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{
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{
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"structure_string": "Sm1 Hf1\n1.0\n1.690091 -2.927324 0.000000\n1.690091 2.927324 0.000000\n0.000000 0.000000 5.503845\nSm Hf\n1 1\ndirect\n0.333333 0.666667 0.000000 Sm\n0.666667 0.333333 0.500000 Hf\n",
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},
{
"id": "mp-677132",
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"structure_string": "Gd4 Cd2 Se8\n1.0\n-4.352306 4.352306 4.539269\n4.352306 -4.352306 4.539269\n4.352306 4.352306 -4.539269\nGd Cd Se\n4 2 8\ndirect\n0.010211 0.625000 0.885211 Gd\n0.875000 0.989789 0.614789 Gd\n0.739789 0.125000 0.114789 Gd\n0.375000 0.260211 0.385211 Gd\n0.500000 0.500000 0.000000 Cd\n0.250000 0.750000 0.500000 Cd\n0.632313 0.255740 0.760319 Se\n0.005740 0.882313 0.260319 Se\n0.744260 0.504579 0.376573 Se\n0.495421 0.871994 0.239681 Se\n0.621994 0.745421 0.739681 Se\n0.117687 0.378006 0.123427 Se\n0.254579 0.994260 0.876573 Se\n0.128006 0.367687 0.623427 Se\n",
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{
"id": "mp-1026900",
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"structure_string": "Hf1 Mg14 Cu1\n1.0\n6.327404 0.053137 0.000000\n-3.117683 5.399986 0.000000\n0.000000 0.000000 10.066265\nHf Mg Cu\n1 14 1\ndirect\n0.151144 0.825572 0.125000 Hf\n0.166224 0.333111 0.625000 Mg\n0.170891 0.835445 0.625000 Mg\n0.649441 0.335077 0.125000 Mg\n0.666034 0.329381 0.625000 Mg\n0.649441 0.814363 0.125000 Mg\n0.666034 0.836652 0.625000 Mg\n0.330825 0.166649 0.366765 Mg\n0.330825 0.166649 0.883235 Mg\n0.330825 0.664177 0.366765 Mg\n0.330825 0.664177 0.883235 Mg\n0.846986 0.173494 0.357315 Mg\n0.846986 0.173494 0.892685 Mg\n0.839354 0.669678 0.377218 Mg\n0.839354 0.669678 0.872782 Mg\n0.184808 0.342404 0.125000 Cu\n",
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{
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"created_at": "2022-09-04T14:44:58.242390Z",
"structure_string": "Li2 Tm2 O4\n1.0\n-2.198608 2.198608 5.119543\n2.198608 -2.198608 5.119543\n2.198608 2.198608 -5.119543\nLi Tm O\n2 2 4\ndirect\n0.250000 0.750000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Tm\n0.750000 0.250000 0.500000 Tm\n0.777674 0.777674 0.000000 O\n0.222326 0.222326 0.000000 O\n0.527674 0.027674 0.500000 O\n0.972326 0.472326 0.500000 O\n",
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{
"id": "mp-1207585",
"created_at": "2022-09-04T14:44:58.188477Z",
"structure_string": "Zn20 Cu2 B16 Rh36\n1.0\n17.884083 0.000000 0.000000\n0.000000 17.884083 0.000000\n0.000000 0.000000 2.878565\nZn Cu B Rh\n20 2 16 36\ndirect\n0.550259 0.050259 0.000000 Zn\n0.449741 0.949741 0.000000 Zn\n0.050259 0.449741 0.000000 Zn\n0.949741 0.550259 0.000000 Zn\n0.031806 0.187096 0.000000 Zn\n0.968194 0.812904 0.000000 Zn\n0.187096 0.968194 0.000000 Zn\n0.531806 0.312904 0.000000 Zn\n0.812904 0.031806 0.000000 Zn\n0.468194 0.687096 0.000000 Zn\n0.687096 0.531806 0.000000 Zn\n0.312904 0.468194 0.000000 Zn\n0.209460 0.709460 0.000000 Zn\n0.790540 0.290540 