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{
"id": "mp-19855",
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"structure_string": "Cr28 C12\n1.0\n4.505687 0.000000 0.000000\n0.000000 6.944503 0.000000\n0.000000 0.000000 12.038149\nCr C\n28 12\ndirect\n0.058855 0.064905 0.811683 Cr\n0.558855 0.435095 0.688317 Cr\n0.941145 0.564905 0.188317 Cr\n0.441145 0.935095 0.311683 Cr\n0.941145 0.935095 0.188317 Cr\n0.441145 0.564905 0.311683 Cr\n0.058855 0.435095 0.811683 Cr\n0.558855 0.064905 0.688317 Cr\n0.250489 0.067019 0.021619 Cr\n0.750489 0.432981 0.478381 Cr\n0.749511 0.567019 0.978381 Cr\n0.249511 0.932981 0.521619 Cr\n0.749511 0.932981 0.978381 Cr\n0.249511 0.567019 0.521619 Cr\n0.250489 0.432981 0.021619 Cr\n0.750489 0.067019 0.478381 Cr\n0.241715 0.750000 0.916765 Cr\n0.741715 0.750000 0.583235 Cr\n0.758285 0.250000 0.083235 Cr\n0.258285 0.250000 0.416765 Cr\n0.257518 0.750000 0.704137 Cr\n0.757518 0.750000 0.795863 Cr\n0.742482 0.250000 0.295863 Cr\n0.242482 0.250000 0.204137 Cr\n0.442145 0.750000 0.126616 Cr\n0.942145 0.750000 0.373384 Cr\n0.557855 0.250000 0.873384 Cr\n0.057855 0.250000 0.626616 Cr\n0.531737 0.033447 0.155776 C\n0.031737 0.466553 0.344224 C\n0.468263 0.533447 0.844224 C\n0.968263 0.966553 0.655776 C\n0.468263 0.966553 0.844224 C\n0.968263 0.533447 0.655776 C\n0.531737 0.466553 0.155776 C\n0.031737 0.033447 0.344224 C\n0.033870 0.750000 0.062867 C\n0.533870 0.750000 0.437133 C\n0.966130 0.250000 0.937133 C\n0.466130 0.250000 0.562867 C\n",
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{
"id": "mp-865496",
"created_at": "2022-09-04T14:48:29.321093Z",
"structure_string": "V2 Ir6\n1.0\n2.732930 -4.733574 0.000000\n2.732930 4.733574 0.000000\n0.000000 0.000000 4.357791\nV Ir\n2 6\ndirect\n0.333333 0.666667 0.750000 V\n0.666667 0.333333 0.250000 V\n0.167503 0.335006 0.250000 Ir\n0.664994 0.832497 0.250000 Ir\n0.167503 0.832497 0.250000 Ir\n0.832497 0.664994 0.750000 Ir\n0.335006 0.167503 0.750000 Ir\n0.832497 0.167503 0.750000 Ir\n",
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"density": 18.485992220668546,
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"formula_full": "V2 Ir6",
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},
{
"id": "mp-553901",
"created_at": "2022-09-04T14:48:29.341517Z",
"structure_string": "H24 Ru4 N12 Cl12 O4\n1.0\n11.645963 0.000000 0.000000\n0.000000 6.793994 0.000000\n0.000000 5.513986 9.933941\nH Ru N Cl O\n24 4 12 12 4\ndirect\n0.595643 0.224213 0.327452 H\n0.888047 0.016182 0.357285 H\n0.743630 0.979934 0.921979 H\n0.095643 0.775787 0.172548 H\n0.611953 0.016182 0.857285 H\n0.388047 0.983818 0.142715 H\n0.540440 0.367370 0.172593 H\n0.141419 0.518580 0.277145 H\n0.904357 0.224213 0.827452 H\n0.641419 0.481420 0.222855 H\n0.040440 0.632630 0.327407 H\n0.194145 0.187147 0.637588 H\n0.959560 0.367370 0.672593 H\n0.305855 0.187147 0.137588 H\n0.858581 0.481420 0.722855 H\n0.404357 0.775787 0.672548 H\n0.756370 0.979934 0.421979 H\n0.358581 0.518580 0.777145 H\n0.111953 0.983818 0.642715 H\n0.694145 0.812853 0.862412 H\n0.459560 0.632630 0.827407 H\n0.805855 0.812853 0.362412 H\n0.256370 0.020066 0.078021 H\n0.243630 0.020066 0.578021 H\n0.240121 0.804251 0.349159 Ru\n0.740121 0.195749 0.150841 