, 0.0000000000000000, -0.0020804300000000 ] - [ -0.0004985800000000, 0.0000000000000000, -0.0001373700000000 ] - [ -0.0000100500000000, -0.0000654500000000, 0.0000096000000000 ] - [ 0.0000370900000000, 0.0000652400000000, 0.0000109100000000 ] - [ -0.0000674300000000, -0.0000000900000000, -0.0000766400000000 ] - [ -0.0000100500000000, 0.0000654500000000, 0.0000096000000000 ] - [ 0.0000370900000000, -0.0000652400000000, 0.0000109100000000 ] - [ -0.0000674300000000, 0.0000000900000000, -0.0000766400000000 ] - [ 0.0000659500000000, 0.0000000000000000, 0.0002241100000000 ] - [ 0.0001085900000000, 0.0000000000000000, 0.0002286200000000 ] - [ 0.0000178400000000, 0.0000000000000000, -0.0003900600000000 ] - [ 0.0000169100000000, -0.0000286800000000, 0.0000327300000000 ] - [ 0.0000638200000000, 0.0000287700000000, 0.0000339600000000 ] - [ -0.0000583500000000, 0.0000000000000000, -0.0000462100000000 ] - [ 0.0000169100000000, 0.0000286800000000, 0.0000327300000000 ] - [ 0.0000638200000000, -0.0000287700000000, 0.0000339600000000 ] - [ -0.0000583500000000, 0.0000000000000000, -0.0000462100000000 ]