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{
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{
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{
"id": "mp-765750",
"created_at": "2022-09-04T14:44:49.725555Z",
"structure_string": "Li5 Cr2 Fe3 O10\n1.0\n5.132081 0.000000 0.000000\n0.880386 5.064132 0.000000\n2.523494 2.105825 7.193602\nLi Cr Fe O\n5 2 3 10\ndirect\n0.498307 0.784878 0.416547 Li\n0.513706 0.612359 0.773066 Li\n0.000000 0.500000 0.500000 Li\n0.486294 0.387641 0.226934 Li\n0.501693 0.215122 0.583453 Li\n0.005177 0.901807 0.691096 Cr\n0.994823 0.098193 0.308904 Cr\n0.002851 0.311784 0.887693 Fe\n0.997149 0.688216 0.112307 Fe\n0.500000 0.000000 0.000000 Fe\n0.238497 0.950579 0.860365 O\n0.769891 0.864534 0.545373 O\n0.766749 0.664170 0.942927 O\n0.249370 0.769151 0.231953 O\n0.231228 0.548981 0.664441 O\n0.768772 0.451019 0.335559 O\n0.750630 0.230849 0.768047 O\n0.233251 0.335830 0.057073 O\n0.230109 0.135466 0.454627 O\n0.761503 0.049421 0.139635 O\n",
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"formula_full": "Li5 Cr2 Fe3 O10",
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{
"id": "mp-1198006",
"created_at": "2022-09-04T14:44:48.910637Z",
"structure_string": "Tl4 Cu8 As8 O32\n1.0\n11.211280 0.000000 0.000000\n0.000000 6.391911 0.000000\n0.000000 1.500771 10.495226\nTl Cu As O\n4 8 8 32\ndirect\n0.415575 0.730584 0.022627 Tl\n0.915575 0.269416 0.477373 Tl\n0.584425 0.269416 0.977373 Tl\n0.084425 0.730584 0.522627 Tl\n0.956529 0.589510 0.157952 Cu\n0.456529 0.410490 0.342048 Cu\n0.043471 0.410490 0.842048 Cu\n0.543471 0.589510 0.657952 Cu\n0.156014 0.942874 0.177676 Cu\n0.656014 0.057126 0.322324 Cu\n0.843986 0.057126 0.822324 Cu\n0.343986 0.942874 0.677676 Cu\n0.387063 0.882303 0.376453 As\n0.887063 0.117697 0.123547 As\n0.612937 0.117697 0.623547 As\n0.112937 0.882303 0.876453 As\n0.707702 0.632169 0.236660 As\n0.207702 0.367831 0.263340 As\n0.292298 0.367831 0.763340 As\n0.792298 0.632169 0.736660 As\n0.296467 0.890841 0.505947 O\n0.796467 0.109159 0.994053 O\n0.703533 0.109159 0.494053 O\n0.203533 0.890841 0.005947 O\n0.314841 0.867954 0.234930 O\n0.814841 0.132046 0.265070 O\n0.685159 0.132046 0.765070 O\n0.185159 0.867954 0.734930 O\n0.484507 0.671131 0.402477 O\n0.984507 0.328869 0.097523 O\n0.515493 0.328869 0.597523 O\n0.015493 0.671131 0.902477 O\n0.486047 0.101502 0.355841 O\n0.986047 0.898498 0.144159 O\n0.513953 0.898498 0.644159 O\n0.013953 0.101502 0.855841 O\n0.631790 0.871624 0.197542 O\n0.131790 0.128376 0.302458 O\n0.368210 0.128376 0.802458 O\n0.868210 0.871624 0.697542 O\n0.796705 0.602981 0.103285 O\n0.296705 0.397019 0.396715 O\n0.203295 0.397019 0.896715 O\n0.703295 0.602981 0.603285 O\n0.599981 0.429737 0.243899 O\n0.099981 0.570263 0.256101 O\n0.400019 0.570263 0.756101 O\n0.900019 0.429737 0.743899 O\n0.805075 0.613917 0.359752 O\n0.305075 0.386083 0.140248 O\n0.194925 0.386083 0.640248 O\n0.694925 0.613917 0.859752 O\n",
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"formula_full": "Tl4 Cu8 As8 O32",
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"spacegroup": 14
},
{
"id": "mp-1191549",
"created_at": "2022-09-04T14:44:49.254106Z",
"structure_string": "Zr2 S4 O18\n1.0\n-5.342938 0.000000 0.000000\n2.522147 7.768547 0.000000\n-0.642513 -2.071423 -8.876666\nZr S O\n2 4 18\ndirect\n0.196625 0.894389 0.725212 Zr\n0.803375 0.105611 0.274788 Zr\n0.803716 0.162636 0.897106 S\n0.196284 0.837364 0.102894 S\n0.340268 0.244131 0.526650 S\n0.659732 0.755869 0.473350 S\n0.967118 0.631938 0.755649 O\n0.032882 0.368062 0.244351 O\n0.981650 0.323832 0.870955 O\n0.018350 0.676168 0.129045 O\n0.440186 0.397915 0.643307 O\n0.559814 0.602085 0.356693 O\n0.254596 0.072920 0.576194 O\n0.745404 0.927080 0.423806 O\n0.891201 0.749035 0.554391 O\n0.108799 0.250965 0.445609 O\n0.454663 0.777208 0.595309 O\n0.545337 0.222792 0.404691 O\n0.256517 0.829506 0.936651 O\n0.743483 0.170494 0.063349 O\n0.543022 0.111116 0.822012 O\n0.456978 0.888884 0.177988 O\n0.915611 0.007900 0.843981 O\n0.084389 0.992100 0.156019 O\n",
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{
