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{
"id": "mp-1018030",
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{
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{
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"structure_string": "Sm12 Si8 Pd8\n1.0\n5.712678 0.000000 0.000000\n0.000000 8.078083 0.000000\n0.000000 0.000000 13.143081\nSm Si Pd\n12 8 8\ndirect\n0.642996 0.251213 0.250000 Sm\n0.357004 0.748787 0.750000 Sm\n0.357004 0.751213 0.250000 Sm\n0.642996 0.248787 0.750000 Sm\n0.129731 0.391463 0.104111 Sm\n0.870269 0.608537 0.895889 Sm\n0.870269 0.608537 0.604111 Sm\n0.870269 0.891463 0.395889 Sm\n0.129731 0.391463 0.395889 Sm\n0.129731 0.108537 0.604111 Sm\n0.129731 0.108537 0.895889 Sm\n0.870269 0.891463 0.104111 Sm\n0.148030 0.102798 0.250000 Si\n0.851970 0.897202 0.750000 Si\n0.851970 0.602798 0.250000 Si\n0.148030 0.397202 0.750000 Si\n0.669228 0.250000 0.000000 Si\n0.330772 0.750000 0.000000 Si\n0.330772 0.750000 0.500000 Si\n0.669228 0.250000 0.500000 Si\n0.382575 0.040199 0.091847 Pd\n0.617425 0.959801 0.908153 Pd\n0.617425 0.959801 0.591847 Pd\n0.617425 0.540199 0.408153 Pd\n0.382575 0.040199 0.408153 Pd\n0.382575 0.459801 0.591847 Pd\n0.382575 0.459801 0.908153 Pd\n0.617425 0.540199 0.091847 Pd\n",
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"formula_full": "Sm12 Si8 Pd8",
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{
"id": "mp-569366",
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"structure_string": "Nb6 Tl2\n1.0\n5.363015 0.000000 0.000000\n0.000000 5.363015 0.000000\n0.000000 0.000000 5.363015\nNb Tl\n6 2\ndirect\n0.500000 0.750000 0.000000 Nb\n0.000000 0.500000 0.750000 Nb\n0.500000 0.250000 0.000000 Nb\n0.000000 0.500000 0.250000 Nb\n0.250000 0.000000 0.500000 Nb\n0.750000 0.000000 0.500000 Nb\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n",
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{
"id": "mp-1202996",
"created_at": "2022-09-04T14:47:13.999661Z",
"structure_string": "Nd6 Ge26 Rh8\n1.0\n9.118498 0.000000 0.000000\n0.000000 9.118498 0.000000\n0.000000 0.000000 9.118498\nNd Ge Rh\n6 26 8\ndirect\n0.000000 0.500000 0.750000 Nd\n0.500000 0.250000 0.000000 Nd\n0.750000 0.000000 0.500000 Nd\n0.000000 0.500000 0.250000 Nd\n0.500000 0.750000 0.000000 Nd\n0.250000 0.000000 0.500000 Nd\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.808264 0.350415 0.500000 Ge\n0.649585 0.500000 0.808264 Ge\n0.500000 0.191736 0.649585 Ge\n0.191736 0.649585 0.500000 Ge\n0.350415 0.500000 0.191736 Ge\n0.500000 0.808264 0.350415 Ge\n0.808264 0.649585 0.500000 Ge\n0.649585 0.500000 0.191736 Ge\n0.191736 0.350415 0.500000 Ge\n0.350415 0.500000 0.808264 Ge\n0.500000 0.808264 0.649585 Ge\n0.500000 0.191736 0.350415 Ge\n0.308264 0.000000 0.850415 Ge\n0.149585 0.308264 0.000000 Ge\n0.000000 0.149585 0.691736 Ge\n0.691736 0.000000 0.149585 Ge\n0.850415 0.691736 0.000000 Ge\n0.000000 0.850415 0.308264 Ge\n0.308264 0.000000 0.149585 Ge\n0.149585 0.691736 0.000000 Ge\n0.691736 0.000000 0.850415 Ge\n0.850415 0.308264 0.000000 Ge\n0.000000 0.149585 0.308264 Ge\n0.000000 0.850415 0.691736 Ge\n0.750000 0.250000 0.750000 Rh\n0.250000 0.750000 0.250000 Rh\n0.750000 0.750000 0.250000 Rh\n0.250000 0.250000 0.750000 Rh\n0.250000 0.750000 0.750000 Rh\n0.750000 0.250000 0.250000 Rh\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n",
