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{
"id": "mp-1097683",
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"structure_string": "Y2 Ag1 Os1\n1.0\n-5.419202 6.096959 8.609450\n5.419202 -6.096959 8.609450\n5.419202 6.096959 -8.609450\nY Ag Os\n2 1 1\ndirect\n0.000000 0.279341 0.279341 Y\n0.000000 0.720659 0.720659 Y\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.500000 Os\n",
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{
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{
"id": "mp-1097139",
"created_at": "2022-09-04T14:42:28.472192Z",
"structure_string": "Zn1 Ga1 Ag2\n1.0\n-5.108586 5.384880 7.613199\n5.108586 -5.384880 7.613199\n5.108586 5.384880 -7.613199\nZn Ga Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Ga\n0.000000 0.250816 0.250816 Ag\n0.000000 0.749184 0.749184 Ag\n",
"nsites": 4,
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"density": 0.6954876815112087,
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"volume": 837.7296980579887,
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"updated_at": "2021-11-28T01:35:49.804000Z",
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{
"id": "mp-1182019",
"created_at": "2022-09-04T14:40:54.538272Z",
"structure_string": "H24 O12\n1.0\n5.199277 2.223072 -1.508027\n-8.137488 4.667261 5.782342\n0.855238 -6.104801 9.217123\nH O\n24 12\ndirect\n0.199948 0.656868 0.141936 H\n0.698648 0.125034 0.639204 H\n0.969427 0.310232 0.277833 H\n0.800052 0.343132 0.858064 H\n0.301352 0.874966 0.360796 H\n0.030573 0.689768 0.722167 H\n0.873307 0.409177 0.195680 H\n0.513464 0.824422 0.602789 H\n0.465989 0.140564 0.143498 H\n0.126693 0.590823 0.804320 H\n0.486536 0.175578 0.397211 H\n0.534011 0.859436 0.856502 H\n0.265533 0.254398 0.437511 H\n0.937408 0.316255 0.776155 H\n0.894776 0.938288 0.919623 H\n0.734467 0.745602 0.562489 H\n0.062592 0.683745 0.223845 H\n0.105224 0.061712 0.080377 H\n0.290760 0.384237 0.500293 H\n0.821740 0.987763 0.608195 H\n0.835711 0.083073 0.775073 H\n0.709240 0.615763 0.499707 H\n0.178260 0.012237 0.391805 H\n0.164289 0.916926 0.224927 H\n0.097827 0.612219 0.206603 O\n0.661268 0.884152 0.555947 O\n0.803957 0.300612 0.201217 O\n0.902173 0.387781 0.793397 O\n0.338732 0.115848 0.444053 O\n0.196043 0.699388 0.798783 O\n0.895573 0.156005 0.704989 O\n0.753513 0.964249 0.887372 O\n0.258465 0.342822 0.419007 O\n0.104427 0.843995 0.295011 O\n0.246487 0.035751 0.112628 O\n0.741535 0.657178 0.580993 O\n",
"nsites": 36,
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"elements": [
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"chemical_system": "H-O",
"density": 0.6956474677751493,
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"volume": 516.0385561050923,
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"formula_full": "H24 O12",
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"spacegroup": 2
},
{
"id": "mp-1096250",
"created_at": "2022-09-04T14:39:30.741305Z",
"structure_string": "Ti1 V1 Mo2\n1.0\n-4.440905 5.234248 7.457810\n4.440905 -5.234248 7.457810\n4.440905 5.234248 -7.457810\nTi V Mo\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.500000 0.500000 V\n0.000000 0.248196 0.248196 Mo\n0.000000 0.751804 0.751804 Mo\n",
"nsites": 4,
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"density": 0.6961131911739857,
"density_atomic": 0.00576850012792557,
"volume": 693.4211513034072,
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"formula_full": "Ti1 V1 Mo2",
"formula_reduced": "TiVMo2",
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"updated_at": "2021-11-28T01:34:38.522000Z",
"spacegroup": 71
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{
"id": "mp-1096345",
"created_at": "2022-09-04T14:44:11.037236Z",
"structure_string": "Al1 Ga1 Ru2\n1.0\n-4.864669 5.088529 7.197656\n4.864669 -5.088529 7.197656\n4.864669 5.088529 -7.197656\nAl Ga Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Ga\n0.000000 0.248948 0.248948 Ru\n0.000000 0.751052 0.751052 Ru\n",
"nsites": 4,
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"Ga",