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"structure_string": "Mn1 N1 F3\n1.0\n3.983070 0.000000 0.000000\n0.000000 3.983070 0.000000\n0.000000 0.000000 3.983070\nMn N F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 N\n0.500000 0.500000 0.000000 F\n0.500000 0.000000 0.500000 F\n0.000000 0.500000 0.500000 F\n",
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{
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{
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{
"id": "mp-1198516",
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"structure_string": "Ag6 C2 N2 Cl4 O20\n1.0\n4.865811 0.000000 0.000000\n0.000000 21.802933 0.000000\n-0.078252 0.000000 5.219808\nAg C N Cl O\n6 2 2 4 20\ndirect\n0.267363 0.241349 0.928217 Ag\n0.732637 0.741349 0.071783 Ag\n0.149300 0.133887 0.620115 Ag\n0.850700 0.633887 0.379885 Ag\n0.293012 0.365736 0.343911 Ag\n0.706988 0.865736 0.656089 Ag\n0.242057 0.231856 0.532904 C\n0.757943 0.731856 0.467096 C\n0.249064 0.257087 0.332783 N\n0.750936 0.757087 0.667217 N\n0.793199 0.379171 0.847161 Cl\n0.206801 0.879171 0.152839 Cl\n0.656486 0.105907 0.139177 Cl\n0.343514 0.605907 0.860823 Cl\n0.692132 0.438226 0.923519 O\n0.307868 0.938226 0.076481 O\n0.740478 0.368311 0.570196 O\n0.259522 0.868311 0.429804 O\n0.663865 0.330034 0.996772 O\n0.336135 0.830034 0.003228 O\n0.095406 0.374910 0.887283 O\n0.904594 0.874910 0.112717 O\n0.781554 0.048043 0.081093 O\n0.218446 0.548043 0.918907 O\n0.772570 0.155355 0.981737 O\n0.227430 0.655355 0.018263 O\n0.701853 0.121396 0.414961 O\n0.298147 0.621396 0.585039 O\n0.356467 0.104062 0.095227 O\n0.643533 0.604062 0.904773 O\n0.056908 0.006165 0.607838 O\n0.943092 0.506165 0.392162 O\n0.171587 0.481526 0.400300 O\n0.828413 0.981526 0.599700 O\n",
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{
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{
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"structure_string": "Ti4 Cr8 P12\n1.0\n0.000000 -3.122802 0.000000\n-5.522759 0.000000 -0.010324\n-0.035036 0.000000 -18.358396\nTi Cr P\n4 8 12\ndirect\n0.750000 0.495078 0.230324 Ti\n0.750000 0.491362 0.566494 Ti\n0.750000 0.490979 0.897351 Ti\n0.750000 0.995216 0.269618 Ti\n0.750000 0.001721 0.603872 Cr\n0.750000 0.002535 0.933749 Cr\n0.250000 0.510899 0.096979 Cr\n0.250000 0.505468 0.441089 Cr\n0.250000 0.507361 0.769636 Cr\n0.250000 0.008977 0.061460 Cr\n0.250000 0.007198 0.400296 Cr\n0.250000 0.009228 0.730945 Cr\n0.750000 0.294830 0.024440 P\n0.750000 0.306979 0.362673 P\n0.750000 0.298355 0.693851 P\n0.750000 0.801673 0.137310 P\n0.750000 0.813881 0.477708 P\n0.750000 0.810575 0.808049 P\n0.250000 0.686335 0.320856 P\n0.250000 0.710217 0.647223 P\n0.250000 0.712607 0.977131 P\n0.250000 0.191538 0.179597 P\n0.250000 0.172024 0.519398 P\n0.250000 0.174966 0.849953 P\n",
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{
"id": "mp-1222927",
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"structure_string": "La1 Mn8 Bi3 O20\n1.0\n5.866151 0.000000 0.000000\n0.000000 7.669466 0.000000\n0.000000 0.012369 8.677567\nLa Mn Bi O\n1 8 3 20\ndirect\n0.000000 0.357335 0.667536 La\n0.500000 0.090775 0.848395 Mn\n0.500000 0.905798 0.150470 Mn\n0.500000 0.596902 0.649249 Mn\n0.500000 0.407014 0.349067 Mn\n0.741641 0.499880 0.001213 Mn\n0.258024 0.999419 0.500555 Mn\n0.258359 0.499880 0.001213 Mn\n0.741976 0.999419 0.500555 Mn\n0.000000 0.659738 0.332225 Bi\n0.000000 0.848082 0.834632 Bi\n0.000000 0.154823 0.166690 Bi\n0.500000 0.354156 0.927417 O\n0.500000 0.645652 0.072194 O\n0.500000 0.852440 0.570808 O\n0.500000 0.145636 0.427865 O\n0.717163 0.501119 0.499607 O\n0.282080 0.999670 0.000522 O\n0.282837 0.501119 0.499607 O\n0.717920 0.999670 0.000522 O\n0.000000 0.345771 0.946872 O\n0.000000 0.655657 0.056063 O\n0.000000 0.843605 0.556290 O\n0.000000 0.152281 0.441753 O\n0.747608 0.106293 0.702187 O\n0.749833 0.887728 0.297943 O\n0.248025 0.609911 0.797278 O\n0.250908 0.388146 0.201932 O\n0.250167 0.887728 0.297943 O\n0.252392 0.106293 0.702187 O\n0.749092 0.388146 0.201932 O\n0.751975 0.609911 0.797278 O\n",
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]
}