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{
"id": "mp-1193708",
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{
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{
"id": "mp-1038674",
"created_at": "2022-09-04T14:45:41.928268Z",
"structure_string": "Sr1 Hf1 Mg30 O32\n1.0\n8.687001 0.000000 0.000000\n0.000000 8.687001 0.000000\n0.000000 0.000000 8.644591\nSr Hf Mg O\n1 1 30 32\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.000000 Hf\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.251672 0.251672 0.000000 Mg\n0.748328 0.251672 0.000000 Mg\n0.251672 0.748328 0.000000 Mg\n0.748328 0.748328 0.000000 Mg\n0.249385 0.249385 0.500000 Mg\n0.750615 0.249385 0.500000 Mg\n0.249385 0.750615 0.500000 Mg\n0.750615 0.750615 0.500000 Mg\n0.253912 0.000000 0.255374 Mg\n0.746088 0.000000 0.255374 Mg\n0.243475 0.500000 0.254500 Mg\n0.756525 0.500000 0.254500 Mg\n0.253912 0.000000 0.744626 Mg\n0.746088 0.000000 0.744626 Mg\n0.243475 0.500000 0.745500 Mg\n0.756525 0.500000 0.745500 Mg\n0.000000 0.253912 0.255374 Mg\n0.500000 0.243475 0.254500 Mg\n0.000000 0.746088 0.255374 Mg\n0.500000 0.756525 0.254500 Mg\n0.000000 0.253912 0.744626 Mg\n0.500000 0.243475 0.745500 Mg\n0.000000 0.746088 0.744626 Mg\n0.500000 0.756525 0.745500 Mg\n0.000000 0.000000 0.270304 O\n0.500000 0.000000 0.254281 O\n0.000000 0.500000 0.254281 O\n0.500000 0.500000 0.245277 O\n0.000000 0.000000 0.729696 O\n0.500000 0.000000 0.745719 O\n0.000000 0.500000 0.745719 O\n0.500000 0.500000 0.754723 O\n0.250448 0.250448 0.249617 O\n0.749552 0.250448 0.249617 O\n0.250448 0.749552 0.249617 O\n0.749552 0.749552 0.249617 O\n0.250448 0.250448 0.750383 O\n0.749552 0.250448 0.750383 O\n0.250448 0.749552 0.750383 O\n0.749552 0.749552 0.750383 O\n0.269700 0.000000 0.000000 O\n0.730300 0.000000 0.000000 O\n0.246697 0.500000 0.000000 O\n0.753303 0.500000 0.000000 O\n0.254346 0.000000 0.500000 O\n0.745654 0.000000 0.500000 O\n0.252347 0.500000 0.500000 O\n0.747653 0.500000 0.500000 O\n0.000000 0.269700 0.000000 O\n0.500000 0.246697 0.000000 O\n0.000000 0.730300 0.000000 O\n0.500000 0.753303 0.000000 O\n0.000000 0.254346 0.500000 O\n0.500000 0.252347 0.500000 O\n0.000000 0.745654 0.500000 O\n0.500000 0.747653 0.500000 O\n",
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{
"id": "mp-1100912",
"created_at": "2022-09-04T14:45:41.965674Z",
"structure_string": "V1 Mo1 O5\n1.0\n3.534312 0.001824 -1.455763\n-0.006257 4.879542 0.028522\n0.405204 0.040603 6.035872\nV Mo O\n1 1 5\ndirect\n0.149672 0.123548 0.301165 V\n0.847851 0.872883 0.693741 Mo\n0.007013 0.008414 0.010869 O\n0.145493 0.453676 0.293361 O\n0.317258 0.980185 0.632519 O\n0.683367 0.037171 0.366009 O\n0.849346 0.524122 0.702335 O\n",
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{
"id": "mp-1226163",
"created_at": "2022-09-04T14:45:41.996643Z",