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"density": 0.6963022423123616,
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"volume": 712.6833737277218,
"volume_molar": 107.29698984750068,
"formula_full": "Al1 Ga1 Ru2",
"formula_reduced": "AlGaRu2",
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"updated_at": "2021-11-28T01:36:27.872000Z",
"spacegroup": 71
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{
"id": "mp-1096546",
"created_at": "2022-09-04T14:43:10.658435Z",
"structure_string": "Sc1 Ga2 Os1\n1.0\n-5.182371 5.690263 7.572201\n5.182371 -5.690263 7.572201\n5.182371 5.690263 -7.572201\nSc Ga Os\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.267466 0.267466 Ga\n0.000000 0.732534 0.732534 Ga\n0.000000 0.500000 0.500000 Os\n",
"nsites": 4,
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"density": 0.6964836107807056,
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"volume": 893.1881753451976,
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"formula_full": "Sc1 Ga2 Os1",
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"updated_at": "2021-11-28T01:36:05.739000Z",
"spacegroup": 71
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{
"id": "mp-1097654",
"created_at": "2022-09-04T14:45:07.237921Z",
"structure_string": "Mn2 Co1 Tc1\n1.0\n-4.722794 4.795983 7.020720\n4.722794 -4.795983 7.020720\n4.722794 4.795983 -7.020720\nMn Co Tc\n2 1 1\ndirect\n0.000000 0.241959 0.241959 Mn\n0.000000 0.758041 0.758041 Mn\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Tc\n",
"nsites": 4,
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"elements": [
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],
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"density": 0.6965170539826151,
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"volume": 636.0895810674173,
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"formula_full": "Mn2 Co1 Tc1",
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"updated_at": "2021-11-28T01:36:52.562000Z",
"spacegroup": 71
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{
"id": "mp-1096064",
"created_at": "2022-09-04T14:39:13.368656Z",
"structure_string": "Zr1 Zn1 Pd2\n1.0\n-4.924554 5.617689 7.945197\n4.924554 -5.617689 7.945197\n4.924554 5.617689 -7.945197\nZr Zn Pd\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Zn\n0.000000 0.261111 0.261111 Pd\n0.000000 0.738889 0.738889 Pd\n",
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{
"id": "mp-1096357",
"created_at": "2022-09-04T14:46:58.364773Z",
"structure_string": "Ta1 Mn2 Ga1\n1.0\n-4.773255 6.280598 7.153424\n4.773255 -6.280598 7.153424\n4.773255 6.280598 -7.153424\nTa Mn Ga\n1 2 1\ndirect\n0.000000 0.500000 0.500000 Ta\n0.000000 0.262454 0.262454 Mn\n0.000000 0.737546 0.737546 Mn\n0.000000 0.000000 0.000000 Ga\n",
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"updated_at": "2021-11-28T01:37:47.328000Z",
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{
"id": "mp-1097156",
"created_at": "2022-09-04T14:43:01.484187Z",
"structure_string": "Ca1 Tl2 Pb1\n1.0\n-6.233171 6.751380 9.270306\n6.233171 -6.751380 9.270306\n6.233171 6.751380 -9.270306\nCa Tl Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.266097 0.266097 Tl\n0.000000 0.733903 0.733903 Tl\n0.000000 0.500000 0.500000 Pb\n",
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"updated_at": "2021-11-28T01:36:03.752000Z",
"spacegroup": 71
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{
"id": "mp-1097134",
"created_at": "2022-09-04T14:43:10.658600Z",
"structure_string": "La2 Cd1 Ag1\n1.0\n-5.849968 6.021407 8.404536\n5.849968 -6.021407 8.404536\n5.849968 6.021407 -8.404536\nLa Cd Ag\n2 1 1\ndirect\n0.000000 0.238918 0.238918 La\n0.000000 0.761082 0.761082 La\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
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"formula_full": "La2 Cd1 Ag1",
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"updated_at": "2021-11-28T01:36:09.365000Z",
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}
]
}