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{
"id": "mp-1095933",
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{
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"formula_full": "Mg4 B8 H31",
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},
{
"id": "mp-1095733",
"created_at": "2022-09-04T14:45:13.362419Z",
"structure_string": "Ti1 Be2 Rh1\n1.0\n-7.868060 0.000000 -4.542627\n-7.754117 -1.246881 4.345272\n-4.619607 7.618852 -1.083859\nTi Be Rh\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.723150 0.000000 0.000000 Be\n0.276850 0.000000 0.000000 Be\n0.500000 0.000000 0.000000 Rh\n",
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"volume": 544.3795305817434,
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"formula_full": "Ti1 Be2 Rh1",
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"spacegroup": 139
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{
"id": "mp-1071539",
"created_at": "2022-09-04T14:43:21.799546Z",
"structure_string": "K2 O4\n1.0\n0.000000 7.325958 0.000000\n-6.050413 3.662979 2.008107\n7.236585 3.662979 7.934316\nK O\n2 4\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.243108 0.654416 0.763579 O\n0.161103 0.845584 0.736421 O\n0.756892 0.345584 0.236421 O\n0.838897 0.154416 0.263579 O\n",
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{
"id": "mp-1095748",
"created_at": "2022-09-04T14:46:24.695668Z",
"structure_string": "Mg2 Cd1 Hg1\n1.0\n-5.655705 6.048993 8.501463\n5.655705 -6.048993 8.501463\n5.655705 6.048993 -8.501463\nMg Cd Hg\n2 1 1\ndirect\n0.000000 0.251767 0.251767 Mg\n0.000000 0.748233 0.748233 Mg\n0.000000 0.000000 0.000000 Cd\n0.000000 0.500000 0.500000 Hg\n",
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"formula_full": "Mg2 Cd1 Hg1",
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{
"id": "mp-1190942",
"created_at": "2022-09-04T14:40:08.407353Z",
"structure_string": "Mg2 B4 H16\n1.0\n0.000000 5.670386 5.956295\n5.140078 0.000000 5.956295\n5.140078 5.670386 0.000000\nMg B H\n2 4 16\ndirect\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Mg\n0.141493 0.620395 0.084727 B\n0.620395 0.141493 0.153385 B\n0.153385 0.084727 0.620395 B\n0.084727 0.153385 0.141493 B\n0.236322 0.711826 0.058730 H\n0.711826 0.236322 0.993122 H\n0.993122 0.058730 0.711826 H\n0.058730 0.993122 0.236322 H\n0.069684 0.554209 0.273000 H\n0.554209 0.069684 0.103107 H\n0.103107 0.273000 0.554209 H\n0.273000 0.103107 0.069684 H\n0.994603 0.728287 0.023434 H\n0.728287 0.994603 0.253676 H\n0.253676 0.023434 0.728287 H\n0.023434 0.253676 0.994603 H\n0.266260 0.486659 0.981089 H\n0.486659 0.266260 0.265991 H\n0.265991 0.981089 0.486659 H\n0.981089 0.265991 0.266260 H\n",
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{
"id": "mp-1096201",
"created_at": "2022-09-04T14:47:27.299145Z",
"structure_string": "Mg2 Cd1 Ir1\n1.0\n-5.388597 6.264214 8.405292\n5.388597 -6.264214 8.405292\n5.388597 6.264214 -8.405292\nMg Cd Ir\n2 1 1\ndirect\n0.000000 0.267390 0.267390 Mg\n0.000000 0.732610 0.732610 Mg\n0.000000 0.000000 0.000000 Cd\n0.000000 0.500000 0.500000 Ir\n",
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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": "Zr1 Al1 Fe2\n1.0\n-4.556622 5.353902 7.537138\n4.556622 -5.353902 7.537138\n4.556622 5.353902 -7.537138\nZr Al Fe\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Al\n0.000000 0.263424 0.263424 Fe\n0.000000 0.736576 0.736576 Fe\n",
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]
}