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{
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"results": [
{
"id": "mp-1177300",
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"structure_string": "Li4 V1 Cr3 O8\n1.0\n2.984132 5.154381 0.000000\n-2.984132 5.154381 0.000000\n0.000000 1.712626 4.850420\nLi V Cr O\n4 1 3 8\ndirect\n0.750790 0.750790 0.497893 Li\n0.249210 0.249210 0.502107 Li\n0.247962 0.752038 0.500000 Li\n0.752038 0.247962 0.500000 Li\n0.500000 0.500000 0.000000 V\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.000000 0.000000 0.000000 Cr\n0.629996 0.629996 0.225691 O\n0.871984 0.368891 0.774656 O\n0.129646 0.129646 0.224289 O\n0.368891 0.871984 0.774656 O\n0.128016 0.631109 0.225344 O\n0.370004 0.370004 0.774309 O\n0.631109 0.128016 0.225344 O\n0.870354 0.870354 0.775711 O\n",
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{
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"formula_full": "Sr4 Y2 Co2 Cu4 O14",
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},
{
"id": "mp-4583",
"created_at": "2022-09-04T14:47:40.807324Z",
"structure_string": "Nb1 Co2 Sn1\n1.0\n0.000000 3.089490 3.089490\n3.089490 0.000000 3.089490\n3.089490 3.089490 0.000000\nNb Co Sn\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Nb\n0.250000 0.250000 0.250000 Co\n0.750000 0.750000 0.750000 Co\n0.000000 0.000000 0.000000 Sn\n",
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"density": 9.27665549878322,
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"spacegroup": 225
},
{
"id": "mp-19161",
"created_at": "2022-09-04T14:47:39.458726Z",
"structure_string": "Ca4 Co2 W2 O12\n1.0\n5.468695 0.000148 -0.024675\n0.000139 5.656917 0.000006\n-0.010218 0.000001 7.829815\nCa Co W O\n4 2 2 12\ndirect\n0.986133 0.055525 0.253157 Ca\n0.513879 0.555531 0.246834 Ca\n0.013868 0.944474 0.746844 Ca\n0.486119 0.444467 0.753167 Ca\n0.499999 0.000000 0.000000 Co\n0.000000 0.499999 0.500000 Co\n0.499997 0.000002 0.499997 W\n0.000008 0.500001 0.000000 W\n0.687629 0.284066 0.445362 O\n0.812353 0.784066 0.054637 O\n0.312374 0.715935 0.554641 O\n0.187648 0.215937 0.945359 O\n0.210648 0.193156 0.545790 O\n0.289323 0.693165 0.954209 O\n0.789354 0.806842 0.454212 O\n0.710671 0.306834 0.045787 O\n0.096496 0.466574 0.239622 O\n0.403518 0.966573 0.260376 O\n0.596482 0.033428 0.739628 O\n0.903504 0.533426 0.760378 O\n",
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"formula_full": "Ca4 Co2 W2 O12",
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},
{
"id": "mp-1080325",
"created_at": "2022-09-04T14:47:39.506236Z",
"structure_string": "Ce4 Se8\n1.0\n2.048896 -3.548793 0.000000\n2.048896 3.548793 0.000000\n0.000000 0.000000 26.813807\nCe Se\n4 8\ndirect\n0.666667 0.333333 0.000000 Ce\n0.333333 0.666667 0.500000 Ce\n0.333333 0.666667 0.750008 Ce\n0.333333 0.666667 0.249992 Ce\n0.333333 0.666667 0.936696 Se\n0.333333 0.666667 0.063304 Se\n0.000000 0.000000 0.813196 Se\n0.000000 0.000000 0.186804 Se\n0.000000 0.000000 0.686698 Se\n0.000000 0.000000 0.313302 Se\n0.666667 0.333333 0.563405 Se\n0.666667 0.333333 0.436595 Se\n",