Ru\n0.759879 0.195749 0.650841 Ru\n0.259879 0.804251 0.849159 Ru\n0.155111 0.601644 0.879915 N\n0.695004 0.975343 0.847185 N\n0.844889 0.398356 0.120085 N\n0.614665 0.333476 0.228027 N\n0.885335 0.333476 0.728027 N\n0.195004 0.024657 0.652815 N\n0.655111 0.398356 0.620085 N\n0.385335 0.666524 0.771973 N\n0.304996 0.024657 0.152815 N\n0.114665 0.666524 0.271973 N\n0.344889 0.601644 0.379915 N\n0.804996 0.975343 0.347185 N\n0.154625 0.580402 0.569524 Cl\n0.654625 0.419598 0.930476 Cl\n0.845375 0.419598 0.430476 Cl\n0.603654 0.909659 0.195862 Cl\n0.866803 0.008875 0.069791 Cl\n0.366803 0.991125 0.430209 Cl\n0.633197 0.008875 0.569791 Cl\n0.133197 0.991125 0.930209 Cl\n0.345375 0.580402 0.069524 Cl\n0.103654 0.090341 0.304138 Cl\n0.896346 0.909659 0.695862 Cl\n0.396346 0.090341 0.804138 Cl\n0.581156 0.527976 0.596601 O\n0.081156 0.472024 0.903399 O\n0.418844 0.472024 0.403399 O\n0.918844 0.527976 0.096601 O\n",
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"formula_full": "H24 Ru4 N12 Cl12 O4",
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"spacegroup": 14
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{
"id": "mp-631288",
"created_at": "2022-09-04T14:48:29.363425Z",
"structure_string": "La1 Ge1 Os1\n1.0\n0.000000 3.372592 3.372592\n3.372592 0.000000 3.372592\n3.372592 3.372592 0.000000\nLa Ge Os\n1 1 1\ndirect\n0.750000 0.750000 0.750000 La\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Os\n",
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{
"id": "mp-9922",
"created_at": "2022-09-04T14:48:29.366263Z",
"structure_string": "Hf2 S6\n1.0\n3.611567 0.000000 0.000000\n0.000000 5.149210 0.000000\n0.000000 1.180892 9.633923\nHf S\n2 6\ndirect\n0.250000 0.716894 0.643291 Hf\n0.750000 0.283106 0.356709 Hf\n0.250000 0.116487 0.195640 S\n0.750000 0.883513 0.804360 S\n0.750000 0.761366 0.450333 S\n0.250000 0.238634 0.549667 S\n0.750000 0.478186 0.805773 S\n0.250000 0.521814 0.194227 S\n",
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"spacegroup": 11
},
{
"id": "mp-15845",
"created_at": "2022-09-04T14:48:29.342151Z",
"structure_string": "Sr2 Li8 N4\n1.0\n-1.914856 1.914856 13.532012\n1.914856 -1.914856 13.532012\n1.914856 1.914856 -13.532012\nSr Li N\n2 8 4\ndirect\n0.750000 0.250000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.853722 0.353722 0.500000 Li\n0.103722 0.103722 0.000000 Li\n0.177829 0.677829 0.500000 Li\n0.427829 0.427829 0.000000 Li\n0.572171 0.572171 0.000000 Li\n0.896278 0.896278 0.000000 Li\n0.646278 0.146278 0.500000 Li\n0.322171 0.822171 0.500000 Li\n0.818029 0.818029 0.000000 N\n0.568029 0.068029 0.500000 N\n0.931971 0.431971 0.500000 N\n0.181971 0.181971 0.000000 N\n",
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{
"id": "mp-771323",
"created_at": "2022-09-04T14:48:29.367248Z",
