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{
"id": "mp-756926",
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"structure_string": "Li4 Ni3 Bi1 O8\n1.0\n5.232222 -3.033127 0.000000\n5.232222 3.033127 0.000000\n3.473914 0.000000 4.950549\nLi Ni Bi O\n4 3 1 8\ndirect\n0.000000 0.500000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.500000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Bi\n0.248465 0.744988 0.248465 O\n0.248465 0.248465 0.744988 O\n0.744988 0.248465 0.248465 O\n0.738070 0.738070 0.738070 O\n0.261930 0.261930 0.261930 O\n0.255012 0.751535 0.751535 O\n0.751535 0.751535 0.255012 O\n0.751535 0.255012 0.751535 O\n",
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{
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"structure_string": "Li12 V8 P12 O48\n1.0\n6.659386 7.214472 0.000000\n-6.659386 7.214472 0.000000\n0.000000 0.852614 9.753792\nLi V P O\n12 8 12 48\ndirect\n0.985433 0.504842 0.240439 Li\n0.620854 0.750025 0.805545 Li\n0.781608 0.563544 0.467381 Li\n0.765296 0.734023 0.179757 Li\n0.297443 0.924373 0.975432 Li\n0.002491 0.256417 0.387599 Li\n0.743583 0.997509 0.612401 Li\n0.075627 0.702557 0.024568 Li\n0.265977 0.234704 0.820243 Li\n0.436456 0.218392 0.532619 Li\n0.249975 0.379146 0.194455 Li\n0.495158 0.014567 0.759561 Li\n0.970496 0.249136 0.782445 V\n0.253467 0.966166 0.280920 V\n0.251507 0.748493 0.500000 V\n0.468568 0.531432 0.500000 V\n0.751252 0.248748 0.000000 V\n0.531807 0.468193 0.000000 V\n0.033834 0.746533 0.719080 V\n0.750864 0.029504 0.217555 V\n0.825923 0.945475 0.902885 P\n0.949730 0.821443 0.404857 P\n0.843801 0.552416 0.928607 P\n0.557737 0.837838 0.429230 P\n0.348191 0.681438 0.803490 P\n0.659191 0.318993 0.697779 P\n0.681007 0.340809 0.302221 P\n0.318562 0.651809 0.196510 P\n0.162162 0.442263 0.570770 P\n0.447584 0.156199 0.071393 P\n0.178557 0.050270 0.595143 P\n0.054525 0.174077 0.097115 P\n0.967919 0.872360 0.868697 O\n0.888388 0.960405 0.344357 O\n0.918555 0.820741 0.563172 O\n0.791610 0.908291 0.058205 O\n0.714961 0.911555 0.810594 O\n0.896946 0.697619 0.342512 O\n0.909642 0.612371 0.792503 O\n0.596861 0.907328 0.552587 O\n0.629394 0.880345 0.289652 O\n0.902214 0.602593 0.056851 O\n0.876890 0.391457 0.924881 O\n0.686930 0.590094 0.927345 O\n0.421958 0.803119 0.844575 O\n0.593524 0.677762 0.444877 O\n0.396505 0.870469 0.417163 O\n0.806470 0.404557 0.348833 O\n0.816829 0.312120 0.668842 O\n0.296942 0.808064 0.155684 O\n0.606127 0.457492 0.630286 O\n0.377652 0.671218 0.642396 O\n0.176020 0.889523 0.629902 O\n0.836218 0.105932 0.875603 O\n0.458661 0.597991 0.133871 O\n0.621409 0.326684 0.859512 O\n0.673316 0.378591 0.140488 O\n0.402009 0.541339 0.866129 O\n0.894068 0.163782 0.124397 O\n0.110477 0.823980 0.370098 O\n0.328782 0.622348 0.357604 O\n0.542508 0.393873 0.369714 O\n0.191936 0.703058 0.844316 O\n0.687880 0.183171 0.331158 O\n0.595443 0.193530 0.651167 O\n0.129531 0.603495 0.582837 O\n0.322238 0.406476 0.555123 O\n0.196881 0.578042 0.155425 O\n0.409906 0.313070 0.072655 O\n0.608543 0.123110 0.075119 O\n0.397407 0.097786 0.943149 O\n0.119655 0.370606 0.710348 O\n0.092672 0.403139 0.447413 O\n0.387629 0.090358 0.207497 O\n0.302381 0.103054 0.657488 O\n0.088445 0.285039 0.189406 O\n0.091709 0.208390 0.941795 O\n0.179259 0.081445 0.436828 O\n0.039595 0.111612 0.655643 O\n0.127640 0.032081 0.131303 O\n",
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"formula_full": "Li12 V8 P12 O48",
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{
"id": "mp-756923",
