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{
"id": "mp-1184336",
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{
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"structure_string": "Li8 Fe10 Co4 O24\n1.0\n8.916391 0.000000 0.000000\n0.000000 5.228267 0.000000\n0.000000 1.581299 9.682575\nLi Fe Co O\n8 10 4 24\ndirect\n0.903471 0.016640 0.746932 Li\n0.917088 0.486950 0.257622 Li\n0.583882 0.761031 0.503124 Li\n0.589982 0.498102 0.256164 Li\n0.403471 0.983360 0.253068 Li\n0.417088 0.513050 0.742378 Li\n0.083882 0.238969 0.496876 Li\n0.089982 0.501898 0.743836 Li\n0.918826 0.255757 0.002623 Fe\n0.921667 0.750642 0.497338 Fe\n0.751505 0.996914 0.256816 Fe\n0.578999 0.240645 0.997015 Fe\n0.744371 0.510194 0.740603 Fe\n0.421667 0.249358 0.502662 Fe\n0.418826 0.744243 0.997377 Fe\n0.251505 0.003086 0.743184 Fe\n0.244371 0.489806 0.259397 Fe\n0.078999 0.759355 0.002985 Fe\n0.747897 0.245355 0.505537 Co\n0.746289 0.756480 0.993166 Co\n0.246289 0.243520 0.006834 Co\n0.247897 0.754645 0.494463 Co\n0.895552 0.125717 0.389694 O\n0.909444 0.893323 0.112974 O\n0.753448 0.153835 0.880208 O\n0.767698 0.852132 0.626598 O\n0.900848 0.381888 0.617892 O\n0.916831 0.611527 0.880498 O\n0.763660 0.651318 0.365554 O\n0.596843 0.136177 0.385684 O\n0.581404 0.887103 0.121159 O\n0.747624 0.352470 0.123639 O\n0.596995 0.385303 0.608781 O\n0.395552 0.874283 0.610306 O\n0.409444 0.106677 0.887026 O\n0.580476 0.596493 0.881319 O\n0.267698 0.147868 0.373402 O\n0.400848 0.618112 0.382108 O\n0.416831 0.388473 0.119502 O\n0.253448 0.846165 0.119792 O\n0.247624 0.647530 0.876361 O\n0.263660 0.348682 0.634446 O\n0.096843 0.863823 0.614316 O\n0.081404 0.112897 0.878841 O\n0.096995 0.614697 0.391219 O\n0.080476 0.403507 0.118681 O\n",
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"formula_full": "Li8 Fe10 Co4 O24",
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},
{
"id": "mp-1407574",
"created_at": "2022-09-04T14:40:23.487717Z",
"structure_string": "Zn2 Fe4 O10\n1.0\n3.295142 0.000000 0.000000\n0.000000 5.048149 0.000000\n0.000000 0.000000 11.842448\nZn Fe O\n2 4 10\ndirect\n0.000000 0.596179 0.500000 Zn\n0.500000 0.403821 0.000000 Zn\n0.500000 0.059299 0.647668 Fe\n0.000000 0.940701 0.852332 Fe\n0.000000 0.940701 0.147668 Fe\n0.500000 0.059299 0.352332 Fe\n0.000000 0.105245 0.000000 O\n0.500000 0.894755 0.500000 O\n0.000000 0.874286 0.686168 O\n0.500000 0.125714 0.813832 O\n0.000000 0.874286 0.313832 O\n0.500000 0.125714 0.186168 O\n0.500000 0.404250 0.409206 O\n0.000000 0.595750 0.090794 O\n0.000000 0.595750 0.909206 O\n0.500000 0.404250 0.590794 O\n",
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{
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"structure_string": "Ce6 B6 N12\n1.0\n6.418724 0.000000 0.000000\n-2.941372 6.127045 0.000000\n-0.025230 -2.446738 7.303826\nCe B N\n6 6 12\ndirect\n0.536788 0.778774 0.066187 Ce\n0.463212 0.221226 0.933813 Ce\n0.465046 0.217644 0.424299 Ce\n0.534954 0.782356 0.575701 Ce\n0.953294 0.648439 0.294312 Ce\n0.046706 0.351561 0.705688 Ce\n0.899277 0.205233 0.331652 B\n0.099221 0.783792 0.987874 B\n0.900779 0.216208 0.012126 B\n0.100723 0.794767 0.668348 B\n0.277761 0.429226 0.230538 B\n0.722239 0.570774 0.769462 B\n0.154333 0.368249 0.044951 N\n0.845667 0.631751 0.955049 N\n0.231294 0.798850 0.830242 N\n0.763063 0.053700 0.431263 N\n0.236937 0.946300 0.568737 N\n0.768706 0.201150 0.169758 N\n0.467864 0.482454 0.747230 N\n0.532136 0.517546 0.252770 N\n0.763971 0.083486 0.833901 N\n0.236029 0.916514 0.166099 N\n0.151004 0.369532 0.384381 N\n0.848996 0.630468 0.615619 N\n",