"nsites": 12,
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"elements": [
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],
"chemical_system": "Ce-Se",
"density": 5.076784836950908,
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"volume": 389.9321615138075,
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"formula_full": "Ce4 Se8",
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},
{
"id": "mp-1078402",
"created_at": "2022-09-04T14:47:39.508463Z",
"structure_string": "Sc3 Ge3 Pd3\n1.0\n3.378225 -5.851257 0.000000\n3.378225 5.851257 0.000000\n0.000000 0.000000 3.968808\nSc Ge Pd\n3 3 3\ndirect\n0.000000 0.576877 0.000000 Sc\n0.423123 0.423123 0.000000 Sc\n0.576877 0.000000 0.000000 Sc\n0.333333 0.666667 0.500000 Ge\n0.666667 0.333333 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.000000 0.248850 0.500000 Pd\n0.751150 0.751150 0.500000 Pd\n0.248850 0.000000 0.500000 Pd\n",
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{
"id": "mp-773113",
"created_at": "2022-09-04T14:47:39.520894Z",
"structure_string": "H48 Ru4 S4 N16 Cl8 O8\n1.0\n7.422557 0.000000 0.000000\n0.000000 9.403715 0.000000\n0.000000 0.000000 14.179456\nH Ru S N Cl O\n48 4 4 16 8 8\ndirect\n0.057830 0.663527 0.023210 H\n0.442170 0.663527 0.023210 H\n0.999291 0.206305 0.049232 H\n0.500709 0.206305 0.049232 H\n0.099483 0.364242 0.058154 H\n0.400517 0.364242 0.058154 H\n0.034594 0.936694 0.135188 H\n0.465406 0.936694 0.135188 H\n0.461553 0.790709 0.199413 H\n0.038447 0.790709 0.199413 H\n0.599097 0.923759 0.229075 H\n0.900903 0.923759 0.229075 H\n0.099097 0.423759 0.270925 H\n0.400903 0.423759 0.270925 H\n0.538447 0.290709 0.300587 H\n0.961553 0.290709 0.300587 H\n0.965406 0.436694 0.364812 H\n0.534594 0.436694 0.364812 H\n0.900517 0.864242 0.441846 H\n0.599483 0.864242 0.441846 H\n0.000709 0.706305 0.450768 H\n0.499291 0.706305 0.450768 H\n0.557830 0.163527 0.476790 H\n0.942170 0.163527 0.476790 H\n0.057830 0.836473 0.523210 H\n0.442170 0.836473 0.523210 H\n0.999291 0.293695 0.549232 H\n0.500709 0.293695 0.549232 H\n0.099483 0.135758 0.558154 H\n0.400517 0.135758 0.558154 H\n0.034594 0.563306 0.635188 H\n0.465406 0.563306 0.635188 H\n0.038447 0.709291 0.699413 H\n0.461553 0.709291 0.699413 H\n0.599097 0.576241 0.729075 H\n0.900903 0.576241 0.729075 H\n0.099097 0.076241 0.770925 H\n0.400903 0.076241 0.770925 H\n0.538447 0.209291 0.800587 H\n0.961553 0.209291 0.800587 H\n0.534594 0.063306 0.864812 H\n0.965406 0.063306 0.864812 H\n0.599483 0.635758 0.941846 H\n0.900517 0.635758 0.941846 H\n0.499291 0.793695 0.950768 H\n0.000709 0.793695 0.950768 H\n0.557830 0.336473 0.976790 H\n0.942170 0.336473 0.976790 H\n0.750000 0.780113 0.085277 Ru\n0.250000 0.280113 0.414723 Ru\n0.750000 0.719887 0.585277 Ru\n0.250000 0.219887 0.914723 Ru\n0.750000 0.592303 0.166512 S\n0.250000 0.092303 0.333488 S\n0.750000 0.907697 