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{
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{
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{
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{
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"structure_string": "Li2 Ni2 F6\n1.0\n4.901269 -2.571369 0.000000\n4.901269 2.571369 0.000000\n3.552243 0.000000 4.244519\nLi Ni F\n2 2 6\ndirect\n0.702584 0.702584 0.702584 Li\n0.297416 0.297416 0.297416 Li\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.729038 0.108296 0.394546 F\n0.108296 0.394546 0.729038 F\n0.394546 0.729038 0.108296 F\n0.605454 0.270962 0.891704 F\n0.891704 0.605454 0.270962 F\n0.270962 0.891704 0.605454 F\n",
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{
"id": "mp-1234469",
"created_at": "2022-09-04T14:47:13.433399Z",
"structure_string": "Ho8 Mg1 Ge8 O28\n1.0\n6.828912 -0.000233 -0.062605\n-0.000233 6.828912 0.062605\n-0.126000 0.126000 12.963075\nHo Mg Ge O\n8 1 8 28\ndirect\n0.848081 0.630575 0.890520 Ho\n0.339070 0.877003 0.878427 Ho\n0.353083 0.148420 0.637484 Ho\n0.647925 0.115068 0.352802 Ho\n0.148420 0.353083 0.362516 Ho\n0.115068 0.647925 0.647198 Ho\n0.630575 0.848081 0.109480 Ho\n0.877003 0.339070 0.121573 Ho\n0.488800 0.488800 0.500000 Mg\n0.405607 0.341771 0.124066 Ge\n0.711905 0.603986 0.351845 Ge\n0.603986 0.711905 0.648155 Ge\n0.099456 0.832246 0.129277 Ge\n0.832246 0.099456 0.870723 Ge\n0.155902 0.879539 0.387936 Ge\n0.879539 0.155902 0.612064 Ge\n0.341771 0.405607 0.875934 Ge\n0.345360 0.190440 0.803503 O\n0.054983 0.963730 0.612129 O\n0.657758 0.191727 0.536166 O\n0.654675 0.939407 0.929830 O\n0.336522 0.066757 0.414245 O\n0.389759 0.848716 0.706368 O\n0.525037 0.584310 0.883865 O\n0.422879 0.485960 0.642479 O\n0.161206 0.766335 0.261643 O\n0.584310 0.525037 0.116135 O\n0.296858 0.296858 0.000000 O\n0.926858 0.021997 0.126225 O\n0.191727 0.657758 0.463834 O\n0.939407 0.654675 0.070170 O\n0.852142 0.312758 0.943495 O\n0.021997 0.926858 0.873775 O\n0.154204 0.568771 0.829380 O\n0.312758 0.852142 0.056505 O\n0.636603 0.817499 0.278253 O\n0.190440 0.345360 0.196497 O\n0.568771 0.154204 0.170620 O\n0.817499 0.636603 0.721747 O\n0.963730 0.054983 0.387871 O\n0.066757 0.336522 0.585755 O\n0.690907 0.690907 0.500000 O\n0.848716 0.389759 0.293632 O\n0.766335 0.161206 0.738357 O\n0.485960 0.422879 0.357521 O\n",
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"spacegroup": 5
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{
"id": "mp-1179454",
"created_at": "2022-09-04T14:47:11.510817Z",
"structure_string": "Si4 O8\n1.0\n-4.512786 4.512786 2.635587\n4.512786 -4.512786 2.635587\n4.512786 4.512786 -2.635587\nSi O\n4 8\ndirect\n0.176700 0.176700 0.353400 Si\n0.823300 0.176700 0.000000 Si\n0.176700 0.823300 0.000000 Si\n0.823300 0.823300 0.646600 Si\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.208923 0.208923 O\n0.791077 0.000000 0.791077 O\n0.208923 0.000000 0.208923 O\n0.000000 0.791077 0.791077 O\n",
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"formula_full": "Si4 O8",
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{
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"created_at": "2022-09-04T14:47:15.879395Z",