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"structure_string": "Gd4 V4 O14\n1.0\n6.847316 -0.002429 0.015751\n0.785547 7.003552 0.083152\n3.191194 0.176589 6.275684\nGd V O\n4 4 14\ndirect\n0.271171 0.572198 0.264211 Gd\n0.253634 0.153380 0.674407 Gd\n0.746366 0.846620 0.325593 Gd\n0.728829 0.427802 0.735789 Gd\n0.274367 0.065531 0.154916 V\n0.195916 0.664517 0.778375 V\n0.804084 0.335483 0.221625 V\n0.725633 0.934469 0.845084 V\n0.050902 0.192295 0.058757 O\n0.102396 0.858848 0.258993 O\n0.258034 0.234091 0.328574 O\n0.127901 0.485691 0.642330 O\n0.526549 0.886954 0.138526 O\n0.366215 0.831519 0.575829 O\n0.643617 0.460781 0.097914 O\n0.356383 0.539219 0.902086 O\n0.633785 0.168481 0.424171 O\n0.473451 0.113046 0.861474 O\n0.872099 0.514309 0.357670 O\n0.741966 0.765909 0.671426 O\n0.897604 0.141152 0.741007 O\n0.949098 0.807705 0.941243 O\n",
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"formula_full": "Gd4 V4 O14",
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{
"id": "mp-756922",
"created_at": "2022-09-04T14:45:12.042522Z",
"structure_string": "Ho4 S2 O4\n1.0\n1.888634 -3.271211 0.000000\n1.888634 3.271211 0.000000\n0.000000 0.000000 13.317964\nHo S O\n4 2 4\ndirect\n0.333333 0.666667 0.892381 Ho\n0.333333 0.666667 0.607619 Ho\n0.666667 0.333333 0.392381 Ho\n0.666667 0.333333 0.107619 Ho\n0.000000 0.000000 0.250000 S\n0.000000 0.000000 0.750000 S\n0.333333 0.666667 0.064725 O\n0.333333 0.666667 0.435275 O\n0.666667 0.333333 0.935275 O\n0.666667 0.333333 0.564725 O\n",
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"volume": 164.5599679062935,
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"formula_full": "Ho4 S2 O4",
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{
"id": "mp-756921",
"created_at": "2022-09-04T14:43:15.245036Z",
"structure_string": "Li1 Zn1 Fe10 O16\n1.0\n10.056845 -3.030770 0.000000\n10.056845 3.030770 0.000000\n9.143480 0.000000 5.169377\nLi Zn Fe O\n1 1 10 16\ndirect\n0.499070 0.499070 0.499070 Li\n0.688121 0.688121 0.688121 Zn\n0.998641 0.998641 0.998641 Fe\n0.377056 0.377056 0.377056 Fe\n0.436539 0.939623 0.939623 Fe\n0.939623 0.939623 0.436539 Fe\n0.939623 0.436539 0.939623 Fe\n0.876248 0.876248 0.876248 Fe\n0.935577 0.437585 0.437585 Fe\n0.185626 0.185626 0.185626 Fe\n0.437585 0.935577 0.437585 Fe\n0.437585 0.437585 0.935577 Fe\n0.571467 0.571467 0.051361 O\n0.571467 0.051361 0.571467 O\n0.051361 0.571467 0.571467 O\n0.805114 0.805114 0.805114 O\n0.841537 0.294054 0.294054 O\n0.064184 0.064184 0.064184 O\n0.294054 0.841537 0.294054 O\n0.294054 0.294054 0.841537 O\n0.081658 0.531746 0.081658 O\n0.081658 0.081658 0.531746 O\n0.531746 0.081658 0.081658 O\n0.310072 0.310072 0.310072 O\n0.569977 0.569977 0.569977 O\n0.323462 0.803447 0.803447 O\n0.803447 0.803447 0.323462 O\n0.803447 0.323462 0.803447 O\n",
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{
"id": "mp-756920",
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"structure_string": "Li2 Mg1 Ni3 O8\n1.0\n2.839140 4.922427 0.000000\n-2.839140 4.922427 0.000000\n0.000000 3.276106 4.855249\nLi Mg Ni O\n2 1 3 8\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.243285 0.715025 0.789673 O\n0.756715 0.284975 0.210327 O\n0.284975 0.756715 0.210327 O\n0.715025 0.243285 0.789673 O\n0.266580 0.266580 0.195407 O\n0.733420 0.733420 0.804593 O\n0.247172 0.247172 0.794109 O\n0.752828 0.752828 0.205891 O\n",
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"spacegroup": 12
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{
"id": "mp-756919",
"created_at": "2022-09-04T14:39:07.444130Z",
