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{
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{
"id": "mp-12005",
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{
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{
"id": "mp-777960",
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"structure_string": "Li32 Mn11 Cr5 O48\n1.0\n5.002918 0.000000 0.000000\n-2.489587 4.349845 0.000000\n-0.656909 -1.252301 38.392478\nLi Mn Cr O\n32 11 5 48\ndirect\n0.906041 0.083357 0.249932 Li\n0.500759 0.000426 0.999968 Li\n0.563854 0.060772 0.187491 Li\n0.625599 0.124982 0.375030 Li\n0.691592 0.190085 0.562511 Li\n0.750386 0.252636 0.749953 Li\n0.812374 0.312538 0.937496 Li\n0.211736 0.036349 0.124791 Li\n0.875699 0.374918 0.124915 Li\n0.339300 0.166488 0.500030 Li\n0.461979 0.287768 0.874975 Li\n0.936667 0.438278 0.312523 Li\n0.998778 0.497561 0.499922 Li\n0.593795 0.417699 0.250139 Li\n0.712661 0.536626 0.624943 Li\n0.037569 0.216050 0.625255 Li\n0.162405 0.339254 0.999886 Li\n0.836134 0.660638 0.000041 Li\n0.959657 0.783697 0.374916 Li\n0.289915 0.465914 0.375197 Li\n0.410751 0.587352 0.749867 Li\n0.062306 0.562459 0.687505 Li\n0.536869 0.714606 0.125011 Li\n0.661258 0.835501 0.499815 Li\n0.126589 0.627576 0.875086 Li\n0.786975 0.960240 0.875204 Li\n0.188869 0.685132 0.062472 Li\n0.250338 0.749268 0.250045 Li\n0.312351 0.812609 0.437483 Li\n0.374553 0.871766 0.625066 Li\n0.434280 0.934156 0.812500 Li\n0.089003 0.910787 0.749992 Li\n0.979565 0.145193 0.437495 Mn\n0.395549 0.229390 0.687486 Mn\n0.520153 0.354728 0.062480 Mn\n0.645547 0.479516 0.437490 Mn\n0.770641 0.604101 0.812502 Mn\n0.895446 0.729480 0.187514 Mn\n0.354155 0.521130 0.562498 Mn\n0.479499 0.645169 0.937503 Mn\n0.604438 0.770566 0.312500 Mn\n0.729541 0.895310 0.687497 Mn\n0.145533 0.979527 0.937499 Mn\n0.856986 0.017088 0.062512 Cr\n0.267690 0.107655 0.312480 Cr\n0.099840 0.265443 0.812458 Cr\n0.232076 0.391526 0.187529 Cr\n0.025386 0.859805 0.562552 Cr\n0.946728 0.086805 0.340517 O\n0.906460 0.047766 0.159175 O\n0.570481 0.069379 0.283991 O\n0.695256 0.194729 0.658918 O\n0.554997 0.056163 0.090960 O\n0.678570 0.178912 0.465991 O\n0.809639 0.307537 0.840919 O\n0.819518 0.320398 0.033949 O\n0.946080 0.445437 0.409052 O\n0.211704 0.072640 0.215504 O\n0.930678 0.431183 0.215999 O\n0.336720 0.195452 0.590470 O\n0.463518 0.320757 0.965446 O\n0.177100 0.038524 0.034504 O\n0.304280 0.161459 0.409499 O\n0.428391 0.289421 0.784505 O\n0.070612 0.212397 0.715489 O\n0.037303 0.184440 0.534270 O\n0.161123 0.303724 0.909525 O\n0.593328 0.451517 0.340775 O\n0.712698 0.570938 0.715367 O\n0.552642 0.413727 0.159557 O\n0.676637 0.535085 0.534391 O\n0.804331 0.660866 0.909605 O\n0.201943 0.344067 0.090838 O\n0.320806 0.464017 0.465468 O\n0.448846 0.590704 0.840638 O\n0.288515 0.427821 0.284559 O\n0.411864 0.553647 0.659511 O\n0.836867 0.697615 0.090370 O\n0.963945 0.821046 0.465512 O\n0.924311 0.782094 0.284315 O\n0.576717 0.718900 0.215792 O\n0.696015 0.835758 0.590492 O\n0.820804 0.963583 0.965558 O\n0.530843 0.673005 0.034202 O\n0.661516 0.803935 0.409586 O\n0.069859 0.575361 0.783580 O\n0.787443 0.929270 0.784548 O\n0.054775 0.549354 0.591413 O\n0.178951 0.679397 0.966008 O\n0.194464 0.695333 0.158948 O\n0.315706 0.818171 0.534103 O\n0.446464 0.945887 0.909063 O\n0.305278 0.804867 0.341061 O\n0.430008 0.930293 0.715975 O\n0.087745 0.941432 0.840722 O\n0.054431 0.912072 0.659416 O\n",
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"formula_full": "Li32 Mn11 Cr5 O48",
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"updated_at": "2021-11-28T01:34:54.416000Z",
"spacegroup": 1
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{
"id": "mp-1472",
"created_at": "2022-09-04T14:40:19.001284Z",
"structure_string": "Zr1 B2\n1.0\n1.590245 -2.754386 0.000000\n1.590245 2.754386 0.000000\n0.000000 0.000000 3.545484\nZr B\n1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.333333 0.666667 0.500000 B\n0.666667 0.333333 0.500000 B\n",