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"elements": [
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"density": 6.206668661251045,
"density_atomic": 0.08355280829069654,
"volume": 287.2434869753188,
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"formula_full": "Ce6 B6 N12",
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"spacegroup": 2
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{
"id": "mp-1058331",
"created_at": "2022-09-04T14:40:22.444987Z",
"structure_string": "Cs1 Se1\n1.0\n4.358173 0.000000 0.000000\n0.000000 4.358173 0.000000\n0.000000 0.000000 4.358173\nCs Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.500000 Se\n",
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"spacegroup": 221
},
{
"id": "mp-1358820",
"created_at": "2022-09-04T14:40:22.926789Z",
"structure_string": "K3 Li3 Sb9 O24\n1.0\n8.803738 0.000000 0.000000\n-3.310790 8.160766 0.000000\n-2.691712 -4.113243 7.497049\nK Li Sb O\n3 3 9 24\ndirect\n0.880319 0.841432 0.929069 K\n0.495283 0.490414 0.016977 K\n0.129501 0.119918 0.038555 K\n0.355001 0.150422 0.542660 Li\n0.969195 0.764746 0.541646 Li\n0.198318 0.717281 0.747226 Li\n0.836997 0.319650 0.166347 Sb\n0.034043 0.151245 0.477775 Sb\n0.646154 0.834225 0.517223 Sb\n0.677721 0.492797 0.491732 Sb\n0.824250 0.332488 0.823798 Sb\n0.505446 0.013857 0.823929 Sb\n0.352785 0.992047 0.317680 Sb\n0.176279 0.658160 0.166488 Sb\n0.310425 0.498306 0.518021 Sb\n0.831814 0.109693 0.346646 O\n0.807245 0.857300 0.635498 O\n0.473393 0.532172 0.657264 O\n0.874859 0.497067 0.290183 O\n0.788140 0.151882 0.721813 O\n0.472789 0.867051 0.688715 O\n0.810229 0.771984 0.364529 O\n0.804461 0.508648 0.639974 O\n0.513857 0.217631 0.639853 O\n0.117648 0.477234 0.067014 O\n0.456462 0.790542 0.024508 O\n0.845682 0.180891 0.025103 O\n0.216894 0.870191 0.953298 O\n0.836633 0.490928 0.953760 O\n0.534984 0.166365 0.960291 O\n0.464842 0.785008 0.411909 O\n0.204632 0.483162 0.347832 O\n0.168562 0.218823 0.635354 O\n0.567708 0.204771 0.309091 O\n0.148827 0.787066 0.306906 O\n0.106321 0.500595 0.688905 O\n0.234414 0.151079 0.276662 O\n0.525545 0.487356 0.364778 O\n0.188543 0.901776 0.570988 O\n",
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{
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"structure_string": "Sr1 Ca3 Mn4 O12\n1.0\n7.637567 0.000000 0.000000\n0.000000 7.637567 0.000000\n0.000000 0.000000 3.820774\nSr Ca Mn O\n1 3 4 12\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.751931 0.248069 0.000000 Mn\n0.248069 0.248069 0.000000 Mn\n0.751931 0.751931 0.000000 Mn\n0.248069 0.751931 0.000000 Mn\n0.754835 0.245165 0.500000 O\n0.245165 0.245165 0.500000 O\n0.754835 0.754835 0.500000 O\n0.245165 0.754835 0.500000 O\n0.758655 0.500000 0.000000 O\n0.241345 0.500000 0.000000 O\n0.751155 0.000000 0.000000 O\n0.248845 0.000000 0.000000 O\n0.000000 0.248845 0.000000 O\n0.500000 0.241345 0.000000 O\n0.000000 0.751155 0.000000 O\n0.500000 0.758655 0.000000 O\n",
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"formula_full": "Sr1 Ca3 Mn4 O12",
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{
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{
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{
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},
{
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{
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}