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{
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{
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"volume": 2062.7964516065185,
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"formula_full": "Ba32 Na8 B24 O72",
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{
"id": "mp-1246676",
"created_at": "2022-09-04T14:39:13.628340Z",
"structure_string": "Mg6 Al4 N8\n1.0\n6.184802 0.223748 0.063579\n-4.480770 5.725884 0.000000\n-0.031106 -0.024342 5.490208\nMg Al N\n6 4 8\ndirect\n0.224711 0.987655 0.968741 Mg\n0.775289 0.762944 0.531259 Mg\n0.775289 0.012345 0.031259 Mg\n0.224711 0.237056 0.468741 Mg\n0.000000 0.597934 0.750000 Mg\n0.000000 0.402066 0.250000 Mg\n0.620350 0.186231 0.606643 Al\n0.379650 0.565881 0.893357 Al\n0.379650 0.813769 0.393357 Al\n0.620350 0.434119 0.106643 Al\n0.240655 0.957071 0.566160 N\n0.759345 0.716416 0.933840 N\n0.759345 0.042929 0.433840 N\n0.240655 0.283584 0.066160 N\n0.717228 0.267354 0.933055 N\n0.282772 0.550126 0.566945 N\n0.282772 0.732646 0.066945 N\n0.717228 0.449874 0.433055 N\n",
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{
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"structure_string": "Tl2 F2\n1.0\n3.842626 0.000000 0.000000\n0.000000 3.842626 0.000000\n0.000000 0.000000 6.317102\nTl F\n2 2\ndirect\n0.000000 0.500000 0.753352 Tl\n0.500000 0.000000 0.246648 Tl\n0.500000 0.000000 0.853267 F\n0.000000 0.500000 0.146733 F\n",
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{
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"structure_string": "Li4 Sm2 P2 C2 O14\n1.0\n6.878087 0.000000 0.000000\n0.000000 4.972182 0.000000\n0.000000 0.479884 9.246913\nLi Sm P C O\n4 2 2 2 14\ndirect\n0.520170 0.798122 0.804315 Li\n0.979830 0.798122 0.804315 Li\n0.479830 0.201878 0.195685 Li\n0.020170 0.201878 0.195685 Li\n0.250000 0.256856 0.627084 Sm\n0.750000 0.743144 0.372916 Sm\n0.750000 0.265632 0.599454 P\n0.250000 0.734368 0.400546 P\n0.250000 0.257646 0.931551 C\n0.750000 0.742354 0.068449 C\n0.750000 0.728618 0.931539 O\n0.250000 0.027916 0.867933 O\n0.250000 0.476477 0.844159 O\n0.932912 0.127128 0.664974 O\n0.567088 0.127128 0.664974 O\n0.250000 0.760341 0.569585 O\n0.750000 0.573527 0.620316 O\n0.250000 0.426473 0.379684 O\n0.750000 0.239659 0.430415 O\n0.432912 0.872872 0.335026 O\n0.067088 0.872872 0.335026 O\n0.750000 0.523523 0.155841 O\n0.750000 0.972084 0.132067 O\n0.250000 0.271382 0.068461 O\n",
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{
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{
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"structure_string": "Ce1 As12 Ru4\n1.0\n-4.294093 4.294093 4.294093\n4.294093 -4.294093 4.294093\n4.294093 4.294093 -4.294093\nCe As Ru\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.850014 0.653133 0.503147 As\n0.149986 0.346867 0.496853 As\n0.149986 0.653133 0.803119 As\n0.850014 0.346867 0.196881 As\n0.653133 0.503147 0.850014 As\n0.346867 0.496853 0.149986 As\n0.653133 0.803119 0.149986 As\n0.346867 0.196881 0.850014 As\n0.503147 0.850014 0.653133 As\n0.496853 0.149986 0.346867 As\n0.803119 0.149986 0.653133 As\n0.196881 0.850014 0.346867 As\n0.500000 0.500000 0.500000 Ru\n0.500000 0.000000 0.000000 Ru\n0.000000 0.500000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n",
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{
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