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{
"id": "mp-1203796",
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"structure_string": "K4 Ru4 N16 O32\n1.0\n10.417126 0.000000 0.000000\n0.000000 8.769761 0.000000\n0.000000 2.612181 9.453223\nK Ru N O\n4 4 16 32\ndirect\n0.163826 0.245621 0.418953 K\n0.663826 0.754379 0.081047 K\n0.836174 0.754379 0.581047 K\n0.336174 0.245621 0.918953 K\n0.931333 0.156341 0.931298 Ru\n0.431333 0.843659 0.568702 Ru\n0.068667 0.843659 0.068702 Ru\n0.568667 0.156341 0.431298 Ru\n0.782930 0.258472 0.936571 N\n0.282930 0.741528 0.563429 N\n0.217070 0.741528 0.063429 N\n0.717070 0.258472 0.436571 N\n0.849382 0.049250 0.775972 N\n0.349382 0.950750 0.724028 N\n0.150618 0.950750 0.224028 N\n0.650618 0.049250 0.275972 N\n0.017476 0.276569 0.073610 N\n0.517476 0.723431 0.426390 N\n0.982524 0.723431 0.926390 N\n0.482524 0.276569 0.573610 N\n0.994750 0.342164 0.752059 N\n0.494750 0.657836 0.747941 N\n0.005250 0.657836 0.247941 N\n0.505250 0.342164 0.252059 N\n0.095670 0.047879 0.927181 O\n0.595670 0.952121 0.572819 O\n0.904330 0.952121 0.072819 O\n0.404330 0.047879 0.427181 O\n0.690548 0.332779 0.934187 O\n0.190548 0.667221 0.565813 O\n0.309452 0.667221 0.065813 O\n0.809452 0.332779 0.434187 O\n0.744528 0.983653 0.810820 O\n0.244528 0.016347 0.689180 O\n0.255472 0.016347 0.189180 O\n0.755472 0.983653 0.310820 O\n0.903880 0.051494 0.662764 O\n0.403880 0.948506 0.837236 O\n0.096120 0.948506 0.337236 O\n0.596120 0.051494 0.162764 O\n0.123960 0.342041 0.049800 O\n0.623960 0.657959 0.450200 O\n0.876040 0.657959 0.950200 O\n0.376040 0.342041 0.549800 O\n0.955015 0.272046 0.182433 O\n0.455015 0.727954 0.317567 O\n0.044985 0.727954 0.817567 O\n0.544985 0.272046 0.682433 O\n0.915970 0.442410 0.687099 O\n0.415970 0.557590 0.812901 O\n0.084030 0.557590 0.312901 O\n0.584030 0.442410 0.187099 O\n0.107928 0.340712 0.712683 O\n0.607928 0.659288 0.787317 O\n0.892072 0.659288 0.287317 O\n0.392072 0.340712 0.212683 O\n",
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{
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"structure_string": "Gd4 S2 Cl8\n1.0\n3.203596 7.656415 0.000000\n-3.203596 7.656415 0.000000\n0.000000 0.965441 6.893038\nGd S Cl\n4 2 8\ndirect\n0.313112 0.901834 0.922260 Gd\n0.901834 0.313111 0.422260 Gd\n0.686888 0.098166 0.077740 Gd\n0.098166 0.686888 0.577740 Gd\n0.936336 0.063664 0.750000 S\n0.063664 0.936336 0.250000 S\n0.488815 0.690438 0.577569 Cl\n0.690438 0.488815 0.077569 Cl\n0.137443 0.300094 0.680990 Cl\n0.300094 0.137443 0.180990 Cl\n0.699906 0.862557 0.819010 Cl\n0.862557 0.699906 0.319010 Cl\n0.309562 0.511185 0.922431 Cl\n0.511185 0.309562 0.422431 Cl\n",
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{
"id": "mp-31139",
"created_at": "2022-09-04T14:45:09.200425Z",