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"elements": [
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"volume": 758.1758058744811,
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"formula_full": "Nd6 Ge26 Rh8",
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},
{
"id": "mp-745173",
"created_at": "2022-09-04T14:47:14.896192Z",
"structure_string": "Na3 Cd4 P6 H10 Cl3 O24\n1.0\n9.322484 0.000000 0.000000\n4.106354 8.468955 0.000000\n2.263791 3.996501 9.391788\nNa Cd P H Cl O\n3 4 6 10 3 24\ndirect\n0.980383 0.791190 0.795373 Na\n0.949975 0.798827 0.406451 Na\n0.960168 0.222169 0.504232 Na\n0.251485 0.001996 0.099680 Cd\n0.767719 0.510124 0.740710 Cd\n0.751044 0.286016 0.153283 Cd\n0.301229 0.979832 0.757907 Cd\n0.623173 0.006603 0.177142 P\n0.819786 0.747111 0.141964 P\n0.292630 0.748030 0.621758 P\n0.403583 0.630581 0.166158 P\n0.272152 0.486163 0.147032 P\n0.627846 0.052212 0.590866 P\n0.795263 0.563862 0.960456 H\n0.567666 0.981761 0.443481 H\n0.754814 0.629609 0.246366 H\n0.662264 0.485345 0.551247 H\n0.376658 0.623820 0.843389 H\n0.156352 0.334512 0.879524 H\n0.384920 0.716721 0.420593 H\n0.452541 0.263409 0.653729 H\n0.386990 0.313279 0.204609 H\n0.283001 0.340525 0.950780 H\n0.139429 0.420111 0.591422 Cl\n0.056737 0.061909 0.914401 Cl\n0.020818 0.108745 0.271059 Cl\n0.819614 0.751912 0.645788 O\n0.728690 0.141258 0.487808 O\n0.826105 0.743585 0.999550 O\n0.672360 0.949016 0.327137 O\n0.942856 0.767432 0.196139 O\n0.405362 0.771228 0.015428 O\n0.721681 0.873614 0.717577 O\n0.167143 0.239691 0.584885 O\n0.425836 0.717133 0.502237 O\n0.421663 0.680396 0.746507 O\n0.152157 0.723406 0.556061 O\n0.821698 0.456109 0.950490 O\n0.188639 0.928745 0.618818 O\n0.263375 0.535556 0.986890 O\n0.564649 0.483672 0.222029 O\n0.317465 0.719332 0.272300 O\n0.126871 0.483049 0.244108 O\n0.213328 0.606304 0.709856 O\n0.659832 0.158805 0.066134 O\n0.766173 0.415098 0.594737 O\n0.512933 0.017646 0.528909 O\n0.508138 0.138468 0.696376 O\n0.257453 0.262398 0.928212 O\n0.477352 0.986505 0.162210 O\n",
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{
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"structure_string": "Sb2 Pb6 N2\n1.0\n-3.779714 -3.645440 -4.959711\n3.779714 -3.645440 4.959711\n-3.779714 3.645440 4.959711\nSb Pb N\n2 6 2\ndirect\n0.002844 0.750000 0.752844 Sb\n0.997156 0.250000 0.247156 Sb\n0.500000 0.289389 0.289389 Pb\n0.000000 0.210611 0.710611 Pb\n0.500000 0.710611 0.710611 Pb\n0.000000 0.789389 0.289389 Pb\n0.567726 0.250000 0.817726 Pb\n0.432274 0.750000 0.182274 Pb\n0.500000 0.500000 0.000000 N\n0.500000 0.000000 0.500000 N\n",
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{
"id": "mp-1197665",
"created_at": "2022-09-04T14:47:14.052694Z",