0.000000 Zn\n0.709460 0.790540 0.000000 Zn\n0.290540 0.209460 0.000000 Zn\n0.668921 0.168921 0.000000 Zn\n0.331079 0.831079 0.000000 Zn\n0.168921 0.331079 0.000000 Zn\n0.831079 0.668921 0.000000 Zn\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.000000 Cu\n0.333846 0.039003 0.000000 B\n0.666154 0.960997 0.000000 B\n0.039003 0.666154 0.000000 B\n0.833846 0.460997 0.000000 B\n0.960997 0.333846 0.000000 B\n0.166154 0.539003 0.000000 B\n0.539003 0.833846 0.000000 B\n0.460997 0.166154 0.000000 B\n0.165067 0.123266 0.000000 B\n0.834933 0.876734 0.000000 B\n0.123266 0.834933 0.000000 B\n0.665067 0.376734 0.000000 B\n0.876734 0.165067 0.000000 B\n0.334933 0.623266 0.000000 B\n0.623266 0.665067 0.000000 B\n0.376734 0.334933 0.000000 B\n0.255766 0.087953 0.500000 Rh\n0.744234 0.912047 0.500000 Rh\n0.087953 0.744234 0.500000 Rh\n0.755766 0.412047 0.500000 Rh\n0.912047 0.255766 0.500000 Rh\n0.244234 0.587953 0.500000 Rh\n0.587953 0.755766 0.500000 Rh\n0.412047 0.244234 0.500000 Rh\n0.047719 0.326019 0.500000 Rh\n0.952281 0.673981 0.500000 Rh\n0.326019 0.952281 0.500000 Rh\n0.547719 0.173981 0.500000 Rh\n0.673981 0.047719 0.500000 Rh\n0.452281 0.826019 0.500000 Rh\n0.826019 0.547719 0.500000 Rh\n0.173981 0.452281 0.500000 Rh\n0.160530 0.211102 0.500000 Rh\n0.839470 0.788898 0.500000 Rh\n0.211102 0.839470 0.500000 Rh\n0.660530 0.288898 0.500000 Rh\n0.788898 0.160530 0.500000 Rh\n0.339470 0.711102 0.500000 Rh\n0.711102 0.660530 0.500000 Rh\n0.288898 0.339470 0.500000 Rh\n0.099179 0.067542 0.500000 Rh\n0.900821 0.932458 0.500000 Rh\n0.067542 0.900821 0.500000 Rh\n0.599179 0.432458 0.500000 Rh\n0.932458 0.099179 0.500000 Rh\n0.400821 0.567542 0.500000 Rh\n0.567542 0.599179 0.500000 Rh\n0.432458 0.400821 0.500000 Rh\n0.082203 0.582203 0.500000 Rh\n0.917797 0.417797 0.500000 Rh\n0.582203 0.917797 0.500000 Rh\n0.417797 0.082203 0.500000 Rh\n",
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{
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"structure_string": "Co4 C4 Br4 N16 O12\n1.0\n4.354794 0.000000 0.000000\n0.000000 9.306341 0.000000\n0.000000 0.000000 15.950924\nCo C Br N O\n4 4 4 16 12\ndirect\n0.750000 0.682433 0.377253 Co\n0.750000 0.817567 0.877253 Co\n0.250000 0.317567 0.622747 Co\n0.250000 0.182433 0.122747 Co\n0.750000 0.264318 0.457114 C\n0.750000 0.235682 0.957114 C\n0.250000 0.735682 0.542886 C\n0.250000 0.764318 0.042886 C\n0.750000 0.002994 0.224445 Br\n0.750000 0.497006 0.724445 Br\n0.250000 0.997006 0.775555 Br\n0.250000 0.502994 0.275555 Br\n0.750000 0.542441 0.296214 N\n0.750000 0.957559 0.796214 N\n0.250000 0.457559 0.703786 N\n0.250000 0.042441 0.203786 N\n0.750000 0.802089 0.998525 N\n0.750000 0.697911 0.498525 N\n0.250000 0.197911 0.001475 N\n0.250000 0.302089 0.501475 N\n0.120854 0.804340 0.361171 N\n0.379146 0.695660 0.861171 N\n0.620854 0.195660 0.638829 N\n0.879146 0.304340 0.138829 N\n0.879146 0.195660 0.638829 N\n0.620854 0.304340 0.138829 N\n0.379146 0.804340 0.361171 N\n0.120854 0.695660 0.861171 N\n0.750000 0.135976 0.461560 O\n0.750000 0.364024 0.961560 O\n0.250000 0.864024 0.538440 O\n0.250000 0.635976 0.038440 O\n0.997048 0.358746 0.456752 O\n0.502952 0.141254 0.956752 O\n0.497048 0.641254 0.543248 O\n0.002952 0.858746 0.043248 O\n0.002952 0.641254 0.543248 O\n0.497048 0.858746 0.043248 O\n0.502952 0.358746 0.456752 O\n0.997048 0.141254 0.956752 O\n",