"structure_string": "Tb12 Ni12\n1.0\n4.210968 0.000000 0.000000\n0.000000 5.436056 0.000000\n0.000000 2.569045 21.092824\nTb Ni\n12 12\ndirect\n0.750000 0.337038 0.060341 Tb\n0.250000 0.662962 0.939659 Tb\n0.750000 0.500025 0.226948 Tb\n0.250000 0.499975 0.773052 Tb\n0.750000 0.189082 0.393610 Tb\n0.250000 0.810918 0.606390 Tb\n0.750000 0.334368 0.560128 Tb\n0.250000 0.665632 0.439872 Tb\n0.750000 0.021137 0.726578 Tb\n0.250000 0.978863 0.273422 Tb\n0.750000 0.175925 0.893278 Tb\n0.250000 0.824075 0.106722 Tb\n0.750000 0.867050 0.012151 Ni\n0.250000 0.132950 0.987849 Ni\n0.750000 0.029595 0.178826 Ni\n0.250000 0.970405 0.821174 Ni\n0.750000 0.705956 0.345612 Ni\n0.250000 0.294044 0.654388 Ni\n0.750000 0.865980 0.512355 Ni\n0.250000 0.134020 0.487645 Ni\n0.750000 0.536079 0.679189 Ni\n0.250000 0.463921 0.320811 Ni\n0.750000 0.705670 0.845819 Ni\n0.250000 0.294330 0.154181 Ni\n",
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{
"id": "mp-27588",
"created_at": "2022-09-04T14:45:09.197958Z",
"structure_string": "Be4 P8 O24\n1.0\n13.080944 0.000000 0.000000\n0.000000 4.962656 0.000000\n0.000000 2.824997 6.744183\nBe P O\n4 8 24\ndirect\n0.932741 0.647200 0.233564 Be\n0.432741 0.352800 0.266436 Be\n0.067259 0.352800 0.766436 Be\n0.567259 0.647200 0.733564 Be\n0.869609 0.025452 0.828803 P\n0.650846 0.046583 0.915342 P\n0.150846 0.953417 0.584658 P\n0.349154 0.953417 0.084658 P\n0.849154 0.046583 0.415342 P\n0.630391 0.025452 0.328803 P\n0.130391 0.974548 0.171197 P\n0.369609 0.974548 0.671197 P\n0.235981 0.821537 0.148308 O\n0.635950 0.789865 0.859495 O\n0.135950 0.210135 0.640505 O\n0.364050 0.210135 0.140505 O\n0.864050 0.789865 0.359495 O\n0.576565 0.293920 0.836767 O\n0.076565 0.706080 0.663233 O\n0.423435 0.706080 0.163233 O\n0.735981 0.178463 0.351692 O\n0.154981 0.080751 0.347409 O\n0.264019 0.821537 0.648308 O\n0.764019 0.178463 0.851692 O\n0.845019 0.919249 0.652591 O\n0.345019 0.080751 0.847409 O\n0.612524 0.752684 0.508639 O\n0.654981 0.919249 0.152591 O\n0.947782 0.262843 0.768468 O\n0.112524 0.247316 0.991361 O\n0.387476 0.247316 0.491361 O\n0.887476 0.752684 0.008639 O\n0.552218 0.262843 0.268468 O\n0.052218 0.737157 0.231532 O\n0.447782 0.737157 0.731532 O\n0.923435 0.293920 0.336767 O\n",
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{
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"created_at": "2022-09-04T14:45:13.126813Z",
"structure_string": "In6 Te9\n1.0\n-6.588290 6.588290 3.823875\n6.588290 -6.588290 3.823875\n6.588290 6.588290 -3.823875\nIn Te\n6 9\ndirect\n0.477120 0.977120 0.500000 In\n0.977120 0.477120 0.500000 In\n0.501409 0.678186 0.176777 In\n0.501409 0.324633 0.823223 In\n0.678186 0.501409 0.176777 In\n0.324633 0.501409 0.823223 In\n0.824435 0.824435 0.000000 Te\n0.588450 0.916802 0.000000 Te\n0.916802 0.588450 0.000000 Te\n0.588450 0.588450 0.671648 Te\n0.916802 0.916802 0.328352 Te\n0.238796 0.574831 0.336035 Te\n0.238796 0.902761 0.663965 Te\n0.574831 0.238796 0.336035 Te\n0.902761 0.238796 0.663965 Te\n",