"structure_string": "Mg2 Tl4 H24 Se4 O28\n1.0\n12.910125 0.000000 0.000000\n0.000000 6.475879 0.000000\n0.000000 2.603040 9.182553\nMg Tl H Se O\n2 4 24 4 28\ndirect\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.141963 0.646537 0.620359 Tl\n0.641963 0.353463 0.879641 Tl\n0.858037 0.353463 0.379641 Tl\n0.358037 0.646537 0.120359 Tl\n0.411803 0.680038 0.709136 H\n0.911803 0.319962 0.790864 H\n0.588197 0.319962 0.290864 H\n0.088197 0.680038 0.209136 H\n0.374527 0.901571 0.737217 H\n0.874527 0.098429 0.762783 H\n0.625473 0.098429 0.262783 H\n0.125473 0.901571 0.237217 H\n0.403142 0.064895 0.237813 H\n0.903142 0.935105 0.262187 H\n0.596858 0.935105 0.762187 H\n0.096858 0.064895 0.737813 H\n0.317512 0.997436 0.360309 H\n0.817512 0.002564 0.139691 H\n0.682488 0.002564 0.639691 H\n0.182488 0.997436 0.860309 H\n0.558775 0.669341 0.400984 H\n0.058775 0.330659 0.099016 H\n0.441225 0.330659 0.599016 H\n0.941225 0.669341 0.900984 H\n0.638611 0.675183 0.525375 H\n0.138611 0.324817 0.974625 H\n0.361389 0.324817 0.474625 H\n0.861389 0.675183 0.025375 H\n0.358914 0.261408 0.905666 Se\n0.858914 0.738592 0.594334 Se\n0.641086 0.738592 0.094334 Se\n0.141086 0.261408 0.405666 Se\n0.257471 0.421599 0.910368 O\n0.757471 0.578401 0.589632 O\n0.742529 0.578401 0.089632 O\n0.242529 0.421599 0.410368 O\n0.426614 0.217321 0.060870 O\n0.926614 0.782679 0.439130 O\n0.573386 0.782679 0.939130 O\n0.073386 0.217321 0.560870 O\n0.438295 0.393374 0.770028 O\n0.938295 0.606626 0.729972 O\n0.561705 0.606626 0.229972 O\n0.061705 0.393374 0.270028 O\n0.318470 0.028847 0.877266 O\n0.818470 0.971153 0.622734 O\n0.681530 0.971153 0.122734 O\n0.181530 0.028847 0.377266 O\n0.396215 0.832826 0.661391 O\n0.896215 0.167174 0.838609 O\n0.603785 0.167174 0.338609 O\n0.103785 0.832826 0.161391 O\n0.391903 0.977383 0.339663 O\n0.891903 0.022617 0.160337 O\n0.608097 0.022617 0.660337 O\n0.108097 0.977383 0.839663 O\n0.566751 0.715820 0.490857 O\n0.066751 0.284180 0.009143 O\n0.433249 0.284180 0.509143 O\n0.933249 0.715820 0.990857 O\n",
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"formula_full": "Mg2 Tl4 H24 Se4 O28",
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{
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"structure_string": "Li2 Ga2 Si4 O12\n1.0\n4.355074 4.868805 0.000000\n-4.355074 4.868805 0.000000\n0.000000 1.898052 4.991341\nLi Ga Si O\n2 2 4 12\ndirect\n0.741521 0.258479 0.750000 Li\n0.258479 0.741521 0.250000 Li\n0.101444 0.898556 0.750000 Ga\n0.898556 0.101444 0.250000 Ga\n0.612873 0.794100 0.762372 Si\n0.387127 0.205900 0.237628 Si\n0.794100 0.612873 0.262372 Si\n0.205900 0.387127 0.737628 Si\n0.355821 0.354879 0.948594 O\n0.354879 0.355821 0.448594 O\n0.644179 0.645121 0.051406 O\n0.645121 0.644179 0.551406 O\n0.970424 0.801702 0.144032 O\n0.627262 0.107755 0.171489 O\n0.029576 0.198298 0.855968 O\n0.801702 0.970424 0.644032 O\n0.198298 0.029576 0.355968 O\n0.372738 0.892245 0.828511 O\n0.107755 0.627262 0.671489 O\n0.892245 0.372738 0.328511 O\n",
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