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"updated_at": "2021-11-28T01:34:51.465000Z",
"spacegroup": 191
},
{
"id": "mp-1213399",
"created_at": "2022-09-04T14:40:19.011039Z",
"structure_string": "Cu2 N8 O6\n1.0\n0.000000 0.000000 -3.784806\n-4.125852 -7.146187 0.000000\n-4.125852 7.146187 0.000000\nCu N O\n2 8 6\ndirect\n0.750000 0.000000 0.000000 Cu\n0.250000 0.000000 0.000000 Cu\n0.750000 0.768952 0.006458 N\n0.750000 0.237506 0.231048 N\n0.250000 0.762494 0.993542 N\n0.750000 0.993542 0.762494 N\n0.250000 0.006458 0.768952 N\n0.250000 0.231048 0.237506 N\n0.750000 0.666667 0.333333 N\n0.250000 0.333333 0.666667 N\n0.750000 0.843141 0.419324 O\n0.750000 0.576183 0.156859 O\n0.250000 0.423817 0.580676 O\n0.750000 0.580676 0.423817 O\n0.250000 0.419324 0.843141 O\n0.250000 0.156859 0.576183 O\n",
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"formula_full": "Cu2 N8 O6",
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"formula_anonymous": "AB3C4",
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{
"id": "mp-1209606",
"created_at": "2022-09-04T14:40:19.013563Z",
"structure_string": "Rb4 Fe4 Br16\n1.0\n7.743136 0.000000 0.000000\n0.000000 10.129272 0.000000\n0.000000 0.000000 12.191424\nRb Fe Br\n4 4 16\ndirect\n0.250000 0.659542 0.184199 Rb\n0.750000 0.340458 0.815801 Rb\n0.750000 0.159542 0.315801 Rb\n0.250000 0.840458 0.684199 Rb\n0.250000 0.191569 0.062747 Fe\n0.750000 0.808431 0.937253 Fe\n0.750000 0.691569 0.437253 Fe\n0.250000 0.308431 0.562747 Fe\n0.250000 0.403613 0.388121 Br\n0.750000 0.596387 0.611879 Br\n0.750000 0.903613 0.111879 Br\n0.250000 0.096387 0.888121 Br\n0.250000 0.030527 0.201935 Br\n0.750000 0.969473 0.798065 Br\n0.750000 0.530527 0.298065 Br\n0.250000 0.469473 0.701935 Br\n0.001892 0.325771 0.082476 Br\n0.998108 0.674229 0.917524 Br\n0.998108 0.825771 0.417524 Br\n0.501892 0.674229 0.917524 Br\n0.001892 0.174229 0.582476 Br\n0.498108 0.325771 0.082476 Br\n0.498108 0.174229 0.582476 Br\n0.501892 0.825771 0.417524 Br\n",
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{
"id": "mp-1210859",
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{
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"formula_full": "La5 Ag1 Se8",
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{
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"structure_string": "Yb8 Co2\n1.0\n0.000000 5.503181 5.503181\n5.503181 0.000000 5.503181\n5.503181 5.503181 0.000000\nYb Co\n8 2\ndirect\n0.377470 0.377470 0.377470 Yb\n0.377470 0.377470 0.867589 Yb\n0.377470 0.867589 0.377470 Yb\n0.872530 0.872530 0.382411 Yb\n0.872530 0.872530 0.872530 Yb\n0.867589 0.377470 0.377470 Yb\n0.872530 0.382411 0.872530 Yb\n0.382411 0.872530 0.872530 Yb\n0.000000 0.000000 0.000000 Co\n0.250000 0.250000 0.250000 Co\n",
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{
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"structure_string": "Cr3 Sn3 Sb2 O16\n1.0\n6.180793 0.000000 0.000000\n-3.074471 -5.367904 0.000000\n-0.127368 0.070957 -9.321623\nCr Sn Sb O\n3 3 2 16\ndirect\n0.655757 0.828380 0.789579 Cr\n0.826693 0.169090 0.282803 Cr\n0.828555 0.658997 0.292109 Cr\n0.163945 0.335368 0.787717 Sn\n0.164596 0.829729 0.788058 Sn\n0.335344 0.168667 0.296601 Sn\n0.344312 0.673178 0.506390 Sb\n0.674944 0.338925 0.011649 Sb\n0.168359 0.345909 0.399730 O\n0.044812 0.523495 0.646064 O\n0.336422 0.668049 0.900601 O\n0.988185 0.994487 0.691792 O\n0.982626 0.999289 0.205229 O\n0.169874 0.827331 0.400141 O\n0.482545 0.528030 0.655956 O\n0.481955 0.954762 0.656473 O\n0.344098 0.171976 0.904774 O\n0.656471 0.830890 0.394171 O\n0.535929 0.050304 0.156954 O\n0.529164 0.476817 0.157155 O\n0.683671 0.330614 0.394394 O\n0.824699 0.170738 0.900077 O\n0.951482 0.468865 0.164681 O\n0.825564 0.655914 0.901183 O\n",
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{
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]
}