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{
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{
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"structure_string": "Se16 S8 N16 Cl16\n1.0\n7.603872 0.000000 0.000000\n0.000000 10.877002 0.000000\n0.000000 0.000000 17.223629\nSe S N Cl\n16 8 16 16\ndirect\n0.716067 0.144880 0.073657 Se\n0.862270 0.450096 0.398037 Se\n0.637730 0.450096 0.898037 Se\n0.283933 0.855120 0.926343 Se\n0.716067 0.644880 0.426343 Se\n0.783933 0.644880 0.926343 Se\n0.362270 0.049904 0.398037 Se\n0.137730 0.549904 0.601963 Se\n0.216067 0.355120 0.073657 Se\n0.862270 0.950096 0.101963 Se\n0.783933 0.144880 0.573657 Se\n0.283933 0.355120 0.573657 Se\n0.362270 0.549904 0.101963 Se\n0.637730 0.950096 0.601963 Se\n0.216067 0.855120 0.426343 Se\n0.137730 0.049904 0.898037 Se\n0.790261 0.605392 0.261886 S\n0.209739 0.894608 0.761886 S\n0.290261 0.394608 0.238114 S\n0.709739 0.105392 0.738114 S\n0.709739 0.605392 0.761886 S\n0.790261 0.105392 0.238114 S\n0.290261 0.894608 0.261886 S\n0.209739 0.394608 0.738114 S\n0.377742 0.015692 0.295080 N\n0.877742 0.984308 0.204920 N\n0.206047 0.311947 0.174337 N\n0.293953 0.811947 0.825663 N\n0.706047 0.188053 0.174337 N\n0.706047 0.688053 0.325663 N\n0.793953 0.688053 0.825663 N\n0.293953 0.311947 0.674337 N\n0.206047 0.811947 0.325663 N\n0.622258 0.484308 0.795080 N\n0.122258 0.015692 0.795080 N\n0.793953 0.188053 0.674337 N\n0.122258 0.515692 0.704920 N\n0.877742 0.484308 0.295080 N\n0.622258 0.984308 0.704920 N\n0.377742 0.515692 0.204920 N\n0.320211 0.537819 0.933487 Cl\n0.895659 0.821412 0.612540 Cl\n0.679789 0.962181 0.433487 Cl\n0.395659 0.178588 0.887460 Cl\n0.179789 0.537819 0.433487 Cl\n0.179789 0.037819 0.066513 Cl\n0.604341 0.821412 0.112540 Cl\n0.320211 0.037819 0.566513 Cl\n0.820211 0.462181 0.566513 Cl\n0.395659 0.678588 0.612540 Cl\n0.104341 0.678588 0.112540 Cl\n0.604341 0.321412 0.387460 Cl\n0.820211 0.962181 0.933487 Cl\n0.104341 0.178588 0.387460 Cl\n0.679789 0.462181 0.066513 Cl\n0.895659 0.321412 0.887460 Cl\n",
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{
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{
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{
"id": "mp-1198102",
"created_at": "2022-09-04T14:40:07.293773Z",
"structure_string": "Sb4 H48 C12 N6 Cl18\n1.0\n9.354150 0.000000 0.000000\n0.000000 9.710944 0.000000\n0.000000 1.523139 14.616411\nSb H C N Cl\n4 48 12 6 18\ndirect\n0.196570 0.998789 0.502866 Sb\n0.803430 0.998789 0.002866 Sb\n0.700089 0.325919 0.339204 Sb\n0.299911 0.325919 0.839204 Sb\n0.264072 0.721932 0.775389 H\n0.735928 0.721932 0.275389 H\n0.285884 0.890842 0.739800 H\n0.714116 0.890842 0.239800 H\n0.112800 0.647384 0.438490 H\n0.887200 0.647384 0.938490 H\n0.033578 0.499332 0.422476 H\n0.966422 0.499332 0.922476 H\n0.142697 0.039228 0.203559 H\n0.857303 0.039228 0.703559 H\n0.119252 0.130028 0.099980 H\n0.880748 0.130028 0.599980 H\n0.511716 0.776484 0.735325 H\n0.488284 0.776484 0.235325 H\n0.490183 0.713079 0.853774 H\n0.509817 0.713079 0.353774 H\n0.511032 0.894619 0.822494 H\n0.488968 0.894619 0.322494 H\n0.126136 0.861298 0.866827 H\n0.873864 0.861298 0.366827 H\n0.287320 0.949825 0.893883 H\n0.712680 0.949825 0.393883 H\n0.264983 0.769980 0.933047 H\n0.735017 0.769980 0.433047 H\n0.218507 0.551500 0.581069 H\n0.781493 0.551500 0.081069 H\n0.135402 0.388534 0.564971 H\n0.864598 0.388534 0.064971 H\n0.028153 0.537007 0.583597 H\n0.971847 0.537007 0.083597 H\n0.262952 0.383418 0.418385 H\n0.737048 0.383418 0.918385 H\n0.243287 0.527673 0.332163 H\n0.756713 0.527673 0.832163 H\n0.345608 0.545263 0.433986 H\n0.654392 0.545263 0.933986 H\n0.055149 0.267155 0.220524 H\n0.944851 0.267155 0.720524 H\n0.207940 0.336459 0.156653 H\n0.792060 0.336459 0.656653 H\n0.232792 0.241521 0.266627 H\n0.767208 0.241521 0.766627 H\n0.367431 0.174221 0.082545 H\n0.632569 0.174221 0.582545 H\n0.399104 0.091172 0.195240 H\n0.600896 0.091172 0.695240 H\n0.335990 0.992049 0.106046 H\n0.664010 0.992049 0.606046 H\n0.467603 0.798329 0.801235 C\n0.532397 0.798329 0.301235 C\n0.241547 0.851408 0.877919 C\n0.758453 0.851408 0.377919 C\n0.126108 0.501370 0.552983 C\n0.873892 0.501370 0.052983 C\n0.252977 0.496114 0.405506 C\n0.747023 0.496114 0.905506 C\n0.167773 0.251143 0.204392 C\n0.832227 0.251143 0.704392 C\n0.331990 0.091963 0.134227 C\n0.668010 0.091963 0.634227 C\n0.309700 0.813406 0.792340 N\n0.690300 0.813406 0.292340 N\n0.122389 0.540675 0.452328 N\n0.877611 0.540675 0.952328 N\n0.181580 0.121041 0.159761 N\n0.818420 0.121041 0.659761 N\n0.008004 0.849118 0.571373 Cl\n0.991996 0.849118 0.071373 Cl\n0.158440 0.878414 0.350001 Cl\n0.841560 0.878414 0.850001 Cl\n0.380696 0.818513 0.550907 Cl\n0.619304 0.818513 0.050907 Cl\n0.490655 0.159386 0.390367 Cl\n0.509345 0.159386 0.890367 Cl\n0.227645 0.094259 0.666007 Cl\n0.772355 0.094259 0.166007 Cl\n0.965013 0.196554 0.466528 Cl\n0.034987 0.196554 0.966528 Cl\n0.890506 0.525325 0.290617 Cl\n0.109494 0.525325 0.790617 Cl\n0.647059 0.455020 0.467959 Cl\n0.352941 0.455020 0.967959 Cl\n0.537158 0.452681 0.232219 Cl\n0.462842 0.452681 0.732219 Cl\n",
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"formula_full": "Sb4 H48 C12 N6 Cl18",
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}
]
}