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{
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{
"id": "mp-1198928",
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{
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{
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"formula_full": "Er2 Co1 Ge6",
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},
{
"id": "mp-1217198",
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"structure_string": "V4 Cd4 Ni4 P8 O52\n1.0\n-3.584989 7.738073 9.508444\n3.584989 -7.738073 9.508444\n3.584989 7.738073 -9.508444\nV Cd Ni P O\n4 4 4 8 52\ndirect\n0.242294 0.778872 0.036769 V\n0.757706 0.794476 0.536578 V\n0.257897 0.294476 0.536769 V\n0.742103 0.278872 0.036578 V\n0.000000 0.277475 0.277475 Cd\n0.500000 0.723968 0.223968 Cd\n0.500000 0.223968 0.723968 Cd\n0.000000 0.777475 0.777475 Cd\n0.870619 0.999174 0.374741 Ni\n0.129381 0.504123 0.128555 Ni\n0.624433 0.499174 0.628555 Ni\n0.375567 0.004123 0.874741 Ni\n0.024152 0.398695 0.617054 P\n0.975848 0.592902 0.374543 P\n0.281394 0.409343 0.884748 P\n0.718606 0.603354 0.127949 P\n0.475405 0.103354 0.384748 P\n0.524595 0.909343 0.627949 P\n0.218359 0.092902 0.117054 P\n0.781641 0.898695 0.874543 P\n0.998451 0.982911 0.461259 O\n0.001549 0.462808 0.984460 O\n0.521652 0.482911 0.484460 O\n0.478348 0.962808 0.961259 O\n0.103677 0.590960 0.844810 O\n0.896323 0.741133 0.487283 O\n0.248249 0.268791 0.660434 O\n0.751751 0.412184 0.020542 O\n0.391642 0.912184 0.160434 O\n0.608358 0.768791 0.520542 O\n0.253850 0.241133 0.344810 O\n0.746150 0.090960 0.987283 O\n0.046063 0.607768 0.508470 O\n0.953937 0.462407 0.561705 O\n0.599140 0.538905 0.994251 O\n0.400860 0.395112 0.939766 O\n0.455346 0.895112 0.494251 O\n0.544654 0.038905 0.439766 O\n0.900702 0.962407 0.008470 O\n0.099298 0.107768 0.061705 O\n0.954923 0.284348 0.588490 O\n0.045077 0.633567 0.329424 O\n0.195795 0.358939 0.905274 O\n0.804205 0.709479 0.163144 O\n0.546334 0.209479 0.405274 O\n0.453666 0.858939 0.663144 O\n0.304143 0.133567 0.088490 O\n0.695857 0.784348 0.829424 O\n0.803959 0.117965 0.551786 O\n0.196041 0.747826 0.314005 O\n0.041879 0.262754 0.930217 O\n0.958121 0.888338 0.220875 O\n0.667463 0.388338 0.430217 O\n0.332537 0.762754 0.720875 O\n0.433821 0.247826 0.051786 O\n0.566179 0.617965 0.814005 O\n0.756791 0.001368 0.262929 O\n0.243209 0.506138 0.244577 O\n0.738439 0.501368 0.744577 O\n0.261561 0.006138 0.762929 O\n0.098062 0.270263 0.468241 O\n0.901938 0.370179 0.172201 O\n0.299163 0.634007 0.040108 O\n0.700837 0.740945 0.334845 O\n0.406100 0.240945 0.540108 O\n0.593900 0.134007 0.834845 O\n0.197978 0.870179 0.968241 O\n0.802022 0.770263 0.672201 O\n0.211984 0.958810 0.250896 O\n0.788016 0.038912 0.746826 O\n0.292087 0.538912 0.750896 O\n0.707913 0.458810 0.246826 O\n",
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}
]
}