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{
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{
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{
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{
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{
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"structure_string": "K2 Y2 C16 O16\n1.0\n6.284011 0.000000 0.000000\n0.000000 6.284011 0.000000\n0.000000 0.000000 11.730254\nK Y C O\n2 2 16 16\ndirect\n0.000000 0.000000 0.250000 K\n0.000000 0.000000 0.750000 K\n0.500000 0.500000 0.250000 Y\n0.500000 0.500000 0.750000 Y\n0.564015 0.097955 0.062855 C\n0.902045 0.435985 0.437145 C\n0.564015 0.902045 0.437145 C\n0.435985 0.097955 0.562855 C\n0.435985 0.902045 0.062855 C\n0.435985 0.097955 0.437145 C\n0.902045 0.435985 0.562855 C\n0.564015 0.902045 0.562855 C\n0.097955 0.564015 0.562855 C\n0.097955 0.435985 0.937145 C\n0.435985 0.902045 0.937145 C\n0.902045 0.564015 0.062855 C\n0.902045 0.564015 0.937145 C\n0.564015 0.097955 0.937145 C\n0.097955 0.435985 0.062855 C\n0.097955 0.564015 0.437145 C\n0.355139 0.784815 0.138934 O\n0.355139 0.215185 0.361066 O\n0.784815 0.644861 0.138934 O\n0.355139 0.215185 0.638934 O\n0.355139 0.784815 0.861066 O\n0.215185 0.644861 0.638934 O\n0.784815 0.355139 0.638934 O\n0.644861 0.784815 0.638934 O\n0.644861 0.215185 0.861066 O\n0.784815 0.644861 0.861066 O\n0.784815 0.355139 0.361066 O\n0.215185 0.644861 0.361066 O\n0.644861 0.784815 0.361066 O\n0.215185 0.355139 0.138934 O\n0.644861 0.215185 0.138934 O\n0.215185 0.355139 0.861066 O\n",
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"elements": [
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],
"chemical_system": "C-K-O-Y",
"density": 2.5243249811474144,
"density_atomic": 0.07771792761455301,
"volume": 463.21358668419833,
"volume_molar": 7.748715058213067,
"formula_full": "K2 Y2 C16 O16",
"formula_reduced": "KY(CO)8",
"formula_anonymous": "ABC8D8",
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"updated_at": "2021-11-28T01:36:45.793000Z",
"spacegroup": 124
},
{
"id": "mp-1224691",
"created_at": "2022-09-04T14:44:58.069141Z",
"structure_string": "Fe2 Sb1 Te3\n1.0\n3.743081 0.000000 0.000000\n0.000000 5.376070 0.000000\n0.000000 0.081298 6.288151\nFe Sb Te\n2 1 3\ndirect\n0.500000 0.504273 0.501461 Fe\n0.000000 0.996909 0.995657 Fe\n0.500000 0.283259 0.145653 Sb\n0.500000 0.714423 0.860992 Te\n0.000000 0.778042 0.354872 Te\n0.000000 0.223094 0.641364 Te\n",
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"elements": [
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"Sb",
"Te"
],
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"volume": 126.5368742687472,
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"formula_reduced": "Fe2SbTe3",
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"updated_at": "2021-11-28T01:36:41.917000Z",
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},
{
"id": "mp-1233547",
"created_at": "2022-09-04T14:44:58.070669Z",
"structure_string": "Ca1 Ag4 Ru4 O12\n1.0\n-5.305294 5.305294 0.000000\n5.299965 -0.005329 5.301121\n5.294636 5.294636 0.000000\nCa Ag Ru O\n1 4 4 12\ndirect\n0.373411 0.746823 0.376589 Ca\n0.577378 0.553485 0.973257 Ag\n0.974806 0.949612 0.972872 Ag\n0.976107 0.553485 0.973257 Ag\n0.974806 0.949612 0.577516 Ag\n0.511876 0.023751 0.964724 Ru\n0.511876 0.023751 0.511525 Ru\n0.512494 0.474898 0.512551 Ru\n0.962404 0.474898 0.512551 Ru\n0.814417 0.249514 0.434579 O\n0.586112 0.172224 0.163888 O\n0.586821 0.748864 0.163258 O\n0.814417 0.249514 0.815907 O\n0.815242 0.630484 0.434758 O\n0.435097 0.249514 0.434579 O\n0.586821 0.748864 0.587878 O\n0.162042 0.748864 0.163258 O\n0.161626 0.323251 0.588374 O\n0.435097 0.249514 0.815907 O\n0.435477 0.870955 0.814523 O\n0.162042 0.748864 0.587878 O\n",
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"formula_full": "Ca1 Ag4 Ru4 O12",
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"updated_at": "2021-11-28T01:36:52.504000Z",
"spacegroup": 216
}
]
}