"structure_string": "La4 Ce2 Te8\n1.0\n-4.816777 4.816777 4.808335\n4.816777 -4.816777 4.808335\n4.816777 4.816777 -4.808335\nLa Ce Te\n4 2 8\ndirect\n0.000087 0.875000 0.625087 La\n0.249913 0.375000 0.374913 La\n0.125000 0.750087 0.125087 La\n0.625000 0.999913 0.874913 La\n0.500000 0.500000 0.000000 Ce\n0.750000 0.250000 0.500000 Ce\n0.028428 0.278782 0.901423 Te\n0.377359 0.127005 0.098577 Te\n0.221572 0.622995 0.750354 Te\n0.872641 0.471218 0.249646 Te\n0.377005 0.127359 0.598577 Te\n0.528782 0.778428 0.401423 Te\n0.721218 0.622641 0.749646 Te\n0.872995 0.971572 0.250354 Te\n",
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"density": 6.9089532989487505,
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"formula_full": "La4 Ce2 Te8",
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{
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"created_at": "2022-09-04T14:45:42.026816Z",
"structure_string": "Ce1 Mg3\n1.0\n3.132934 0.000000 0.000000\n0.000000 5.312911 0.000000\n0.000000 0.000000 6.225466\nCe Mg\n1 3\ndirect\n0.500000 0.000000 0.154942 Ce\n0.000000 0.000000 0.652857 Mg\n0.000000 0.500000 0.360754 Mg\n0.500000 0.500000 0.831448 Mg\n",
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{
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"structure_string": "Th12 Tl12\n1.0\n6.583650 0.000000 0.000000\n0.000000 10.023669 0.000000\n0.000000 0.000000 10.958246\nTh Tl\n12 12\ndirect\n0.000000 0.750000 0.609341 Th\n0.500000 0.250000 0.390659 Th\n0.000000 0.250000 0.390659 Th\n0.500000 0.750000 0.609341 Th\n0.750000 0.630697 0.314996 Th\n0.250000 0.369303 0.685004 Th\n0.750000 0.130697 0.685004 Th\n0.250000 0.869303 0.314996 Th\n0.750000 0.535499 0.885239 Th\n0.250000 0.464501 0.114761 Th\n0.750000 0.035499 0.114761 Th\n0.250000 0.964501 0.885239 Th\n0.000000 0.750000 0.077554 Tl\n0.500000 0.250000 0.922446 Tl\n0.000000 0.250000 0.922446 Tl\n0.500000 0.750000 0.077554 Tl\n0.750000 0.949400 0.406685 Tl\n0.250000 0.050600 0.593315 Tl\n0.750000 0.449400 0.593315 Tl\n0.250000 0.550600 0.406685 Tl\n0.750000 0.872307 0.851377 Tl\n0.250000 0.127693 0.148623 Tl\n0.750000 0.372307 0.148623 Tl\n0.250000 0.627693 0.851377 Tl\n",
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{
"id": "mp-1174178",
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"structure_string": "Li6 Mn2 Co2 O10\n1.0\n-2.916875 0.000000 0.000000\n1.455471 6.410024 0.000000\n-0.133256 -1.885672 -9.725549\nLi Mn Co O\n6 2 2 10\ndirect\n0.116437 0.202465 0.308759 Li\n0.905641 0.813397 0.704407 Li\n0.513383 0.011219 0.507201 Li\n0.293753 0.581574 0.888992 Li\n0.678164 0.392623 0.084029 Li\n0.610191 0.206976 0.803756 Li\n0.991664 0.009759 0.995733 Mn\n0.808407 0.596501 0.402128 Mn\n0.397261 0.798223 0.196807 Co\n0.195654 0.379272 0.615587 Co\n0.519849 0.083216 0.133714 O\n0.348926 0.685426 0.528692 O\n0.959760 0.877269 0.338902 O\n0.755057 0.505522 0.739406 O\n0.129261 0.277373 0.957373 O\n0.671141 0.325340 0.449748 O\n0.447082 0.911971 0.871978 O\n0.057748 0.110464 0.643005 O\n0.828978 0.716994 0.060723 O\n0.271644 0.514416 0.269060 O\n",
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"formula_full": "Li6 Mn2 Co2 O10",
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{
"id": "mp-8975",
"created_at": "2022-09-04T14:45:41.730097Z",
