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{
"id": "mp-861240",
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"structure_string": "Li12 Al8 Cr4 O24\n1.0\n-1.697874 0.000000 4.809579\n0.000001 8.629882 0.000000\n-8.270191 -0.000001 -4.855262\nLi Al Cr O\n12 8 4 24\ndirect\n0.000000 0.500000 0.500000 Li\n0.250001 0.000000 0.750000 Li\n0.500000 0.500000 0.000000 Li\n0.750000 0.000000 0.250000 Li\n0.000001 0.167562 0.500000 Li\n0.250000 0.667562 0.750000 Li\n0.500000 0.167562 0.000000 Li\n0.750000 0.667562 0.250000 Li\n0.000001 0.832438 0.500000 Li\n0.250000 0.332438 0.750000 Li\n0.500000 0.832438 0.000000 Li\n0.750000 0.332439 0.250000 Li\n0.500001 0.333282 0.500001 Al\n0.750000 0.833283 0.749999 Al\n0.000000 0.333283 0.000000 Al\n0.250000 0.833283 0.250000 Al\n0.500001 0.666718 0.500001 Al\n0.750000 0.166718 0.749999 Al\n0.000000 0.666718 0.000000 Al\n0.250000 0.166718 0.250000 Al\n0.500007 0.999999 0.500000 Cr\n0.749994 0.499990 0.750003 Cr\n0.999993 0.999999 0.999991 Cr\n0.249998 0.499999 0.250004 Cr\n0.395534 0.500000 0.613688 O\n0.645534 0.000000 0.863689 O\n0.895534 0.500000 0.113689 O\n0.145534 0.000000 0.363688 O\n0.604467 0.500000 0.386311 O\n0.854467 0.000000 0.636312 O\n0.104467 0.500000 0.886312 O\n0.354467 0.000000 0.136311 O\n0.843914 0.672930 0.626933 O\n0.093912 0.172931 0.876935 O\n0.343913 0.672931 0.126933 O\n0.593911 0.172931 0.376934 O\n0.843914 0.327070 0.626933 O\n0.093912 0.827070 0.876934 O\n0.343913 0.327069 0.126934 O\n0.593911 0.827070 0.376933 O\n0.156088 0.672930 0.373065 O\n0.406086 0.172930 0.623067 O\n0.656089 0.672931 0.873066 O\n0.906087 0.172931 0.123067 O\n0.156088 0.327070 0.373065 O\n0.406086 0.827070 0.623067 O\n0.656089 0.327070 0.873066 O\n0.906088 0.827069 0.123067 O\n",
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{
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"structure_string": "Li8 Ni4 O8 F4\n1.0\n-0.027810 2.918988 4.085069\n-8.687985 2.914156 0.060550\n-0.030994 -2.918679 4.084795\nLi Ni O F\n8 4 8 4\ndirect\n0.995073 0.994665 0.490980 Li\n0.581588 0.832066 0.406514 Li\n0.164662 0.669738 0.347687 Li\n0.741326 0.495446 0.272208 Li\n0.245981 0.494837 0.741731 Li\n0.326616 0.332927 0.168983 Li\n0.425665 0.171224 0.589526 Li\n0.526675 0.995096 0.986980 Li\n0.094241 0.834318 0.907302 Ni\n0.658726 0.672281 0.825419 Ni\n0.823507 0.334264 0.677816 Ni\n0.903425 0.172197 0.080634 Ni\n0.346334 0.824432 0.120280 O\n0.861217 0.825883 0.681592 O\n0.399911 0.674492 0.617998 O\n0.953751 0.500420 0.550145 O\n0.605364 0.325757 0.436860 O\n0.045959 0.324722 0.920457 O\n0.693879 0.174462 0.824384 O\n0.800539 0.000088 0.203010 O\n0.894369 0.664921 0.100311 F\n0.465682 0.501107 0.030690 F\n0.184837 0.164864 0.308006 F\n0.280073 0.000953 0.714618 F\n",
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{
"id": "mp-799788",
