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{
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"spacegroup": 2
},
{
"id": "mp-1097803",
"created_at": "2022-09-04T14:42:51.984535Z",
"structure_string": "Cr3 N2\n1.0\n2.598794 -4.501243 0.000000\n2.598794 4.501243 0.000000\n0.000000 0.000000 2.858202\nCr N\n3 2\ndirect\n0.000000 0.687819 0.000000 Cr\n0.687819 0.000000 0.000000 Cr\n0.312181 0.312181 0.000000 Cr\n0.666667 0.333333 0.924330 N\n0.333333 0.666667 0.075670 N\n",
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{
"id": "mp-2187",
"created_at": "2022-09-04T14:42:52.046591Z",
"structure_string": "Ti2 Sb2\n1.0\n2.028340 -3.513188 0.000000\n2.028340 3.513188 0.000000\n0.000000 0.000000 6.230711\nTi Sb\n2 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.750000 Sb\n",
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},
{
"id": "mp-1521419",
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"structure_string": "Ce1 Nb2 In1 O6\n1.0\n0.000000 5.692934 -0.000000\n2.846467 -2.846467 4.143671\n5.692934 0.000000 0.000000\nCe Nb In O\n1 2 1 6\ndirect\n-0.000000 -0.000000 0.000000 Ce\n0.250000 0.500000 0.250000 Nb\n0.750000 0.500000 0.750000 Nb\n0.500000 -0.000000 0.500000 In\n0.500000 -0.000000 0.000000 O\n-0.000000 -0.000000 0.500000 O\n0.437193 0.480719 0.562807 O\n0.043526 0.480719 0.956474 O\n0.562807 0.519281 0.043526 O\n0.956474 0.519281 0.437193 O\n",
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{
"id": "mp-1103526",
"created_at": "2022-09-04T14:42:52.066320Z",
"structure_string": "Zn4 Si2 O9\n1.0\n0.000000 0.000000 -5.191741\n-4.200999 5.457390 -2.595871\n4.200999 5.457390 -2.595871\nZn Si O\n4 2 9\ndirect\n0.154403 0.634301 0.046610 Zn\n0.835314 0.365699 0.953390 Zn\n0.154403 0.046610 0.634301 Zn\n0.835314 0.953390 0.365699 Zn\n0.629423 0.854461 0.854461 Si\n0.338345 0.145539 0.145539 Si\n0.560820 0.633160 0.956462 O\n0.150441 0.366840 0.043538 O\n0.560820 0.956462 0.633160 O\n0.150441 0.043538 0.366840 O\n0.962160 0.834357 0.834357 O\n0.630875 0.165643 0.165643 O\n0.946150 0.700590 0.299410 O\n0.946150 0.299410 0.700590 O\n0.400441 0.000000 0.000000 O\n",
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"elements": [
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"density": 3.2212464092190585,
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"formula_full": "Zn4 Si2 O9",
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{
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"structure_string": "Sr1 Mg1 Tl2\n1.0\n0.000000 3.886229 3.886229\n3.886229 0.000000 3.886229\n3.886229 3.886229 0.000000\nSr Mg Tl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Mg\n0.250000 0.250000 0.250000 Tl\n0.750000 0.750000 0.750000 Tl\n",
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{
"id": "mp-1201554",
"created_at": "2022-09-04T14:42:51.992184Z",
"structure_string": "Ba2 Yb12 Si14 O48\n1.0\n27.906554 0.000000 0.000000\n0.000000 5.665680 0.000000\n0.000000 2.011753 6.753790\nBa Yb Si O\n2 12 14 48\ndirect\n0.750000 0.712949 0.911559 Ba\n0.250000 0.287051 0.088441 Ba\n0.687406 0.111973 0.240601 Yb\n0.187406 0.888027 0.759399 Yb\n0.312594 0.888027 0.759399 Yb\n0.812594 0.111973 0.240601 Yb\n0.600722 0.782901 0.591720 Yb\n0.100722 0.217099 0.408280 Yb\n0.399278 0.217099 0.408280 Yb\n0.899278 0.782901 0.591720 Yb\n0.542379 0.181602 0.818231 Yb\n0.042379 0.818398 0.181769 Yb\n0.457621 0.818398 0.181769 Yb\n0.957621 0.181602 0.818231 Yb\n0.473615 