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{
"id": "mp-1215457",
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{
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{
"id": "mp-1227902",
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"structure_string": "Ca12 Al4 Fe4 Si12 O48\n1.0\n-6.039012 6.039012 6.039012\n6.039012 -6.039012 6.039012\n6.039012 6.039012 -6.039012\nCa Al Fe Si O\n12 4 4 12 48\ndirect\n0.124672 0.374672 0.750000 Ca\n0.375328 0.125328 0.250000 Ca\n0.250000 0.375328 0.125328 Ca\n0.750000 0.124672 0.374672 Ca\n0.125328 0.250000 0.375328 Ca\n0.374672 0.750000 0.124672 Ca\n0.875328 0.625328 0.250000 Ca\n0.624672 0.874672 0.750000 Ca\n0.750000 0.624672 0.874672 Ca\n0.250000 0.875328 0.625328 Ca\n0.874672 0.750000 0.624672 Ca\n0.625328 0.250000 0.875328 Ca\n0.500000 0.500000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.872924 0.122924 0.750000 Si\n0.627076 0.377076 0.250000 Si\n0.250000 0.627076 0.377076 Si\n0.750000 0.872924 0.122924 Si\n0.377076 0.250000 0.627076 Si\n0.122924 0.750000 0.872924 Si\n0.127076 0.877076 0.250000 Si\n0.372924 0.622924 0.750000 Si\n0.750000 0.372924 0.622924 Si\n0.250000 0.127076 0.877076 Si\n0.622924 0.750000 0.372924 Si\n0.877076 0.250000 0.127076 Si\n0.811273 0.507787 0.393787 O\n0.614000 0.417486 0.106213 O\n0.688727 0.082514 0.696513 O\n0.886000 0.992213 0.803487 O\n0.696513 0.688727 0.082514 O\n0.803487 0.886000 0.992213 O\n0.393787 0.811273 0.507787 O\n0.106213 0.614000 0.417486 O\n0.992213 0.803487 0.886000 O\n0.082514 0.696513 0.688727 O\n0.417486 0.106213 0.614000 O\n0.507787 0.393787 0.811273 O\n0.188727 0.492213 0.606213 O\n0.386000 0.582514 0.893787 O\n0.311273 0.917486 0.303487 O\n0.114000 0.007787 0.196513 O\n0.303487 0.311273 0.917486 O\n0.196513 0.114000 0.007787 O\n0.606213 0.188727 0.492213 O\n0.893787 0.386000 0.582514 O\n0.007787 0.196513 0.114000 O\n0.917486 0.303487 0.311273 O\n0.582514 0.893787 0.386000 O\n0.492213 0.606213 0.188727 O\n0.295683 0.491451 0.384175 O\n0.204317 0.588493 0.195768 O\n0.607275 0.911507 0.115825 O\n0.892725 0.008549 0.304232 O\n0.008549 0.304232 0.892725 O\n0.911507 0.115825 0.607275 O\n0.588493 0.195768 0.204317 O\n0.491451 0.384175 0.295683 O\n0.195768 0.204317 0.588493 O\n0.384175 0.295683 0.491451 O\n0.304232 0.892725 0.008549 O\n0.115825 0.607275 0.911507 O\n0.704317 0.508549 0.615825 O\n0.795683 0.411507 0.804232 O\n0.392725 0.088493 0.884175 O\n0.107275 0.991451 0.695768 O\n0.991451 0.695768 0.107275 O\n0.088493 0.884175 0.392725 O\n0.411507 0.804232 0.795683 O\n0.508549 0.615825 0.704317 O\n0.804232 0.795683 0.411507 O\n0.615825 0.704317 0.508549 O\n0.695768 0.107275 0.991451 O\n0.884175 0.392725 0.088493 O\n",
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"formula_full": "Ca12 Al4 Fe4 Si12 O48",
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{
"id": "mp-581510",
"created_at": "2022-09-04T14:40:32.571128Z",
"structure_string": "La16 Cd4 Co4\n1.0\n0.000000 7.059312 7.059312\n7.059312 0.000000 7.059312\n7.059312 7.059312 0.000000\nLa Cd Co\n16 4 4\ndirect\n0.940629 0.940629 0.559371 La\n0.559371 0.940629 0.559371 La\n0.559371 0.940629 0.940629 La\n0.689588 0.689588 0.310412 La\n0.154456 0.154456 0.536631 La\n0.310412 0.689588 0.689588 La\n0.154456 0.154456 0.154456 La\n0.536631 0.154456 0.154456 La\n0.310412 0.689588 0.310412 La\n0.310412 0.310412 0.689588 La\n0.689588 0.310412 0.689588 La\n0.940629 0.559371 0.559371 La\n0.559371 0.559371 0.940629 La\n0.154456 0.536631 0.154456 La\n0.689588 0.310412 0.310412 La\n0.940629 0.559371 0.940629 La\n0.236162 0.921279 0.921279 Cd\n0.921279 0.921279 0.921279 Cd\n0.921279 0.921279 0.236162 Cd\n0.921279 0.236162 0.921279 Cd\n0.920560 0.359813 0.359813 Co\n0.359813 0.359813 0.920560 Co\n0.359813 0.920560 0.359813 Co\n0.359813 0.359813 0.359813 Co\n",
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{
"id": "mp-1205907",
"created_at": "2022-09-04T14:40:53.492526Z",