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"structure_string": "Li8 Ni4 O8 F4\n1.0\n5.020478 0.000000 0.000000\n-1.626925 4.749965 0.000000\n-1.591258 -2.438798 8.688913\nLi Ni O F\n8 4 8 4\ndirect\n0.498350 0.984402 0.005335 Li\n0.257617 0.245719 0.167934 Li\n0.991789 0.504137 0.330262 Li\n0.718685 0.732218 0.504554 Li\n0.247943 0.235656 0.505163 Li\n0.496871 0.992470 0.667073 Li\n0.752921 0.768112 0.828776 Li\n0.003211 0.516866 0.004904 Li\n0.761334 0.762877 0.165682 Ni\n0.519143 0.003287 0.327719 Ni\n0.990711 0.492035 0.665736 Ni\n0.263759 0.247818 0.827803 Ni\n0.528584 0.995199 0.175568 O\n0.970173 0.512982 0.174117 O\n0.730985 0.748894 0.325508 O\n0.450695 0.954591 0.499580 O\n0.214653 0.256877 0.674243 O\n0.728987 0.695403 0.675278 O\n0.524540 0.042803 0.825538 O\n0.797166 0.800714 0.999912 O\n0.229530 0.224210 0.335079 F\n0.971524 0.467896 0.498893 F\n0.021722 0.514565 0.835136 F\n0.287288 0.281979 0.999047 F\n",
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"formula_full": "Li8 Ni4 O8 F4",
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{
"id": "mp-1272313",
"created_at": "2022-09-04T14:40:04.629712Z",
"structure_string": "Li8 Ni4 O8 F4\n1.0\n-1.412595 2.445799 0.000970\n3.164919 0.202639 14.323911\n4.451155 2.569874 0.091775\nLi Ni O F\n8 4 8 4\ndirect\n0.833292 0.666634 0.833275 Li\n0.333315 0.666655 0.333303 Li\n0.583254 0.166577 0.083395 Li\n0.083267 0.166624 0.583340 Li\n0.165386 0.331299 0.167124 Li\n0.665381 0.331269 0.667233 Li\n0.501187 0.002030 0.499415 Li\n0.001191 0.002042 0.999372 Li\n0.417288 0.834316 0.917305 Ni\n0.249441 0.499046 0.749260 Ni\n0.917255 0.834328 0.417309 Ni\n0.749440 0.499040 0.249258 Ni\n0.955001 0.909979 0.731249 O\n0.454969 0.909980 0.231294 O\n0.711922 0.423425 0.935147 O\n0.211869 0.423358 0.435143 O\n0.287362 0.574784 0.063441 O\n0.787339 0.574718 0.563466 O\n0.879235 0.758638 0.103340 O\n0.379217 0.758632 0.603299 O\n0.042329 0.084284 0.293620 F\n0.542294 0.084287 0.793575 F\n0.624393 0.249051 0.373409 F\n0.124377 0.249012 0.873425 F\n",
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{
"id": "mp-567842",
"created_at": "2022-09-04T14:47:16.617981Z",
"structure_string": "Ta1 Be12\n1.0\n-3.649320 3.649320 2.106980\n3.649320 -3.649320 2.106980\n3.649320 3.649320 -2.106980\nTa Be\n1 12\ndirect\n0.000000 0.000000 0.000000 Ta\n0.647279 0.000000 0.647279 Be\n0.000000 0.500000 0.000000 Be\n0.000000 0.647279 0.647279 Be\n0.715707 0.500000 0.215707 Be\n0.352721 0.000000 0.352721 Be\n0.000000 0.000000 0.500000 Be\n0.000000 0.352721 0.352721 Be\n0.500000 0.284293 0.784293 Be\n0.284293 0.500000 0.784293 Be\n0.500000 0.500000 0.500000 Be\n0.500000 0.715707 0.215707 Be\n0.500000 0.000000 0.000000 Be\n",
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{
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{
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{
"id": "mp-1174153",
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"structure_string": "Li5 Co3 O8\n1.0\n5.030558 0.000000 0.000000\n1.608568 5.520294 0.000000\n1.558907 2.516853 4.975410\nLi Co O\n5 3 8\ndirect\n0.496303 0.756047 0.248335 Li\n0.497088 0.755933 0.747153 Li\n0.503697 0.243953 0.751665 Li\n0.502912 0.244067 0.252847 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.778008 0.866847 0.887989 O\n0.783246 0.866947 0.350710 O\n0.779980 0.391335 0.377090 O\n0.762080 0.356454 0.884868 O\n0.220020 0.608665 0.622910 O\n0.237920 0.643546 0.115132 O\n0.221992 0.133153 0.112011 O\n0.216754 0.133053 0.649290 O\n",
