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{
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{
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{
"id": "mp-1104318",
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"structure_string": "Ni1 Sn1 Cl6 O6\n1.0\n4.249511 -5.263516 0.000000\n4.249511 5.263516 0.000000\n-2.269968 0.000000 6.372612\nNi Sn Cl O\n1 1 6 6\ndirect\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Sn\n0.196994 0.331444 0.953092 Cl\n0.953092 0.196994 0.331444 Cl\n0.331444 0.953092 0.196994 Cl\n0.803006 0.668556 0.046908 Cl\n0.046908 0.803006 0.668556 Cl\n0.668556 0.046908 0.803006 Cl\n0.642719 0.770989 0.472111 O\n0.472111 0.642719 0.770989 O\n0.770989 0.472111 0.642719 O\n0.357281 0.229011 0.527889 O\n0.527889 0.357281 0.229011 O\n0.229011 0.527889 0.357281 O\n",
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{
"id": "mp-1199632",
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"structure_string": "U4 H24 C4 S6 N4 O32\n1.0\n8.763471 0.000000 0.000000\n0.027792 9.959925 0.000000\n1.027956 0.031472 9.932856\nU H C S N O\n4 24 4 6 4 32\ndirect\n0.496967 0.865568 0.474655 U\n0.737350 0.367688 0.340888 U\n0.494071 0.258547 0.859419 U\n0.736363 0.749463 0.947894 U\n0.108733 0.378875 0.556702 H\n0.941046 0.452087 0.614542 H\n0.050283 0.383086 0.723169 H\n0.215226 0.499927 0.011052 H\n0.255686 0.663713 0.026835 H\n0.080339 0.608427 0.077987 H\n0.031954 0.144870 0.016938 H\n0.957018 0.005566 0.088455 H\n0.128758 0.998744 0.999311 H\n0.965329 0.903187 0.513240 H\n0.003307 0.866678 0.671038 H\n0.139940 0.931321 0.559426 H\n0.255292 0.546957 0.661094 H\n0.079614 0.625559 0.727342 H\n0.134423 0.622386 0.548641 H\n0.190485 0.456103 0.243806 H\n0.204830 0.632541 0.278166 H\n0.367357 0.542360 0.201684 H\n0.248692 0.130298 0.159185 H\n0.152389 0.989757 0.241679 H\n0.066437 0.153610 0.255228 H\n0.991060 0.142012 0.558633 H\n0.054439 0.099825 0.719346 H\n0.860277 0.069149 0.687278 H\n0.136335 0.567370 0.643602 C\n0.242593 0.551377 0.208983 C\n0.137048 0.084987 0.189641 C\n0.979456 0.071304 0.643086 C\n0.383904 0.218485 0.518875 S\n0.386044 0.904538 0.836843 S\n0.840064 0.719785 0.291882 S\n0.621062 0.561144 0.657498 S\n0.849444 0.397528 0.980497 S\n0.619907 0.059628 0.155897 S\n0.053976 0.437192 0.633821 N\n0.195300 0.583124 0.072459 N\n0.058843 0.057130 0.065930 N\n0.024767 0.934547 0.592756 N\n0.723259 0.468387 0.571688 O\n0.880136 0.390610 0.125136 O\n0.868146 0.579708 0.337967 O\n0.547774 0.243458 0.466260 O\n0.720824 0.158344 0.214975 O\n0.903470 0.291333 0.403591 O\n0.579343 0.451214 0.275396 O\n0.875493 0.722874 0.140698 O\n0.878307 0.538854 0.931576 O\n0.720279 0.651950 0.729373 O\n0.673211 0.751649 0.323457 O\n0.939618 0.814081 0.352226 O\n0.519638 0.482205 0.756916 O\n0.525697 0.641664 0.572594 O\n0.662692 0.935026 0.540637 O\n0.518980 0.991638 0.263392 O\n0.322786 0.798879 0.418116 O\n0.357998 0.069713 0.513343 O\n0.359284 0.859704 0.698519 O\n0.280248 0.836003 0.937859 O\n0.356775 0.052583 0.847784 O\n0.551282 0.879203 0.855613 O\n0.684565 0.365404 0.971199 O\n0.954427 0.305864 0.901083 O\n0.574023 0.663505 0.032729 O\n0.904609 0.829801 0.860547 O\n0.326789 0.333408 0.953980 O\n0.653638 0.184143 0.759516 O\n0.362110 0.261545 0.663554 O\n0.522053 0.127361 0.063169 O\n0.722847 0.959578 0.079529 O\n0.274361 0.289849 0.444185 O\n",
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{
"id": "mp-561786",
"created_at": "2022-09-04T14:45:19.746008Z",
