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{
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{
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{
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"structure_string": "Cu8 O12\n1.0\n7.103053 0.000000 0.000000\n0.000000 5.343833 0.000000\n0.000000 4.388211 5.760473\nCu O\n8 12\ndirect\n0.012877 0.120618 0.136885 Cu\n0.487123 0.120618 0.636885 Cu\n0.255588 0.506856 0.235589 Cu\n0.755588 0.493144 0.264411 Cu\n0.244412 0.506856 0.735589 Cu\n0.744412 0.493144 0.764411 Cu\n0.512877 0.879382 0.363115 Cu\n0.987123 0.879382 0.863115 Cu\n0.077144 0.997335 0.440793 O\n0.818690 0.488258 0.016049 O\n0.422856 0.997335 0.940793 O\n0.506407 0.280711 0.312144 O\n0.006407 0.719289 0.187856 O\n0.681310 0.488258 0.516049 O\n0.318690 0.511742 0.483951 O\n0.993593 0.280711 0.812144 O\n0.493593 0.719289 0.687856 O\n0.577144 0.002665 0.059207 O\n0.181310 0.511742 0.983951 O\n0.922856 0.002665 0.559207 O\n",
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{
"id": "mp-1178155",
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"structure_string": "La6 Al2 O12\n1.0\n4.710255 -5.909863 0.000000\n4.710255 5.909863 0.000000\n0.000000 0.000000 5.644697\nLa Al O\n6 2 12\ndirect\n0.085133 0.300927 0.467804 La\n0.300927 0.085133 0.967804 La\n0.604965 0.395035 0.428814 La\n0.395035 0.604965 0.928814 La\n0.699073 0.914867 0.467804 La\n0.914867 0.699073 0.967804 La\n0.805331 0.194669 0.009104 Al\n0.194669 0.805331 0.509104 Al\n0.326846 0.353233 0.200845 O\n0.353233 0.326846 0.700845 O\n0.114089 0.592499 0.661218 O\n0.592499 0.114089 0.161218 O\n0.947356 0.052644 0.121595 O\n0.787088 0.212912 0.694702 O\n0.212912 0.787088 0.194702 O\n0.052644 0.947356 0.621595 O\n0.885911 0.407501 0.161218 O\n0.407501 0.885911 0.661218 O\n0.646767 0.673154 0.200845 O\n0.673154 0.646767 0.700845 O\n",
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{
"id": "mp-1238840",
"created_at": "2022-09-04T14:39:06.403318Z",
"structure_string": "K4 Cr8 S16\n1.0\n6.556712 0.001251 0.465718\n-0.074579 8.532500 1.309470\n-0.195616 0.212338 12.347209\nK Cr S\n4 8 16\ndirect\n0.153950 0.207200 0.661674 K\n0.846050 0.792800 0.338326 K\n0.250236 0.352750 0.019425 K\n0.749764 0.647250 0.980575 K\n0.158620 0.710461 0.710232 Cr\n0.841380 0.289539 0.289768 Cr\n0.288384 0.872443 0.001166 Cr\n0.711616 0.127557 0.998834 Cr\n0.351848 0.551087 0.300875 Cr\n0.648152 0.448913 0.699125 Cr\n0.368037 0.046801 0.301190 Cr\n0.631963 0.953199 0.698810 Cr\n0.197200 0.692611 0.883655 S\n0.802800 0.307389 0.116345 S\n0.051474 0.073929 0.926725 S\n0.948526 0.926071 0.073275 S\n0.309824 0.784242 0.362479 S\n0.690176 0.215758 0.637521 S\n0.186406 0.287437 0.328418 S\n0.813594 0.712563 0.671582 S\n0.336509 0.908364 0.622249 S\n0.663491 0.091636 0.377751 S\n0.330812 0.521931 0.650877 S\n0.669188 0.478069 0.349123 S\n0.433815 0.032620 0.118244 S\n0.566185 0.967380 0.881756 S\n0.325255 0.641003 0.125698 S\n0.674745 0.358997 0.874302 S\n",
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{
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"created_at": "2022-09-04T14:39:06.413233Z",
"structure_string": "Ca4 Al2 H20 Cl2 O16\n1.0\n2.897929 4.950225 0.000000\n-2.897929 4.950225 0.000000\n0.000000 3.367151 15.953444\nCa Al H Cl O\n4 2 20 2 16\ndirect\n0.847654 0.345125 0.461545 Ca\n0.345125 0.847654 0.961545 Ca\n0.153596 0.654288 0.538441 Ca\n0.654288 0.153596 0.038441 Ca\n0.501003 0.999715 0.499995 Al\n0.999715 0.501003 0.999995 Al\n0.400586 0.380732 0.381187 H\n0.885033 0.838974 0.381921 H\n0.330359 0.903488 0.381539 H\n0.380732 0.400586 0.881187 H\n0.903488 0.330359 0.881539 H\n0.838974 0.885033 0.881921 H\n0.596338 0.615465 0.618692 H\n0.118529 0.162446 0.619027 H\n0.661432 0.105288 0.617651 H\n0.615465 0.596338 0.118692 H\n0.105288 0.661432 0.117651 H\n0.162446 0.118529 0.119027 H\n0.723901 0.490126 0.277861 H\n0.993441 0.504022 0.277804 H\n0.504022 0.993441 0.777804 H\n0.490126 