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"formula_full": "In6 Te9",
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{
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{
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"structure_string": "Ta2 Cl8\n1.0\n3.417841 6.561989 0.000000\n-3.417841 6.561989 0.000000\n0.000000 5.647606 6.665942\nTa Cl\n2 8\ndirect\n0.280820 0.719180 0.000000 Ta\n0.719180 0.280820 0.000000 Ta\n0.275940 0.764755 0.717123 Cl\n0.235245 0.724060 0.282877 Cl\n0.165787 0.165787 0.855817 Cl\n0.834213 0.834213 0.144183 Cl\n0.308379 0.308379 0.166595 Cl\n0.691621 0.691621 0.833405 Cl\n0.764755 0.275940 0.717123 Cl\n0.724060 0.235245 0.282877 Cl\n",
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{
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"structure_string": "Si4 Pb8 Se16\n1.0\n7.386488 0.000000 0.000000\n0.000000 8.802417 0.000000\n0.000000 4.334845 13.302153\nSi Pb Se\n4 8 16\ndirect\n0.747956 0.203613 0.354681 Si\n0.247956 0.796387 0.145319 Si\n0.252044 0.796387 0.645319 Si\n0.752044 0.203613 0.854681 Si\n0.637158 0.556030 0.137716 Pb\n0.137158 0.443970 0.362284 Pb\n0.362842 0.443970 0.862284 Pb\n0.862842 0.556030 0.637716 Pb\n0.643854 0.054420 0.125624 Pb\n0.143854 0.945580 0.374376 Pb\n0.356146 0.945580 0.874376 Pb\n0.856146 0.054420 0.625624 Pb\n0.765657 0.936455 0.443869 Se\n0.265657 0.063545 0.056131 Se\n0.234343 0.063545 0.556131 Se\n0.734343 0.936455 0.943869 Se\n0.522813 0.269886 0.737774 Se\n0.022813 0.730114 0.762226 Se\n0.477187 0.730114 0.262226 Se\n0.977187 0.269886 0.237774 Se\n0.517626 0.746270 0.734818 Se\n0.017626 0.253730 0.765182 Se\n0.482374 0.253730 0.265182 Se\n0.982374 0.746270 0.234818 Se\n0.723780 0.363453 0.957423 Se\n0.223780 0.636547 0.542577 Se\n0.276220 0.636547 0.042577 Se\n0.776220 0.363453 0.457423 Se\n",
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{
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"structure_string": "Ce8 Te12\n1.0\n4.449150 0.000000 0.000000\n0.000000 11.948972 0.000000\n0.000000 0.000000 12.320472\nCe Te\n8 12\ndirect\n0.250000 0.186873 0.485714 Ce\n0.250000 0.313127 0.985714 Ce\n0.750000 0.813127 0.514286 Ce\n0.750000 0.686873 0.014286 Ce\n0.250000 0.999733 0.804478 Ce\n0.250000 0.500267 0.304478 Ce\n0.750000 0.000267 0.195522 Ce\n0.750000 0.499733 0.695522 Ce\n0.250000 0.624547 0.545120 Te\n0.250000 0.875453 0.045120 Te\n0.750000 0.375453 0.454880 Te\n0.750000 0.124547 0.954880 Te\n0.250000 0.942801 0.379386 Te\n0.250000 0.557199 0.879386 Te\n0.750000 0.057199 0.620614 Te\n0.750000 0.442801 0.120614 Te\n0.250000 0.298131 0.726494 Te\n0.250000 0.201869 0.226494 Te\n0.750000 0.701869 0.273506 Te\n0.750000 0.798131 0.773506 Te\n",
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{
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