"structure_string": "Tm8 Ti8 O28\n1.0\n5.282933 0.000000 0.000000\n0.000000 7.476049 0.000000\n0.000000 1.899447 13.009487\nTm Ti O\n8 8 28\ndirect\n0.775803 0.765115 0.926416 Tm\n0.358542 0.858836 0.560926 Tm\n0.246126 0.713571 0.136121 Tm\n0.778536 0.644461 0.385753 Tm\n0.278536 0.355539 0.614247 Tm\n0.746126 0.286429 0.863879 Tm\n0.858542 0.141164 0.439074 Tm\n0.275803 0.234885 0.073584 Tm\n0.282390 0.930362 0.320983 Ti\n0.769679 0.969957 0.121846 Ti\n0.793514 0.590437 0.671226 Ti\n0.268451 0.530713 0.874055 Ti\n0.768451 0.469287 0.125945 Ti\n0.293514 0.409563 0.328774 Ti\n0.269679 0.030043 0.878154 Ti\n0.782390 0.069638 0.679017 Ti\n0.429384 0.993494 0.177810 O\n0.564713 0.928229 0.408732 O\n0.663842 0.827963 0.682755 O\n0.360779 0.779300 0.880995 O\n0.064856 0.857218 0.432013 O\n0.045363 0.934819 0.025657 O\n0.951891 0.867288 0.233789 O\n0.100827 0.636700 0.617910 O\n0.927957 0.579469 0.823505 O\n0.386833 0.673538 0.304615 O\n0.644766 0.728266 0.088384 O\n0.587967 0.586493 0.550920 O\n0.542386 0.448998 0.972850 O\n0.453739 0.482010 0.763384 O\n0.953739 0.517990 0.236616 O\n0.042386 0.551002 0.027150 O\n0.087967 0.413507 0.449080 O\n0.144766 0.271734 0.911616 O\n0.886833 0.326462 0.695385 O\n0.427957 0.420531 0.176495 O\n0.600827 0.363300 0.382090 O\n0.451891 0.132712 0.766211 O\n0.545363 0.065181 0.974343 O\n0.564856 0.142782 0.567987 O\n0.860779 0.220700 0.119005 O\n0.163842 0.172037 0.317245 O\n0.064713 0.071771 0.591268 O\n0.929384 0.006506 0.822190 O\n",
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{
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"structure_string": "Pm2 Hg1 Ge1\n1.0\n0.000000 3.733073 3.733073\n3.733073 0.000000 3.733073\n3.733073 3.733073 0.000000\nPm Hg Ge\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.750000 0.750000 Pm\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Ge\n",
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{
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"structure_string": "Ta2 O5\n1.0\n-2.651726 2.651726 4.793525\n2.651726 -2.651726 4.793525\n2.651726 2.651726 -4.793525\nTa O\n2 5\ndirect\n0.198089 0.198089 0.000000 Ta\n0.801911 0.801911 0.000000 Ta\n0.000000 0.000000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n",
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{
"id": "mp-1212553",
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"structure_string": "H14 C4 S2 Br2 N8\n1.0\n5.485624 0.206218 0.337215\n-1.692221 7.257729 -0.540977\n0.670352 0.209402 10.506982\nH C S Br N\n14 4 2 2 8\ndirect\n0.946784 0.080332 0.311296 H\n0.053216 0.919668 0.688704 H\n0.287296 0.520318 0.610717 H\n0.712704 0.479682 0.389283 H\n0.248340 0.934760 0.276924 H\n0.751660 0.065240 0.723076 H\n0.148985 0.466351 0.119179 H\n0.851015 0.533649 0.880821 H\n0.564873 0.055817 0.871645 H\n0.435127 0.944183 0.128355 H\n0.701253 0.254521 0.432460 H\n0.298747 0.745479 0.567540 H\n0.039238 0.394850 0.778977 H\n0.960762 0.605150 0.221023 H\n0.223074 0.141995 0.161487 C\n0.776926 0.858005 0.838513 C\n0.057776 0.655458 0.728013 C\n0.942224 0.344542 0.271987 C\n0.332538 0.251450 0.025609 S\n0.667462 0.748550 0.974391 S\n0.255908 0.197712 0.622476 Br\n0.744092 0.802288 0.377524 Br\n0.026743 0.486127 0.198978 N\n0.973257 0.513873 0.801022 N\n0.236347 0.645421 0.631057 N\n0.763653 0.354579 0.368943 N\n0.033857 0.186430 0.251921 N\n0.966143 0.813570 0.748079 N\n0.689864 0.002432 0.807438 N\n0.310136 0.997568 0.192562 N\n",
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},
{
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],
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},
{
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]
}