0.722073 0.701856 Si\n0.973615 0.277927 0.298144 Si\n0.526385 0.277927 0.298144 Si\n0.026385 0.722073 0.701856 Si\n0.610983 0.680485 0.113503 Si\n0.110983 0.319515 0.886497 Si\n0.389017 0.319515 0.886497 Si\n0.889017 0.680485 0.113503 Si\n0.669740 0.251621 0.696854 Si\n0.169740 0.748379 0.303146 Si\n0.330260 0.748379 0.303146 Si\n0.830260 0.251621 0.696854 Si\n0.750000 0.546434 0.423605 Si\n0.250000 0.453566 0.576395 Si\n0.450512 0.879617 0.491445 O\n0.950512 0.120383 0.508555 O\n0.549488 0.120383 0.508555 O\n0.049488 0.879617 0.491445 O\n0.524650 0.593921 0.674884 O\n0.024650 0.406079 0.325116 O\n0.475350 0.406079 0.325116 O\n0.975350 0.593921 0.674884 O\n0.434985 0.497994 0.795576 O\n0.934985 0.502006 0.204424 O\n0.565015 0.502006 0.204424 O\n0.065015 0.497994 0.795576 O\n0.480985 0.885503 0.855720 O\n0.980985 0.114497 0.144280 O\n0.519015 0.114497 0.144280 O\n0.019015 0.885503 0.855720 O\n0.658992 0.520338 0.095532 O\n0.158992 0.479662 0.904468 O\n0.341008 0.479662 0.904468 O\n0.841008 0.520338 0.095532 O\n0.593968 0.848531 0.897608 O\n0.093968 0.151469 0.102392 O\n0.406032 0.151469 0.102392 O\n0.906032 0.848531 0.897608 O\n0.624912 0.835951 0.267038 O\n0.124912 0.164049 0.732962 O\n0.375088 0.164049 0.732962 O\n0.875088 0.835951 0.267038 O\n0.697168 0.128733 0.908196 O\n0.197168 0.871267 0.091804 O\n0.302832 0.871267 0.091804 O\n0.802832 0.128733 0.908196 O\n0.618015 0.367856 0.731794 O\n0.118015 0.632144 0.268206 O\n0.381985 0.632144 0.268206 O\n0.881985 0.367856 0.731794 O\n0.665603 0.059242 0.565461 O\n0.165603 0.940758 0.434539 O\n0.334397 0.940758 0.434539 O\n0.834397 0.059242 0.565461 O\n0.703436 0.497038 0.579156 O\n0.203436 0.502962 0.420844 O\n0.296564 0.502962 0.420844 O\n0.796564 0.497038 0.579156 O\n0.750000 0.360258 0.285271 O\n0.250000 0.639742 0.714729 O\n0.750000 0.830673 0.290254 O\n0.250000 0.169327 0.709746 O\n",
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"formula_full": "Ba2 Yb12 Si14 O48",
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{
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"created_at": "2022-09-04T14:42:52.000031Z",
"structure_string": "Cr2 Fe4 P6 O24\n1.0\n7.225212 -4.307152 0.000000\n7.225212 4.307152 0.000000\n4.657597 0.000000 7.004430\nCr Fe P O\n2 4 6 24\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.146110 0.146110 0.146110 Fe\n0.353890 0.353890 0.353890 Fe\n0.646110 0.646110 0.646110 Fe\n0.853890 0.853890 0.853890 Fe\n0.750000 0.048400 0.451600 P\n0.048400 0.451600 0.750000 P\n0.451600 0.750000 0.048400 P\n0.548400 0.250000 0.951600 P\n0.951600 0.548400 0.250000 P\n0.250000 0.951600 0.548400 P\n0.324675 0.105481 0.504953 O\n0.504953 0.324675 0.105481 O\n0.905172 0.063003 0.248103 O\n0.105481 0.504953 0.324675 O\n0.824675 0.004953 0.605481 O\n0.594828 0.251897 0.436997 O\n0.063003 0.248103 0.905172 O\n0.251897 0.436997 0.594828 O\n0.394519 0.175325 0.995047 O\n0.436997 0.594828 0.251897 O\n0.751897 0.094828 0.936997 O\n0.995047 0.394519 0.175325 O\n0.004953 0.605481 0.824675 O\n0.248103 0.905172 0.063003 O\n0.563003 0.405172 0.748103 O\n0.605481 0.824675 0.004953 O\n0.748103 0.563003 0.405172 O\n0.936997 0.751897 0.094828 O\n0.405172 0.748103 0.563003 O\n0.175325 0.995047 0.394519 O\n0.894519 0.495047 0.675325 O\n0.094828 0.936997 0.751897 O\n0.495047 0.675325 0.894519 O\n0.675325 0.894519 0.495047 O\n",
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{
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