"structure_string": "Hg12 As8 O32\n1.0\n12.034530 0.000000 0.000000\n0.000000 6.676884 0.000000\n0.000000 1.684573 10.241901\nHg As O\n12 8 32\ndirect\n0.171149 0.089165 0.658018 Hg\n0.671149 0.410835 0.341982 Hg\n0.828851 0.910835 0.341982 Hg\n0.328851 0.589165 0.658018 Hg\n0.897934 0.675821 0.700960 Hg\n0.397934 0.824179 0.299040 Hg\n0.102066 0.324179 0.299040 Hg\n0.602066 0.175821 0.700960 Hg\n0.118982 0.830246 0.045566 Hg\n0.618982 0.669754 0.954434 Hg\n0.881018 0.169754 0.954434 Hg\n0.381018 0.330246 0.045566 Hg\n0.366956 0.906090 0.901875 As\n0.866956 0.593910 0.098125 As\n0.633044 0.093910 0.098125 As\n0.133044 0.406090 0.901875 As\n0.905220 0.198735 0.606024 As\n0.405220 0.301265 0.393976 As\n0.094780 0.801265 0.393976 As\n0.594780 0.698735 0.606024 As\n0.445606 0.119504 0.870492 O\n0.945606 0.380496 0.129508 O\n0.554394 0.880496 0.129508 O\n0.054394 0.619504 0.870492 O\n0.442136 0.680801 0.914023 O\n0.942136 0.819199 0.085977 O\n0.557864 0.319199 0.085977 O\n0.057864 0.180801 0.914023 O\n0.273179 0.869464 0.779644 O\n0.773179 0.630536 0.220356 O\n0.726821 0.130536 0.220356 O\n0.226821 0.369464 0.779644 O\n0.291024 0.915312 0.044436 O\n0.791024 0.584688 0.955564 O\n0.708976 0.084688 0.955564 O\n0.208976 0.415312 0.044436 O\n0.813677 0.181850 0.483830 O\n0.313677 0.318150 0.516170 O\n0.186323 0.818150 0.516170 O\n0.686323 0.681850 0.483830 O\n0.461306 0.761411 0.547193 O\n0.961306 0.738589 0.452807 O\n0.538694 0.238589 0.452807 O\n0.038694 0.261411 0.547193 O\n0.582690 0.480783 0.723262 O\n0.082690 0.019217 0.276738 O\n0.417310 0.519217 0.276738 O\n0.917310 0.980783 0.723262 O\n0.643093 0.867210 0.706345 O\n0.143093 0.632790 0.293655 O\n0.356907 0.132790 0.293655 O\n0.856907 0.367210 0.706345 O\n",
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{
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"elements": [
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],
"chemical_system": "B-N",
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"updated_at": "2021-11-28T01:37:13.841000Z",
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},
{
"id": "mp-866139",
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"structure_string": "Ti1 Be2 Ir1\n1.0\n0.000000 2.840591 2.840591\n2.840591 0.000000 2.840591\n2.840591 2.840591 0.000000\nTi Be Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750000 0.750000 0.750000 Be\n0.250000 0.250000 0.250000 Be\n0.500000 0.500000 0.500000 Ir\n",
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"chemical_system": "Be-Ir-Ti",
"density": 9.349643674601415,
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"volume": 45.84121456976108,
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"formula_full": "Ti1 Be2 Ir1",
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{
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"structure_string": "Ce1 Ga1 O3\n1.0\n3.894384 0.000000 0.000000\n0.000000 3.894384 0.000000\n0.000000 0.000000 3.894384\nCe Ga O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Ga\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n",
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]
}