0.666512 S\n0.250000 0.407697 0.833488 S\n0.049383 0.290534 0.011439 N\n0.450617 0.290534 0.011439 N\n0.545185 0.868145 0.173234 N\n0.954815 0.868145 0.173234 N\n0.045185 0.368145 0.326766 N\n0.454815 0.368145 0.326766 N\n0.950617 0.790534 0.488561 N\n0.549383 0.790534 0.488561 N\n0.049383 0.209466 0.511439 N\n0.450617 0.209466 0.511439 N\n0.545185 0.631855 0.673234 N\n0.954815 0.631855 0.673234 N\n0.045185 0.131855 0.826766 N\n0.454815 0.131855 0.826766 N\n0.549383 0.709466 0.988561 N\n0.950617 0.709466 0.988561 N\n0.750000 0.007585 0.003926 Cl\n0.250000 0.565871 0.150877 Cl\n0.750000 0.065871 0.349123 Cl\n0.250000 0.507585 0.496074 Cl\n0.750000 0.492415 0.503926 Cl\n0.250000 0.934129 0.650877 Cl\n0.750000 0.434129 0.849123 Cl\n0.250000 0.992415 0.996074 Cl\n0.750000 0.445797 0.130218 O\n0.250000 0.101604 0.230071 O\n0.750000 0.601604 0.269929 O\n0.250000 0.945797 0.369782 O\n0.750000 0.054203 0.630218 O\n0.250000 0.398396 0.730071 O\n0.750000 0.898396 0.769929 O\n0.250000 0.554203 0.869782 O\n",
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"formula_full": "H48 Ru4 S4 N16 Cl8 O8",
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{
"id": "mp-1194382",
"created_at": "2022-09-04T14:47:39.677798Z",
"structure_string": "Mg4 Ti8 O16\n1.0\n6.066141 0.000000 0.000000\n0.000000 6.066141 0.000000\n0.000000 0.000000 8.480974\nMg Ti O\n4 8 16\ndirect\n0.245251 0.754749 0.750000 Mg\n0.754749 0.245251 0.250000 Mg\n0.254749 0.254749 0.500000 Mg\n0.745251 0.745251 0.000000 Mg\n0.491199 0.251249 0.880398 Ti\n0.508801 0.748751 0.380398 Ti\n0.751249 0.008801 0.630398 Ti\n0.248751 0.991199 0.130398 Ti\n0.748751 0.508801 0.619602 Ti\n0.251249 0.491199 0.119602 Ti\n0.008801 0.751249 0.369602 Ti\n0.991199 0.248751 0.869602 Ti\n0.984702 0.256449 0.629392 O\n0.015298 0.743551 0.129392 O\n0.756449 0.515298 0.379392 O\n0.243551 0.484702 0.879392 O\n0.743551 0.015298 0.870608 O\n0.256449 0.984702 0.370608 O\n0.515298 0.756449 0.620608 O\n0.484702 0.243551 0.120608 O\n0.745068 0.478103 0.866680 O\n0.254932 0.521897 0.366680 O\n0.978103 0.754932 0.616680 O\n0.021897 0.245068 0.116680 O\n0.521897 0.254932 0.633320 O\n0.478103 0.745068 0.133320 O\n0.754932 0.978103 0.383320 O\n0.245068 0.021897 0.883320 O\n",
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"formula_full": "Mg4 Ti8 O16",
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{
"id": "mp-1114071",
"created_at": "2022-09-04T14:47:39.756269Z",
"structure_string": "Rb2 In1 Bi1 Cl6\n1.0\n0.000000 5.704965 5.704965\n5.704965 0.000000 5.704965\n5.704965 5.704965 0.000000\nRb In Bi Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Bi\n0.760942 0.239058 0.239058 Cl\n0.239058 0.239058 0.760942 Cl\n0.239058 0.760942 0.760942 Cl\n0.239058 0.760942 0.239058 Cl\n0.760942 0.239058 0.760942 Cl\n0.760942 0.760942 0.239058 Cl\n",
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{
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{
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}