"structure_string": "Ir1 Br6 N2\n1.0\n0.000000 5.144992 5.144992\n5.144992 0.000000 5.144992\n5.144992 5.144992 0.000000\nIr Br N\n1 6 2\ndirect\n0.000000 0.000000 0.000000 Ir\n0.760717 0.239283 0.239283 Br\n0.239283 0.760717 0.760717 Br\n0.239283 0.760717 0.239283 Br\n0.760717 0.239283 0.760717 Br\n0.239283 0.239283 0.760717 Br\n0.760717 0.760717 0.239283 Br\n0.250000 0.250000 0.250000 N\n0.750000 0.750000 0.750000 N\n",
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{
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{
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{
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},
{
"id": "mp-1206253",
"created_at": "2022-09-04T14:40:28.217559Z",
"structure_string": "Eu2 Bi3 Pd3\n1.0\n7.315047 0.000000 0.000000\n0.000000 7.315047 0.000000\n0.000000 0.000000 21.935341\nEu Bi Pd\n2 3 3\ndirect\n0.500000 0.500000 0.762671 Eu\n0.500000 0.500000 0.237329 Eu\n0.500000 0.500000 0.382170 Bi\n0.500000 0.500000 0.617830 Bi\n0.500000 0.500000 0.000000 Bi\n0.500000 0.500000 0.122330 Pd\n0.500000 0.500000 0.877670 Pd\n0.500000 0.500000 0.500000 Pd\n",
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{
"id": "mp-1245329",
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"structure_string": "Sn40 O40\n1.0\n11.329993 0.467410 0.172872\n0.492926 12.182149 -0.338039\n0.200422 -0.354438 12.536498\nSn O\n40 40\ndirect\n0.795536 0.261932 0.709361 Sn\n0.472250 0.194513 0.153640 Sn\n0.288693 0.440414 0.273079 Sn\n0.660003 0.574850 0.047835 Sn\n0.791719 0.239947 0.375959 Sn\n0.066731 0.677058 0.450532 Sn\n0.864761 0.011054 0.549242 Sn\n0.015922 0.874351 0.285448 Sn\n0.296512 0.909059 0.421415 Sn\n0.577942 0.077556 0.746142 Sn\n0.316888 0.872029 0.734360 Sn\n0.551806 0.078917 0.501960 Sn\n0.077647 0.396200 0.461354 Sn\n0.173313 0.871490 0.974344 Sn\n0.769012 0.128645 0.092611 Sn\n0.312861 0.985868 0.169337 Sn\n0.356225 0.594242 0.546825 Sn\n0.037331 0.611350 0.058082 Sn\n0.618055 0.969296 0.257935 Sn\n0.967152 0.006912 0.834257 Sn\n0.296858 0.135682 0.892111 Sn\n0.929437 0.417596 0.182156 Sn\n0.490464 0.718342 0.306693 Sn\n0.271191 0.414856 0.028289 Sn\n0.041960 0.188099 0.040070 Sn\n0.587951 0.892810 0.993559 Sn\n0.592225 0.333676 0.926132 Sn\n0.397847 0.316522 0.648365 Sn\n0.056017 0.696619 0.761607 Sn\n0.592345 0.538788 0.744318 Sn\n0.539182 0.376467 0.405682 Sn\n0.765589 0.884410 0.734428 Sn\n0.111165 0.352361 0.751343 Sn\n0.879815 0.468052 0.881160 Sn\n0.099076 0.123234 0.575839 Sn\n0.120014 0.165113 0.305598 Sn\n0.373078 0.692041 0.051206 Sn\n0.793988 0.750752 0.402472 Sn\n0.581557 0.776722 0.582468 Sn\n0.856427 0.555317 0.625939 Sn\n0.560966 0.726349 0.024003 O\n0.184925 0.055495 0.415072 O\n0.620019 0.198921 0.030368 O\n0.150697 0.813326 0.388272 O\n0.082905 0.417647 0.071811 O\n0.939365 0.837378 0.800995 O\n0.727688 0.573270 0.891376 O\n0.655344 0.793197 0.294775 O\n0.137153 0.524829 0.374348 O\n0.868076 0.907617 0.406707 O\n0.526545 0.242456 0.792942 O\n0.957591 0.714368 0.307800 O\n0.715392 0.968661 0.108814 O\n0.295659 0.928593 0.581233 O\n0.678453 0.630898 0.630395 O\n0.753930 0.433064 0.685377 O\n0.478367 0.246731 0.499543 O\n0.026525 0.234371 0.450567 O\n0.911300 0.468289 0.484467 O\n0.881136 0.265137 0.105483 O\n0.472120 0.463544 0.605262 O\n0.351503 0.249229 0.031804 O\n0.731570 0.120405 0.480234 O\n0.487503 0.917914 0.144303 O\n0.385780 0.484202 0.404152 O\n0.254014 0.830319 0.124545 O\n0.980588 0.258217 0.695690 O\n0.447395 0.747334 0.688657 O\n0.916843 0.067565 0.004104 O\n0.424283 0.017199 0.807862 O\n0.158661 0.408670 0.600927 O\n0.715239 0.155157 0.246819 O\n0.015545 0.615318 0.896915 O\n0.267617 0.016765 0.006741 O\n0.200790 0.313301 0.342493 O\n0.869536 0.528718 0.062041 O\n0.497443 0.676212 0.466379 O\n0.461225 0.335021 0.253993 O\n0.771965 0.314654 0.875836 O\n0.315638 0.766070 0.916410 O\n",
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}
]
}