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{
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{
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{
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{
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"structure_string": "Al3 Cu6 Sb3 H36 O36\n1.0\n9.209496 0.000000 0.000000\n-4.491238 8.085027 0.000000\n-0.024406 -0.033386 9.743427\nAl Cu Sb H O\n3 6 3 36 36\ndirect\n0.999524 0.002637 0.502660 Al\n0.332373 0.664600 0.493591 Al\n0.666171 0.329421 0.509139 Al\n0.013222 0.671966 0.507182 Cu\n0.659374 0.986550 0.494473 Cu\n0.671741 0.657289 0.503989 Cu\n0.326053 0.339902 0.504012 Cu\n0.340275 0.013775 0.496362 Cu\n0.986466 0.327063 0.498538 Cu\n0.004077 0.997679 0.003155 Sb\n0.321259 0.661050 0.986297 Sb\n0.667621 0.352842 0.011873 Sb\n0.143694 0.961719 0.296255 H\n0.095845 0.804021 0.886274 H\n0.434889 0.944473 0.848824 H\n0.159877 0.764285 0.116868 H\n0.246896 0.783276 0.701148 H\n0.461409 0.854304 0.287565 H\n0.727880 0.932304 0.891869 H\n0.131014 0.600325 0.295621 H\n0.594832 0.828431 0.109562 H\n0.795186 0.864943 0.299654 H\n0.530258 0.737384 0.699522 H\n0.051638 0.426884 0.885488 H\n0.207437 0.460006 0.700108 H\n0.951420 0.811471 0.706794 H\n0.564466 0.624238 0.889734 H\n0.388354 0.527016 0.292807 H\n0.807561 0.726668 0.119755 H\n0.218189 0.391603 0.111415 H\n0.797743 0.633607 0.893716 H\n0.184624 0.273999 0.886354 H\n0.607274 0.467365 0.712184 H\n0.439509 0.396759 0.119459 H\n0.050084 0.193860 0.294909 H\n0.791907 0.538365 0.308957 H\n0.945250 0.560983 0.122163 H\n0.466748 0.265922 0.303860 H\n0.197568 0.138149 0.706028 H\n0.376062 0.183453 0.898343 H\n0.859302 0.389371 0.712343 H\n0.153093 0.988990 0.109622 H\n0.551969 0.078501 0.702316 H\n0.747002 0.219016 0.294353 H\n0.814327 0.227931 0.887815 H\n0.607169 0.066264 0.103524 H\n0.913226 0.191858 0.110993 H\n0.858500 0.058183 0.704911 H\n0.126606 0.931244 0.393099 O\n0.492967 0.839195 0.114095 O\n0.242605 0.781482 0.597018 O\n0.447396 0.862879 0.388486 O\n0.266564 0.800932 0.874133 O\n0.146905 0.653072 0.124577 O\n0.126972 0.577851 0.395924 O\n0.791176 0.875800 0.401559 O\n0.535562 0.748637 0.596924 O\n0.513698 0.697025 0.869196 O\n0.810884 0.835648 0.123538 O\n0.170744 0.455789 0.873608 O\n0.216740 0.459839 0.597560 O\n0.931796 0.805419 0.605668 O\n0.415156 0.544835 0.392368 O\n0.987800 0.811531 0.883496 O\n0.329261 0.492217 0.116457 O\n0.681744 0.538058 0.892658 O\n0.017513 0.186588 0.122269 O\n0.581734 0.447509 0.612765 O\n0.070278 0.199022 0.396054 O\n0.783032 0.540999 0.411475 O\n0.826042 0.530061 0.139194 O\n0.185700 0.166107 0.882039 O\n0.488111 0.322843 0.140350 O\n0.460789 0.247120 0.406158 O\n0.200586 0.127926 0.604372 O\n0.865170 0.410418 0.611831 O\n0.842597 0.345989 0.888515 O\n0.494359 0.218738 0.871969 O\n0.553351 0.112985 0.590467 O\n0.762990 0.227298 0.396089 O\n0.693688 0.182399 0.123079 O\n0.556650 0.032268 0.826425 O\n0.870507 0.076960 0.603726 O\n0.842969 0.022514 0.880277 O\n",
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]
}