0.723901 0.777861 H\n0.996479 0.774188 0.722075 H\n0.009188 0.491531 0.722307 H\n0.774188 0.996479 0.222075 H\n0.491531 0.009188 0.222307 H\n0.247374 0.749915 0.250006 Cl\n0.749915 0.247374 0.750006 Cl\n0.466286 0.330151 0.436009 O\n0.830096 0.769986 0.436562 O\n0.267625 0.966312 0.436830 O\n0.330151 0.466286 0.936009 O\n0.966312 0.267625 0.936830 O\n0.769986 0.830096 0.936562 O\n0.534703 0.669787 0.563240 O\n0.171756 0.230552 0.563961 O\n0.731974 0.035691 0.563390 O\n0.669787 0.534703 0.063240 O\n0.035691 0.731974 0.063390 O\n0.230552 0.171756 0.063961 O\n0.890792 0.409626 0.304534 O\n0.409626 0.890792 0.804534 O\n0.090096 0.606362 0.695421 O\n0.606362 0.090096 0.195421 O\n",
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{
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"structure_string": "K2 Co6 Cu2 As6 O24\n1.0\n6.460580 6.201417 0.000000\n-6.460580 6.201417 0.000000\n0.000000 2.763704 6.346974\nK Co Cu As O\n2 6 2 6 24\ndirect\n0.513737 0.486263 0.250000 K\n0.486263 0.513737 0.750000 K\n0.560420 0.876277 0.370729 Co\n0.439580 0.123723 0.629271 Co\n0.123723 0.439580 0.129271 Co\n0.876277 0.560420 0.870729 Co\n0.241135 0.758865 0.250000 Co\n0.758865 0.241135 0.750000 Co\n0.997912 0.002088 0.250000 Cu\n0.002088 0.997912 0.750000 Cu\n0.377718 0.147268 0.127380 As\n0.622282 0.852732 0.872620 As\n0.852732 0.622282 0.372620 As\n0.147268 0.377718 0.627380 As\n0.785446 0.214554 0.250000 As\n0.214554 0.785446 0.750000 As\n0.223867 0.999893 0.185947 O\n0.776133 0.000107 0.814053 O\n0.000107 0.776133 0.314053 O\n0.999893 0.223867 0.685947 O\n0.471143 0.092914 0.319458 O\n0.528857 0.907086 0.680542 O\n0.907086 0.528857 0.180542 O\n0.092914 0.471143 0.819458 O\n0.490705 0.830400 0.118591 O\n0.509295 0.169600 0.881409 O\n0.169600 0.509295 0.381409 O\n0.830400 0.490705 0.618591 O\n0.673693 0.250214 0.476697 O\n0.326307 0.749786 0.523303 O\n0.749786 0.326307 0.023303 O\n0.250214 0.673693 0.976697 O\n0.776429 0.016121 0.261853 O\n0.223571 0.983879 0.738147 O\n0.983879 0.223571 0.238147 O\n0.016121 0.776429 0.761853 O\n0.674792 0.684416 0.373890 O\n0.325208 0.315584 0.626110 O\n0.315584 0.325208 0.126110 O\n0.684416 0.674792 0.873890 O\n",
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{
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"structure_string": "Mg4 B8 H32\n1.0\n0.000000 6.207089 6.207089\n6.207089 0.000000 6.207089\n6.207089 6.207089 0.000000\nMg B H\n4 8 32\ndirect\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.750000 0.750000 0.750000 Mg\n0.924000 0.358667 0.358667 B\n0.358667 0.924000 0.358667 B\n0.358667 0.358667 0.924000 B\n0.358667 0.358667 0.358667 B\n0.326000 0.891333 0.891333 B\n0.891333 0.326000 0.891333 B\n0.891333 0.891333 0.326000 B\n0.891333 0.891333 0.891333 B\n0.750793 0.416402 0.416402 H\n0.416402 0.750793 0.416402 H\n0.416402 0.416402 0.750793 H\n0.416402 0.416402 0.416402 H\n0.499207 0.833598 0.833598 H\n0.833598 0.499207 0.833598 H\n0.833598 0.833598 0.499207 H\n0.833598 0.833598 0.833598 H\n0.494959 0.265597 0.265597 H\n0.265597 0.494959 0.973847 H\n0.265597 0.973847 0.494959 H\n0.973847 0.265597 0.265597 H\n0.265597 0.265597 0.494959 H\n0.494959 0.973847 0.265597 H\n0.973847 0.494959 0.265597 H\n0.265597 0.265597 0.973847 H\n0.265597 0.494959 0.265597 H\n0.973847 0.265597 0.494959 H\n0.494959 0.265597 0.973847 H\n0.265597 0.973847 0.265597 H\n0.755041 0.984403 0.984403 H\n0.984403 0.755041 0.276153 H\n0.984403 0.276153 0.755041 H\n0.276153 0.984403 0.984403 H\n0.984403 0.984403 0.755041 H\n0.755041 0.276153 0.984403 H\n0.276153 0.755041 0.984403 H\n0.984403 0.984403 0.276153 H\n0.984403 0.755041 0.984403 H\n0.276153 0.984403 0.755041 H\n0.755041 0.984403 0.276153 H\n0.984403 0.276153 0.984403 H\n",
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{
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{
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{
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}