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{
"id": "mp-1030325",
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"structure_string": "Te6 Mo3 W1 Se2\n1.0\n1.749634 -3.030455 0.000000\n1.749634 3.030455 0.000000\n0.000000 0.000000 39.559892\nTe Mo W Se\n6 3 1 2\ndirect\n0.333333 0.666667 0.328114 Te\n0.333333 0.666667 0.704126 Te\n0.666667 0.333333 0.047617 Te\n0.666667 0.333333 0.140229 Te\n0.333333 0.666667 0.235500 Te\n0.333333 0.666667 0.610926 Te\n0.333333 0.666667 0.093901 Mo\n0.333333 0.666667 0.469661 Mo\n0.666667 0.333333 0.281826 Mo\n0.666667 0.333333 0.657531 W\n0.666667 0.333333 0.428738 Se\n0.666667 0.333333 0.510577 Se\n",
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{
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{
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"structure_string": "Ho1 B2 Rh3\n1.0\n2.713530 -4.699971 0.000000\n2.713530 4.699971 0.000000\n0.000000 0.000000 3.129264\nHo B Rh\n1 2 3\ndirect\n0.000000 0.000000 0.500000 Ho\n0.666667 0.333333 0.500000 B\n0.333333 0.666667 0.500000 B\n0.000000 0.500000 0.000000 Rh\n0.500000 0.500000 0.000000 Rh\n0.500000 0.000000 0.000000 Rh\n",
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"formula_full": "Ho1 B2 Rh3",
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"formula_anonymous": "AB2C3",
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"updated_at": "2021-11-28T01:36:29.615000Z",
"spacegroup": 191
},
{
"id": "mp-1147711",
"created_at": "2022-09-04T14:44:18.652566Z",
"structure_string": "Ba4 Pd3 Br1 O6\n1.0\n-4.102744 4.102744 4.102744\n4.102744 -4.102744 4.102744\n4.102744 4.102744 -4.102744\nBa Pd Br O\n4 3 1 6\ndirect\n0.000000 0.500000 0.000000 Ba\n0.500000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Pd\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.000000 0.000000 0.000000 Br\n0.250000 0.750000 0.500000 O\n0.750000 0.250000 0.500000 O\n0.500000 0.250000 0.750000 O\n0.500000 0.750000 0.250000 O\n0.250000 0.500000 0.750000 O\n0.750000 0.500000 0.250000 O\n",
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"formula_full": "Ba4 Pd3 Br1 O6",
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{
"id": "mp-1212924",
"created_at": "2022-09-04T14:44:18.656863Z",
"structure_string": "Er16 Cd4 Ni4\n1.0\n0.000000 6.705680 6.705680\n6.705680 0.000000 6.705680\n6.705680 6.705680 0.000000\nEr Cd Ni\n16 4 4\ndirect\n0.349371 0.349371 0.349371 Er\n0.349371 0.349371 0.951888 Er\n0.349371 0.951888 0.349371 Er\n0.951888 0.349371 0.349371 Er\n0.810419 0.189581 0.189581 Er\n0.189581 0.810419 0.810419 Er\n0.189581 0.810419 0.189581 Er\n0.810419 0.189581 0.810419 Er\n0.189581 0.189581 0.810419 Er\n0.810419 0.810419 0.189581 Er\n0.937029 0.562971 0.562971 Er\n0.562971 0.937029 0.937029 Er\n0.562971 0.937029 0.562971 Er\n0.937029 0.562971 0.937029 Er\n0.562971 0.562971 0.937029 Er\n0.937029 0.937029 0.562971 Er\n0.581757 0.581757 0.581757 Cd\n0.581757 0.581757 0.254728 Cd\n0.581757 0.254728 0.581757 Cd\n0.254728 0.581757 0.581757 Cd\n0.142473 0.142473 0.142473 Ni\n0.142473 0.142473 0.572581 Ni\n0.142473 0.572581 0.142473 Ni\n0.572581 0.142473 0.142473 Ni\n",
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"density": 9.253424548995586,
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"volume": 603.0571485149809,
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"formula_full": "Er16 Cd4 Ni4",
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"spacegroup": 216
},
{
"id": "mp-865443",
"created_at": "2022-09-04T14:44:17.685098Z",
"structure_string": "Lu1 Rh2 Pb1\n1.0\n0.000000 3.338752 3.338752\n3.338752 0.000000 3.338752\n3.338752 3.338752 0.000000\nLu Rh Pb\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Lu\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
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"density": 13.1167939073448,
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"formula_full": "Lu1 Rh2 Pb1",
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"updated_at": "2021-11-28T01:36:30.651000Z",
"spacegroup": 225
},
{
"id": "mp-631526",
"created_at": "2022-09-04T14:44:17.693862Z",
"structure_string": "Si1 B1 Pb1\n1.0\n0.000000 3.159299 3.159299\n3.159299 0.000000 3.159299\n3.159299 3.159299 0.000000\nSi B Pb\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Si\n0.000000 0.000000 0.000000 B\n0.500000 0.500000 0.500000 Pb\n",
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{
"id": "mp-1020144",
"created_at": "2022-09-04T14:44:16.649942Z",
"structure_string": "Na16 Be32 B32 O88\n1.0\n8.906096 0.000000 0.000000\n-4.436716 12.077569 0.000000\n-0.005278 -0.012040 15.365355\nNa Be B O\n16 32 32 88\ndirect\n0.758079 0.782304 0.103174 Na\n0.607509 0.270534 0.209551 Na\n0.319464 0.395023 0.711563 Na\n0.756366 0.311176 0.970738 Na\n0.775506 0.847594 0.567521 Na\n0.172096 0.900453 0.604760 Na\n0.637531 0.808430 0.346674 Na\n0.283534 0.858874 0.840473 Na\n0.805256 0.374882 0.510814 Na\n0.126493 0.304707 0.005663 Na\n0.255099 0.324821 0.245732 Na\n0.668664 0.343907 0.744008 Na\n0.168441 0.372948 0.467635 Na\n0.653332 0.846095 0.819023 Na\n0.156391 0.827655 0.069766 Na\n0.268973 0.820480 0.311496 Na\n0.496918 0.663534 0.695574 Be\n0.254097 0.159289 0.609892 Be\n0.975486 0.133854 0.867888 Be\n0.987482 0.141585 0.359390 Be\n0.491968 0.152169 0.869035 Be\n0.004495 0.660122 0.704094 Be\n0.962856 0.546273 0.368226 Be\n0.754634 0.155883 0.619943 Be\n0.751733 0.634007 0.444234 Be\n0.449704 0.531158 0.369805 Be\n0.976950 0.623410 0.196943 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{
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{
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{
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{
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}