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{
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{
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{
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"structure_string": "Cs1 Hg1 Br2 Cl1\n1.0\n5.655472 0.000000 0.000000\n0.000000 5.655472 0.000000\n0.000000 0.000000 5.490166\nCs Hg Br Cl\n1 1 2 1\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.500000 Hg\n0.000000 0.500000 0.500000 Br\n0.500000 0.000000 0.500000 Br\n0.500000 0.500000 0.000000 Cl\n",
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{
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{
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},
{
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"created_at": "2022-09-04T14:47:04.691201Z",
"structure_string": "Co4 Sn2 O8\n1.0\n-3.043619 3.152567 4.392038\n3.043619 -3.152567 4.392038\n3.043619 3.152567 -4.392038\nCo Sn O\n4 2 8\ndirect\n0.111806 0.861806 0.250000 Co\n0.888194 0.138194 0.750000 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n0.748258 0.265026 0.016768 O\n0.748258 0.731490 0.483232 O\n0.746636 0.264741 0.481895 O\n0.282846 0.264741 0.018105 O\n0.717154 0.735259 0.981895 O\n0.253364 0.735259 0.518105 O\n0.251742 0.268510 0.516768 O\n0.251742 0.734974 0.983232 O\n",
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"elements": [
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"Sn",
"O"
],
"chemical_system": "Co-O-Sn",
"density": 5.921746302098108,
"density_atomic": 0.08305147378852615,
"volume": 168.5701572936343,
"volume_molar": 7.251094393982903,
"formula_full": "Co4 Sn2 O8",
"formula_reduced": "Co2SnO4",
"formula_anonymous": "AB2C4",
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"updated_at": "2021-11-28T01:37:54.509000Z",
"spacegroup": 74
},
{
"id": "mp-10669",
"created_at": "2022-09-04T14:47:05.235092Z",
"structure_string": "Ba3 Al2 Ge2\n1.0\n-2.184105 2.579232 10.115395\n2.184105 -2.579232 10.115395\n2.184105 2.579232 -10.115395\nBa Al Ge\n3 2 2\ndirect\n0.816529 0.816529 0.000000 Ba\n0.000000 0.500000 0.500000 Ba\n0.183471 0.183471 0.000000 Ba\n0.435567 0.935567 0.500000 Al\n0.564433 0.064433 0.500000 Al\n0.365006 0.365006 0.000000 Ge\n0.634994 0.634994 0.000000 Ge\n",
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"nelements": 3,
"elements": [
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],
"chemical_system": "Al-Ba-Ge",
"density": 4.4528984588933636,
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"volume": 227.93276514312726,
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"formula_full": "Ba3 Al2 Ge2",
"formula_reduced": "Ba3(AlGe)2",
"formula_anonymous": "A2B2C3",
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}
]
}