"structure_string": "Mg6 As4 O16\n1.0\n8.453711 0.000000 0.000000\n0.000000 5.365652 0.000000\n0.000000 4.571603 7.923916\nMg As O\n6 4 16\ndirect\n0.000000 0.500000 0.500000 Mg\n0.355491 0.499635 0.601195 Mg\n0.855491 0.500365 0.898805 Mg\n0.500000 0.500000 0.000000 Mg\n0.144509 0.499635 0.101195 Mg\n0.644509 0.500365 0.398805 Mg\n0.306084 0.848381 0.195420 As\n0.806084 0.151619 0.304580 As\n0.193916 0.848381 0.695420 As\n0.693916 0.151619 0.804580 As\n0.873566 0.330581 0.740935 O\n0.436744 0.700035 0.361527 O\n0.646449 0.234398 0.958303 O\n0.804023 0.787781 0.383746 O\n0.146449 0.765602 0.541697 O\n0.373566 0.669419 0.759065 O\n0.304023 0.212219 0.116254 O\n0.936744 0.299965 0.138473 O\n0.063256 0.700035 0.861527 O\n0.695977 0.787781 0.883746 O\n0.626434 0.330581 0.240935 O\n0.853551 0.234398 0.458303 O\n0.195977 0.212219 0.616254 O\n0.353551 0.765602 0.041697 O\n0.563256 0.299965 0.638473 O\n0.126434 0.669419 0.259065 O\n",
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"formula_full": "Mg6 As4 O16",
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"spacegroup": 14
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{
"id": "mp-756918",
"created_at": "2022-09-04T14:48:06.583677Z",
"structure_string": "Li2 Mn3 Sn1 O8\n1.0\n5.399410 -2.994981 0.000000\n5.399410 2.994981 0.000000\n3.738134 0.000000 4.914255\nLi Mn Sn O\n2 3 1 8\ndirect\n0.878243 0.878243 0.878243 Li\n0.121757 0.121757 0.121757 Li\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Sn\n0.727789 0.727789 0.727789 O\n0.742026 0.278575 0.742026 O\n0.278575 0.742026 0.742026 O\n0.742026 0.742026 0.278575 O\n0.257974 0.257974 0.721425 O\n0.721425 0.257974 0.257974 O\n0.257974 0.721425 0.257974 O\n0.272211 0.272211 0.272211 O\n",
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{
"id": "mp-756917",
"created_at": "2022-09-04T14:39:31.442214Z",
"structure_string": "Mn3 Cr2 Te3 O16\n1.0\n3.088939 5.316989 0.000000\n-3.088939 5.316989 0.000000\n0.000000 0.219749 8.957819\nMn Cr Te O\n3 2 3 16\ndirect\n0.175797 0.175797 0.786192 Mn\n0.341138 0.831923 0.290220 Mn\n0.831923 0.341138 0.290220 Mn\n0.324573 0.324573 0.508034 Cr\n0.663434 0.663434 0.022576 Cr\n0.176310 0.672490 0.793612 Te\n0.672490 0.176310 0.793612 Te\n0.838222 0.838222 0.297566 Te\n0.174554 0.664125 0.399510 O\n0.474180 0.474180 0.636455 O\n0.311729 0.311729 0.910090 O\n0.012925 0.012925 0.678850 O\n0.008140 0.008140 0.188047 O\n0.664125 0.174554 0.399510 O\n0.054387 0.457684 0.656103 O\n0.457684 0.054387 0.656103 O\n0.826981 0.826981 0.907451 O\n0.166780 0.166780 0.391013 O\n0.516039 0.943801 0.160120 O\n0.943801 0.516039 0.160120 O\n0.654387 0.654387 0.401063 O\n0.346580 0.839430 0.895405 O\n0.526221 0.526221 0.167072 O\n0.839430 0.346580 0.895405 O\n",
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{
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{
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"structure_string": "Er4 B8 O18\n1.0\n6.174631 0.000000 0.000000\n-1.381882 6.279151 0.000000\n-0.932707 -1.872545 7.173198\nEr B O\n4 8 18\ndirect\n0.112818 0.322917 0.640142 Er\n0.450084 0.909329 0.712191 Er\n0.549916 0.090671 0.287809 Er\n0.887182 0.677083 0.359858 Er\n0.005737 0.855122 0.809736 B\n0.268554 0.666480 0.018598 B\n0.373624 0.643427 0.349512 B\n0.338491 0.317148 0.072647 B\n0.661509 0.682852 0.927353 B\n0.626376 0.356573 0.650488 B\n0.731446 0.333520 0.981402 B\n0.994263 0.144878 0.190264 B\n0.070358 0.956702 0.674211 O\n0.139680 0.717507 0.855534 O\n0.225997 0.427670 0.956991 O\n0.218769 0.595184 0.478691 O\n0.235582 0.737149 0.211883 O\n0.187880 0.130793 0.121429 O\n0.419544 0.181572 0.553793 O\n0.495095 0.207857 0.978616 O\n0.539044 0.537794 0.747503 O\n0.460956 0.462206 0.252497 O\n0.504905 0.792143 0.021384 O\n0.580456 0.818428 0.446207 O\n0.812120 0.869207 0.878571 O\n0.764418 0.262851 0.788117 O\n0.781231 0.404816 0.521309 O\n0.774003 0.572330 0.043009 O\n0.860320 0.282493 0.144466 O\n0.929642 0.043298 0.325789 O\n",
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