"structure_string": "Mn2 Mo2 O8\n1.0\n4.863986 -0.006717 0.000000\n-0.078746 5.057124 0.000000\n0.000000 0.000000 5.854009\nMn Mo O\n2 2 8\ndirect\n0.000000 0.750000 0.817208 Mn\n0.000000 0.250000 0.182779 Mn\n0.500000 0.750000 0.319164 Mo\n0.500000 0.250000 0.680839 Mo\n0.711949 0.442522 0.395637 O\n0.288051 0.057478 0.395637 O\n0.288048 0.557479 0.604369 O\n0.711951 0.942521 0.604369 O\n0.752637 0.395462 0.873716 O\n0.247363 0.104538 0.873716 O\n0.247364 0.604543 0.126283 O\n0.752636 0.895457 0.126283 O\n",
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{
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{
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"structure_string": "Ba1 Sr1 Ca1 Se1 O6\n1.0\n0.000000 -4.179739 -4.179739\n4.179739 0.000000 -4.179739\n4.179739 -4.179739 0.000000\nBa Sr Ca Se O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Sr\n0.750000 0.750000 0.750000 Ca\n-0.000000 -0.000000 0.000000 Se\n0.781631 0.218369 0.218369 O\n0.218369 0.781631 0.781631 O\n0.781631 0.218369 0.781631 O\n0.218369 0.781631 0.218369 O\n0.781631 0.781631 0.218369 O\n0.218369 0.218369 0.781631 O\n",
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{
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},
{
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"structure_string": "K16 Sn4 Te8 Se8\n1.0\n8.565509 0.000000 0.000000\n0.000000 10.834462 0.000000\n0.000000 0.000000 15.245790\nK Sn Te Se\n16 4 8 8\ndirect\n0.500000 0.500000 0.500000 K\n0.144915 0.463156 0.271346 K\n0.144915 0.036844 0.271346 K\n0.981758 0.750000 0.435070 K\n0.018242 0.250000 0.564930 K\n0.644915 0.963156 0.228654 K\n0.355085 0.036844 0.771346 K\n0.855085 0.963156 0.728654 K\n0.355085 0.463156 0.771346 K\n0.000000 0.500000 0.000000 K\n0.481758 0.250000 0.064930 K\n0.644915 0.536844 0.228654 K\n0.518242 0.750000 0.935070 K\n0.000000 0.000000 0.000000 K\n0.855085 0.536844 0.728654 K\n0.500000 0.000000 0.500000 K\n0.737381 0.250000 0.838316 Sn\n0.762619 0.250000 0.338316 Sn\n0.237381 0.750000 0.661684 Sn\n0.262619 0.750000 0.161684 Sn\n0.564038 0.750000 0.665894 Te\n0.435962 0.250000 0.334106 Te\n0.373206 0.750000 0.335174 Te\n0.126794 0.750000 0.835174 Te\n0.064038 0.250000 0.834106 Te\n0.935962 0.750000 0.165894 Te\n0.626794 0.250000 0.664826 Te\n0.873206 0.250000 0.164826 Te\n0.855541 0.444956 0.415835 Se\n0.644459 0.055044 0.915835 Se\n0.355541 0.944956 0.084165 Se\n0.355541 0.555044 0.084165 Se\n0.144459 0.555044 0.584165 Se\n0.855541 0.055044 0.415835 Se\n0.144459 0.944956 0.584165 Se\n0.644459 0.444956 0.915835 Se\n",
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"formula_full": "K16 Sn4 Te8 Se8",
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},
{
"id": "mp-757335",
"created_at": "2022-09-04T14:48:22.401824Z",
"structure_string": "Li4 Cr2 P4 O14\n1.0\n5.624331 0.099856 0.096206\n-1.847487 6.144934 0.041428\n-0.795799 -3.386967 8.199670\nLi Cr P O\n4 2 4 14\ndirect\n0.147471 0.768851 0.955980 Li\n0.852414 0.231378 0.043888 Li\n0.287775 0.217544 0.768015 Li\n0.712402 0.782708 0.232104 Li\n0.877461 0.385696 0.619321 Cr\n0.122570 0.614215 0.380737 Cr\n0.241212 0.148928 0.401224 P\n0.758744 0.850942 0.598745 P\n0.618360 0.704492 0.878979 P\n0.381686 0.295571 0.121070 P\n0.077372 0.891324 0.328477 O\n0.922777 0.108492 0.671526 O\n0.065200 0.304771 0.422102 O\n0.934472 0.694818 0.577709 O\n0.346489 0.562283 0.864761 O\n0.653539 0.437944 0.135467 O\n0.198723 0.439581 0.158631 O\n0.801166 0.560299 0.841325 O\n0.275053 0.090805 0.959480 O\n0.725257 0.909375 0.040495 O\n0.572326 0.783371 0.445298 O\n0.427635 0.216758 0.554723 O\n0.602503 0.811997 0.735893 O\n0.397394 0.187860 0.264050 O\n",
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}