"structure_string": "Cs2 Te4 O12\n1.0\n6.529118 -3.710355 0.000000\n6.529118 3.710355 0.000000\n4.420605 0.000000 6.070780\nCs Te O\n2 4 12\ndirect\n0.877578 0.877578 0.877578 Cs\n0.122422 0.122422 0.122422 Cs\n0.000000 0.500000 0.500000 Te\n0.500000 0.500000 0.000000 Te\n0.500000 0.500000 0.500000 Te\n0.500000 0.000000 0.500000 Te\n0.182922 0.575935 0.182922 O\n0.428424 0.834934 0.428424 O\n0.424065 0.817078 0.817078 O\n0.575935 0.182922 0.182922 O\n0.428424 0.428424 0.834934 O\n0.817078 0.424065 0.817078 O\n0.834934 0.428424 0.428424 O\n0.165066 0.571576 0.571576 O\n0.817078 0.817078 0.424065 O\n0.571576 0.571576 0.165066 O\n0.571576 0.165066 0.571576 O\n0.182922 0.182922 0.575935 O\n",
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{
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"structure_string": "Al4 H24 C8 Se4 Cl12\n1.0\n6.606856 0.000000 0.000000\n0.000000 11.011038 0.000000\n0.000000 0.000000 13.427082\nAl H C Se Cl\n4 24 8 4 12\ndirect\n0.437606 0.750000 0.942175 Al\n0.562394 0.250000 0.057825 Al\n0.437606 0.250000 0.557825 Al\n0.562394 0.750000 0.442175 Al\n0.044058 0.878723 0.078836 H\n0.955942 0.378723 0.921164 H\n0.044058 0.121277 0.421164 H\n0.955942 0.621277 0.578836 H\n0.955942 0.121277 0.921164 H\n0.044058 0.621277 0.078836 H\n0.955942 0.878723 0.578836 H\n0.044058 0.378723 0.421164 H\n0.245495 0.968473 0.131914 H\n0.754505 0.468473 0.868086 H\n0.245495 0.031527 0.368086 H\n0.754505 0.531527 0.631914 H\n0.754505 0.031527 0.868086 H\n0.245495 0.531527 0.131914 H\n0.754505 0.968473 0.631914 H\n0.245495 0.468473 0.368086 H\n0.089868 0.875140 0.211860 H\n0.910132 0.375140 0.788140 H\n0.089868 0.124860 0.288140 H\n0.910132 0.624860 0.711860 H\n0.910132 0.124860 0.788140 H\n0.089868 0.624860 0.211860 H\n0.910132 0.875140 0.711860 H\n0.089868 0.375140 0.288140 H\n0.158156 0.884294 0.137805 C\n0.841844 0.384294 0.862195 C\n0.158156 0.115706 0.362195 C\n0.841844 0.615706 0.637805 C\n0.841844 0.115706 0.862195 C\n0.158156 0.615706 0.137805 C\n0.841844 0.884294 0.637805 C\n0.158156 0.384294 0.362195 C\n0.352487 0.750000 0.126846 Se\n0.647513 0.250000 0.873154 Se\n0.352487 0.250000 0.373154 Se\n0.647513 0.750000 0.626846 Se\n0.761924 0.750000 0.934003 Cl\n0.238076 0.250000 0.065997 Cl\n0.761924 0.250000 0.565997 Cl\n0.238076 0.750000 0.434003 Cl\n0.316146 0.586026 0.881879 Cl\n0.683854 0.086026 0.118121 Cl\n0.316146 0.413974 0.618121 Cl\n0.683854 0.913974 0.381879 Cl\n0.683854 0.413974 0.118121 Cl\n0.316146 0.913974 0.881879 Cl\n0.683854 0.586026 0.381879 Cl\n0.316146 0.086026 0.618121 Cl\n",
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{
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{
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{
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{
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"structure_string": "Pu2 Zn17\n1.0\n5.125767 -4.506503 0.000000\n5.125767 4.506503 0.000000\n1.163711 0.000000 6.725164\nPu Zn\n2 17\ndirect\n0.665068 0.665068 0.665068 Pu\n0.334932 0.334932 0.334932 Pu\n0.000000 0.000000 0.500000 Zn\n0.500000 0.000000 0.000000 Zn\n0.000000 0.500000 0.000000 Zn\n0.699383 0.300617 0.000000 Zn\n0.000000 0.699383 0.300617 Zn\n0.300617 0.000000 0.699383 Zn\n0.000000 0.300617 0.699383 Zn\n0.699383 0.000000 0.300617 Zn\n0.300617 0.699383 0.000000 Zn\n0.352189 0.352189 0.837808 Zn\n0.837808 0.352189 0.352189 Zn\n0.352189 0.837808 0.352189 Zn\n0.647811 0.647811 0.162192 Zn\n0.162192 0.647811 0.647811 Zn\n0.647811 0.162192 0.647811 Zn\n0.898452 0.898452 0.898452 Zn\n0.101548 0.101548 0.101548 Zn\n",
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}